A0A087XZ06_POEFO Loading...

BAR/IMD domain-containing adapter protein 2-like 1

May function as adapter protein. Involved in the formation of clusters of actin bundles. Plays a role in the reorganization of the actin cytoskeleton in response to bacterial infection.

AlphaFold DB , UniProt , Accession A0A087XZ06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 484 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.4Low81.7Confident188 Ų18895.3 Ų95.393%0.92649%0.486SS*.  0-38.70-71.6-171.5-161.900112.7N3 K4M1-N3 PolarHBondContact O-N 3.41Å; M1-K4 PolarHBondContact O-N 3.08Å
2S61.7Low83.1Confident80 Ų8087.3 Ų87.356%0.55945%0.445SS*.Hα-helixtrans-50.8-48.6-178.7-152.40000114.8K4 V5 D6S2-K4 VanDerWaalsContact C-N 3.33Å; S2-K4 PolarHBondContact O-N 3.31Å; S2-V5 WeakPolarHBondContact O-CB 3.48Å; S2-V5 PolarHBondContact O-N 3.27Å; S2-D6 PolarHBondContact O-N 3.48Å
3N71.4Confident84.2Confident120 Ų12084 Ų8464%0.64243%0.427SS*.Hα-helixtrans-59.2-38.4-175.8-666.9000114.1M1 V5 D6 E7M1-N3 PolarHBondContact O-N 3.41Å; N3-V5 VanDerWaalsContact C-N 3.28Å; N3-V5 PolarHBondContact O-N 3.48Å; N3-D6 PolarHBondContact O-N 3.07Å; N3-E7 WeakPolarHBondContact O-CB 3.31Å; N3-E7 VanDerWaalsContact O-CG 3.25Å; N3-E7 WeakPolarHBondContact O-CG 3.37Å; N3-E7 PolarHBondContact O-N 3.2Å
4K78.8Confident85.2Confident166 Ų16682.3 Ų82.372%0.72243%0.426SS*.Hα-helixtrans-69.3-29.9179.3-68.8-171.7176-175.10112.3M1 S2 A8M1-K4 PolarHBondContact O-N 3.08Å; S2-K4 VanDerWaalsContact C-N 3.33Å; S2-K4 PolarHBondContact O-N 3.31Å; K4-A8 PolarHBondContact O-N 2.96Å; K4-A8 VanDerWaalsContact O-N 3.13Å
5V80.6Confident86.1Confident29 Ų2977.3 Ų77.318%0.17640%0.401CS..Hα-helixtrans-74.3-43179.1178.20000109.6S2 N3 A8 N9 Q174 L177S2-V5 WeakPolarHBondContact O-CB 3.48Å; S2-V5 PolarHBondContact O-N 3.27Å; N3-V5 VanDerWaalsContact C-N 3.28Å; N3-V5 PolarHBondContact O-N 3.48Å; V5-A8 PolarHBondContact O-N 2.92Å; V5-N9 PolarHBondContact O-N 3.39Å; V5-Q174 HydrophobicContact CG2-CG 3.93Å; V5-L177 HydrophobicContact CB-CD1 4.47Å; V5-L177 HydrophobicContact CG1-CD1 3.16Å; V5-L177 HydrophobicContact CG1-CG 4.48Å
6D82.8Confident86.9Confident77 Ų7772.9 Ų72.941%0.41238%0.377SS..Hα-helixtrans-66.2-36.6174.7-62.4-37.5000112.3S2 N3 K10S2-D6 PolarHBondContact O-N 3.48Å; N3-D6 PolarHBondContact O-N 3.07Å; D6-K10 VanDerWaalsContact O-CG 3.29Å; D6-K10 WeakPolarHBondContact O-CG 3.41Å; D6-K10 PolarHBondContact O-N 3.36Å; D6-K10 VanDerWaalsContact O-N 3.09Å
7E91Very high87.5Confident124 Ų12473.2 Ų73.258%0.57938%0.375SS*.Hα-helixtrans-63.4-42.9173.3-78.9170.4-170.300112.2N3 K10 L11N3-E7 WeakPolarHBondContact O-CB 3.31Å; N3-E7 VanDerWaalsContact O-CG 3.25Å; N3-E7 WeakPolarHBondContact O-CG 3.37Å; N3-E7 PolarHBondContact O-N 3.2Å; E7-K10 PolarHBondContact O-N 2.82Å; E7-L11 WeakPolarHBondContact O-CB 3.42Å; E7-L11 PolarHBondContact O-N 3.02Å
8A93.4Very high88.1Confident23 Ų2372.9 Ų72.919%0.1937%0.374CS..Hα-helixtrans-62.6-43.4177.800000112.1K4 V5 L11 A12 C181K4-A8 PolarHBondContact O-N 2.96Å; K4-A8 VanDerWaalsContact O-N 3.13Å; V5-A8 PolarHBondContact O-N 2.92Å; A8-L11 PolarHBondContact O-N 2.92Å; A8-A12 WeakPolarHBondContact O-CB 3.32Å; A8-A12 PolarHBondContact O-N 2.98Å; A8-C181 HydrophobicContact CB-CB 4.33Å
9N94.7Very high88.6Confident18 Ų1869.1 Ų69.110%0.09636%0.355CS..Hα-helixtrans-62.6-47.2175.8-174.653.5000111.7V5 L11 A12 E13 Y122 L177V5-N9 PolarHBondContact O-N 3.39Å; N9-L11 VanDerWaalsContact C-N 3.3Å; N9-L11 PolarHBondContact O-N 3.02Å; N9-A12 PolarHBondContact O-N 3.47Å; N9-E13 PolarHBondContact ND2-OE1 3.48Å; N9-E13 WeakPolarHBondContact O-CG 3.44Å; N9-E13 PolarHBondContact O-N 3.27Å; N9-Y122 WeakPolarHBondContact OD1-CE1 3.42Å; N9-Y122 PolarHBondContact OD1-OH 3.05Å; N9-L177 HydrophobicContact CB-CD2 3.66Å
10K96Very high89.1Confident145 Ų14567.8 Ų67.863%0.6335%0.348SS*.Hα-helixtrans-60.1-41.9178.7-74.4173.6-175.91760111.7D6 E7 S14D6-K10 VanDerWaalsContact O-CG 3.29Å; D6-K10 WeakPolarHBondContact O-CG 3.41Å; D6-K10 PolarHBondContact O-N 3.36Å; D6-K10 VanDerWaalsContact O-N 3.09Å; E7-K10 PolarHBondContact O-N 2.82Å; K10-S14 VanDerWaalsContact O-CB 3.26Å; K10-S14 WeakPolarHBondContact O-CB 3.46Å; K10-S14 PolarHBondContact O-N 3.2Å; K10-S14 PolarHBondContact O-OG 3.3Å
11L97.2Very high89.5Confident78 Ų7870.4 Ų70.441%0.40836%0.358SS..Hα-helixtrans-61.3-51.3176.3-178.656000110.4E7 A8 N9 E13 S14 T15 L185E7-L11 WeakPolarHBondContact O-CB 3.42Å; E7-L11 PolarHBondContact O-N 3.02Å; A8-L11 PolarHBondContact O-N 2.92Å; N9-L11 VanDerWaalsContact C-N 3.3Å; N9-L11 PolarHBondContact O-N 3.02Å; L11-E13 PolarHBondContact O-N 3.07Å; L11-S14 PolarHBondContact O-N 3.18Å; L11-S14 VanDerWaalsContact O-N 3.16Å; L11-S14 PolarHBondContact O-OG 3.47Å; L11-T15 PolarHBondContact O-N 3.16Å; L11-T15 PolarHBondContact O-OG1 2.98Å; L11-T15 VanDerWaalsContact O-OG1 3.06Å; L11-L185 HydrophobicContact CD2-CD1 4.35Å
12A97.9Very high91.7Very high0 Ų067.4 Ų67.40%034%0.342CS..Hα-helixtrans-54.3-51.3177.400000112.3A8 N9 S14 T15 Y16 Y122 C181 A184A8-A12 WeakPolarHBondContact O-CB 3.32Å; A8-A12 PolarHBondContact O-N 2.98Å; N9-A12 PolarHBondContact O-N 3.47Å; A12-S14 VanDerWaalsContact C-N 3.33Å; A12-S14 PolarHBondContact O-N 2.84Å; A12-T15 PolarHBondContact O-N 3.09Å; A12-Y16 WeakPolarHBondContact O-CD2 3.48Å; A12-Y16 PolarHBondContact O-N 2.99Å; A12-Y16 VanDerWaalsContact O-N 3.07Å; A12-Y122 HydrophobicContact CB-CE1 4.17Å; A12-Y122 HydrophobicContact CB-CE2 4.43Å; A12-C181 HydrophobicContact CB-CB 4.27Å; A12-A184 HydrophobicContact CB-CB 4.15Å
13E97.8Very high93.4Very high44 Ų4464.7 Ų64.721%0.20632%0.32CS..Hα-helixtrans-61.4-41.2178.2-68.9-170.9-167.400112.5N9 L11 T15 Y16 K17 F119 Y122N9-E13 PolarHBondContact ND2-OE1 3.48Å; N9-E13 WeakPolarHBondContact O-CG 3.44Å; N9-E13 PolarHBondContact O-N 3.27Å; L11-E13 PolarHBondContact O-N 3.07Å; E13-T15 VanDerWaalsContact C-N 3.33Å; E13-Y16 PolarHBondContact O-N 2.96Å; E13-K17 WeakPolarHBondContact O-CG 3.34Å; E13-K17 PolarHBondContact O-N 3.36Å; E13-F119 HydrophobicContact CB-CE2 4.13Å; E13-F119 HydrophobicContact CB-CZ 4.39Å; E13-F119 HydrophobicContact CG-CE2 4.02Å; E13-F119 HydrophobicContact CG-CZ 4.42Å; E13-Y122 HydrophobicContact CG-CE1 4.14Å
14S98.2Very high94.6Very high60 Ų6059.1 Ų59.142%0.4229%0.29SS..Hα-helixtrans-64.6-38.2178.175.40000111.9K10 L11 A12 K17 N18K10-S14 VanDerWaalsContact O-CB 3.26Å; K10-S14 WeakPolarHBondContact O-CB 3.46Å; K10-S14 PolarHBondContact O-N 3.2Å; K10-S14 PolarHBondContact O-OG 3.3Å; L11-S14 PolarHBondContact O-N 3.18Å; L11-S14 VanDerWaalsContact O-N 3.16Å; L11-S14 PolarHBondContact O-OG 3.47Å; A12-S14 VanDerWaalsContact C-N 3.33Å; A12-S14 PolarHBondContact O-N 2.84Å; S14-K17 PolarHBondContact O-N 2.93Å; S14-N18 WeakPolarHBondContact O-CB 3.44Å; S14-N18 PolarHBondContact O-N 2.77Å
15T98.5Very high95.5Very high7 Ų754 Ų544%0.04327%0.274CS..Hα-helixtrans-66.9-45.6177.7-59.60000111.4L11 A12 E13 K17 N18 V19 A184 L185 E188L11-T15 PolarHBondContact O-N 3.16Å; L11-T15 PolarHBondContact O-OG1 2.98Å; L11-T15 VanDerWaalsContact O-OG1 3.06Å; A12-T15 PolarHBondContact O-N 3.09Å; E13-T15 VanDerWaalsContact C-N 3.33Å; T15-K17 VanDerWaalsContact C-N 3.33Å; T15-K17 PolarHBondContact O-N 2.71Å; T15-N18 PolarHBondContact O-N 2.92Å; T15-V19 WeakPolarHBondContact O-CG2 3.44Å; T15-V19 PolarHBondContact O-N 3.32Å; T15-A184 HydrophobicContact CG2-CB 4.27Å; T15-A184 VanDerWaalsContact CG2-O 3.23Å; T15-A184 WeakPolarHBondContact CG2-O 3.45Å; T15-L185 HydrophobicContact CG2-CD2 4.35Å; T15-E188 HydrophobicContact CG2-CB 3.7Å; T15-E188 HydrophobicContact CG2-CG 4.41Å
16Y98.4Very high96.4Very high7 Ų754.4 Ų54.43%0.02729%0.285CS..Hα-helixtrans-58.7-45.1174.7-76.9-63.1000111.9A12 E13 V19 M20 M115 T118 F119 Y122 A184A12-Y16 WeakPolarHBondContact O-CD2 3.48Å; A12-Y16 PolarHBondContact O-N 2.99Å; A12-Y16 VanDerWaalsContact O-N 3.07Å; E13-Y16 PolarHBondContact O-N 2.96Å; Y16-V19 PolarHBondContact O-N 3.01Å; Y16-M20 WeakPolarHBondContact O-CE 3.32Å; Y16-M20 WeakPolarHBondContact O-CG 3.44Å; Y16-M20 PolarHBondContact O-N 2.93Å; Y16-M20 VanDerWaalsContact O-N 3.14Å; Y16-M115 HydrophobicContact CD1-CE 3.46Å; Y16-M115 VanDerWaalsContact CD1-CE 3.46Å; Y16-M115 HydrophobicContact CE1-CE 3.86Å; Y16-T118 HydrophobicContact CE1-CG2 3.84Å; Y16-F119 HydrophobicContact CD1-CB 4.15Å; Y16-F119 HydrophobicContact CD1-CD2 4.41Å; Y16-F119 AromaticContact CD2-CD2 3.48Å; Y16-F119 HydrophobicContact CD2-CD2 3.48Å; Y16-F119 VanDerWaalsContact CD2-CD2 3.48Å; Y16-F119 HydrophobicContact CD2-CE2 4.08Å; Y16-F119 HydrophobicContact CD2-CG 4.43Å; Y16-F119 HydrophobicContact CE2-CD2 4.38Å; Y16-F119 HydrophobicContact CG-CB 4.05Å; Y16-F119 AromaticContact CG-CD2 3.51Å; Y16-F119 HydrophobicContact CG-CD2 3.51Å; Y16-F119 HydrophobicContact CG-CE2 4.29Å; Y16-F119 HydrophobicContact CG-CG 4.06Å; Y16-Y122 HydrophobicContact CE2-CD1 4.3Å; Y16-Y122 HydrophobicContact CE2-CG 4.1Å; Y16-A184 HydrophobicContact CD2-CB 4.01Å; Y16-A184 HydrophobicContact CE1-CB 4.4Å; Y16-A184 HydrophobicContact CE2-CB 3.57Å
17K98.1Very high97.1Very high79 Ų7951.1 Ų51.134%0.34327%0.267SS..Hα-helixtrans-62.6-45.1175.9-73172.6-178.9166.70111.6E13 S14 T15 V19 M20 E21 F119E13-K17 WeakPolarHBondContact O-CG 3.34Å; E13-K17 PolarHBondContact O-N 3.36Å; S14-K17 PolarHBondContact O-N 2.93Å; T15-K17 VanDerWaalsContact C-N 3.33Å; T15-K17 PolarHBondContact O-N 2.71Å; K17-V19 VanDerWaalsContact C-N 3.3Å; K17-V19 PolarHBondContact O-N 3.04Å; K17-M20 PolarHBondContact O-N 2.87Å; K17-M20 VanDerWaalsContact O-N 3.14Å; K17-E21 VanDerWaalsContact O-CB 3.25Å; K17-E21 WeakPolarHBondContact O-CB 3.46Å; K17-E21 WeakPolarHBondContact O-CG 3.26Å; K17-E21 PolarHBondContact O-N 3.12Å; K17-F119 HydrophobicContact CG-CE1 4.41Å; K17-F119 HydrophobicContact CG-CZ 4.36Å
18N98.2Very high97.4Very high67 Ų6750.7 Ų50.736%0.35826%0.26SS..Hα-helixtrans-55.7-45.7177.4-169.921.7000111.5S14 T15 M20 Q22 F23 E188S14-N18 WeakPolarHBondContact O-CB 3.44Å; S14-N18 PolarHBondContact O-N 2.77Å; T15-N18 PolarHBondContact O-N 2.92Å; N18-M20 PolarHBondContact O-N 3.18Å; N18-Q22 WeakPolarHBondContact O-CA 3.31Å; N18-Q22 VanDerWaalsContact O-CB 3.28Å; N18-Q22 WeakPolarHBondContact O-CB 3.48Å; N18-Q22 PolarHBondContact O-N 3.39Å; N18-Q22 WeakPolarHBondContact OD1-CB 3.5Å; N18-Q22 WeakPolarHBondContact OD1-CG 3.4Å; N18-F23 PolarHBondContact O-N 3.28Å; N18-E188 PolarHBondContact ND2-OE1 3.48Å
19V98.2Very high97.6Very high1 Ų153.8 Ų53.81%0.00627%0.274CS..Iπ-helixtrans-61.4-46.1177.5173.40000111.8T15 Y16 K17 F23 N24 M115 E188 R191T15-V19 WeakPolarHBondContact O-CG2 3.44Å; T15-V19 PolarHBondContact O-N 3.32Å; Y16-V19 PolarHBondContact O-N 3.01Å; K17-V19 VanDerWaalsContact C-N 3.3Å; K17-V19 PolarHBondContact O-N 3.04Å; V19-F23 HydrophobicContact CG1-CD1 4.48Å; V19-F23 WeakPolarHBondContact O-CB 3.26Å; V19-F23 PolarHBondContact O-N 3.46Å; V19-N24 PolarHBondContact O-N 2.91Å; V19-M115 HydrophobicContact CB-CE 3.88Å; V19-M115 HydrophobicContact CG1-CE 3.75Å; V19-M115 HydrophobicContact CG1-CG 3.95Å; V19-M115 HydrophobicContact CG2-CE 4.15Å; V19-E188 HydrophobicContact CG2-CB 3.95Å; V19-E188 HydrophobicContact CG2-CG 4.18Å; V19-R191 VanDerWaalsContact CG1-CD 3.44Å
20M97.6Very high97.8Very high43 Ų4355.8 Ų55.821%0.21228%0.284CS..Iπ-helixtrans-75.9-37.1-175.4-67-174.8-64.100113.8Y16 K17 N18 P25 M115 F119Y16-M20 WeakPolarHBondContact O-CE 3.32Å; Y16-M20 WeakPolarHBondContact O-CG 3.44Å; Y16-M20 PolarHBondContact O-N 2.93Å; Y16-M20 VanDerWaalsContact O-N 3.14Å; K17-M20 PolarHBondContact O-N 2.87Å; K17-M20 VanDerWaalsContact O-N 3.14Å; N18-M20 PolarHBondContact O-N 3.18Å; M20-P25 VanDerWaalsContact O-CD 3.25Å; M20-P25 WeakPolarHBondContact O-CD 3.47Å; M20-M115 HydrophobicContact CG-CB 3.82Å; M20-M115 HydrophobicContact SD-CB 4.23Å; M20-F119 HydrophobicContact CE-CB 4.16Å; M20-F119 HydrophobicContact CE-CD1 3.51Å; M20-F119 HydrophobicContact CE-CE1 4.12Å; M20-F119 HydrophobicContact CE-CG 4Å
21E97.4Very high97.9Very high122 Ų12249 Ų4957%0.5726%0.255SS*.Iπ-helixtrans-96.8-24.4-170.4-62.5175.2-173.100112.7K17 P25K17-E21 VanDerWaalsContact O-CB 3.25Å; K17-E21 WeakPolarHBondContact O-CB 3.46Å; K17-E21 WeakPolarHBondContact O-CG 3.26Å; K17-E21 PolarHBondContact O-N 3.12Å; E21-P25 WeakPolarHBondContact O-CG 3.39Å
22Q97.2Very high98Very high125 Ų12549.2 Ų49.258%0.58426%0.256SS*.Iπ-helixtrans-116.7-58.8-178.9-55.6-66.7-12.900111.7N18 G26N18-Q22 WeakPolarHBondContact O-CA 3.31Å; N18-Q22 VanDerWaalsContact O-CB 3.28Å; N18-Q22 WeakPolarHBondContact O-CB 3.48Å; N18-Q22 PolarHBondContact O-N 3.39Å; N18-Q22 WeakPolarHBondContact OD1-CB 3.5Å; N18-Q22 WeakPolarHBondContact OD1-CG 3.4Å; Q22-G26 PolarHBondContact O-N 2.99Å
23F98Very high98Very high24 Ų2453.9 Ų53.911%0.10528%0.28CS..Iπ-helixtrans-63.2-52.2-173179.1-91.7000112.2N18 V19 G26 L27 R191 F192 L195N18-F23 PolarHBondContact O-N 3.28Å; V19-F23 HydrophobicContact CG1-CD1 4.48Å; V19-F23 WeakPolarHBondContact O-CB 3.26Å; V19-F23 PolarHBondContact O-N 3.46Å; F23-G26 CarbonylContact O-C 3.46Å; F23-G26 PolarHBondContact O-N 3.12Å; F23-L27 HydrophobicContact CE1-CB 4.44Å; F23-L27 HydrophobicContact CE1-CD2 3.77Å; F23-L27 HydrophobicContact CZ-CD2 3.99Å; F23-L27 WeakPolarHBondContact O-CB 3.46Å; F23-L27 PolarHBondContact O-N 3.47Å; F23-R191 HydrophobicContact CD1-CB 4.23Å; F23-R191 HydrophobicContact CD1-CG 4.48Å; F23-R191 HydrophobicContact CE1-CB 3.63Å; F23-R191 HydrophobicContact CE1-CG 3.98Å; F23-R191 HydrophobicContact CE2-CB 4.16Å; F23-R191 HydrophobicContact CZ-CB 3.6Å; F23-R191 HydrophobicContact CZ-CG 4.42Å; F23-F192 HydrophobicContact CD2-CD1 4.36Å; F23-F192 AromaticContact CD2-CE1 3.84Å; F23-F192 HydrophobicContact CD2-CE1 3.84Å; F23-F192 HydrophobicContact CD2-CE2 4.18Å; F23-F192 AromaticContact CD2-CZ 3.74Å; F23-F192 HydrophobicContact CD2-CZ 3.74Å; F23-F192 HydrophobicContact CE2-CD1 4.03Å; F23-F192 AromaticContact CE2-CE1 3.93Å; F23-F192 HydrophobicContact CE2-CE1 3.93Å; F23-F192 HydrophobicContact CE2-CG 4.41Å; F23-F192 HydrophobicContact CE2-CZ 4.24Å; F23-L195 HydrophobicContact CE2-CD2 4.33Å
24N97.5Very high98Very high2 Ų252.1 Ų52.11%0.01127%0.274CS..Hα-helixtrans-65-44.6-176.7-79.8-20.4000113.2V19 G26 L27 R28 D111 V112V19-N24 PolarHBondContact O-N 2.91Å; N24-G26 VanDerWaalsContact C-N 3.35Å; N24-L27 PolarHBondContact O-N 2.85Å; N24-R28 PolarHBondContact O-N 3.21Å; N24-D111 PolarHBondContact ND2-OD2 3.45Å; N24-D111 PolarHBondContact OD1-OD2 3.19Å; N24-V112 HydrophobicContact CB-CG2 4.45Å
25P97.7Very high98Very high58 Ų5852.6 Ų52.638%0.37727%0.269SS..Hα-helixtrans-61.4-41170.8-28.238.8000113M20 E21 L27 R28 N29M20-P25 VanDerWaalsContact O-CD 3.25Å; M20-P25 WeakPolarHBondContact O-CD 3.47Å; E21-P25 WeakPolarHBondContact O-CG 3.39Å; P25-L27 PolarHBondContact O-N 3.34Å; P25-R28 PolarHBondContact O-N 3.39Å; P25-N29 PolarHBondContact O-N 2.79Å
26G97.9Very high98Very high39 Ų3955.5 Ų55.540%0.40229%0.289SS..Hα-helixtrans-60.9-42.6175.400000112.4Q22 F23 N24 N29 L30Q22-G26 PolarHBondContact O-N 2.99Å; F23-G26 CarbonylContact O-C 3.46Å; F23-G26 PolarHBondContact O-N 3.12Å; N24-G26 VanDerWaalsContact C-N 3.35Å; G26-N29 WeakPolarHBondContact O-CB 3.48Å; G26-N29 PolarHBondContact O-N 3.05Å; G26-L30 PolarHBondContact O-N 3.47Å
27L97.5Very high98Very high7 Ų760.4 Ų60.44%0.03731%0.309CS..Hα-helixtrans-67.7-39.5178-170.556.9000112F23 N24 P25 N29 L30 V31 L104 T108 L195F23-L27 HydrophobicContact CE1-CB 4.44Å; F23-L27 HydrophobicContact CE1-CD2 3.77Å; F23-L27 HydrophobicContact CZ-CD2 3.99Å; F23-L27 WeakPolarHBondContact O-CB 3.46Å; F23-L27 PolarHBondContact O-N 3.47Å; N24-L27 PolarHBondContact O-N 2.85Å; P25-L27 PolarHBondContact O-N 3.34Å; L27-N29 VanDerWaalsContact C-N 3.33Å; L27-N29 PolarHBondContact O-N 3.46Å; L27-L30 HydrophobicContact CD1-CD2 4.08Å; L27-L30 WeakPolarHBondContact O-CB 3.36Å; L27-L30 PolarHBondContact O-N 3.37Å; L27-V31 WeakPolarHBondContact O-CG2 3.49Å; L27-V31 PolarHBondContact O-N 3.01Å; L27-L104 HydrophobicContact CD1-CD1 4.08Å; L27-L104 HydrophobicContact CD1-CD2 4.09Å; L27-L104 HydrophobicContact CD1-CG 4.45Å; L27-T108 WeakPolarHBondContact CD2-OG1 3.32Å; L27-T108 WeakPolarHBondContact CG-OG1 3.31Å; L27-L195 HydrophobicContact CD1-CD1 3.87Å
28R97.8Very high98Very high116 Ų11658.1 Ų58.144%0.43830%0.299SS..Hα-helixtrans-61.9-42172.8-173178.4-66.6136.51.8111.8N24 P25 L30 V31 N32 T108N24-R28 PolarHBondContact O-N 3.21Å; P25-R28 PolarHBondContact O-N 3.39Å; R28-L30 VanDerWaalsContact C-N 3.34Å; R28-V31 PolarHBondContact O-N 3.31Å; R28-N32 PolarHBondContact O-N 2.96Å; R28-N32 VanDerWaalsContact O-N 3.13Å; R28-T108 HydrophobicContact CB-CG2 4.43Å
29N98.3Very high98Very high88 Ų8862.6 Ų62.647%0.47132%0.316SS..Hα-helixtrans-62.8-42.5174-175.555000111.4P25 G26 L27 V31 N32 L33P25-N29 PolarHBondContact O-N 2.79Å; G26-N29 WeakPolarHBondContact O-CB 3.48Å; G26-N29 PolarHBondContact O-N 3.05Å; L27-N29 VanDerWaalsContact C-N 3.33Å; L27-N29 PolarHBondContact O-N 3.46Å; N29-V31 VanDerWaalsContact C-N 3.32Å; N29-V31 PolarHBondContact O-N 3.41Å; N29-N32 WeakPolarHBondContact O-CB 3.35Å; N29-N32 PolarHBondContact O-N 3.27Å; N29-N32 VanDerWaalsContact O-N 3.14Å; N29-L33 WeakPolarHBondContact O-CG 3.39Å; N29-L33 PolarHBondContact O-N 3.43Å
30L98.4Very high98Very high59 Ų5966.2 Ų66.231%0.30934%0.341SS..Hα-helixtrans-59.8-40.8175.9-178.163000112.3G26 L27 R28 N32 L33 G34 L104 L195G26-L30 PolarHBondContact O-N 3.47Å; L27-L30 HydrophobicContact CD1-CD2 4.08Å; L27-L30 WeakPolarHBondContact O-CB 3.36Å; L27-L30 PolarHBondContact O-N 3.37Å; R28-L30 VanDerWaalsContact C-N 3.34Å; L30-N32 VanDerWaalsContact C-N 3.35Å; L30-N32 PolarHBondContact O-N 3.46Å; L30-L33 PolarHBondContact O-N 2.87Å; L30-G34 PolarHBondContact O-N 2.91Å; L30-L104 HydrophobicContact CD2-CD1 4.41Å; L30-L195 HydrophobicContact CD2-CD1 3.8Å
31V98.4Very high97.9Very high4 Ų464.7 Ų64.72%0.02433%0.334CS..Hα-helixtrans-59.3-45.4173.6166.90000111.1L27 R28 N29 G34 K35 I101 L104 E105L27-V31 WeakPolarHBondContact O-CG2 3.49Å; L27-V31 PolarHBondContact O-N 3.01Å; R28-V31 PolarHBondContact O-N 3.31Å; N29-V31 VanDerWaalsContact C-N 3.32Å; N29-V31 PolarHBondContact O-N 3.41Å; V31-G34 PolarHBondContact O-N 3.01Å; V31-K35 HydrophobicContact CG1-CD 4.47Å; V31-K35 WeakPolarHBondContact O-CG 3.46Å; V31-K35 PolarHBondContact O-N 3.22Å; V31-I101 HydrophobicContact CG1-CG2 4.16Å; V31-L104 HydrophobicContact CG2-CB 3.63Å; V31-L104 HydrophobicContact CG2-CD1 4.48Å; V31-E105 HydrophobicContact CG1-CB 4.06Å; V31-E105 HydrophobicContact CG1-CG 4.39Å; V31-E105 HydrophobicContact CG2-CB 4.45Å
32N98.4Very high97.9Very high82 Ų8262.2 Ų62.244%0.43933%0.325SS..Hα-helixtrans-63-44177.4-68.1-23.4000111.9R28 N29 L30 G34 K35 S36R28-N32 PolarHBondContact O-N 2.96Å; R28-N32 VanDerWaalsContact O-N 3.13Å; N29-N32 WeakPolarHBondContact O-CB 3.35Å; N29-N32 PolarHBondContact O-N 3.27Å; N29-N32 VanDerWaalsContact O-N 3.14Å; L30-N32 VanDerWaalsContact C-N 3.35Å; L30-N32 PolarHBondContact O-N 3.46Å; N32-G34 VanDerWaalsContact C-N 3.29Å; N32-G34 PolarHBondContact O-N 3.44Å; N32-K35 PolarHBondContact O-N 3.46Å; N32-S36 PolarHBondContact O-N 3.35Å; N32-S36 PolarHBondContact O-OG 2.97Å
33L98.6Very high97.9Very high97 Ų9759.3 Ų59.351%0.50832%0.322SS..Hα-helixtrans-62.5-38.4175-69.5173.4000111.6N29 L30 S36 Y37N29-L33 WeakPolarHBondContact O-CG 3.39Å; N29-L33 PolarHBondContact O-N 3.43Å; L30-L33 PolarHBondContact O-N 2.87Å; L33-S36 WeakPolarHBondContact O-CB 3.46Å; L33-S36 PolarHBondContact O-N 3.49Å; L33-Y37 WeakPolarHBondContact O-CB 3.5Å; L33-Y37 PolarHBondContact O-N 3.15Å
34G98.4Very high97.8Very high7 Ų762.5 Ų62.57%0.07234%0.338CS..Hα-helixtrans-61.6-43.5174.200000113L30 V31 N32 Y37 E38L30-G34 PolarHBondContact O-N 2.91Å; V31-G34 PolarHBondContact O-N 3.01Å; N32-G34 VanDerWaalsContact C-N 3.29Å; N32-G34 PolarHBondContact O-N 3.44Å; G34-Y37 WeakPolarHBondContact O-CB 3.24Å; G34-Y37 PolarHBondContact O-N 3.48Å; G34-E38 PolarHBondContact O-N 3.21Å
35K98.3Very high97.8Very high70 Ų7062.5 Ų62.530%0.30434%0.338SS..Hα-helixtrans-62.5-41.3173.4-68.9174.6-179.2177.90111.8V31 N32 Y37 E38 K39 I101 E105V31-K35 HydrophobicContact CG1-CD 4.47Å; V31-K35 WeakPolarHBondContact O-CG 3.46Å; V31-K35 PolarHBondContact O-N 3.22Å; N32-K35 PolarHBondContact O-N 3.46Å; K35-Y37 VanDerWaalsContact C-N 3.35Å; K35-E38 PolarHBondContact O-N 3.27Å; K35-K39 PolarHBondContact O-N 3.44Å; K35-I101 HydrophobicContact CG-CG2 3.88Å; K35-E105 WeakPolarHBondContact CE-OE2 3.11Å; K35-E105 IonicContact NZ-OE1 2.74Å; K35-E105 PolarHBondContact NZ-OE1 3.22Å; K35-E105 IonicContact NZ-OE2 2.7Å; K35-E105 PolarHBondContact NZ-OE2 3.47Å
36S98.5Very high97.6Very high69 Ų6964.3 Ų64.348%0.48334%0.343SS..Hα-helixtrans-63.8-40.2174.2-66.30000112N32 L33 K39 S40N32-S36 PolarHBondContact O-N 3.35Å; N32-S36 PolarHBondContact O-OG 2.97Å; L33-S36 WeakPolarHBondContact O-CB 3.46Å; L33-S36 PolarHBondContact O-N 3.49Å; S36-K39 PolarHBondContact O-N 3.32Å; S36-S40 PolarHBondContact O-N 2.97Å; S36-S40 PolarHBondContact O-OG 2.89Å
37Y98.4Very high97.6Very high109 Ų10965 Ų6543%0.42734%0.344SS..Hα-helixtrans-62.8-47.4177-179.2-148.2000111.6L33 G34 K35 K39 S40 V41 F93 F96 F206L33-Y37 WeakPolarHBondContact O-CB 3.5Å; L33-Y37 PolarHBondContact O-N 3.15Å; G34-Y37 WeakPolarHBondContact O-CB 3.24Å; G34-Y37 PolarHBondContact O-N 3.48Å; K35-Y37 VanDerWaalsContact C-N 3.35Å; Y37-K39 VanDerWaalsContact C-N 3.33Å; Y37-K39 PolarHBondContact O-N 3.44Å; Y37-S40 PolarHBondContact O-N 3.44Å; Y37-V41 HydrophobicContact CD2-CG2 4.03Å; Y37-V41 HydrophobicContact CE2-CG2 3.69Å; Y37-V41 PolarHBondContact O-N 2.91Å; Y37-F93 AromaticContact CD1-CE1 3.89Å; Y37-F93 HydrophobicContact CD1-CE1 3.89Å; Y37-F93 HydrophobicContact CD1-CZ 4.15Å; Y37-F93 HydrophobicContact CD2-CE1 4.49Å; Y37-F93 AromaticContact CE1-CE1 3.81Å; Y37-F93 HydrophobicContact CE1-CE1 3.81Å; Y37-F93 AromaticContact CE1-CZ 3.58Å; Y37-F93 HydrophobicContact CE1-CZ 3.58Å; Y37-F93 HydrophobicContact CE2-CE1 4.41Å; Y37-F93 HydrophobicContact CE2-CZ 4.07Å; Y37-F93 HydrophobicContact CG-CE1 4.25Å; Y37-F93 AromaticContact CZ-CZ 3.54Å; Y37-F96 HydrophobicContact CD1-CE1 4.38Å; Y37-F96 HydrophobicContact CD1-CZ 4.31Å; Y37-F206 HydrophobicContact CE1-CZ 4.42Å
38E97.4Very high97.6Very high32 Ų3265.3 Ų65.315%0.1535%0.35CS..Hα-helixtrans-56.7-45.3174.2179.5-175.5-16400111.9G34 K35 S40 V41 N42 F93 F96 H97G34-E38 PolarHBondContact O-N 3.21Å; K35-E38 PolarHBondContact O-N 3.27Å; E38-S40 VanDerWaalsContact C-N 3.33Å; E38-S40 PolarHBondContact O-N 2.96Å; E38-V41 PolarHBondContact O-N 2.82Å; E38-N42 PolarHBondContact O-N 2.94Å; E38-N42 PolarHBondContact O-ND2 2.97Å; E38-F93 HydrophobicContact CB-CD1 4.17Å; E38-F93 HydrophobicContact CG-CD1 4.29Å; E38-F96 HydrophobicContact CB-CE1 4.45Å; E38-H97 WeakPolarHBondContact OE1-CB 3.42Å; E38-H97 IonicContact OE1-CG 3.47Å; E38-H97 IonicContact OE1-ND1 2.88Å; E38-H97 PolarHBondContact OE1-ND1 3.38Å; E38-H97 IonicContact OE2-CE1 3.64Å; E38-H97 IonicContact OE2-CG 3.76Å; E38-H97 IonicContact OE2-ND1 3.53Å; E38-H97 PolarHBondContact OE2-ND1 3.44Å
39K97.6Very high97.5Very high161 Ų16165 Ų6570%0.735%0.352SS*.Hα-helixtrans-58.5-44.3177.1-174.7-177.4178-175.20111.9K35 S36 Y37 V41 N42 A43K35-K39 PolarHBondContact O-N 3.44Å; S36-K39 PolarHBondContact O-N 3.32Å; Y37-K39 VanDerWaalsContact C-N 3.33Å; Y37-K39 PolarHBondContact O-N 3.44Å; K39-V41 VanDerWaalsContact C-N 3.35Å; K39-N42 PolarHBondContact O-N 3.1Å; K39-A43 PolarHBondContact O-N 3.23Å
40S98.3Very high97.5Very high77 Ų7767.1 Ų67.154%0.53836%0.36SS..Hα-helixtrans-64-39.6177.8-64.60000112.1S36 Y37 E38 A43 M44S36-S40 PolarHBondContact O-N 2.97Å; S36-S40 PolarHBondContact O-OG 2.89Å; Y37-S40 PolarHBondContact O-N 3.44Å; E38-S40 VanDerWaalsContact C-N 3.33Å; E38-S40 PolarHBondContact O-N 2.96Å; S40-A43 PolarHBondContact O-N 3.06Å; S40-M44 PolarHBondContact O-N 3.31Å
41V96.6Very high97.5Very high11 Ų1171.4 Ų71.47%0.06737%0.374CS..Hα-helixtrans-68.4-37.3176.91730000111.9Y37 E38 K39 A43 M44 S45 M89 F93Y37-V41 HydrophobicContact CD2-CG2 4.03Å; Y37-V41 HydrophobicContact CE2-CG2 3.69Å; Y37-V41 PolarHBondContact O-N 2.91Å; E38-V41 PolarHBondContact O-N 2.82Å; K39-V41 VanDerWaalsContact C-N 3.35Å; V41-A43 VanDerWaalsContact C-N 3.34Å; V41-A43 PolarHBondContact O-N 3.33Å; V41-M44 HydrophobicContact CG1-CE 4.14Å; V41-M44 WeakPolarHBondContact O-CB 3.48Å; V41-M44 PolarHBondContact O-N 2.98Å; V41-S45 WeakPolarHBondContact O-CB 3.44Å; V41-S45 PolarHBondContact O-N 3.41Å; V41-M89 HydrophobicContact CG1-CG 4.05Å; V41-F93 HydrophobicContact CB-CD1 4.13Å; V41-F93 HydrophobicContact CB-CD2 4.31Å; V41-F93 HydrophobicContact CB-CE1 4.01Å; V41-F93 HydrophobicContact CB-CE2 4.2Å; V41-F93 HydrophobicContact CB-CG 4.27Å; V41-F93 HydrophobicContact CB-CZ 4.05Å; V41-F93 HydrophobicContact CG1-CD1 4.26Å; V41-F93 HydrophobicContact CG1-CD2 3.62Å; V41-F93 HydrophobicContact CG1-CE1 4.36Å; V41-F93 HydrophobicContact CG1-CE2 3.74Å; V41-F93 HydrophobicContact CG1-CG 3.89Å; V41-F93 HydrophobicContact CG1-CZ 4.12Å; V41-F93 HydrophobicContact CG2-CD1 4.38Å; V41-F93 HydrophobicContact CG2-CE1 3.75Å; V41-F93 HydrophobicContact CG2-CE2 3.91Å; V41-F93 HydrophobicContact CG2-CZ 3.49Å; V41-F93 VanDerWaalsContact CG2-CZ 3.49Å
42N95.9Very high97.5Very high70 Ų7072.7 Ų72.737%0.37438%0.379SS..Hα-helixtrans-62.5-41.4172.7-72.2-24.5000111.8E38 K39 S45 M46E38-N42 PolarHBondContact O-N 2.94Å; E38-N42 PolarHBondContact O-ND2 2.97Å; K39-N42 PolarHBondContact O-N 3.1Å; N42-S45 WeakPolarHBondContact O-CB 3.4Å; N42-S45 PolarHBondContact O-N 2.9Å; N42-M46 WeakPolarHBondContact O-CG 3.34Å; N42-M46 PolarHBondContact O-N 3.24Å
43A97.4Very high97.5Very high64 Ų6472 Ų7253%0.52938%0.375SS..Hα-helixtrans-63.9-43.8175.300000112K39 S40 V41 S45 M46 A47K39-A43 PolarHBondContact O-N 3.23Å; S40-A43 PolarHBondContact O-N 3.06Å; V41-A43 VanDerWaalsContact C-N 3.34Å; V41-A43 PolarHBondContact O-N 3.33Å; A43-S45 VanDerWaalsContact C-N 3.26Å; A43-S45 PolarHBondContact O-N 2.88Å; A43-M46 PolarHBondContact O-N 3.34Å; A43-A47 PolarHBondContact O-N 2.99Å
44M97.3Very high97.5Very high91 Ų9170 Ų7045%0.44837%0.373SS..Hα-helixtrans-57-42.2172.7-179.2-169.678.100111.1S40 V41 A47 G48 M89S40-M44 PolarHBondContact O-N 3.31Å; V41-M44 HydrophobicContact CG1-CE 4.14Å; V41-M44 WeakPolarHBondContact O-CB 3.48Å; V41-M44 PolarHBondContact O-N 2.98Å; M44-A47 PolarHBondContact O-N 3.43Å; M44-G48 PolarHBondContact O-N 3.45Å; M44-M89 HydrophobicContact CE-CG 4.48Å
45S95.7Very high97.5Very high1 Ų171.1 Ų71.11%0.00738%0.377CS..Hα-helixtrans-61.1-45.8178.6-156.90000113.3V41 N42 A43 G48 K49 Q86 E90V41-S45 WeakPolarHBondContact O-CB 3.44Å; V41-S45 PolarHBondContact O-N 3.41Å; N42-S45 WeakPolarHBondContact O-CB 3.4Å; N42-S45 PolarHBondContact O-N 2.9Å; A43-S45 VanDerWaalsContact C-N 3.26Å; A43-S45 PolarHBondContact O-N 2.88Å; S45-G48 PolarHBondContact O-N 3.13Å; S45-K49 WeakPolarHBondContact O-CB 3.29Å; S45-K49 PolarHBondContact O-N 2.91Å; S45-Q86 WeakPolarHBondContact OG-CG 3.47Å; S45-Q86 PolarHBondContact OG-NE2 2.9Å; S45-E90 WeakPolarHBondContact CB-OE1 3.43Å; S45-E90 VanDerWaalsContact OG-CD 3.25Å; S45-E90 VanDerWaalsContact OG-CG 3.26Å; S45-E90 WeakPolarHBondContact OG-CG 3.43Å; S45-E90 PolarHBondContact OG-OE1 3.44Å
46M95.1Very high97.5Very high97 Ų9768.3 Ų68.348%0.47837%0.366SS..Hα-helixtrans-65.8-42177.9-66.2-59.396.200112N42 A43 K49 M50 E90N42-M46 WeakPolarHBondContact O-CG 3.34Å; N42-M46 PolarHBondContact O-N 3.24Å; A43-M46 PolarHBondContact O-N 3.34Å; M46-K49 PolarHBondContact O-N 3.44Å; M46-M50 WeakPolarHBondContact O-CG 3.47Å; M46-M50 PolarHBondContact O-N 3.23Å; M46-M50 VanDerWaalsContact O-N 3.11Å; M46-E90 WeakPolarHBondContact CE-OE1 3.35Å
47A97.8Very high97.5Very high52 Ų5270.3 Ų70.343%0.4337%0.366SS..Hα-helixtrans-62.3-45.5175.300000111.8A43 M44 K49 M50 Y51A43-A47 PolarHBondContact O-N 2.99Å; M44-A47 PolarHBondContact O-N 3.43Å; A47-K49 PolarHBondContact O-N 3.48Å; A47-M50 PolarHBondContact O-N 3.32Å; A47-Y51 PolarHBondContact O-N 3.32Å; A47-Y51 VanDerWaalsContact O-N 3.07Å
48G97.5Very high97.4Very high15 Ų1569.9 Ų69.916%0.15537%0.37CS..Hα-helixtrans-59.3-44.817600000112M44 S45 M50 Y51 F52M44-G48 PolarHBondContact O-N 3.45Å; S45-G48 PolarHBondContact O-N 3.13Å; G48-M50 PolarHBondContact O-N 3.2Å; G48-Y51 PolarHBondContact O-N 2.92Å; G48-F52 WeakPolarHBondContact O-CD2 3.43Å; G48-F52 PolarHBondContact O-N 2.97Å
49K95.3Very high97.5Very high109 Ų10968.3 Ų68.347%0.47436%0.363SS..Hα-helixtrans-56.8-49.5176-176179177.4-1760111.9S45 M46 A47 Y51 F52 D53S45-K49 WeakPolarHBondContact O-CB 3.29Å; S45-K49 PolarHBondContact O-N 2.91Å; M46-K49 PolarHBondContact O-N 3.44Å; A47-K49 PolarHBondContact O-N 3.48Å; K49-Y51 VanDerWaalsContact C-N 3.3Å; K49-Y51 PolarHBondContact O-N 3.13Å; K49-F52 PolarHBondContact O-N 3.03Å; K49-D53 WeakPolarHBondContact O-CB 3.17Å; K49-D53 PolarHBondContact O-N 3.44Å
50M97.4Very high97.5Very high132 Ų13265.2 Ų65.265%0.6535%0.351SS*.Hα-helixtrans-59.5-40.7178.3-68.9-172.6-66.100112.4M46 A47 G48 A54M46-M50 WeakPolarHBondContact O-CG 3.47Å; M46-M50 PolarHBondContact O-N 3.23Å; M46-M50 VanDerWaalsContact O-N 3.11Å; A47-M50 PolarHBondContact O-N 3.32Å; G48-M50 PolarHBondContact O-N 3.2Å; M50-A54 PolarHBondContact O-N 3.29Å; M50-A54 VanDerWaalsContact O-N 3.09Å
51Y98.6Very high97.4Very high150 Ų15066.8 Ų66.859%0.58835%0.353SS*.Hα-helixtrans-63.1-49.7177.7177.5-97000112.1A47 G48 K49 D53 A54 L55A47-Y51 PolarHBondContact O-N 3.32Å; A47-Y51 VanDerWaalsContact O-N 3.07Å; G48-Y51 PolarHBondContact O-N 2.92Å; K49-Y51 VanDerWaalsContact C-N 3.3Å; K49-Y51 PolarHBondContact O-N 3.13Å; Y51-D53 VanDerWaalsContact C-N 3.34Å; Y51-D53 PolarHBondContact O-N 3.04Å; Y51-A54 PolarHBondContact O-N 3.05Å; Y51-L55 PolarHBondContact O-N 2.94Å
52F98.4Very high97.3Very high30 Ų3067.4 Ų67.413%0.13236%0.359CS..Hα-helixtrans-72.8-26.4-179.1-66.2-62.1000112.7G48 K49 L55 S56 S79 H82 R83G48-F52 WeakPolarHBondContact O-CD2 3.43Å; G48-F52 PolarHBondContact O-N 2.97Å; K49-F52 PolarHBondContact O-N 3.03Å; F52-L55 HydrophobicContact CD1-CD2 4.04Å; F52-L55 HydrophobicContact CE1-CD2 4.45Å; F52-L55 PolarHBondContact O-N 3.18Å; F52-S56 WeakPolarHBondContact O-CB 3.4Å; F52-S56 PolarHBondContact O-N 2.91Å; F52-S79 VanDerWaalsContact O-CB 3.29Å; F52-S79 WeakPolarHBondContact O-CB 3.48Å; F52-H82 HydrophobicContact CD1-CB 3.69Å; F52-H82 HydrophobicContact CD2-CB 3.71Å; F52-H82 HydrophobicContact CE1-CB 3.39Å; F52-H82 AromaticContact CE1-CD2 3.68Å; F52-H82 AromaticContact CE1-CG 3.45Å; F52-H82 VanDerWaalsContact CE1-CG 3.45Å; F52-H82 HydrophobicContact CE2-CB 3.46Å; F52-H82 VanDerWaalsContact CE2-CB 3.46Å; F52-H82 AromaticContact CE2-CG 3.96Å; F52-H82 HydrophobicContact CG-CB 3.86Å; F52-H82 HydrophobicContact CZ-CB 3.29Å; F52-H82 AromaticContact CZ-CD2 3.94Å; F52-H82 AromaticContact CZ-CG 3.32Å; F52-H82 AromaticContact CZ-ND1 3.55Å; F52-R83 HydrophobicContact CB-CG 3.92Å; F52-R83 PolarHBondContact O-NH2 2.91Å
53D98.1Very high97.1Very high68 Ų6866 Ų6636%0.36436%0.358SS..Hα-helixtrans-65.1-43.9169.8-70.9-10.9000111.3K49 Y51 S56 K57 R83K49-D53 WeakPolarHBondContact O-CB 3.17Å; K49-D53 PolarHBondContact O-N 3.44Å; Y51-D53 VanDerWaalsContact C-N 3.34Å; Y51-D53 PolarHBondContact O-N 3.04Å; D53-S56 WeakPolarHBondContact O-CB 3.41Å; D53-S56 PolarHBondContact O-N 3.4Å; D53-K57 PolarHBondContact O-N 2.97Å; D53-R83 IonicContact OD1-CZ 2.83Å; D53-R83 IonicContact OD1-NE 3.62Å; D53-R83 PolarHBondContact OD1-NE 3.35Å; D53-R83 IonicContact OD1-NH2 3.89Å; D53-R83 PolarHBondContact OD1-NH2 3.45Å
54A98.6Very high96.8Very high56 Ų5666.3 Ų66.346%0.46337%0.367SS..Hα-helixtrans-63.5-42.117400000112.2M50 Y51 S56 K57 I58M50-A54 PolarHBondContact O-N 3.29Å; M50-A54 VanDerWaalsContact O-N 3.09Å; Y51-A54 PolarHBondContact O-N 3.05Å; A54-S56 PolarHBondContact O-N 2.84Å; A54-K57 PolarHBondContact O-N 2.93Å; A54-I58 WeakPolarHBondContact O-CG1 3.46Å; A54-I58 PolarHBondContact O-N 2.65Å; A54-I58 VanDerWaalsContact O-N 3.12Å
55L98.6Very high96.5Very high30 Ų3063.5 Ų63.516%0.15736%0.356CS..Hα-helixtrans-60.2-45.7176.7-173.864.9000111.8Y51 F52 K57 I58 G59 L75 I78Y51-L55 PolarHBondContact O-N 2.94Å; F52-L55 HydrophobicContact CD1-CD2 4.04Å; F52-L55 HydrophobicContact CE1-CD2 4.45Å; F52-L55 PolarHBondContact O-N 3.18Å; L55-K57 VanDerWaalsContact C-N 3.26Å; L55-K57 PolarHBondContact O-N 2.79Å; L55-I58 PolarHBondContact O-N 3.32Å; L55-G59 PolarHBondContact O-N 3.46Å; L55-L75 HydrophobicContact CD1-CD2 3.92Å; L55-I78 HydrophobicContact CD2-CG2 3.88Å
56S98.4Very high96.2Very high11 Ų1168 Ų688%0.07739%0.385CS..Hα-helixtrans-58.5-40.5175.2-1660000111.7F52 D53 A54 I58 G59 E60 S79 R83F52-S56 WeakPolarHBondContact O-CB 3.4Å; F52-S56 PolarHBondContact O-N 2.91Å; D53-S56 WeakPolarHBondContact O-CB 3.41Å; D53-S56 PolarHBondContact O-N 3.4Å; A54-S56 PolarHBondContact O-N 2.84Å; S56-I58 VanDerWaalsContact C-N 3.33Å; S56-I58 PolarHBondContact O-N 3.39Å; S56-G59 CarbonylContact O-C 3.57Å; S56-G59 WeakPolarHBondContact O-CA 3.3Å; S56-G59 PolarHBondContact O-N 3.48Å; S56-G59 VanDerWaalsContact O-N 3.11Å; S56-E60 WeakPolarHBondContact O-CG 3.18Å; S56-E60 PolarHBondContact O-N 2.94Å; S56-S79 VanDerWaalsContact CB-OG 3.3Å; S56-S79 WeakPolarHBondContact CB-OG 3.48Å; S56-S79 PolarHBondContact OG-OG 3.42Å; S56-R83 PolarHBondContact OG-NH2 3.09Å; S56-R83 VanDerWaalsContact OG-NH2 3.13Å
57K98.3Very high96Very high110 Ų11066.2 Ų66.248%0.47838%0.38SS..Hα-helixtrans-65.4-37.7179.7-170.362.8-170.3169.30112.6D53 A54 L55 G59 E60 N61D53-K57 PolarHBondContact O-N 2.97Å; A54-K57 PolarHBondContact O-N 2.93Å; L55-K57 VanDerWaalsContact C-N 3.26Å; L55-K57 PolarHBondContact O-N 2.79Å; K57-G59 VanDerWaalsContact C-N 3.32Å; K57-E60 WeakPolarHBondContact CD-OE2 3.46Å; K57-E60 IonicContact NZ-OE2 3.78Å; K57-E60 PolarHBondContact NZ-OE2 3.03Å; K57-E60 PolarHBondContact O-N 3.5Å; K57-N61 VanDerWaalsContact O-CG 3.26Å; K57-N61 PolarHBondContact O-N 3.35Å; K57-N61 VanDerWaalsContact O-N 3.17Å; K57-N61 PolarHBondContact O-ND2 3.08Å; K57-N61 PolarHBondContact O-OD1 2.73Å
58I98.3Very high95.8Very high100 Ų10065.5 Ų65.551%0.51337%0.372SS..Hα-helixtrans-63.8-42.7172.3-64169000109.9A54 L55 S56 N61 A62 L75A54-I58 WeakPolarHBondContact O-CG1 3.46Å; A54-I58 PolarHBondContact O-N 2.65Å; A54-I58 VanDerWaalsContact O-N 3.12Å; L55-I58 PolarHBondContact O-N 3.32Å; S56-I58 VanDerWaalsContact C-N 3.33Å; S56-I58 PolarHBondContact O-N 3.39Å; I58-N61 PolarHBondContact O-N 2.86Å; I58-A62 PolarHBondContact O-N 3.41Å; I58-L75 HydrophobicContact CG2-CD1 4.17Å
59G97.9Very high95.5Very high0 Ų071.1 Ų71.10%039%0.392CS..Hα-helixtrans-58.7-45.2175.100000113.5L55 S56 K57 N61 A62 A63 G72L55-G59 PolarHBondContact O-N 3.46Å; S56-G59 CarbonylContact O-C 3.57Å; S56-G59 WeakPolarHBondContact O-CA 3.3Å; S56-G59 PolarHBondContact O-N 3.48Å; S56-G59 VanDerWaalsContact O-N 3.11Å; K57-G59 VanDerWaalsContact C-N 3.32Å; G59-N61 VanDerWaalsContact C-N 3.33Å; G59-N61 PolarHBondContact O-N 2.93Å; G59-A62 PolarHBondContact O-N 3.45Å; G59-A63 WeakPolarHBondContact O-CB 3.36Å; G59-A63 PolarHBondContact O-N 3.37Å; G59-G72 WeakPolarHBondContact CA-O 3.45Å; G59-G72 VanDerWaalsContact O-CA 3.24Å; G59-G72 WeakPolarHBondContact O-CA 3.37Å
60E97.3Very high95.3Very high96 Ų9671.4 Ų71.445%0.44940%0.399SS..Hα-helixtrans-58.9-41.9174.8-72.6170.2-162.300112.4S56 K57 A63 V76S56-E60 WeakPolarHBondContact O-CG 3.18Å; S56-E60 PolarHBondContact O-N 2.94Å; K57-E60 WeakPolarHBondContact CD-OE2 3.46Å; K57-E60 IonicContact NZ-OE2 3.78Å; K57-E60 PolarHBondContact NZ-OE2 3.03Å; K57-E60 PolarHBondContact O-N 3.5Å; E60-A63 WeakPolarHBondContact O-CB 3.25Å; E60-A63 PolarHBondContact O-N 2.99Å; E60-V76 HydrophobicContact CG-CG2 4.44Å
61N96.5Very high95.2Very high110 Ų11068.6 Ų68.659%0.58839%0.386SS*.Hα-helixtrans-66.1-42.1177.7-65.8-15.9000111.1K57 I58 G59 A63 G64K57-N61 VanDerWaalsContact O-CG 3.26Å; K57-N61 PolarHBondContact O-N 3.35Å; K57-N61 VanDerWaalsContact O-N 3.17Å; K57-N61 PolarHBondContact O-ND2 3.08Å; K57-N61 PolarHBondContact O-OD1 2.73Å; I58-N61 PolarHBondContact O-N 2.86Å; G59-N61 VanDerWaalsContact C-N 3.33Å; G59-N61 PolarHBondContact O-N 2.93Å; N61-A63 VanDerWaalsContact C-N 3.32Å; N61-G64 PolarHBondContact O-N 2.91Å
62A95.4Very high95Very high23 Ų2361.4 Ų61.419%0.1936%0.358CS..Hα-helixtrans-67.6-31.4176.300000112.4I58 G59 G64 S65 S68I58-A62 PolarHBondContact O-N 3.41Å; G59-A62 PolarHBondContact O-N 3.45Å; A62-G64 PolarHBondContact O-N 2.96Å; A62-S65 WeakPolarHBondContact O-CB 3.35Å; A62-S65 PolarHBondContact O-N 3.02Å; A62-S68 CarbonylContact O-C 3.52Å
63A91.9Very high94.9Very high42 Ų4262.6 Ų62.635%0.34737%0.372SS..Hα-helixtrans-62.1-24.917600000113G59 E60 N61 S65G59-A63 WeakPolarHBondContact O-CB 3.36Å; G59-A63 PolarHBondContact O-N 3.37Å; E60-A63 WeakPolarHBondContact O-CB 3.25Å; E60-A63 PolarHBondContact O-N 2.99Å; N61-A63 VanDerWaalsContact C-N 3.32Å; A63-S65 VanDerWaalsContact C-N 3.35Å
64G90.1Very high94.8Very high69 Ų6959.5 Ų59.571%0.71136%0.356SS*.THydrogen-bonded Turntrans-80.7-10172.300000114.6N61 A62N61-G64 PolarHBondContact O-N 2.91Å; A62-G64 PolarHBondContact O-N 2.96Å
65S92.1Very high94.8Very high32 Ų3259.2 Ų59.222%0.22435%0.347CS..SBendtrans-77.1134.2179.6175.20000110.9A62 A63 V67 S68 K69A62-S65 WeakPolarHBondContact O-CB 3.35Å; A62-S65 PolarHBondContact O-N 3.02Å; A63-S65 VanDerWaalsContact C-N 3.35Å; S65-V67 PolarHBondContact O-N 3.2Å; S65-V67 WeakPolarHBondContact OG-CG2 3.24Å; S65-V67 PolarHBondContact OG-N 3.1Å; S65-S68 PolarHBondContact O-N 2.88Å; S65-S68 PolarHBondContact OG-N 2.96Å; S65-S68 PolarHBondContact OG-OG 3.45Å; S65-K69 PolarHBondContact O-N 3.15Å
66P87.9Confident94.7Very high95 Ų9559.2 Ų59.262%0.61735%0.348SS*.THydrogen-bonded Turntrans-64.3-22.1176.527.1-34.6000113P235 V238P66-P235 WeakPolarHBondContact O-CG 3.34Å; P66-V238 HydrophobicContact CB-CG2 4.18Å
67V91.6Very high94.7Very high61 Ų6161.2 Ų61.237%0.3736%0.356SS..THydrogen-bonded Turntrans-110.1-14.4-177-62.60000113.6S65 M234 V238S65-V67 PolarHBondContact O-N 3.2Å; S65-V67 WeakPolarHBondContact OG-CG2 3.24Å; S65-V67 PolarHBondContact OG-N 3.1Å; V67-M234 HydrophobicContact CG1-CG 4.24Å; V67-M234 HydrophobicContact CG1-SD 3.92Å; V67-V238 HydrophobicContact CG1-CG1 4.34Å; V67-V238 HydrophobicContact CG1-CG2 4.26Å
68S93.1Very high94.6Very high37 Ų3757.8 Ų57.826%0.25934%0.343SS..THydrogen-bonded Turntrans-120.812-173.3-41.80000113.4A62 S65 D70 L71 G72A62-S68 CarbonylContact O-C 3.52Å; S65-S68 PolarHBondContact O-N 2.88Å; S65-S68 PolarHBondContact OG-N 2.96Å; S65-S68 PolarHBondContact OG-OG 3.45Å; S68-D70 VanDerWaalsContact C-N 3.32Å; S68-D70 PolarHBondContact O-N 3.5Å; S68-L71 PolarHBondContact O-N 3.26Å; S68-G72 PolarHBondContact O-N 2.98Å
69K92Very high94.6Very high133 Ų13353 Ų5358%0.57832%0.318SS*.Hα-helixtrans-52.8-48.6-175.5179.4177.1176.8-172.90112.7S65 G72 A73S65-K69 PolarHBondContact O-N 3.15Å; K69-G72 PolarHBondContact O-N 3.41Å; K69-A73 PolarHBondContact O-N 3.4Å; K69-A73 VanDerWaalsContact O-N 3.08Å
70D91.5Very high94.6Very high115 Ų11558.1 Ų58.162%0.61534%0.342SS*.Hα-helixtrans-70.4-38.6-176.5-60.6-25.4000111.4S68 G72 A73 V74S68-D70 VanDerWaalsContact C-N 3.32Å; S68-D70 PolarHBondContact O-N 3.5Å; D70-G72 VanDerWaalsContact C-N 3.28Å; D70-G72 PolarHBondContact O-N 2.89Å; D70-A73 WeakPolarHBondContact O-CB 3.25Å; D70-A73 PolarHBondContact O-N 3.36Å; D70-A73 VanDerWaalsContact O-N 3.13Å; D70-V74 WeakPolarHBondContact O-CG2 3.41Å; D70-V74 PolarHBondContact O-N 3.37Å
71L94.5Very high94.6Very high72 Ų7254.1 Ų54.138%0.37732%0.324SS..Hα-helixtrans-61.9-37.2171.7-61.6178.7000111.9S68 V74 L75 Q227 C228S68-L71 PolarHBondContact O-N 3.26Å; L71-V74 PolarHBondContact O-N 3.34Å; L71-L75 WeakPolarHBondContact O-CG 3.38Å; L71-L75 PolarHBondContact O-N 2.89Å; L71-Q227 WeakPolarHBondContact CD2-O 3.31Å; L71-C228 HydrophobicContact CD2-CB 4.4Å
72G95.7Very high94.6Very high0 Ų052 Ų520%031%0.31CS..Hα-helixtrans-60.5-44172.700000112.4G59 S68 K69 D70 L75 V76G59-G72 WeakPolarHBondContact CA-O 3.45Å; G59-G72 VanDerWaalsContact O-CA 3.24Å; G59-G72 WeakPolarHBondContact O-CA 3.37Å; S68-G72 PolarHBondContact O-N 2.98Å; K69-G72 PolarHBondContact O-N 3.41Å; D70-G72 VanDerWaalsContact C-N 3.28Å; D70-G72 PolarHBondContact O-N 2.89Å; G72-L75 PolarHBondContact O-N 3.46Å; G72-V76 WeakPolarHBondContact O-CG2 3.45Å; G72-V76 PolarHBondContact O-N 3.34Å; G72-V76 VanDerWaalsContact O-N 3.11Å
73A94.9Very high94.7Very high54 Ų5453.7 Ų53.745%0.44631%0.312SS..Hα-helixtrans-62.3-41.5175.400000112.3K69 D70 L75 V76 E77K69-A73 PolarHBondContact O-N 3.4Å; K69-A73 VanDerWaalsContact O-N 3.08Å; D70-A73 WeakPolarHBondContact O-CB 3.25Å; D70-A73 PolarHBondContact O-N 3.36Å; D70-A73 VanDerWaalsContact O-N 3.13Å; A73-L75 PolarHBondContact O-N 3.09Å; A73-V76 PolarHBondContact O-N 2.95Å; A73-E77 WeakPolarHBondContact O-CB 3.31Å; A73-E77 PolarHBondContact O-N 3.11Å
74V96.4Very high94.8Very high4 Ų457 Ų572%0.02432%0.319CS..Hα-helixtrans-58.7-46.6174.41720000111.5D70 L71 V76 E77 I78 W224 Q227D70-V74 WeakPolarHBondContact O-CG2 3.41Å; D70-V74 PolarHBondContact O-N 3.37Å; L71-V74 PolarHBondContact O-N 3.34Å; V74-V76 VanDerWaalsContact C-N 3.34Å; V74-V76 PolarHBondContact O-N 3.48Å; V74-E77 PolarHBondContact O-N 2.68Å; V74-I78 HydrophobicContact CG1-CD1 3.7Å; V74-I78 HydrophobicContact CG1-CG1 4.28Å; V74-I78 VanDerWaalsContact O-CG1 3.27Å; V74-I78 WeakPolarHBondContact O-CG1 3.38Å; V74-I78 PolarHBondContact O-N 3.41Å; V74-W224 HydrophobicContact CG1-CB 3.88Å; V74-W224 HydrophobicContact CG1-CG 3.89Å; V74-Q227 HydrophobicContact CG2-CB 3.94Å; V74-Q227 HydrophobicContact CG2-CG 4.47Å
75L97.9Very high95.1Very high50 Ų5054.1 Ų54.126%0.26229%0.287SS..Hα-helixtrans-62.6-40.3179.5-70.2173.2000112.6L55 I58 L71 G72 A73 S79L55-L75 HydrophobicContact CD1-CD2 3.92Å; I58-L75 HydrophobicContact CG2-CD1 4.17Å; L71-L75 WeakPolarHBondContact O-CG 3.38Å; L71-L75 PolarHBondContact O-N 2.89Å; G72-L75 PolarHBondContact O-N 3.46Å; A73-L75 PolarHBondContact O-N 3.09Å; L75-S79 PolarHBondContact O-N 3.07Å; L75-S79 VanDerWaalsContact O-N 3.11Å
76V97.7Very high95.3Very high30 Ų3053.9 Ų53.918%0.18228%0.283CS..Hα-helixtrans-63.3-47.4173.8175.20000110.1E60 G72 A73 V74 I78 S79 E80E60-V76 HydrophobicContact CG-CG2 4.44Å; G72-V76 WeakPolarHBondContact O-CG2 3.45Å; G72-V76 PolarHBondContact O-N 3.34Å; G72-V76 VanDerWaalsContact O-N 3.11Å; A73-V76 PolarHBondContact O-N 2.95Å; V74-V76 VanDerWaalsContact C-N 3.34Å; V74-V76 PolarHBondContact O-N 3.48Å; V76-I78 PolarHBondContact O-N 2.83Å; V76-S79 WeakPolarHBondContact O-CB 3.29Å; V76-S79 PolarHBondContact O-N 3.25Å; V76-S79 VanDerWaalsContact O-N 3.12Å; V76-S79 PolarHBondContact O-OG 2.62Å; V76-E80 HydrophobicContact CG1-CG 4.44Å; V76-E80 WeakPolarHBondContact O-CG 3.23Å; V76-E80 PolarHBondContact O-N 2.93Å
77E97.2Very high95.5Very high52 Ų5254.5 Ų54.524%0.24328%0.281CS..Hα-helixtrans-63.8-40.8-178.8-162.4-178.4-163.700112.6A73 V74 S79 E80 V81 K220 W224A73-E77 WeakPolarHBondContact O-CB 3.31Å; A73-E77 PolarHBondContact O-N 3.11Å; V74-E77 PolarHBondContact O-N 2.68Å; E77-S79 VanDerWaalsContact C-N 3.3Å; E77-S79 PolarHBondContact O-N 3.41Å; E77-E80 PolarHBondContact O-N 3.36Å; E77-V81 WeakPolarHBondContact O-CG2 3.45Å; E77-V81 PolarHBondContact O-N 2.67Å; E77-K220 WeakPolarHBondContact OE1-CD 3.24Å; E77-K220 WeakPolarHBondContact OE1-CE 3.4Å; E77-K220 IonicContact OE1-NZ 3.64Å; E77-K220 PolarHBondContact OE1-NZ 2.84Å; E77-W224 HydrophobicContact CB-CZ2 4.33Å; E77-W224 HydrophobicContact CG-CZ2 4.01Å; E77-W224 PolarHBondContact OE2-NE1 3Å
78I97.8Very high95.7Very high39 Ų3954.9 Ų54.920%0.228%0.278CS..Hα-helixtrans-56.5-47.8172.4-71.1168.2000110L55 V74 V76 E80 V81 H82 W224L55-I78 HydrophobicContact CD2-CG2 3.88Å; V74-I78 HydrophobicContact CG1-CD1 3.7Å; V74-I78 HydrophobicContact CG1-CG1 4.28Å; V74-I78 VanDerWaalsContact O-CG1 3.27Å; V74-I78 WeakPolarHBondContact O-CG1 3.38Å; V74-I78 PolarHBondContact O-N 3.41Å; V76-I78 PolarHBondContact O-N 2.83Å; I78-E80 VanDerWaalsContact C-N 3.34Å; I78-E80 PolarHBondContact O-N 3.2Å; I78-V81 PolarHBondContact O-N 3.18Å; I78-H82 PolarHBondContact O-CD2 3.42Å; I78-H82 PolarHBondContact O-N 3.32Å; I78-H82 VanDerWaalsContact O-N 3.08Å; I78-W224 HydrophobicContact CB-CH2 4.42Å; I78-W224 HydrophobicContact CD1-CD2 4.31Å; I78-W224 HydrophobicContact CD1-CE3 4.3Å; I78-W224 HydrophobicContact CG1-CD2 3.64Å; I78-W224 HydrophobicContact CG1-CE3 3.64Å; I78-W224 HydrophobicContact CG1-CG 4.27Å; I78-W224 HydrophobicContact CG1-CH2 3.92Å; I78-W224 HydrophobicContact CG1-CZ2 3.92Å; I78-W224 HydrophobicContact CG1-CZ3 3.79Å
79S98.2Very high95.8Very high0 Ų054.1 Ų54.10%027%0.271CS..Hα-helixtrans-61.3-41.9-179.980.20000112.4F52 S56 L75 V76 E77 R83F52-S79 VanDerWaalsContact O-CB 3.29Å; F52-S79 WeakPolarHBondContact O-CB 3.48Å; S56-S79 VanDerWaalsContact CB-OG 3.3Å; S56-S79 WeakPolarHBondContact CB-OG 3.48Å; S56-S79 PolarHBondContact OG-OG 3.42Å; L75-S79 PolarHBondContact O-N 3.07Å; L75-S79 VanDerWaalsContact O-N 3.11Å; V76-S79 WeakPolarHBondContact O-CB 3.29Å; V76-S79 PolarHBondContact O-N 3.25Å; V76-S79 VanDerWaalsContact O-N 3.12Å; V76-S79 PolarHBondContact O-OG 2.62Å; E77-S79 VanDerWaalsContact C-N 3.3Å; E77-S79 PolarHBondContact O-N 3.41Å; S79-R83 WeakPolarHBondContact O-CB 3.45Å; S79-R83 WeakPolarHBondContact O-CG 3.15Å; S79-R83 PolarHBondContact O-N 2.8Å; S79-R83 PolarHBondContact OG-NH2 2.89Å
80E96.9Very high95.9Very high107 Ų10749.7 Ų49.750%0.525%0.252SS..Hα-helixtrans-66.4-44.5179.5-72179172.800112.2V76 E77 I78 H82 R83 K84V76-E80 HydrophobicContact CG1-CG 4.44Å; V76-E80 WeakPolarHBondContact O-CG 3.23Å; V76-E80 PolarHBondContact O-N 2.93Å; E77-E80 PolarHBondContact O-N 3.36Å; I78-E80 VanDerWaalsContact C-N 3.34Å; I78-E80 PolarHBondContact O-N 3.2Å; E80-H82 PolarHBondContact O-N 3.37Å; E80-R83 PolarHBondContact O-N 3.04Å; E80-K84 WeakPolarHBondContact O-CB 3.32Å; E80-K84 PolarHBondContact O-N 3.07Å
81V97.2Very high96.1Very high11 Ų1147.2 Ų47.27%0.06724%0.237CC..Hα-helixtrans-60.1-46.2177.3161.90000111E77 I78 K84 A85 L216 L217 K220 W224E77-V81 WeakPolarHBondContact O-CG2 3.45Å; E77-V81 PolarHBondContact O-N 2.67Å; I78-V81 PolarHBondContact O-N 3.18Å; V81-K84 PolarHBondContact O-N 3Å; V81-A85 PolarHBondContact O-N 2.98Å; V81-L216 HydrophobicContact CG1-CD2 3.88Å; V81-L216 HydrophobicContact CG1-CG 3.79Å; V81-L216 HydrophobicContact CG2-CG 4.48Å; V81-L216 WeakPolarHBondContact O-CD2 3.4Å; V81-L217 HydrophobicContact CG1-CD2 3.71Å; V81-L217 HydrophobicContact CG1-CG 4.45Å; V81-K220 HydrophobicContact CG2-CG 4.37Å; V81-W224 HydrophobicContact CB-CH2 3.85Å; V81-W224 HydrophobicContact CB-CZ2 4.31Å; V81-W224 HydrophobicContact CG1-CH2 3.94Å; V81-W224 HydrophobicContact CG2-CH2 3.85Å; V81-W224 HydrophobicContact CG2-CZ2 3.89Å
82H97.6Very high96.2Very high65 Ų6544.6 Ų44.630%0.30122%0.223SC..Hα-helixtrans-69-39.1178.4-85-78.7000113.2F52 I78 E80 K84 A85 Q86F52-H82 HydrophobicContact CD1-CB 3.69Å; F52-H82 HydrophobicContact CD2-CB 3.71Å; F52-H82 HydrophobicContact CE1-CB 3.39Å; F52-H82 AromaticContact CE1-CD2 3.68Å; F52-H82 AromaticContact CE1-CG 3.45Å; F52-H82 VanDerWaalsContact CE1-CG 3.45Å; F52-H82 HydrophobicContact CE2-CB 3.46Å; F52-H82 VanDerWaalsContact CE2-CB 3.46Å; F52-H82 AromaticContact CE2-CG 3.96Å; F52-H82 HydrophobicContact CG-CB 3.86Å; F52-H82 HydrophobicContact CZ-CB 3.29Å; F52-H82 AromaticContact CZ-CD2 3.94Å; F52-H82 AromaticContact CZ-CG 3.32Å; F52-H82 AromaticContact CZ-ND1 3.55Å; I78-H82 PolarHBondContact O-CD2 3.42Å; I78-H82 PolarHBondContact O-N 3.32Å; I78-H82 VanDerWaalsContact O-N 3.08Å; E80-H82 PolarHBondContact O-N 3.37Å; H82-K84 VanDerWaalsContact C-N 3.28Å; H82-K84 PolarHBondContact O-N 3.41Å; H82-A85 PolarHBondContact O-N 2.98Å; H82-Q86 WeakPolarHBondContact O-CB 3.23Å; H82-Q86 PolarHBondContact O-N 3.29Å
83R96.1Very high96.3Very high59 Ų5944.8 Ų44.822%0.22322%0.224CC..Hα-helixtrans-59.2-41.5171.9-75.4-169-140.6106.42.4111.4F52 D53 S56 S79 E80 Q86 L87F52-R83 HydrophobicContact CB-CG 3.92Å; F52-R83 PolarHBondContact O-NH2 2.91Å; D53-R83 IonicContact OD1-CZ 2.83Å; D53-R83 IonicContact OD1-NE 3.62Å; D53-R83 PolarHBondContact OD1-NE 3.35Å; D53-R83 IonicContact OD1-NH2 3.89Å; D53-R83 PolarHBondContact OD1-NH2 3.45Å; S56-R83 PolarHBondContact OG-NH2 3.09Å; S56-R83 VanDerWaalsContact OG-NH2 3.13Å; S79-R83 WeakPolarHBondContact O-CB 3.45Å; S79-R83 WeakPolarHBondContact O-CG 3.15Å; S79-R83 PolarHBondContact O-N 2.8Å; S79-R83 PolarHBondContact OG-NH2 2.89Å; E80-R83 PolarHBondContact O-N 3.04Å; R83-Q86 WeakPolarHBondContact O-CB 3.39Å; R83-Q86 PolarHBondContact O-N 3.06Å; R83-L87 WeakPolarHBondContact O-CG 3.45Å; R83-L87 PolarHBondContact O-N 3.16Å
84K95.6Very high96.4Very high113 Ų11346.8 Ų46.849%0.49122%0.223SC..Hα-helixtrans-63.9-43.9176.9-173.9177.3-179.1-179.30111.9E80 V81 H82 Q86 L87 E88 L216E80-K84 WeakPolarHBondContact O-CB 3.32Å; E80-K84 PolarHBondContact O-N 3.07Å; V81-K84 PolarHBondContact O-N 3Å; H82-K84 VanDerWaalsContact C-N 3.28Å; H82-K84 PolarHBondContact O-N 3.41Å; K84-Q86 PolarHBondContact O-N 2.73Å; K84-L87 PolarHBondContact O-N 3.32Å; K84-E88 PolarHBondContact O-N 3.46Å; K84-E88 VanDerWaalsContact O-N 3.08Å; K84-L216 HydrophobicContact CB-CD2 4.14Å; K84-L216 HydrophobicContact CD-CD1 4.19Å; K84-L216 HydrophobicContact CD-CD2 4.07Å; K84-L216 HydrophobicContact CG-CD2 4.17Å
85A95.8Very high96.4Very high7 Ų751.3 Ų51.36%0.05824%0.239CC..Hα-helixtrans-60.4-36.6173.800000112.1V81 H82 M89 Y209 T213 L216V81-A85 PolarHBondContact O-N 2.98Å; H82-A85 PolarHBondContact O-N 2.98Å; A85-M89 PolarHBondContact O-N 3.36Å; A85-M89 VanDerWaalsContact O-N 3.16Å; A85-Y209 WeakPolarHBondContact O-CE2 3.44Å; A85-Y209 PolarHBondContact O-OH 3.39Å; A85-T213 HydrophobicContact CB-CG2 3.89Å; A85-L216 HydrophobicContact CB-CD2 4.49Å
86Q95.2Very high96.4Very high28 Ų2849.3 Ų49.313%0.13123%0.229CC..Hα-helixtrans-69.9-40.6177.3-168.159.639.800112.3S45 H82 R83 K84 E88 M89 E90S45-Q86 WeakPolarHBondContact OG-CG 3.47Å; S45-Q86 PolarHBondContact OG-NE2 2.9Å; H82-Q86 WeakPolarHBondContact O-CB 3.23Å; H82-Q86 PolarHBondContact O-N 3.29Å; R83-Q86 WeakPolarHBondContact O-CB 3.39Å; R83-Q86 PolarHBondContact O-N 3.06Å; K84-Q86 PolarHBondContact O-N 2.73Å; Q86-E88 PolarHBondContact O-N 3.3Å; Q86-M89 WeakPolarHBondContact O-CB 3.45Å; Q86-M89 PolarHBondContact O-N 3.02Å; Q86-M89 VanDerWaalsContact O-N 3.15Å; Q86-E90 PolarHBondContact O-N 3.29Å
87L93.7Very high96.5Very high108 Ų10851.4 Ų51.457%0.56524%0.236SC*.Hα-helixtrans-62-40.3174.5-72.7169.4000112.5R83 K84 M89 E90 E91R83-L87 WeakPolarHBondContact O-CG 3.45Å; R83-L87 PolarHBondContact O-N 3.16Å; K84-L87 PolarHBondContact O-N 3.32Å; L87-M89 VanDerWaalsContact C-N 3.3Å; L87-M89 PolarHBondContact O-N 2.9Å; L87-E90 PolarHBondContact O-N 3.4Å; L87-E91 PolarHBondContact O-N 2.9Å; L87-E91 VanDerWaalsContact O-N 3.08Å
88E94.8Very high96.5Very high69 Ų6955.2 Ų55.232%0.32225%0.248SC..Hα-helixtrans-63.7-36.5174-70.6-70.4146.100111.6K84 Q86 E91 N92 Y209 K212K84-E88 PolarHBondContact O-N 3.46Å; K84-E88 VanDerWaalsContact O-N 3.08Å; Q86-E88 PolarHBondContact O-N 3.3Å; E88-E91 PolarHBondContact O-N 3.42Å; E88-N92 PolarHBondContact O-N 3.33Å; E88-N92 VanDerWaalsContact O-N 3.11Å; E88-N92 PolarHBondContact O-ND2 2.89Å; E88-Y209 HydrophobicContact CB-CD2 4.09Å; E88-Y209 HydrophobicContact CB-CE2 4.03Å; E88-K212 IonicContact OE2-NZ 2.74Å; E88-K212 PolarHBondContact OE2-NZ 3.35Å
89M95.5Very high96.5Very high20 Ų2056 Ų5610%0.09925%0.251CS..Hα-helixtrans-63.1-45.6173.8-176.46592.400111.3V41 M44 A85 Q86 L87 E91 N92 F93 F206 Y209V41-M89 HydrophobicContact CG1-CG 4.05Å; M44-M89 HydrophobicContact CE-CG 4.48Å; A85-M89 PolarHBondContact O-N 3.36Å; A85-M89 VanDerWaalsContact O-N 3.16Å; Q86-M89 WeakPolarHBondContact O-CB 3.45Å; Q86-M89 PolarHBondContact O-N 3.02Å; Q86-M89 VanDerWaalsContact O-N 3.15Å; L87-M89 VanDerWaalsContact C-N 3.3Å; L87-M89 PolarHBondContact O-N 2.9Å; M89-E91 VanDerWaalsContact C-N 3.31Å; M89-E91 PolarHBondContact O-N 3.41Å; M89-N92 WeakPolarHBondContact O-CB 3.32Å; M89-N92 PolarHBondContact O-N 2.96Å; M89-F93 HydrophobicContact CG-CD2 4.19Å; M89-F93 HydrophobicContact CG-CE2 4.41Å; M89-F93 PolarHBondContact O-N 2.91Å; M89-F93 HydrophobicContact SD-CD2 3.89Å; M89-F93 HydrophobicContact SD-CE2 3.7Å; M89-F206 HydrophobicContact CE-CE1 4.5Å; M89-F206 HydrophobicContact SD-CE1 4.23Å; M89-Y209 HydrophobicContact CB-CE2 3.77Å; M89-Y209 HydrophobicContact CE-CD1 3.85Å; M89-Y209 HydrophobicContact CE-CE1 3.17Å; M89-Y209 HydrophobicContact CE-CE2 4.42Å; M89-Y209 HydrophobicContact SD-CD1 4.21Å; M89-Y209 HydrophobicContact SD-CE1 3.95Å; M89-Y209 HydrophobicContact SD-CE2 4.42Å
90E94.9Very high96.5Very high40 Ų4056.1 Ų56.119%0.18725%0.252CS..Hα-helixtrans-57.8-43.3176.8-69.9-178172.800111.9S45 M46 Q86 L87 N92 F93 K94S45-E90 WeakPolarHBondContact CB-OE1 3.43Å; S45-E90 VanDerWaalsContact OG-CD 3.25Å; S45-E90 VanDerWaalsContact OG-CG 3.26Å; S45-E90 WeakPolarHBondContact OG-CG 3.43Å; S45-E90 PolarHBondContact OG-OE1 3.44Å; M46-E90 WeakPolarHBondContact CE-OE1 3.35Å; Q86-E90 PolarHBondContact O-N 3.29Å; L87-E90 PolarHBondContact O-N 3.4Å; E90-N92 VanDerWaalsContact C-N 3.33Å; E90-N92 PolarHBondContact O-N 3.41Å; E90-F93 PolarHBondContact O-N 3.29Å; E90-F93 VanDerWaalsContact O-N 3.17Å; E90-K94 WeakPolarHBondContact O-CG 3.5Å; E90-K94 PolarHBondContact O-N 3.17Å
91E94.9Very high96.6Very high63 Ų6351.2 Ų51.229%0.29423%0.229SC..Hα-helixtrans-66.1-36.4178.8-169.755-143.700112.2L87 E88 M89 F93 K94 R95 R98L87-E91 PolarHBondContact O-N 2.9Å; L87-E91 VanDerWaalsContact O-N 3.08Å; E88-E91 PolarHBondContact O-N 3.42Å; M89-E91 VanDerWaalsContact C-N 3.31Å; M89-E91 PolarHBondContact O-N 3.41Å; E91-F93 VanDerWaalsContact C-N 3.32Å; E91-F93 PolarHBondContact O-N 3.28Å; E91-K94 PolarHBondContact O-N 3.2Å; E91-K94 WeakPolarHBondContact OE2-CD 3.47Å; E91-K94 IonicContact OE2-NZ 3.52Å; E91-K94 PolarHBondContact OE2-NZ 3.43Å; E91-R95 WeakPolarHBondContact O-CG 3.49Å; E91-R95 PolarHBondContact O-N 2.98Å; E91-R95 VanDerWaalsContact O-N 3.12Å; E91-R98 IonicContact OE1-NH2 3.56Å
92N96.3Very high96.6Very high17 Ų1752.6 Ų52.69%0.09124%0.241CC..Hα-helixtrans-62.8-39.2171.7-75.2-52000112.1E88 M89 E90 R95 F96 Y209E88-N92 PolarHBondContact O-N 3.33Å; E88-N92 VanDerWaalsContact O-N 3.11Å; E88-N92 PolarHBondContact O-ND2 2.89Å; M89-N92 WeakPolarHBondContact O-CB 3.32Å; M89-N92 PolarHBondContact O-N 2.96Å; E90-N92 VanDerWaalsContact C-N 3.33Å; E90-N92 PolarHBondContact O-N 3.41Å; N92-R95 WeakPolarHBondContact O-CB 3.26Å; N92-R95 PolarHBondContact O-N 3.01Å; N92-R95 VanDerWaalsContact O-N 3.16Å; N92-F96 PolarHBondContact O-N 3.41Å; N92-Y209 VanDerWaalsContact ND2-CB 3.3Å; N92-Y209 WeakPolarHBondContact ND2-CB 3.05Å; N92-Y209 VanDerWaalsContact ND2-CD2 3.35Å; N92-Y209 WeakPolarHBondContact ND2-CD2 3.42Å
93F97.6Very high96.6Very high4 Ų451.8 Ų51.82%0.01824%0.238CC..Hα-helixtrans-70.9-31.1177.5-91.7-94.4000113.4Y37 E38 V41 M89 E90 E91 R95 F96 H97 F206Y37-F93 AromaticContact CD1-CE1 3.89Å; Y37-F93 HydrophobicContact CD1-CE1 3.89Å; Y37-F93 HydrophobicContact CD1-CZ 4.15Å; Y37-F93 HydrophobicContact CD2-CE1 4.49Å; Y37-F93 AromaticContact CE1-CE1 3.81Å; Y37-F93 HydrophobicContact CE1-CE1 3.81Å; Y37-F93 AromaticContact CE1-CZ 3.58Å; Y37-F93 HydrophobicContact CE1-CZ 3.58Å; Y37-F93 HydrophobicContact CE2-CE1 4.41Å; Y37-F93 HydrophobicContact CE2-CZ 4.07Å; Y37-F93 HydrophobicContact CG-CE1 4.25Å; Y37-F93 AromaticContact CZ-CZ 3.54Å; E38-F93 HydrophobicContact CB-CD1 4.17Å; E38-F93 HydrophobicContact CG-CD1 4.29Å; V41-F93 HydrophobicContact CB-CD1 4.13Å; V41-F93 HydrophobicContact CB-CD2 4.31Å; V41-F93 HydrophobicContact CB-CE1 4.01Å; V41-F93 HydrophobicContact CB-CE2 4.2Å; V41-F93 HydrophobicContact CB-CG 4.27Å; V41-F93 HydrophobicContact CB-CZ 4.05Å; V41-F93 HydrophobicContact CG1-CD1 4.26Å; V41-F93 HydrophobicContact CG1-CD2 3.62Å; V41-F93 HydrophobicContact CG1-CE1 4.36Å; V41-F93 HydrophobicContact CG1-CE2 3.74Å; V41-F93 HydrophobicContact CG1-CG 3.89Å; V41-F93 HydrophobicContact CG1-CZ 4.12Å; V41-F93 HydrophobicContact CG2-CD1 4.38Å; V41-F93 HydrophobicContact CG2-CE1 3.75Å; V41-F93 HydrophobicContact CG2-CE2 3.91Å; V41-F93 HydrophobicContact CG2-CZ 3.49Å; V41-F93 VanDerWaalsContact CG2-CZ 3.49Å; M89-F93 HydrophobicContact CG-CD2 4.19Å; M89-F93 HydrophobicContact CG-CE2 4.41Å; M89-F93 PolarHBondContact O-N 2.91Å; M89-F93 HydrophobicContact SD-CD2 3.89Å; M89-F93 HydrophobicContact SD-CE2 3.7Å; E90-F93 PolarHBondContact O-N 3.29Å; E90-F93 VanDerWaalsContact O-N 3.17Å; E91-F93 VanDerWaalsContact C-N 3.32Å; E91-F93 PolarHBondContact O-N 3.28Å; F93-R95 VanDerWaalsContact C-N 3.31Å; F93-R95 PolarHBondContact O-N 3.25Å; F93-F96 AromaticContact CD1-CD1 3.82Å; F93-F96 HydrophobicContact CD1-CD1 3.82Å; F93-F96 HydrophobicContact CD1-CE1 4.44Å; F93-F96 AromaticContact CE1-CD1 4Å; F93-F96 HydrophobicContact CE1-CD1 4Å; F93-F96 HydrophobicContact CE1-CE1 4.28Å; F93-F96 WeakPolarHBondContact O-CB 3.34Å; F93-F96 PolarHBondContact O-N 3.05Å; F93-H97 PolarHBondContact O-N 3.31Å; F93-F206 HydrophobicContact CE2-CE1 4.05Å; F93-F206 AromaticContact CE2-CZ 3.71Å; F93-F206 HydrophobicContact CE2-CZ 3.71Å; F93-F206 HydrophobicContact CZ-CE1 4.49Å; F93-F206 AromaticContact CZ-CZ 3.77Å; F93-F206 HydrophobicContact CZ-CZ 3.77Å
94K96.8Very high96.7Very high97 Ų9749 Ų4942%0.42223%0.228SC..Hα-helixtrans-63-37.2168-66.9178.9-154.8153.50112.2E90 E91 R98E90-K94 WeakPolarHBondContact O-CG 3.5Å; E90-K94 PolarHBondContact O-N 3.17Å; E91-K94 PolarHBondContact O-N 3.2Å; E91-K94 WeakPolarHBondContact OE2-CD 3.47Å; E91-K94 IonicContact OE2-NZ 3.52Å; E91-K94 PolarHBondContact OE2-NZ 3.43Å; K94-R98 WeakPolarHBondContact O-CG 3.4Å; K94-R98 PolarHBondContact O-N 2.88Å; K94-R98 VanDerWaalsContact O-N 3.13Å
95R97Very high96.8Very high99 Ų9947.1 Ų47.137%0.37422%0.22SC..Hα-helixtrans-68.2-45.4173.4-67.2171.2-174-109.12.8111.2E91 N92 F93 H97 R98 E99E91-R95 WeakPolarHBondContact O-CG 3.49Å; E91-R95 PolarHBondContact O-N 2.98Å; E91-R95 VanDerWaalsContact O-N 3.12Å; N92-R95 WeakPolarHBondContact O-CB 3.26Å; N92-R95 PolarHBondContact O-N 3.01Å; N92-R95 VanDerWaalsContact O-N 3.16Å; F93-R95 VanDerWaalsContact C-N 3.31Å; F93-R95 PolarHBondContact O-N 3.25Å; R95-H97 VanDerWaalsContact C-N 3.28Å; R95-H97 PolarHBondContact O-N 3.42Å; R95-R98 PolarHBondContact O-N 3.48Å; R95-E99 VanDerWaalsContact O-CB 3.32Å; R95-E99 WeakPolarHBondContact O-CB 3.44Å; R95-E99 PolarHBondContact O-N 2.82Å
96F98.4Very high96.9Very high8 Ų851.5 Ų51.54%0.03524%0.235CC..Iπ-helixtrans-52.7-47.1173.5168.8-112.8000111.5Y37 E38 N92 F93 I100 I101 L202Y37-F96 HydrophobicContact CD1-CE1 4.38Å; Y37-F96 HydrophobicContact CD1-CZ 4.31Å; E38-F96 HydrophobicContact CB-CE1 4.45Å; N92-F96 PolarHBondContact O-N 3.41Å; F93-F96 AromaticContact CD1-CD1 3.82Å; F93-F96 HydrophobicContact CD1-CD1 3.82Å; F93-F96 HydrophobicContact CD1-CE1 4.44Å; F93-F96 AromaticContact CE1-CD1 4Å; F93-F96 HydrophobicContact CE1-CD1 4Å; F93-F96 HydrophobicContact CE1-CE1 4.28Å; F93-F96 WeakPolarHBondContact O-CB 3.34Å; F93-F96 PolarHBondContact O-N 3.05Å; F96-I100 HydrophobicContact CD2-CB 3.9Å; F96-I100 HydrophobicContact CD2-CG1 3.9Å; F96-I100 HydrophobicContact CD2-CG2 4.32Å; F96-I100 HydrophobicContact CE2-CB 4.2Å; F96-I100 HydrophobicContact CE2-CG2 4.14Å; F96-I100 WeakPolarHBondContact O-CA 3.48Å; F96-I100 WeakPolarHBondContact O-CB 3.32Å; F96-I100 PolarHBondContact O-N 2.66Å; F96-I101 HydrophobicContact CD1-CG1 4.14Å; F96-I101 HydrophobicContact CE1-CD1 3.93Å; F96-I101 HydrophobicContact CE1-CG1 3.7Å; F96-I101 HydrophobicContact CE2-CD1 3.95Å; F96-I101 HydrophobicContact CE2-CG1 4.2Å; F96-I101 HydrophobicContact CZ-CD1 3.5Å; F96-I101 HydrophobicContact CZ-CG1 3.77Å; F96-I101 PolarHBondContact O-N 2.74Å; F96-I101 VanDerWaalsContact O-N 3.09Å; F96-L202 HydrophobicContact CB-CD1 4.18Å; F96-L202 HydrophobicContact CD2-CD1 3.5Å; F96-L202 VanDerWaalsContact CD2-CD1 3.5Å; F96-L202 HydrophobicContact CD2-CD2 3.88Å; F96-L202 HydrophobicContact CD2-CG 4.27Å; F96-L202 HydrophobicContact CE2-CD1 4.22Å; F96-L202 HydrophobicContact CE2-CD2 3.74Å; F96-L202 HydrophobicContact CG-CD1 4.16Å
97H98.4Very high96.9Very high73 Ų7351.3 Ų51.334%0.33823%0.234SC..Iπ-helixtrans-59.3-53.3176.5-171.796.9000112.2E38 F93 R95 I101 A102E38-H97 WeakPolarHBondContact OE1-CB 3.42Å; E38-H97 IonicContact OE1-CG 3.47Å; E38-H97 IonicContact OE1-ND1 2.88Å; E38-H97 PolarHBondContact OE1-ND1 3.38Å; E38-H97 IonicContact OE2-CE1 3.64Å; E38-H97 IonicContact OE2-CG 3.76Å; E38-H97 IonicContact OE2-ND1 3.53Å; E38-H97 PolarHBondContact OE2-ND1 3.44Å; F93-H97 PolarHBondContact O-N 3.31Å; R95-H97 VanDerWaalsContact C-N 3.28Å; R95-H97 PolarHBondContact O-N 3.42Å; H97-I101 PolarHBondContact O-N 3.03Å; H97-A102 WeakPolarHBondContact O-CB 3.46Å; H97-A102 PolarHBondContact O-N 3.08Å
98R97.8Very high96.9Very high132 Ų13246.4 Ų46.450%0.49821%0.208SC..Iπ-helixtrans-69.3-44.4-175.2-70.4-171.5-59-101.30.9113.7E91 K94 R95E91-R98 IonicContact OE1-NH2 3.56Å; K94-R98 WeakPolarHBondContact O-CG 3.4Å; K94-R98 PolarHBondContact O-N 2.88Å; K94-R98 VanDerWaalsContact O-N 3.13Å; R95-R98 PolarHBondContact O-N 3.48Å
99E97.6Very high96.9Very high57 Ų5747.3 Ų47.327%0.26622%0.216SC..Iπ-helixtrans-91.9-25.8-168-64175.8-166.800112.6R95 K198 L201 H205R95-E99 VanDerWaalsContact O-CB 3.32Å; R95-E99 WeakPolarHBondContact O-CB 3.44Å; R95-E99 PolarHBondContact O-N 2.82Å; E99-K198 WeakPolarHBondContact O-CD 3.35Å; E99-K198 PolarHBondContact O-NZ 3.37Å; E99-L201 HydrophobicContact CB-CD2 4.21Å; E99-L201 WeakPolarHBondContact OE2-CD2 3.46Å; E99-H205 IonicContact OE2-CD2 2.69Å; E99-H205 IonicContact OE2-CE1 3.03Å; E99-H205 IonicContact OE2-NE2 3.54Å; E99-H205 PolarHBondContact OE2-NE2 2.62Å
100I98.3Very high96.9Very high1 Ų150.3 Ų50.31%0.00523%0.23CC..Iπ-helixtrans-109.7-69-177.7-44.1-54.1000109.8F96 A102 E103 L104 K198 L201 L202F96-I100 HydrophobicContact CD2-CB 3.9Å; F96-I100 HydrophobicContact CD2-CG1 3.9Å; F96-I100 HydrophobicContact CD2-CG2 4.32Å; F96-I100 HydrophobicContact CE2-CB 4.2Å; F96-I100 HydrophobicContact CE2-CG2 4.14Å; F96-I100 WeakPolarHBondContact O-CA 3.48Å; F96-I100 WeakPolarHBondContact O-CB 3.32Å; F96-I100 PolarHBondContact O-N 2.66Å; I100-A102 PolarHBondContact O-N 3.02Å; I100-E103 PolarHBondContact O-N 2.91Å; I100-L104 HydrophobicContact CG2-CD1 3.97Å; I100-L104 HydrophobicContact CG2-CG 4.29Å; I100-L104 WeakPolarHBondContact O-CB 3.5Å; I100-L104 VanDerWaalsContact O-CG 3.25Å; I100-L104 WeakPolarHBondContact O-CG 3.34Å; I100-L104 PolarHBondContact O-N 2.85Å; I100-K198 HydrophobicContact CD1-CB 4.07Å; I100-K198 HydrophobicContact CD1-CD 4.01Å; I100-K198 WeakPolarHBondContact CD1-O 3.35Å; I100-K198 HydrophobicContact CG2-CB 4.39Å; I100-L201 HydrophobicContact CD1-CB 4.37Å; I100-L201 HydrophobicContact CD1-CD2 4.14Å; I100-L201 HydrophobicContact CD1-CG 4.42Å; I100-L202 HydrophobicContact CG1-CB 4.43Å
101I98.5Very high97Very high4 Ų448.7 Ų48.72%0.02122%0.223CC..Iπ-helixtrans-61.1-52.5-170.2-60-53.4000112.2V31 K35 F96 H97 E103 L104 E105V31-I101 HydrophobicContact CG1-CG2 4.16Å; K35-I101 HydrophobicContact CG-CG2 3.88Å; F96-I101 HydrophobicContact CD1-CG1 4.14Å; F96-I101 HydrophobicContact CE1-CD1 3.93Å; F96-I101 HydrophobicContact CE1-CG1 3.7Å; F96-I101 HydrophobicContact CE2-CD1 3.95Å; F96-I101 HydrophobicContact CE2-CG1 4.2Å; F96-I101 HydrophobicContact CZ-CD1 3.5Å; F96-I101 HydrophobicContact CZ-CG1 3.77Å; F96-I101 PolarHBondContact O-N 2.74Å; F96-I101 VanDerWaalsContact O-N 3.09Å; H97-I101 PolarHBondContact O-N 3.03Å; I101-E103 VanDerWaalsContact C-N 3.28Å; I101-E103 PolarHBondContact O-N 2.69Å; I101-L104 PolarHBondContact O-N 3.17Å; I101-E105 WeakPolarHBondContact O-CB 3.34Å; I101-E105 PolarHBondContact O-N 3.01Å
102A98.2Very high97Very high40 Ų4048.3 Ų48.333%0.33123%0.225SC..Hα-helixtrans-61.6-37.3-179.500000112.3H97 I100 R106H97-A102 WeakPolarHBondContact O-CB 3.46Å; H97-A102 PolarHBondContact O-N 3.08Å; I100-A102 PolarHBondContact O-N 3.02Å; A102-R106 VanDerWaalsContact O-CB 3.3Å; A102-R106 WeakPolarHBondContact O-CB 3.49Å; A102-R106 PolarHBondContact O-N 3.14Å
103E97.9Very high97Very high49 Ų4955.4 Ų55.423%0.22926%0.255CS..Hα-helixtrans-76.5-37.6-179.1-17456-164.700112.3I100 I101 R106 K107 F194I100-E103 PolarHBondContact O-N 2.91Å; I101-E103 VanDerWaalsContact C-N 3.28Å; I101-E103 PolarHBondContact O-N 2.69Å; E103-R106 IonicContact OE1-CZ 2.79Å; E103-R106 IonicContact OE1-NE 2.68Å; E103-R106 IonicContact OE1-NH2 3.12Å; E103-R106 PolarHBondContact OE1-NH2 3.32Å; E103-R106 IonicContact OE2-CZ 3.18Å; E103-R106 IonicContact OE2-NE 2.66Å; E103-R106 PolarHBondContact OE2-NE 2.83Å; E103-R106 IonicContact OE2-NH2 3.44Å; E103-K107 WeakPolarHBondContact O-CB 3.25Å; E103-K107 PolarHBondContact O-N 3.39Å; E103-F194 HydrophobicContact CG-CE2 4.14Å; E103-F194 HydrophobicContact CG-CZ 4.02Å
104L98Very high97Very high1 Ų156.7 Ų56.71%0.00526%0.26CS..Hα-helixtrans-62.3-44171.1-69.6-173.4000110.9L27 L30 V31 I100 I101 K107 T108 F194 L195 K198L27-L104 HydrophobicContact CD1-CD1 4.08Å; L27-L104 HydrophobicContact CD1-CD2 4.09Å; L27-L104 HydrophobicContact CD1-CG 4.45Å; L30-L104 HydrophobicContact CD2-CD1 4.41Å; V31-L104 HydrophobicContact CG2-CB 3.63Å; V31-L104 HydrophobicContact CG2-CD1 4.48Å; I100-L104 HydrophobicContact CG2-CD1 3.97Å; I100-L104 HydrophobicContact CG2-CG 4.29Å; I100-L104 WeakPolarHBondContact O-CB 3.5Å; I100-L104 VanDerWaalsContact O-CG 3.25Å; I100-L104 WeakPolarHBondContact O-CG 3.34Å; I100-L104 PolarHBondContact O-N 2.85Å; I101-L104 PolarHBondContact O-N 3.17Å; L104-K107 PolarHBondContact O-N 3.41Å; L104-T108 WeakPolarHBondContact O-CB 3.41Å; L104-T108 PolarHBondContact O-N 3.06Å; L104-T108 PolarHBondContact O-OG1 3.16Å; L104-F194 HydrophobicContact CD2-CD1 4.26Å; L104-F194 HydrophobicContact CD2-CE1 3.36Å; L104-F194 HydrophobicContact CD2-CZ 3.8Å; L104-L195 HydrophobicContact CD1-CD1 4.35Å; L104-L195 HydrophobicContact CD2-CD1 4.17Å; L104-K198 HydrophobicContact CD2-CG 4.28Å
105E97.7Very high97.1Very high73 Ų7352.1 Ų52.134%0.34124%0.24SC..Hα-helixtrans-62.2-54.3178.6-174.2162.5-150.800111.3V31 K35 I101 K107 T108 D109V31-E105 HydrophobicContact CG1-CB 4.06Å; V31-E105 HydrophobicContact CG1-CG 4.39Å; V31-E105 HydrophobicContact CG2-CB 4.45Å; K35-E105 WeakPolarHBondContact CE-OE2 3.11Å; K35-E105 IonicContact NZ-OE1 2.74Å; K35-E105 PolarHBondContact NZ-OE1 3.22Å; K35-E105 IonicContact NZ-OE2 2.7Å; K35-E105 PolarHBondContact NZ-OE2 3.47Å; I101-E105 WeakPolarHBondContact O-CB 3.34Å; I101-E105 PolarHBondContact O-N 3.01Å; E105-K107 VanDerWaalsContact C-N 3.28Å; E105-K107 PolarHBondContact O-N 2.72Å; E105-T108 PolarHBondContact O-N 2.88Å; E105-D109 PolarHBondContact O-N 3.26Å; E105-D109 VanDerWaalsContact O-N 3.09Å
106R96.8Very high97.1Very high99 Ų9949.9 Ų49.937%0.37424%0.238SC..Hα-helixtrans-53.7-46.7176.7-174-164.971.778.8-3.4111.7A102 E103 M110A102-R106 VanDerWaalsContact O-CB 3.3Å; A102-R106 WeakPolarHBondContact O-CB 3.49Å; A102-R106 PolarHBondContact O-N 3.14Å; E103-R106 IonicContact OE1-CZ 2.79Å; E103-R106 IonicContact OE1-NE 2.68Å; E103-R106 IonicContact OE1-NH2 3.12Å; E103-R106 PolarHBondContact OE1-NH2 3.32Å; E103-R106 IonicContact OE2-CZ 3.18Å; E103-R106 IonicContact OE2-NE 2.66Å; E103-R106 PolarHBondContact OE2-NE 2.83Å; E103-R106 IonicContact OE2-NH2 3.44Å; R106-M110 PolarHBondContact NH1-SD 3.18Å; R106-M110 PolarHBondContact O-N 3.06Å
107K95.1Very high97Very high24 Ų2451.6 Ų51.610%0.10425%0.253CS..Hα-helixtrans-67.6-43.6-177.4-166.3132.4171.8-179.10111.4E103 L104 E105 D109 M110 D111 F194 Y432E103-K107 WeakPolarHBondContact O-CB 3.25Å; E103-K107 PolarHBondContact O-N 3.39Å; L104-K107 PolarHBondContact O-N 3.41Å; E105-K107 VanDerWaalsContact C-N 3.28Å; E105-K107 PolarHBondContact O-N 2.72Å; K107-D109 VanDerWaalsContact C-N 3.32Å; K107-D109 PolarHBondContact O-N 3.3Å; K107-M110 PolarHBondContact O-N 3.34Å; K107-D111 WeakPolarHBondContact O-CB 3.45Å; K107-D111 PolarHBondContact O-N 3.48Å; K107-F194 HydrophobicContact CB-CE1 4.11Å; K107-F194 HydrophobicContact CB-CZ 4.14Å; K107-F194 HydrophobicContact CD-CD1 4.07Å; K107-F194 HydrophobicContact CD-CD2 4.12Å; K107-F194 HydrophobicContact CD-CE1 3.71Å; K107-F194 HydrophobicContact CD-CE2 3.76Å; K107-F194 HydrophobicContact CD-CG 4.26Å; K107-F194 HydrophobicContact CD-CZ 3.57Å; K107-F194 HydrophobicContact CG-CD1 4.49Å; K107-F194 HydrophobicContact CG-CE1 4.01Å; K107-F194 HydrophobicContact CG-CZ 4.23Å; K107-Y432 WeakPolarHBondContact CE-OH 3.33Å; K107-Y432 VanDerWaalsContact NZ-CD1 3.28Å
108T95.4Very high97Very high4 Ų449 Ų493%0.02524%0.242CC..Hα-helixtrans-58.7-43.3177.9-55.50000111.7L27 R28 L104 E105 D111 V112L27-T108 WeakPolarHBondContact CD2-OG1 3.32Å; L27-T108 WeakPolarHBondContact CG-OG1 3.31Å; R28-T108 HydrophobicContact CB-CG2 4.43Å; L104-T108 WeakPolarHBondContact O-CB 3.41Å; L104-T108 PolarHBondContact O-N 3.06Å; L104-T108 PolarHBondContact O-OG1 3.16Å; E105-T108 PolarHBondContact O-N 2.88Å; T108-D111 PolarHBondContact O-N 3.07Å; T108-V112 WeakPolarHBondContact O-CG2 3.18Å; T108-V112 PolarHBondContact O-N 2.93Å
109D93.6Very high97Very high88 Ų8843.5 Ų43.547%0.47122%0.222SC..Hα-helixtrans-66.7-38.8-179-75.5-15.8000113.1E105 K107E105-D109 PolarHBondContact O-N 3.26Å; E105-D109 VanDerWaalsContact O-N 3.09Å; K107-D109 VanDerWaalsContact C-N 3.32Å; K107-D109 PolarHBondContact O-N 3.3Å
110M95.6Very high97.1Very high83 Ų8346.5 Ų46.541%0.40923%0.234SC..Hα-helixtrans-68.9-39.9172.8-69.7-176.264.300111.6R106 K107 V112 K113 Y114R106-M110 PolarHBondContact NH1-SD 3.18Å; R106-M110 PolarHBondContact O-N 3.06Å; K107-M110 PolarHBondContact O-N 3.34Å; M110-V112 VanDerWaalsContact C-N 3.35Å; M110-V112 PolarHBondContact O-N 3.4Å; M110-K113 PolarHBondContact O-N 3.19Å; M110-Y114 PolarHBondContact O-N 3.26Å
111D96.7Very high97.1Very high7 Ų749.9 Ų49.94%0.03725%0.247CC..Hα-helixtrans-65.2-36.8-173.2-157.375.2000112.9N24 K107 T108 K113 Y114 M115 R191 Y432N24-D111 PolarHBondContact ND2-OD2 3.45Å; N24-D111 PolarHBondContact OD1-OD2 3.19Å; K107-D111 WeakPolarHBondContact O-CB 3.45Å; K107-D111 PolarHBondContact O-N 3.48Å; T108-D111 PolarHBondContact O-N 3.07Å; D111-K113 VanDerWaalsContact C-N 3.29Å; D111-K113 PolarHBondContact O-N 2.97Å; D111-Y114 PolarHBondContact O-N 3.26Å; D111-M115 WeakPolarHBondContact O-CB 3.47Å; D111-M115 WeakPolarHBondContact O-CG 3.37Å; D111-M115 PolarHBondContact O-N 2.92Å; D111-M115 WeakPolarHBondContact OD2-CG 3.15Å; D111-R191 IonicContact OD1-CZ 2.65Å; D111-R191 IonicContact OD1-NE 3.47Å; D111-R191 PolarHBondContact OD1-NE 3.48Å; D111-R191 IonicContact OD1-NH2 3.07Å; D111-R191 PolarHBondContact OD1-NH2 3.22Å; D111-R191 IonicContact OD2-CZ 2.73Å; D111-R191 IonicContact OD2-NE 2.67Å; D111-R191 PolarHBondContact OD2-NE 2.87Å; D111-R191 IonicContact OD2-NH2 3.36Å; D111-R191 PolarHBondContact OD2-NH2 3.02Å; D111-Y432 PolarHBondContact OD1-OH 3.37Å
112V95.3Very high97.1Very high55 Ų5550.2 Ų50.233%0.33325%0.248SC..Hα-helixtrans-56-45.3174.7170.30000111.3N24 T108 M110 T116N24-V112 HydrophobicContact CB-CG2 4.45Å; T108-V112 WeakPolarHBondContact O-CG2 3.18Å; T108-V112 PolarHBondContact O-N 2.93Å; M110-V112 VanDerWaalsContact C-N 3.35Å; M110-V112 PolarHBondContact O-N 3.4Å; V112-T116 WeakPolarHBondContact O-CB 3.43Å; V112-T116 PolarHBondContact O-N 3.39Å; V112-T116 PolarHBondContact O-OG1 3.3Å
113K96.3Very high97Very high165 Ų16551.9 Ų51.972%0.71725%0.249SC*.Hα-helixtrans-69.7-47.3179.7-63.4177.9-175.5173.20110.9M110 D111 T116 A117M110-K113 PolarHBondContact O-N 3.19Å; D111-K113 VanDerWaalsContact C-N 3.29Å; D111-K113 PolarHBondContact O-N 2.97Å; K113-T116 PolarHBondContact O-N 2.81Å; K113-A117 WeakPolarHBondContact O-CB 3.31Å; K113-A117 PolarHBondContact O-N 2.76Å
114Y97.9Very high97Very high32 Ų3255.3 Ų55.313%0.12527%0.266CS..Hα-helixtrans-59.8-48.8-178.9176-94.6000112M110 D111 A117 T118 E187 P428 T430M110-Y114 PolarHBondContact O-N 3.26Å; D111-Y114 PolarHBondContact O-N 3.26Å; Y114-A117 PolarHBondContact O-N 3.26Å; Y114-T118 WeakPolarHBondContact O-CB 3.45Å; Y114-T118 PolarHBondContact O-N 3.47Å; Y114-T118 PolarHBondContact O-OG1 2.89Å; Y114-E187 WeakPolarHBondContact CE1-OE2 3.47Å; Y114-E187 PolarHBondContact OH-OE1 3.43Å; Y114-P428 HydrophobicContact CD2-CG 4.45Å; Y114-T430 HydrophobicContact CE2-CG2 4.27Å
115M97.9Very high97Very high0 Ų059 Ų590%028%0.284CS..Hα-helixtrans-69.5-37.3-178-71.8-55.5-81.500112.7Y16 V19 M20 D111 A117 T118 F119 E187 R191Y16-M115 HydrophobicContact CD1-CE 3.46Å; Y16-M115 VanDerWaalsContact CD1-CE 3.46Å; Y16-M115 HydrophobicContact CE1-CE 3.86Å; V19-M115 HydrophobicContact CB-CE 3.88Å; V19-M115 HydrophobicContact CG1-CE 3.75Å; V19-M115 HydrophobicContact CG1-CG 3.95Å; V19-M115 HydrophobicContact CG2-CE 4.15Å; M20-M115 HydrophobicContact CG-CB 3.82Å; M20-M115 HydrophobicContact SD-CB 4.23Å; D111-M115 WeakPolarHBondContact O-CB 3.47Å; D111-M115 WeakPolarHBondContact O-CG 3.37Å; D111-M115 PolarHBondContact O-N 2.92Å; D111-M115 WeakPolarHBondContact OD2-CG 3.15Å; M115-A117 PolarHBondContact O-N 3.45Å; M115-T118 PolarHBondContact O-N 3.13Å; M115-F119 VanDerWaalsContact O-CB 3.25Å; M115-F119 WeakPolarHBondContact O-CB 3.33Å; M115-F119 PolarHBondContact O-N 3.49Å; M115-E187 HydrophobicContact CE-CB 4.17Å; M115-E187 HydrophobicContact SD-CB 4.48Å; M115-R191 PolarHBondContact SD-NH2 3.04Å
116T97.3Very high97Very high53 Ų5357.2 Ų57.233%0.32528%0.275SS..Hα-helixtrans-61.5-45.3174.3-57.60000111.3V112 K113 K120V112-T116 WeakPolarHBondContact O-CB 3.43Å; V112-T116 PolarHBondContact O-N 3.39Å; V112-T116 PolarHBondContact O-OG1 3.3Å; K113-T116 PolarHBondContact O-N 2.81Å; T116-K120 HydrophobicContact CG2-CD 4.31Å; T116-K120 WeakPolarHBondContact O-CB 3.45Å; T116-K120 VanDerWaalsContact O-CG 3.31Å; T116-K120 WeakPolarHBondContact O-CG 3.36Å; T116-K120 PolarHBondContact O-N 3.4Å; T116-K120 VanDerWaalsContact O-N 3.09Å
117A98.1Very high96.9Very high43 Ų4359 Ų5936%0.35529%0.285SS..Hα-helixtrans-67-44.5179.600000111.9K113 Y114 M115 K120 R121K113-A117 WeakPolarHBondContact O-CB 3.31Å; K113-A117 PolarHBondContact O-N 2.76Å; Y114-A117 PolarHBondContact O-N 3.26Å; M115-A117 PolarHBondContact O-N 3.45Å; A117-K120 PolarHBondContact O-N 2.93Å; A117-R121 WeakPolarHBondContact O-CB 3.4Å; A117-R121 PolarHBondContact O-N 3.03Å
118T97.8Very high97Very high18 Ų1863.8 Ų63.811%0.1131%0.31CS..Hα-helixtrans-63-45.7179.4-57.20000111.3Y16 Y114 M115 R121 Y122Y16-T118 HydrophobicContact CE1-CG2 3.84Å; Y114-T118 WeakPolarHBondContact O-CB 3.45Å; Y114-T118 PolarHBondContact O-N 3.47Å; Y114-T118 PolarHBondContact O-OG1 2.89Å; M115-T118 PolarHBondContact O-N 3.13Å; T118-R121 PolarHBondContact O-N 3.31Å; T118-Y122 PolarHBondContact O-N 3.45Å
119F98.3Very high97Very high17 Ų1766 Ų668%0.07532%0.319CS..Hα-helixtrans-64.7-44.1178.5-178.2-130.9000112.4E13 Y16 K17 M20 M115 R121 Y122 Q123E13-F119 HydrophobicContact CB-CE2 4.13Å; E13-F119 HydrophobicContact CB-CZ 4.39Å; E13-F119 HydrophobicContact CG-CE2 4.02Å; E13-F119 HydrophobicContact CG-CZ 4.42Å; Y16-F119 HydrophobicContact CD1-CB 4.15Å; Y16-F119 HydrophobicContact CD1-CD2 4.41Å; Y16-F119 AromaticContact CD2-CD2 3.48Å; Y16-F119 HydrophobicContact CD2-CD2 3.48Å; Y16-F119 VanDerWaalsContact CD2-CD2 3.48Å; Y16-F119 HydrophobicContact CD2-CE2 4.08Å; Y16-F119 HydrophobicContact CD2-CG 4.43Å; Y16-F119 HydrophobicContact CE2-CD2 4.38Å; Y16-F119 HydrophobicContact CG-CB 4.05Å; Y16-F119 AromaticContact CG-CD2 3.51Å; Y16-F119 HydrophobicContact CG-CD2 3.51Å; Y16-F119 HydrophobicContact CG-CE2 4.29Å; Y16-F119 HydrophobicContact CG-CG 4.06Å; K17-F119 HydrophobicContact CG-CE1 4.41Å; K17-F119 HydrophobicContact CG-CZ 4.36Å; M20-F119 HydrophobicContact CE-CB 4.16Å; M20-F119 HydrophobicContact CE-CD1 3.51Å; M20-F119 HydrophobicContact CE-CE1 4.12Å; M20-F119 HydrophobicContact CE-CG 4Å; M115-F119 VanDerWaalsContact O-CB 3.25Å; M115-F119 WeakPolarHBondContact O-CB 3.33Å; M115-F119 PolarHBondContact O-N 3.49Å; F119-R121 VanDerWaalsContact C-N 3.32Å; F119-R121 PolarHBondContact O-N 3.48Å; F119-Y122 WeakPolarHBondContact O-CB 3.36Å; F119-Y122 PolarHBondContact O-N 3.33Å; F119-Q123 HydrophobicContact CD2-CG 4.25Å; F119-Q123 HydrophobicContact CE1-CG 4.46Å; F119-Q123 HydrophobicContact CE2-CG 3.87Å; F119-Q123 HydrophobicContact CZ-CG 4Å; F119-Q123 VanDerWaalsContact CZ-NE2 3.29Å; F119-Q123 WeakPolarHBondContact O-CG 3.49Å; F119-Q123 PolarHBondContact O-N 3.21Å
120K98.3Very high97.1Very high121 Ų12164.8 Ų64.853%0.52631%0.31SS..Hα-helixtrans-59.8-42.5175.6-78-179.6178.7-176.80112T116 A117 Q123 M124T116-K120 HydrophobicContact CG2-CD 4.31Å; T116-K120 WeakPolarHBondContact O-CB 3.45Å; T116-K120 VanDerWaalsContact O-CG 3.31Å; T116-K120 WeakPolarHBondContact O-CG 3.36Å; T116-K120 PolarHBondContact O-N 3.4Å; T116-K120 VanDerWaalsContact O-N 3.09Å; A117-K120 PolarHBondContact O-N 2.93Å; K120-Q123 PolarHBondContact O-N 2.92Å; K120-M124 WeakPolarHBondContact O-CG 3.4Å; K120-M124 PolarHBondContact O-N 2.78Å
121R98Very high97.1Very high72 Ų7264.8 Ų64.827%0.27231%0.312SS..Hα-helixtrans-59.5-49.3176.5-178.2-178.9-57-170.2-5.2111.5A117 T118 F119 Q123 M124 E125 M425 L427A117-R121 WeakPolarHBondContact O-CB 3.4Å; A117-R121 PolarHBondContact O-N 3.03Å; T118-R121 PolarHBondContact O-N 3.31Å; F119-R121 VanDerWaalsContact C-N 3.32Å; F119-R121 PolarHBondContact O-N 3.48Å; R121-Q123 VanDerWaalsContact C-N 3.31Å; R121-Q123 PolarHBondContact O-N 3.43Å; R121-M124 PolarHBondContact O-N 3.04Å; R121-E125 WeakPolarHBondContact CD-OE1 3.43Å; R121-E125 HydrophobicContact CG-CG 4.49Å; R121-E125 WeakPolarHBondContact CG-OE1 3.11Å; R121-E125 PolarHBondContact O-N 3.14Å; R121-M425 PolarHBondContact NH2-O 3.38Å; R121-L427 VanDerWaalsContact NH1-CG 3.31Å; R121-L427 VanDerWaalsContact NH2-CG 3.28Å
122Y98.3Very high97Very high11 Ų1167 Ų674%0.04333%0.328CS..Hα-helixtrans-54.7-47.2176.2174.8-96.2000111.7N9 A12 E13 Y16 T118 F119 M124 E125 H126 F176 L177N9-Y122 WeakPolarHBondContact OD1-CE1 3.42Å; N9-Y122 PolarHBondContact OD1-OH 3.05Å; A12-Y122 HydrophobicContact CB-CE1 4.17Å; A12-Y122 HydrophobicContact CB-CE2 4.43Å; E13-Y122 HydrophobicContact CG-CE1 4.14Å; Y16-Y122 HydrophobicContact CE2-CD1 4.3Å; Y16-Y122 HydrophobicContact CE2-CG 4.1Å; T118-Y122 PolarHBondContact O-N 3.45Å; F119-Y122 WeakPolarHBondContact O-CB 3.36Å; F119-Y122 PolarHBondContact O-N 3.33Å; Y122-M124 PolarHBondContact O-N 3.47Å; Y122-E125 PolarHBondContact O-N 2.83Å; Y122-H126 VanDerWaalsContact O-CB 3.24Å; Y122-H126 WeakPolarHBondContact O-CB 3.28Å; Y122-H126 PolarHBondContact O-N 3.2Å; Y122-F176 HydrophobicContact CD2-CE1 4.19Å; Y122-F176 HydrophobicContact CD2-CE2 4.46Å; Y122-F176 AromaticContact CD2-CZ 3.68Å; Y122-F176 HydrophobicContact CD2-CZ 3.68Å; Y122-F176 AromaticContact CE2-CE1 3.75Å; Y122-F176 HydrophobicContact CE2-CE1 3.75Å; Y122-F176 AromaticContact CE2-CZ 3.73Å; Y122-F176 HydrophobicContact CE2-CZ 3.73Å; Y122-F176 HydrophobicContact CG-CZ 4.49Å; Y122-L177 VanDerWaalsContact OH-CD2 3.25Å; Y122-L177 WeakPolarHBondContact OH-CD2 3.48Å
123Q97.9Very high97Very high75 Ų7565 Ų6535%0.3532%0.315SS..Hα-helixtrans-62.8-41.3178.4-70.9-174.1-48.600113.2F119 K120 R121 K127F119-Q123 HydrophobicContact CD2-CG 4.25Å; F119-Q123 HydrophobicContact CE1-CG 4.46Å; F119-Q123 HydrophobicContact CE2-CG 3.87Å; F119-Q123 HydrophobicContact CZ-CG 4Å; F119-Q123 VanDerWaalsContact CZ-NE2 3.29Å; F119-Q123 WeakPolarHBondContact O-CG 3.49Å; F119-Q123 PolarHBondContact O-N 3.21Å; K120-Q123 PolarHBondContact O-N 2.92Å; R121-Q123 VanDerWaalsContact C-N 3.31Å; R121-Q123 PolarHBondContact O-N 3.43Å; Q123-K127 WeakPolarHBondContact O-CB 3.18Å; Q123-K127 PolarHBondContact O-N 3.34Å
124M97.8Very high97Very high121 Ų12161.6 Ų61.660%0.59630%0.302SS*.Hα-helixtrans-66.1-47.6178.7-71.4-175-58.900111.6K120 R121 Y122 K127 M128K120-M124 WeakPolarHBondContact O-CG 3.4Å; K120-M124 PolarHBondContact O-N 2.78Å; R121-M124 PolarHBondContact O-N 3.04Å; Y122-M124 PolarHBondContact O-N 3.47Å; M124-K127 PolarHBondContact O-N 3.21Å; M124-M128 WeakPolarHBondContact O-CB 3.35Å; M124-M128 PolarHBondContact O-N 3.04Å
125E97.4Very high96.9Very high78 Ų7867 Ų6736%0.36433%0.326SS..Hα-helixtrans-64.7-41.6178.7-72.3-176.7-138.400112R121 Y122 K127 M128 K129 F176R121-E125 WeakPolarHBondContact CD-OE1 3.43Å; R121-E125 HydrophobicContact CG-CG 4.49Å; R121-E125 WeakPolarHBondContact CG-OE1 3.11Å; R121-E125 PolarHBondContact O-N 3.14Å; Y122-E125 PolarHBondContact O-N 2.83Å; E125-K127 PolarHBondContact O-N 2.8Å; E125-M128 PolarHBondContact O-N 2.94Å; E125-K129 PolarHBondContact O-N 3.36Å; E125-F176 HydrophobicContact CB-CE2 3.68Å; E125-F176 HydrophobicContact CB-CZ 3.82Å
126H96.6Very high96.7Very high36 Ų3667.5 Ų67.517%0.16733%0.33CS..Hα-helixtrans-56.2-51.8173.8177.9-114.3000111Y122 M128 K129 Q130 F176Y122-H126 VanDerWaalsContact O-CB 3.24Å; Y122-H126 WeakPolarHBondContact O-CB 3.28Å; Y122-H126 PolarHBondContact O-N 3.2Å; H126-M128 PolarHBondContact O-N 2.84Å; H126-K129 PolarHBondContact O-N 2.99Å; H126-Q130 WeakPolarHBondContact O-CB 3.45Å; H126-Q130 PolarHBondContact O-N 3.47Å; H126-F176 HydrophobicContact CB-CE1 3.66Å; H126-F176 HydrophobicContact CB-CZ 4.11Å
127K96.4Very high96.6Very high135 Ų13569 Ų6959%0.58733%0.333SS*.Hα-helixtrans-60.4-45.5179.6-177174180176.20111.8Q123 M124 E125 K129 Q130 D131Q123-K127 WeakPolarHBondContact O-CB 3.18Å; Q123-K127 PolarHBondContact O-N 3.34Å; M124-K127 PolarHBondContact O-N 3.21Å; E125-K127 PolarHBondContact O-N 2.8Å; K127-K129 PolarHBondContact O-N 3.26Å; K127-Q130 PolarHBondContact O-N 2.66Å; K127-D131 WeakPolarHBondContact O-CB 3.41Å; K127-D131 VanDerWaalsContact O-CG 3.22Å; K127-D131 PolarHBondContact O-N 2.96Å
128M96.8Very high96.5Very high125 Ų12569 Ų6962%0.61633%0.333SS*.Hα-helixtrans-60.5-43.8179.3-175-178.367.600112.2M124 E125 H126 S132M124-M128 WeakPolarHBondContact O-CB 3.35Å; M124-M128 PolarHBondContact O-N 3.04Å; E125-M128 PolarHBondContact O-N 2.94Å; H126-M128 PolarHBondContact O-N 2.84Å; M128-S132 WeakPolarHBondContact O-CB 3.25Å; M128-S132 PolarHBondContact O-N 3.29Å; M128-S132 VanDerWaalsContact O-N 3.13Å
129K95.4Very high96.2Very high52 Ų5271.2 Ų71.223%0.22634%0.344CS..Hα-helixtrans-66.9-38.4176.3-75.2-178.3174.7-730111.8E125 H126 K127 S132 L133 E172 M173 F176E125-K129 PolarHBondContact O-N 3.36Å; H126-K129 PolarHBondContact O-N 2.99Å; K127-K129 PolarHBondContact O-N 3.26Å; K129-S132 PolarHBondContact O-N 3.09Å; K129-L133 PolarHBondContact O-N 3.41Å; K129-E172 IonicContact NZ-OE2 3.43Å; K129-E172 PolarHBondContact NZ-OE2 3.34Å; K129-M173 VanDerWaalsContact C-CE 3.45Å; K129-M173 HydrophobicContact CB-CE 3.52Å; K129-M173 HydrophobicContact CB-SD 4.26Å; K129-F176 HydrophobicContact CD-CB 3.85Å; K129-F176 HydrophobicContact CD-CD1 4.28Å; K129-F176 HydrophobicContact CD-CD2 4.17Å; K129-F176 HydrophobicContact CD-CG 3.82Å
130Q95.5Very high96.1Very high61 Ų6171 Ų7129%0.28534%0.343SS..Hα-helixtrans-64.5-49.7178.1-17863.519.600110.8H126 K127 S132 L133 E134 M173H126-Q130 WeakPolarHBondContact O-CB 3.45Å; H126-Q130 PolarHBondContact O-N 3.47Å; K127-Q130 PolarHBondContact O-N 2.66Å; Q130-S132 VanDerWaalsContact C-N 3.28Å; Q130-S132 PolarHBondContact O-N 2.91Å; Q130-L133 WeakPolarHBondContact O-CB 3.49Å; Q130-L133 PolarHBondContact O-N 2.98Å; Q130-L133 VanDerWaalsContact O-N 3.1Å; Q130-E134 PolarHBondContact NE2-OE1 3.48Å; Q130-E134 WeakPolarHBondContact O-CG 3.25Å; Q130-E134 PolarHBondContact O-N 3.22Å; Q130-M173 VanDerWaalsContact CA-CE 3.43Å; Q130-M173 HydrophobicContact CB-CE 3.73Å
131D96Very high95.9Very high84 Ų8471.4 Ų71.445%0.44935%0.345SS..Hα-helixtrans-59.4-39.1178.5-68.3-14.8000111.3K127 K135K127-D131 WeakPolarHBondContact O-CB 3.41Å; K127-D131 VanDerWaalsContact O-CG 3.22Å; K127-D131 PolarHBondContact O-N 2.96Å; D131-K135 VanDerWaalsContact O-CB 3.29Å; D131-K135 WeakPolarHBondContact O-CB 3.4Å; D131-K135 PolarHBondContact O-N 2.97Å
132S94.8Very high95.6Very high52 Ų5273.5 Ų73.536%0.36436%0.356SS..Hα-helixtrans-64.5-40.6175.5-176.40000112.9M128 K129 Q130 S136 R169M128-S132 WeakPolarHBondContact O-CB 3.25Å; M128-S132 PolarHBondContact O-N 3.29Å; M128-S132 VanDerWaalsContact O-N 3.13Å; K129-S132 PolarHBondContact O-N 3.09Å; Q130-S132 VanDerWaalsContact C-N 3.28Å; Q130-S132 PolarHBondContact O-N 2.91Å; S132-S136 PolarHBondContact O-N 3.27Å; S132-S136 PolarHBondContact O-OG 2.93Å; S132-R169 WeakPolarHBondContact OG-CD 3.5Å; S132-R169 PolarHBondContact OG-NE 2.96Å
133L94.7Very high95.3Very high13 Ų1373.7 Ų73.77%0.06836%0.358CS..Hα-helixtrans-68-47.5177-174.667000111.1K129 Q130 K135 S136 Q137 L166 R169 Q170K129-L133 PolarHBondContact O-N 3.41Å; Q130-L133 WeakPolarHBondContact O-CB 3.49Å; Q130-L133 PolarHBondContact O-N 2.98Å; Q130-L133 VanDerWaalsContact O-N 3.1Å; L133-K135 VanDerWaalsContact C-N 3.34Å; L133-K135 PolarHBondContact O-N 3.37Å; L133-S136 PolarHBondContact O-N 3.32Å; L133-Q137 WeakPolarHBondContact O-CG 3.2Å; L133-Q137 PolarHBondContact O-N 2.94Å; L133-L166 HydrophobicContact CD1-CG 4.49Å; L133-R169 HydrophobicContact CD1-CB 3.78Å; L133-Q170 HydrophobicContact CD1-CB 4.1Å
134E95.4Very high94.9Very high95 Ų9575.6 Ų75.644%0.44436%0.362SS..Hα-helixtrans-61.6-40.4178.4-72.6-177.4-173.800112.1Q130 S136 Q137 A138Q130-E134 PolarHBondContact NE2-OE1 3.48Å; Q130-E134 WeakPolarHBondContact O-CG 3.25Å; Q130-E134 PolarHBondContact O-N 3.22Å; E134-S136 PolarHBondContact O-N 3.49Å; E134-Q137 PolarHBondContact O-N 3.44Å; E134-A138 WeakPolarHBondContact O-CB 3.32Å; E134-A138 PolarHBondContact O-N 3.08Å
135K95.5Very high94.5Very high145 Ų14578.5 Ų78.563%0.6337%0.366SS*.Hα-helixtrans-59.5-46.2174.4-175.8177-179.8179.50111.8D131 L133 Q137 A138 D139D131-K135 VanDerWaalsContact O-CB 3.29Å; D131-K135 WeakPolarHBondContact O-CB 3.4Å; D131-K135 PolarHBondContact O-N 2.97Å; L133-K135 VanDerWaalsContact C-N 3.34Å; L133-K135 PolarHBondContact O-N 3.37Å; K135-Q137 PolarHBondContact O-N 2.94Å; K135-A138 PolarHBondContact O-N 3.29Å; K135-D139 PolarHBondContact O-N 3.42Å
136S93.8Very high94Very high10 Ų1081.7 Ų81.77%0.0738%0.379CS..Hα-helixtrans-65.8-38.4179.5-55.60000112.1S132 L133 E134 D139 L140 R169S132-S136 PolarHBondContact O-N 3.27Å; S132-S136 PolarHBondContact O-OG 2.93Å; L133-S136 PolarHBondContact O-N 3.32Å; E134-S136 PolarHBondContact O-N 3.49Å; S136-D139 PolarHBondContact O-N 2.97Å; S136-L140 PolarHBondContact O-N 3.34Å; S136-R169 VanDerWaalsContact OG-CD 3.31Å; S136-R169 WeakPolarHBondContact OG-CD 3.45Å; S136-R169 PolarHBondContact OG-NE 2.88Å; S136-R169 VanDerWaalsContact OG-NE 3.15Å; S136-R169 PolarHBondContact OG-NH1 3.29Å
137Q95.7Very high93.4Very high86 Ų8681 Ų8140%0.40238%0.378SS..Hα-helixtrans-64-42.4172.7-72.2173.5-3.600112.1L133 E134 K135 D139 L140 K141 L166L133-Q137 WeakPolarHBondContact O-CG 3.2Å; L133-Q137 PolarHBondContact O-N 2.94Å; E134-Q137 PolarHBondContact O-N 3.44Å; K135-Q137 PolarHBondContact O-N 2.94Å; Q137-D139 VanDerWaalsContact C-N 3.34Å; Q137-L140 PolarHBondContact O-N 3.04Å; Q137-K141 WeakPolarHBondContact O-CB 3.25Å; Q137-K141 PolarHBondContact O-N 2.92Å; Q137-L166 HydrophobicContact CG-CD1 3.81Å; Q137-L166 HydrophobicContact CG-CG 4.37Å
138A95.8Very high92.6Very high41 Ų4183.2 Ų83.234%0.33939%0.391SS..Hα-helixtrans-63.9-40.2177.300000111.7E134 K135 K141 K142E134-A138 WeakPolarHBondContact O-CB 3.32Å; E134-A138 PolarHBondContact O-N 3.08Å; K135-A138 PolarHBondContact O-N 3.29Å; A138-K141 PolarHBondContact O-N 3.48Å; A138-K142 VanDerWaalsContact O-CG 3.32Å; A138-K142 WeakPolarHBondContact O-CG 3.42Å; A138-K142 PolarHBondContact O-N 3.47Å
139D92.9Very high91.5Very high65 Ų6579.7 Ų79.735%0.34839%0.386SS..Hα-helixtrans-69.1-40.1178.3-71.5-18.6000112.2K135 S136 Q137 K141 K142 L143K135-D139 PolarHBondContact O-N 3.42Å; S136-D139 PolarHBondContact O-N 2.97Å; Q137-D139 VanDerWaalsContact C-N 3.34Å; D139-K141 VanDerWaalsContact C-N 3.34Å; D139-K141 PolarHBondContact O-N 2.89Å; D139-K142 PolarHBondContact O-N 2.9Å; D139-K142 IonicContact OD1-NZ 2.64Å; D139-K142 PolarHBondContact OD1-NZ 3.38Å; D139-L143 WeakPolarHBondContact O-CB 3.34Å; D139-L143 PolarHBondContact O-N 3.03Å
140L94.4Very high90.3Very high12 Ų1287.5 Ų87.56%0.06342%0.42CS..Hα-helixtrans-58.1-46.6170.7-177.260.5000111.5S136 Q137 K142 L143 R144 E159 I162 L163 L166S136-L140 PolarHBondContact O-N 3.34Å; Q137-L140 PolarHBondContact O-N 3.04Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 2.9Å; L140-L143 PolarHBondContact O-N 3.2Å; L140-R144 HydrophobicContact CD1-CG 4.46Å; L140-R144 WeakPolarHBondContact O-CG 3.46Å; L140-R144 PolarHBondContact O-N 3.37Å; L140-E159 HydrophobicContact CD1-CG 3.89Å; L140-I162 HydrophobicContact CB-CG2 3.69Å; L140-I162 HydrophobicContact CD1-CB 4.39Å; L140-I162 HydrophobicContact CD1-CG2 4.02Å; L140-I162 HydrophobicContact CG-CG2 4.35Å; L140-L163 HydrophobicContact CD1-CD2 4.28Å; L140-L163 HydrophobicContact CD1-CG 4.22Å; L140-L163 HydrophobicContact CD2-CD2 3.67Å; L140-L163 HydrophobicContact CD2-CG 4.45Å; L140-L166 HydrophobicContact CD2-CD1 3.89Å
141K94.1Very high89.1Confident130 Ų13089.5 Ų89.557%0.56543%0.433SS*.Hα-helixtrans-62-39.6178.8-170.8175.6-176.4175.30111.8Q137 A138 D139 R145Q137-K141 WeakPolarHBondContact O-CB 3.25Å; Q137-K141 PolarHBondContact O-N 2.92Å; A138-K141 PolarHBondContact O-N 3.48Å; D139-K141 VanDerWaalsContact C-N 3.34Å; D139-K141 PolarHBondContact O-N 2.89Å; K141-R145 WeakPolarHBondContact O-CG 3.41Å; K141-R145 PolarHBondContact O-N 2.91Å
142K92.6Very high88Confident117 Ų11787.9 Ų87.951%0.50943%0.431SS..Hα-helixtrans-65.9-42.5174.3-72.5170-169.5163.50111.7A138 D139 L140 R145 K146A138-K142 VanDerWaalsContact O-CG 3.32Å; A138-K142 WeakPolarHBondContact O-CG 3.42Å; A138-K142 PolarHBondContact O-N 3.47Å; D139-K142 PolarHBondContact O-N 2.9Å; D139-K142 IonicContact OD1-NZ 2.64Å; D139-K142 PolarHBondContact OD1-NZ 3.38Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 2.9Å; K142-R145 PolarHBondContact O-N 2.97Å; K142-K146 WeakPolarHBondContact O-CG 3.3Å; K142-K146 PolarHBondContact O-N 3.35Å
143L91.2Very high87.3Confident15 Ų1592.1 Ų92.18%0.07945%0.449CS..Hα-helixtrans-63.4-46.2178.8-172.770.2000111.2D139 L140 R145 K146 S147 Y155 K158 E159 I162D139-L143 WeakPolarHBondContact O-CB 3.34Å; D139-L143 PolarHBondContact O-N 3.03Å; L140-L143 PolarHBondContact O-N 3.2Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.3Å; L143-K146 CarbonylContact O-C 3.6Å; L143-K146 WeakPolarHBondContact O-CA 3.43Å; L143-K146 WeakPolarHBondContact O-CB 3.4Å; L143-K146 PolarHBondContact O-N 3.49Å; L143-S147 PolarHBondContact O-N 2.79Å; L143-Y155 HydrophobicContact CD1-CD1 3.64Å; L143-Y155 HydrophobicContact CD1-CE1 4.38Å; L143-Y155 HydrophobicContact CD1-CG 4.22Å; L143-K158 HydrophobicContact CD1-CD 4.42Å; L143-K158 HydrophobicContact CD2-CB 4.27Å; L143-K158 HydrophobicContact CD2-CG 4.16Å; L143-E159 VanDerWaalsContact CD2-CA 3.48Å; L143-E159 HydrophobicContact CD2-CB 3.73Å; L143-E159 HydrophobicContact CD2-CG 4.49Å; L143-I162 HydrophobicContact CB-CD1 4.44Å; L143-I162 HydrophobicContact CD2-CD1 3.79Å
144R89.8Confident86.8Confident114 Ų11499 Ų9943%0.4348%0.479SS..Hα-helixtrans-57.7-40.9177.3-76.7179.6170.8169.8-0.6112.8L140 K146 S147 Q148 E159L140-R144 HydrophobicContact CD1-CG 4.46Å; L140-R144 WeakPolarHBondContact O-CG 3.46Å; L140-R144 PolarHBondContact O-N 3.37Å; R144-K146 VanDerWaalsContact C-N 3.3Å; R144-K146 PolarHBondContact O-N 3.49Å; R144-S147 PolarHBondContact O-N 3.17Å; R144-S147 PolarHBondContact O-OG 3.46Å; R144-Q148 WeakPolarHBondContact O-CG 3.38Å; R144-E159 IonicContact CZ-OE1 2.77Å; R144-E159 IonicContact NE-OE1 2.75Å; R144-E159 PolarHBondContact NE-OE1 2.93Å; R144-E159 IonicContact NH2-OE1 3.16Å; R144-E159 PolarHBondContact NH2-OE1 3.24Å; R144-E159 VanDerWaalsContact NH2-OE1 3.16Å
145R89.2Confident86.3Confident182 Ų18297.5 Ų97.569%0.68747%0.469SS*.Hα-helixtrans-61.3-36.1173.8-72.1173.8177.7-176.2-3.2112.9K141 K142 L143K141-R145 WeakPolarHBondContact O-CG 3.41Å; K141-R145 PolarHBondContact O-N 2.91Å; K142-R145 PolarHBondContact O-N 2.97Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.3Å
146K86.7Confident85.9Confident146 Ų14696.7 Ų96.764%0.63547%0.468SS*.Hα-helixtrans-75.9-24.5176.9-66.4177-179.7-176.90113K142 L143 R144K142-K146 WeakPolarHBondContact O-CG 3.3Å; K142-K146 PolarHBondContact O-N 3.35Å; L143-K146 CarbonylContact O-C 3.6Å; L143-K146 WeakPolarHBondContact O-CA 3.43Å; L143-K146 WeakPolarHBondContact O-CB 3.4Å; L143-K146 PolarHBondContact O-N 3.49Å; R144-K146 VanDerWaalsContact C-N 3.3Å; R144-K146 PolarHBondContact O-N 3.49Å
147S84.9Confident85.6Confident21 Ų21101 Ų10115%0.14750%0.498CS..Hα-helixtrans-78-19.4-176.775.60000114.8L143 R144 G149L143-S147 PolarHBondContact O-N 2.79Å; R144-S147 PolarHBondContact O-N 3.17Å; R144-S147 PolarHBondContact O-OG 3.46Å; S147-G149 PolarHBondContact O-N 3.01Å
148Q79.3Confident85.4Confident182 Ų182102.6 Ų102.685%0.8550%0.503SS*.SBendtrans-71.812-172.9-63.8-134.4-3500115.9R144R144-Q148 WeakPolarHBondContact O-CG 3.38Å
149G73.8Confident85.1Confident50 Ų50102.6 Ų102.652%0.51550%0.497SS..SBendtrans-107.6-167.8177.900000113.4S147 N151S147-G149 PolarHBondContact O-N 3.01Å; G149-N151 PolarHBondContact O-N 3.19Å
150K71Confident85.1Confident216 Ų216103 Ų10394%0.93951%0.505SS*.THydrogen-bonded Turntrans-63.8-0.7-178.4-65.4-174.9177.8-177.70115.7
151N69.3Low85Confident104 Ų104108.6 Ų108.656%0.55653%0.53SS*.THydrogen-bonded Turntrans-118.430-174.6-71.4-26.6000113.3G149 N153 K154 Y155G149-N151 PolarHBondContact O-N 3.19Å; N151-N153 VanDerWaalsContact C-N 3.33Å; N151-N153 PolarHBondContact O-N 3.11Å; N151-K154 HydrophobicContact CB-CB 4.39Å; N151-K154 VanDerWaalsContact O-CB 3.31Å; N151-K154 WeakPolarHBondContact O-CB 3.41Å; N151-K154 PolarHBondContact O-N 3.35Å; N151-K154 VanDerWaalsContact O-N 3.07Å; N151-Y155 HydrophobicContact CB-CE2 4.47Å; N151-Y155 WeakPolarHBondContact O-CD2 3.4Å
152A73.8Confident85Confident49 Ų49103.9 Ų103.941%0.40551%0.511SS..G310 helixtrans-52.4-47-177.300000113.2K154 Y155A152-K154 PolarHBondContact O-N 3.33Å; A152-K154 VanDerWaalsContact O-N 3.08Å; A152-Y155 PolarHBondContact O-N 2.84Å
153N79.3Confident85Confident141 Ų141101.4 Ų101.475%0.75450%0.503SS*.G310 helixtrans-61.5-22-179-57.60.6000113.4N151 Y155N151-N153 VanDerWaalsContact C-N 3.33Å; N151-N153 PolarHBondContact O-N 3.11Å; N153-Y155 VanDerWaalsContact C-N 3.26Å; N153-Y155 PolarHBondContact O-N 3.12Å
154K84Confident85.2Confident157 Ų157107.1 Ų107.168%0.68353%0.529SS*.G310 helixtrans-69.5-25.1177.3-173.2177.5177.7177.70112.3N151 A152N151-K154 HydrophobicContact CB-CB 4.39Å; N151-K154 VanDerWaalsContact O-CB 3.31Å; N151-K154 WeakPolarHBondContact O-CB 3.41Å; N151-K154 PolarHBondContact O-N 3.35Å; N151-K154 VanDerWaalsContact O-N 3.07Å; A152-K154 PolarHBondContact O-N 3.33Å; A152-K154 VanDerWaalsContact O-N 3.08Å
155Y85.6Confident85.4Confident64 Ų64103.2 Ų103.225%0.25152%0.521SS..THydrogen-bonded Turntrans-104.9-7.8-174.5-61.9-72.5000113.6L143 N151 A152 N153 S157 K158 E159L143-Y155 HydrophobicContact CD1-CD1 3.64Å; L143-Y155 HydrophobicContact CD1-CE1 4.38Å; L143-Y155 HydrophobicContact CD1-CG 4.22Å; N151-Y155 HydrophobicContact CB-CE2 4.47Å; N151-Y155 WeakPolarHBondContact O-CD2 3.4Å; A152-Y155 PolarHBondContact O-N 2.84Å; N153-Y155 VanDerWaalsContact C-N 3.26Å; N153-Y155 PolarHBondContact O-N 3.12Å; Y155-S157 PolarHBondContact O-N 3.09Å; Y155-K158 PolarHBondContact O-N 3.46Å; Y155-E159 WeakPolarHBondContact O-CB 3.4Å; Y155-E159 PolarHBondContact O-N 3.16Å
156E86.8Confident85.7Confident129 Ų12995.6 Ų95.660%0.60349%0.494SS*.Hα-helixtrans-58.8-49.4-174.8-173.6174-166.400112.9K158 E159 S160E156-K158 VanDerWaalsContact C-N 3.32Å; E156-K158 PolarHBondContact O-N 2.96Å; E156-E159 PolarHBondContact O-N 2.9Å; E156-S160 PolarHBondContact O-N 3.13Å
157S88.4Confident86.1Confident99 Ų9992.7 Ų92.769%0.69249%0.489SS*.Hα-helixtrans-59.6-41.6176.8170.40000112.3Y155 S160 E161Y155-S157 PolarHBondContact O-N 3.09Å; S157-S160 PolarHBondContact O-N 2.75Å; S157-E161 PolarHBondContact O-N 2.75Å
158K90.1Very high86.5Confident120 Ų12095.1 Ų95.152%0.52250%0.503SS..Hα-helixtrans-72.1-31.7178.6-169.7164.6-173.3160.80112.6L143 Y155 E156 I162L143-K158 HydrophobicContact CD1-CD 4.42Å; L143-K158 HydrophobicContact CD2-CB 4.27Å; L143-K158 HydrophobicContact CD2-CG 4.16Å; Y155-K158 PolarHBondContact O-N 3.46Å; E156-K158 VanDerWaalsContact C-N 3.32Å; E156-K158 PolarHBondContact O-N 2.96Å; K158-I162 VanDerWaalsContact O-CG1 3.32Å; K158-I162 WeakPolarHBondContact O-CG1 3.31Å; K158-I162 PolarHBondContact O-N 3.32Å
159E90.9Very high87.3Confident42 Ų4290.2 Ų90.220%0.19648%0.476CS..Hα-helixtrans-68.1-42.8173.1-178.2166-176.100110.8L140 L143 R144 Y155 E156 E161 I162 L163L140-E159 HydrophobicContact CD1-CG 3.89Å; L143-E159 VanDerWaalsContact CD2-CA 3.48Å; L143-E159 HydrophobicContact CD2-CB 3.73Å; L143-E159 HydrophobicContact CD2-CG 4.49Å; R144-E159 IonicContact CZ-OE1 2.77Å; R144-E159 IonicContact NE-OE1 2.75Å; R144-E159 PolarHBondContact NE-OE1 2.93Å; R144-E159 IonicContact NH2-OE1 3.16Å; R144-E159 PolarHBondContact NH2-OE1 3.24Å; R144-E159 VanDerWaalsContact NH2-OE1 3.16Å; Y155-E159 WeakPolarHBondContact O-CB 3.4Å; Y155-E159 PolarHBondContact O-N 3.16Å; E156-E159 PolarHBondContact O-N 2.9Å; E159-E161 PolarHBondContact O-N 3.36Å; E159-I162 PolarHBondContact O-N 3Å; E159-L163 HydrophobicContact CG-CD1 4.01Å; E159-L163 HydrophobicContact CG-CG 4.41Å; E159-L163 WeakPolarHBondContact O-CB 3.4Å; E159-L163 WeakPolarHBondContact O-CG 3.3Å; E159-L163 PolarHBondContact O-N 3.14Å
160S91.8Very high88.2Confident74 Ų7491.7 Ų91.752%0.51747%0.47SS..Hα-helixtrans-58.6-45.3174.8-165.90000111.8E156 S157 I162 L163 E164E156-S160 PolarHBondContact O-N 3.13Å; S157-S160 PolarHBondContact O-N 2.75Å; S160-I162 PolarHBondContact O-N 3.3Å; S160-L163 PolarHBondContact O-N 2.89Å; S160-E164 PolarHBondContact O-N 2.81Å
161E93.1Very high89.3Confident128 Ų12884.6 Ų84.660%0.59845%0.445SS*.Hα-helixtrans-59.6-45.4176.7-173.1-170.2169.500112.1S157 E159 E164 A165S157-E161 PolarHBondContact O-N 2.75Å; E159-E161 PolarHBondContact O-N 3.36Å; E161-E164 PolarHBondContact O-N 3.31Å; E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 3.29Å
162I92.7Very high90.6Very high31 Ų3184 Ų8416%0.15944%0.438CS..Hα-helixtrans-66.7-38.4178.1-65.2174000111.1L140 L143 K158 E159 S160 A165 L166L140-I162 HydrophobicContact CB-CG2 3.69Å; L140-I162 HydrophobicContact CD1-CB 4.39Å; L140-I162 HydrophobicContact CD1-CG2 4.02Å; L140-I162 HydrophobicContact CG-CG2 4.35Å; L143-I162 HydrophobicContact CB-CD1 4.44Å; L143-I162 HydrophobicContact CD2-CD1 3.79Å; K158-I162 VanDerWaalsContact O-CG1 3.32Å; K158-I162 WeakPolarHBondContact O-CG1 3.31Å; K158-I162 PolarHBondContact O-N 3.32Å; E159-I162 PolarHBondContact O-N 3Å; S160-I162 PolarHBondContact O-N 3.3Å; I162-A165 PolarHBondContact O-N 3.36Å; I162-L166 VanDerWaalsContact O-CB 3.26Å; I162-L166 WeakPolarHBondContact O-CB 3.43Å; I162-L166 PolarHBondContact O-N 3.09Å
163L94.4Very high91.6Very high65 Ų6582 Ų8234%0.3442%0.421SS..Hα-helixtrans-65.2-42.8177.7-77.4170.7000112.3L140 E159 S160 L166 T167L140-L163 HydrophobicContact CD1-CD2 4.28Å; L140-L163 HydrophobicContact CD1-CG 4.22Å; L140-L163 HydrophobicContact CD2-CD2 3.67Å; L140-L163 HydrophobicContact CD2-CG 4.45Å; E159-L163 HydrophobicContact CG-CD1 4.01Å; E159-L163 HydrophobicContact CG-CG 4.41Å; E159-L163 WeakPolarHBondContact O-CB 3.4Å; E159-L163 WeakPolarHBondContact O-CG 3.3Å; E159-L163 PolarHBondContact O-N 3.14Å; S160-L163 PolarHBondContact O-N 2.89Å; L163-L166 PolarHBondContact O-N 2.69Å; L163-T167 PolarHBondContact O-N 3.01Å; L163-T167 PolarHBondContact O-OG1 2.86Å
164E94.2Very high92.3Very high136 Ų13678.4 Ų78.464%0.63640%0.4SS*.Hα-helixtrans-61.2-49.6174.3-174.8175-173.800110.5S160 E161 L166 T167 V168S160-E164 PolarHBondContact O-N 2.81Å; E161-E164 PolarHBondContact O-N 3.31Å; E164-L166 VanDerWaalsContact C-N 3.26Å; E164-L166 PolarHBondContact O-N 2.84Å; E164-T167 WeakPolarHBondContact O-CB 3.42Å; E164-T167 PolarHBondContact O-N 3.4Å; E164-T167 VanDerWaalsContact O-N 3.09Å; E164-V168 WeakPolarHBondContact O-CG2 3.35Å; E164-V168 PolarHBondContact O-N 3.43Å
165A94Very high92.8Very high32 Ų3275.7 Ų75.726%0.26439%0.392SS..Hα-helixtrans-64.7-29.3179.400000113E161 I162 R169E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 3.29Å; I162-A165 PolarHBondContact O-N 3.36Å; A165-R169 VanDerWaalsContact C-NH1 3.31Å; A165-R169 VanDerWaalsContact O-CG 3.31Å; A165-R169 WeakPolarHBondContact O-CG 3.49Å; A165-R169 PolarHBondContact O-N 3.49Å; A165-R169 VanDerWaalsContact O-N 3.12Å; A165-R169 PolarHBondContact O-NH1 3.16Å
166L95.3Very high93.4Very high21 Ų2174 Ų7411%0.1139%0.386CS..Hα-helixtrans-70.7-42.3173.4-167.1159.6000110.7L133 Q137 L140 I162 L163 E164 V168 R169 Q170L133-L166 HydrophobicContact CD1-CG 4.49Å; Q137-L166 HydrophobicContact CG-CD1 3.81Å; Q137-L166 HydrophobicContact CG-CG 4.37Å; L140-L166 HydrophobicContact CD2-CD1 3.89Å; I162-L166 VanDerWaalsContact O-CB 3.26Å; I162-L166 WeakPolarHBondContact O-CB 3.43Å; I162-L166 PolarHBondContact O-N 3.09Å; L163-L166 PolarHBondContact O-N 2.69Å; E164-L166 VanDerWaalsContact C-N 3.26Å; E164-L166 PolarHBondContact O-N 2.84Å; L166-V168 VanDerWaalsContact C-N 3.33Å; L166-V168 PolarHBondContact O-N 2.64Å; L166-R169 PolarHBondContact O-N 2.67Å; L166-Q170 VanDerWaalsContact O-CB 3.26Å; L166-Q170 WeakPolarHBondContact O-CB 3.46Å; L166-Q170 PolarHBondContact O-N 3.49Å
167T94.7Very high93.8Very high85 Ų8568.1 Ų68.152%0.52136%0.358SS..Hα-helixtrans-61.1-43.3176.8-54.10000111.2L163 E164 Q170 T171L163-T167 PolarHBondContact O-N 3.01Å; L163-T167 PolarHBondContact O-OG1 2.86Å; E164-T167 WeakPolarHBondContact O-CB 3.42Å; E164-T167 PolarHBondContact O-N 3.4Å; E164-T167 VanDerWaalsContact O-N 3.09Å; T167-Q170 PolarHBondContact O-N 3.48Å; T167-T171 WeakPolarHBondContact O-CB 3.39Å; T167-T171 PolarHBondContact O-N 3.27Å; T167-T171 PolarHBondContact O-OG1 3.41Å
168V94.9Very high94.2Very high73 Ų7366 Ų6644%0.44235%0.347SS..Hα-helixtrans-60.5-53.6174.5174.10000110.9E164 L166 Q170 T171 E172E164-V168 WeakPolarHBondContact O-CG2 3.35Å; E164-V168 PolarHBondContact O-N 3.43Å; L166-V168 VanDerWaalsContact C-N 3.33Å; L166-V168 PolarHBondContact O-N 2.64Å; V168-Q170 VanDerWaalsContact C-N 3.29Å; V168-Q170 PolarHBondContact O-N 2.81Å; V168-T171 WeakPolarHBondContact O-CB 3.48Å; V168-T171 PolarHBondContact O-N 2.83Å; V168-T171 VanDerWaalsContact O-N 3.12Å; V168-E172 HydrophobicContact CG1-CG 4.46Å; V168-E172 WeakPolarHBondContact O-CG 3.34Å; V168-E172 PolarHBondContact O-N 2.9Å
169R94.4Very high94.5Very high79 Ų7965.1 Ų65.130%0.29835%0.348SS..Hα-helixtrans-60.5-37.4179.8-72.6-179.2-170.891.1-3.9113.1S132 L133 S136 A165 L166 E172 M173S132-R169 WeakPolarHBondContact OG-CD 3.5Å; S132-R169 PolarHBondContact OG-NE 2.96Å; L133-R169 HydrophobicContact CD1-CB 3.78Å; S136-R169 VanDerWaalsContact OG-CD 3.31Å; S136-R169 WeakPolarHBondContact OG-CD 3.45Å; S136-R169 PolarHBondContact OG-NE 2.88Å; S136-R169 VanDerWaalsContact OG-NE 3.15Å; S136-R169 PolarHBondContact OG-NH1 3.29Å; A165-R169 VanDerWaalsContact C-NH1 3.31Å; A165-R169 VanDerWaalsContact O-CG 3.31Å; A165-R169 WeakPolarHBondContact O-CG 3.49Å; A165-R169 PolarHBondContact O-N 3.49Å; A165-R169 VanDerWaalsContact O-N 3.12Å; A165-R169 PolarHBondContact O-NH1 3.16Å; L166-R169 PolarHBondContact O-N 2.67Å; R169-E172 PolarHBondContact O-N 3.08Å; R169-M173 WeakPolarHBondContact O-CB 3.39Å; R169-M173 PolarHBondContact O-N 3.29Å
170Q94.6Very high94.8Very high81 Ų8163.6 Ų63.638%0.37934%0.344SS..Hα-helixtrans-68-38.6177.7-171.3162-100111.3L133 L166 T167 V168 M173 Q174L133-Q170 HydrophobicContact CD1-CB 4.1Å; L166-Q170 VanDerWaalsContact O-CB 3.26Å; L166-Q170 WeakPolarHBondContact O-CB 3.46Å; L166-Q170 PolarHBondContact O-N 3.49Å; T167-Q170 PolarHBondContact O-N 3.48Å; V168-Q170 VanDerWaalsContact C-N 3.29Å; V168-Q170 PolarHBondContact O-N 2.81Å; Q170-M173 PolarHBondContact O-N 3.45Å; Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.36Å; Q170-Q174 PolarHBondContact O-N 3.23Å
171T94.1Very high95.1Very high67 Ų6760.9 Ų60.941%0.41133%0.325SS..Hα-helixtrans-66.3-45174.2-54.90000111.1T167 V168 M173 Q174 L175T167-T171 WeakPolarHBondContact O-CB 3.39Å; T167-T171 PolarHBondContact O-N 3.27Å; T167-T171 PolarHBondContact O-OG1 3.41Å; V168-T171 WeakPolarHBondContact O-CB 3.48Å; V168-T171 PolarHBondContact O-N 2.83Å; V168-T171 VanDerWaalsContact O-N 3.12Å; T171-M173 VanDerWaalsContact C-N 3.32Å; T171-M173 PolarHBondContact O-N 3.34Å; T171-Q174 PolarHBondContact O-N 3.49Å; T171-L175 HydrophobicContact CG2-CD1 4.13Å; T171-L175 HydrophobicContact CG2-CG 4.46Å; T171-L175 WeakPolarHBondContact O-CG 3.46Å; T171-L175 PolarHBondContact O-N 3.14Å
172E94.8Very high95.3Very high90 Ų9060.9 Ų60.942%0.42132%0.323SS..Hα-helixtrans-59.3-40.7175.4-74-178.1-17100112.7K129 V168 R169 F176K129-E172 IonicContact NZ-OE2 3.43Å; K129-E172 PolarHBondContact NZ-OE2 3.34Å; V168-E172 HydrophobicContact CG1-CG 4.46Å; V168-E172 WeakPolarHBondContact O-CG 3.34Å; V168-E172 PolarHBondContact O-N 2.9Å; R169-E172 PolarHBondContact O-N 3.08Å; E172-F176 VanDerWaalsContact O-CB 3.24Å; E172-F176 WeakPolarHBondContact O-CB 3.24Å; E172-F176 PolarHBondContact O-N 3.15Å
173M95Very high95.5Very high8 Ų862.8 Ų62.84%0.03933%0.331CS..Hα-helixtrans-63.9-44.7175.4177.757.788.200111.3K129 Q130 R169 Q170 T171 F176 L177K129-M173 VanDerWaalsContact C-CE 3.45Å; K129-M173 HydrophobicContact CB-CE 3.52Å; K129-M173 HydrophobicContact CB-SD 4.26Å; Q130-M173 VanDerWaalsContact CA-CE 3.43Å; Q130-M173 HydrophobicContact CB-CE 3.73Å; R169-M173 WeakPolarHBondContact O-CB 3.39Å; R169-M173 PolarHBondContact O-N 3.29Å; Q170-M173 PolarHBondContact O-N 3.45Å; T171-M173 VanDerWaalsContact C-N 3.32Å; T171-M173 PolarHBondContact O-N 3.34Å; M173-F176 PolarHBondContact O-N 3.42Å; M173-F176 HydrophobicContact SD-CD1 4.34Å; M173-L177 HydrophobicContact CG-CD1 3.97Å; M173-L177 WeakPolarHBondContact O-CB 3.32Å; M173-L177 WeakPolarHBondContact O-CG 3.22Å; M173-L177 PolarHBondContact O-N 3.08Å; M173-L177 HydrophobicContact SD-CD1 3.76Å; M173-L177 HydrophobicContact SD-CG 3.95Å
174Q94.4Very high95.7Very high66 Ų6659.7 Ų59.731%0.30832%0.315SS..Hα-helixtrans-62.8-43.7178.2-74.6177.82.700112.3V5 Q170 T171 L177 A178V5-Q174 HydrophobicContact CG2-CG 3.93Å; Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.36Å; Q170-Q174 PolarHBondContact O-N 3.23Å; T171-Q174 PolarHBondContact O-N 3.49Å; Q174-L177 PolarHBondContact O-N 3.29Å; Q174-A178 WeakPolarHBondContact O-CB 3.3Å; Q174-A178 PolarHBondContact O-N 2.93Å
175L95Very high95.9Very high100 Ų10056.4 Ų56.452%0.52430%0.301SS..Hα-helixtrans-63.6-47.3176.4-71.3172.3000111.2T171 L177 A178 D179T171-L175 HydrophobicContact CG2-CD1 4.13Å; T171-L175 HydrophobicContact CG2-CG 4.46Å; T171-L175 WeakPolarHBondContact O-CG 3.46Å; T171-L175 PolarHBondContact O-N 3.14Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.47Å; L175-A178 PolarHBondContact O-N 3.01Å; L175-D179 WeakPolarHBondContact O-CB 3.12Å; L175-D179 PolarHBondContact O-N 3.38Å
176F96.8Very high96.2Very high28 Ų2857.6 Ų57.612%0.12330%0.303CS..Hα-helixtrans-55.7-44.6176.6170.6-95.5000112.1Y122 E125 H126 K129 E172 M173 G180Y122-F176 HydrophobicContact CD2-CE1 4.19Å; Y122-F176 HydrophobicContact CD2-CE2 4.46Å; Y122-F176 AromaticContact CD2-CZ 3.68Å; Y122-F176 HydrophobicContact CD2-CZ 3.68Å; Y122-F176 AromaticContact CE2-CE1 3.75Å; Y122-F176 HydrophobicContact CE2-CE1 3.75Å; Y122-F176 AromaticContact CE2-CZ 3.73Å; Y122-F176 HydrophobicContact CE2-CZ 3.73Å; Y122-F176 HydrophobicContact CG-CZ 4.49Å; E125-F176 HydrophobicContact CB-CE2 3.68Å; E125-F176 HydrophobicContact CB-CZ 3.82Å; H126-F176 HydrophobicContact CB-CE1 3.66Å; H126-F176 HydrophobicContact CB-CZ 4.11Å; K129-F176 HydrophobicContact CD-CB 3.85Å; K129-F176 HydrophobicContact CD-CD1 4.28Å; K129-F176 HydrophobicContact CD-CD2 4.17Å; K129-F176 HydrophobicContact CD-CG 3.82Å; E172-F176 VanDerWaalsContact O-CB 3.24Å; E172-F176 WeakPolarHBondContact O-CB 3.24Å; E172-F176 PolarHBondContact O-N 3.15Å; M173-F176 PolarHBondContact O-N 3.42Å; M173-F176 HydrophobicContact SD-CD1 4.34Å; F176-G180 WeakPolarHBondContact O-CA 3.36Å; F176-G180 PolarHBondContact O-N 3.48Å
177L96.5Very high96.3Very high5 Ų556.7 Ų56.73%0.02630%0.298CS..Hα-helixtrans-71.1-37.6179.8-72.2174.2000112.9V5 N9 Y122 M173 Q174 L175 C181V5-L177 HydrophobicContact CB-CD1 4.47Å; V5-L177 HydrophobicContact CG1-CD1 3.16Å; V5-L177 HydrophobicContact CG1-CG 4.48Å; N9-L177 HydrophobicContact CB-CD2 3.66Å; Y122-L177 VanDerWaalsContact OH-CD2 3.25Å; Y122-L177 WeakPolarHBondContact OH-CD2 3.48Å; M173-L177 HydrophobicContact CG-CD1 3.97Å; M173-L177 WeakPolarHBondContact O-CB 3.32Å; M173-L177 WeakPolarHBondContact O-CG 3.22Å; M173-L177 PolarHBondContact O-N 3.08Å; M173-L177 HydrophobicContact SD-CD1 3.76Å; M173-L177 HydrophobicContact SD-CG 3.95Å; Q174-L177 PolarHBondContact O-N 3.29Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 3.47Å; L177-C181 WeakPolarHBondContact O-CB 3.33Å; L177-C181 PolarHBondContact O-N 3.3Å
178A95.8Very high96.4Very high55 Ų5554.5 Ų54.546%0.45528%0.282SS..Hα-helixtrans-63.5-48.117500000111.4Q174 L175 K182Q174-A178 WeakPolarHBondContact O-CB 3.3Å; Q174-A178 PolarHBondContact O-N 2.93Å; L175-A178 PolarHBondContact O-N 3.01Å; A178-K182 WeakPolarHBondContact O-CB 3.35Å; A178-K182 PolarHBondContact O-N 2.97Å
179D96.8Very high96.6Very high101 Ų10157.4 Ų57.454%0.5429%0.288SS..Hα-helixtrans-69.1-41.8179.5-72.6-25.6000111.8L175 K182 E183L175-D179 WeakPolarHBondContact O-CB 3.12Å; L175-D179 PolarHBondContact O-N 3.38Å; D179-K182 PolarHBondContact O-N 3.31Å; D179-E183 WeakPolarHBondContact O-CB 3.49Å; D179-E183 PolarHBondContact O-N 3.44Å
180G97.3Very high96.8Very high11 Ų1155.8 Ų55.811%0.11328%0.283CS..Hα-helixtrans-64.3-41.6177.200000113F176 E183 A184F176-G180 WeakPolarHBondContact O-CA 3.36Å; F176-G180 PolarHBondContact O-N 3.48Å; G180-E183 PolarHBondContact O-N 3.1Å; G180-A184 WeakPolarHBondContact O-CB 3.44Å; G180-A184 PolarHBondContact O-N 2.97Å
181C97.5Very high96.9Very high16 Ų1652 Ų5211%0.10827%0.265CS..Hα-helixtrans-63.5-43.7173.3-177.30000111.7A8 A12 L177 A184 L185A8-C181 HydrophobicContact CB-CB 4.33Å; A12-C181 HydrophobicContact CB-CB 4.27Å; L177-C181 WeakPolarHBondContact O-CB 3.33Å; L177-C181 PolarHBondContact O-N 3.3Å; C181-A184 PolarHBondContact O-N 3.24Å; C181-L185 VanDerWaalsContact O-CG 3.31Å; C181-L185 WeakPolarHBondContact O-CG 3.46Å; C181-L185 PolarHBondContact O-N 3.28Å; C181-L185 VanDerWaalsContact O-N 3.15Å
182K97.9Very high97.1Very high128 Ų12853.5 Ų53.556%0.55727%0.266SS*.Hα-helixtrans-60.8-45.9176178.2-176.5172.6-171.50111.2A178 D179 L185 L186A178-K182 WeakPolarHBondContact O-CB 3.35Å; A178-K182 PolarHBondContact O-N 2.97Å; D179-K182 PolarHBondContact O-N 3.31Å; K182-L185 PolarHBondContact O-N 3Å; K182-L186 HydrophobicContact CG-CD1 4.06Å; K182-L186 VanDerWaalsContact O-CG 3.3Å; K182-L186 WeakPolarHBondContact O-CG 3.45Å; K182-L186 PolarHBondContact O-N 3.13Å
183E98.1Very high97.3Very high71 Ų7152.5 Ų52.533%0.33227%0.268SS..Hα-helixtrans-68.2-39.3-178.3-164.558.3-151.800111.8D179 G180 L185 L186 E187 R190D179-E183 WeakPolarHBondContact O-CB 3.49Å; D179-E183 PolarHBondContact O-N 3.44Å; G180-E183 PolarHBondContact O-N 3.1Å; E183-L185 PolarHBondContact O-N 3.27Å; E183-L186 PolarHBondContact O-N 2.97Å; E183-E187 WeakPolarHBondContact O-CB 3.45Å; E183-E187 WeakPolarHBondContact O-CG 3.39Å; E183-E187 PolarHBondContact O-N 3.24Å; E183-R190 IonicContact OE1-CZ 2.91Å; E183-R190 VanDerWaalsContact OE1-CZ 3.32Å; E183-R190 IonicContact OE1-NH1 3.32Å; E183-R190 PolarHBondContact OE1-NH1 2.91Å; E183-R190 IonicContact OE1-NH2 3.44Å; E183-R190 PolarHBondContact OE1-NH2 3.36Å; E183-R190 IonicContact OE2-NH2 3.44Å
184A98.4Very high97.5Very high0 Ų053 Ų530%027%0.27CS..Hα-helixtrans-57.5-46.5173.900000112.1A12 T15 Y16 G180 C181 E187 E188A12-A184 HydrophobicContact CB-CB 4.15Å; T15-A184 HydrophobicContact CG2-CB 4.27Å; T15-A184 VanDerWaalsContact CG2-O 3.23Å; T15-A184 WeakPolarHBondContact CG2-O 3.45Å; Y16-A184 HydrophobicContact CD2-CB 4.01Å; Y16-A184 HydrophobicContact CE1-CB 4.4Å; Y16-A184 HydrophobicContact CE2-CB 3.57Å; G180-A184 WeakPolarHBondContact O-CB 3.44Å; G180-A184 PolarHBondContact O-N 2.97Å; C181-A184 PolarHBondContact O-N 3.24Å; A184-E187 WeakPolarHBondContact O-CB 3.4Å; A184-E187 PolarHBondContact O-N 3.1Å; A184-E188 PolarHBondContact O-N 2.93Å; A184-E188 VanDerWaalsContact O-N 3.11Å
185L98.4Very high97.7Very high68 Ų6851.4 Ų51.436%0.35626%0.263SS..Hα-helixtrans-66.1-36.9177.2-67.5170.8000112.3L11 T15 C181 K182 E183 E188 K189L11-L185 HydrophobicContact CD2-CD1 4.35Å; T15-L185 HydrophobicContact CG2-CD2 4.35Å; C181-L185 VanDerWaalsContact O-CG 3.31Å; C181-L185 WeakPolarHBondContact O-CG 3.46Å; C181-L185 PolarHBondContact O-N 3.28Å; C181-L185 VanDerWaalsContact O-N 3.15Å; K182-L185 PolarHBondContact O-N 3Å; E183-L185 PolarHBondContact O-N 3.27Å; L185-E188 PolarHBondContact O-N 3.08Å; L185-K189 WeakPolarHBondContact O-CB 3.45Å; L185-K189 PolarHBondContact O-N 3.31Å
186L98.4Very high97.8Very high57 Ų5750.8 Ų50.830%0.29826%0.264SS..Hα-helixtrans-68.5-38.6175.7-73.3175.5000112K182 E183 K189 R190K182-L186 HydrophobicContact CG-CD1 4.06Å; K182-L186 VanDerWaalsContact O-CG 3.3Å; K182-L186 WeakPolarHBondContact O-CG 3.45Å; K182-L186 PolarHBondContact O-N 3.13Å; E183-L186 PolarHBondContact O-N 2.97Å; L186-K189 PolarHBondContact O-N 3.23Å; L186-R190 WeakPolarHBondContact O-CB 3.45Å; L186-R190 VanDerWaalsContact O-CG 3.23Å; L186-R190 WeakPolarHBondContact O-CG 3.48Å; L186-R190 PolarHBondContact O-N 2.92Å
187E97.7Very high97.9Very high1 Ų153 Ų531%0.00528%0.276CS..Hα-helixtrans-56.8-51.2172.2-79.7-58.9142.900110.5Y114 M115 E183 A184 K189 R190 R191Y114-E187 WeakPolarHBondContact CE1-OE2 3.47Å; Y114-E187 PolarHBondContact OH-OE1 3.43Å; M115-E187 HydrophobicContact CE-CB 4.17Å; M115-E187 HydrophobicContact SD-CB 4.48Å; E183-E187 WeakPolarHBondContact O-CB 3.45Å; E183-E187 WeakPolarHBondContact O-CG 3.39Å; E183-E187 PolarHBondContact O-N 3.24Å; A184-E187 WeakPolarHBondContact O-CB 3.4Å; A184-E187 PolarHBondContact O-N 3.1Å; E187-K189 PolarHBondContact O-N 3.38Å; E187-R190 PolarHBondContact O-N 3.37Å; E187-R190 IonicContact OE1-CZ 3.75Å; E187-R190 IonicContact OE1-NH1 3.91Å; E187-R190 PolarHBondContact OE1-NH1 2.51Å; E187-R191 PolarHBondContact O-N 2.98Å; E187-R191 PolarHBondContact O-NH1 3.43Å; E187-R191 IonicContact OE2-CZ 3.48Å; E187-R191 IonicContact OE2-NH1 2.77Å; E187-R191 PolarHBondContact OE2-NH1 3.28Å; E187-R191 IonicContact OE2-NH2 3.49Å; E187-R191 PolarHBondContact OE2-NH2 3.41Å; E187-R191 VanDerWaalsContact OE2-NH2 3.07Å
188E97.9Very high98Very high40 Ų4054.2 Ų54.219%0.18728%0.282CS..Hα-helixtrans-57.7-50175.4-178.1179.2-124.900111.8T15 N18 V19 A184 L185 R190 R191 F192T15-E188 HydrophobicContact CG2-CB 3.7Å; T15-E188 HydrophobicContact CG2-CG 4.41Å; N18-E188 PolarHBondContact ND2-OE1 3.48Å; V19-E188 HydrophobicContact CG2-CB 3.95Å; V19-E188 HydrophobicContact CG2-CG 4.18Å; A184-E188 PolarHBondContact O-N 2.93Å; A184-E188 VanDerWaalsContact O-N 3.11Å; L185-E188 PolarHBondContact O-N 3.08Å; E188-R190 PolarHBondContact O-N 2.94Å; E188-R191 WeakPolarHBondContact O-CB 3.36Å; E188-R191 PolarHBondContact O-N 2.93Å; E188-F192 HydrophobicContact CG-CD2 3.93Å; E188-F192 HydrophobicContact CG-CE2 3.7Å; E188-F192 WeakPolarHBondContact O-CD2 3.45Å; E188-F192 PolarHBondContact O-N 3.46Å
189K98.4Very high98.1Very high133 Ų13354.5 Ų54.558%0.57827%0.273SS*.Hα-helixtrans-58.5-43.1-179.4-176.6176.1179.4176.70112.8L185 L186 E187 R191 F192 C193L185-K189 WeakPolarHBondContact O-CB 3.45Å; L185-K189 PolarHBondContact O-N 3.31Å; L186-K189 PolarHBondContact O-N 3.23Å; E187-K189 PolarHBondContact O-N 3.38Å; K189-R191 PolarHBondContact O-N 3.32Å; K189-F192 PolarHBondContact O-N 3.4Å; K189-C193 WeakPolarHBondContact O-CB 3.38Å; K189-C193 PolarHBondContact O-N 3.03Å; K189-C193 PolarHBondContact O-SG 3.33Å; K189-C193 VanDerWaalsContact O-SG 3.37Å
190R98.4Very high98.2Very high46 Ų4653.2 Ų53.217%0.17427%0.272CS..Hα-helixtrans-58.7-37.1179.7-75.7171.6-163.4140.37.9111.9E183 L186 E187 E188 F194 Y432E183-R190 IonicContact OE1-CZ 2.91Å; E183-R190 VanDerWaalsContact OE1-CZ 3.32Å; E183-R190 IonicContact OE1-NH1 3.32Å; E183-R190 PolarHBondContact OE1-NH1 2.91Å; E183-R190 IonicContact OE1-NH2 3.44Å; E183-R190 PolarHBondContact OE1-NH2 3.36Å; E183-R190 IonicContact OE2-NH2 3.44Å; L186-R190 WeakPolarHBondContact O-CB 3.45Å; L186-R190 VanDerWaalsContact O-CG 3.23Å; L186-R190 WeakPolarHBondContact O-CG 3.48Å; L186-R190 PolarHBondContact O-N 2.92Å; E187-R190 PolarHBondContact O-N 3.37Å; E187-R190 IonicContact OE1-CZ 3.75Å; E187-R190 IonicContact OE1-NH1 3.91Å; E187-R190 PolarHBondContact OE1-NH1 2.51Å; E188-R190 PolarHBondContact O-N 2.94Å; R190-F194 WeakPolarHBondContact O-CB 3.43Å; R190-F194 PolarHBondContact O-N 3.02Å; R190-Y432 HydrophobicContact CB-CD1 4.07Å; R190-Y432 HydrophobicContact CB-CE1 4.25Å
191R98.1Very high98.2Very high1 Ų155.4 Ų55.40%0.00428%0.28CS..Hα-helixtrans-68.3-45.9178.4-75.4170.1-176.769.214.1112.4V19 F23 D111 M115 E187 E188 K189 F194 L195 Y432V19-R191 VanDerWaalsContact CG1-CD 3.44Å; F23-R191 HydrophobicContact CD1-CB 4.23Å; F23-R191 HydrophobicContact CD1-CG 4.48Å; F23-R191 HydrophobicContact CE1-CB 3.63Å; F23-R191 HydrophobicContact CE1-CG 3.98Å; F23-R191 HydrophobicContact CE2-CB 4.16Å; F23-R191 HydrophobicContact CZ-CB 3.6Å; F23-R191 HydrophobicContact CZ-CG 4.42Å; D111-R191 IonicContact OD1-CZ 2.65Å; D111-R191 IonicContact OD1-NE 3.47Å; D111-R191 PolarHBondContact OD1-NE 3.48Å; D111-R191 IonicContact OD1-NH2 3.07Å; D111-R191 PolarHBondContact OD1-NH2 3.22Å; D111-R191 IonicContact OD2-CZ 2.73Å; D111-R191 IonicContact OD2-NE 2.67Å; D111-R191 PolarHBondContact OD2-NE 2.87Å; D111-R191 IonicContact OD2-NH2 3.36Å; D111-R191 PolarHBondContact OD2-NH2 3.02Å; M115-R191 PolarHBondContact SD-NH2 3.04Å; E187-R191 PolarHBondContact O-N 2.98Å; E187-R191 PolarHBondContact O-NH1 3.43Å; E187-R191 IonicContact OE2-CZ 3.48Å; E187-R191 IonicContact OE2-NH1 2.77Å; E187-R191 PolarHBondContact OE2-NH1 3.28Å; E187-R191 IonicContact OE2-NH2 3.49Å; E187-R191 PolarHBondContact OE2-NH2 3.41Å; E187-R191 VanDerWaalsContact OE2-NH2 3.07Å; E188-R191 WeakPolarHBondContact O-CB 3.36Å; E188-R191 PolarHBondContact O-N 2.93Å; K189-R191 PolarHBondContact O-N 3.32Å; R191-F194 PolarHBondContact O-N 3.48Å; R191-L195 PolarHBondContact O-N 3.46Å; R191-Y432 WeakPolarHBondContact CG-OH 3.43Å
192F98.4Very high98.2Very high98 Ų9855.7 Ų55.743%0.4328%0.281SS..Hα-helixtrans-64.5-41.4174.1-76-70.7000112F23 E188 K189 F194 L195 V196F23-F192 HydrophobicContact CD2-CD1 4.36Å; F23-F192 AromaticContact CD2-CE1 3.84Å; F23-F192 HydrophobicContact CD2-CE1 3.84Å; F23-F192 HydrophobicContact CD2-CE2 4.18Å; F23-F192 AromaticContact CD2-CZ 3.74Å; F23-F192 HydrophobicContact CD2-CZ 3.74Å; F23-F192 HydrophobicContact CE2-CD1 4.03Å; F23-F192 AromaticContact CE2-CE1 3.93Å; F23-F192 HydrophobicContact CE2-CE1 3.93Å; F23-F192 HydrophobicContact CE2-CG 4.41Å; F23-F192 HydrophobicContact CE2-CZ 4.24Å; E188-F192 HydrophobicContact CG-CD2 3.93Å; E188-F192 HydrophobicContact CG-CE2 3.7Å; E188-F192 WeakPolarHBondContact O-CD2 3.45Å; E188-F192 PolarHBondContact O-N 3.46Å; K189-F192 PolarHBondContact O-N 3.4Å; F192-F194 VanDerWaalsContact C-N 3.33Å; F192-F194 PolarHBondContact O-N 3.22Å; F192-L195 PolarHBondContact O-N 3.25Å; F192-V196 WeakPolarHBondContact O-CG2 3.13Å; F192-V196 PolarHBondContact O-N 3.2Å
193C98.4Very high98.2Very high69 Ų6954 Ų5447%0.46628%0.281SS..Hα-helixtrans-59.2-43.8174.5-73.80000112K189 V196 D197K189-C193 WeakPolarHBondContact O-CB 3.38Å; K189-C193 PolarHBondContact O-N 3.03Å; K189-C193 PolarHBondContact O-SG 3.33Å; K189-C193 VanDerWaalsContact O-SG 3.37Å; C193-V196 PolarHBondContact O-N 3.4Å; C193-D197 WeakPolarHBondContact O-CB 3.26Å; C193-D197 PolarHBondContact O-N 3.33Å
194F98Very high98.2Very high19 Ų1958 Ų588%0.08330%0.295CS..Hα-helixtrans-61.1-43.9174.9166.1-103.3000112.1E103 L104 K107 R190 R191 F192 V196 D197 K198 Y432E103-F194 HydrophobicContact CG-CE2 4.14Å; E103-F194 HydrophobicContact CG-CZ 4.02Å; L104-F194 HydrophobicContact CD2-CD1 4.26Å; L104-F194 HydrophobicContact CD2-CE1 3.36Å; L104-F194 HydrophobicContact CD2-CZ 3.8Å; K107-F194 HydrophobicContact CB-CE1 4.11Å; K107-F194 HydrophobicContact CB-CZ 4.14Å; K107-F194 HydrophobicContact CD-CD1 4.07Å; K107-F194 HydrophobicContact CD-CD2 4.12Å; K107-F194 HydrophobicContact CD-CE1 3.71Å; K107-F194 HydrophobicContact CD-CE2 3.76Å; K107-F194 HydrophobicContact CD-CG 4.26Å; K107-F194 HydrophobicContact CD-CZ 3.57Å; K107-F194 HydrophobicContact CG-CD1 4.49Å; K107-F194 HydrophobicContact CG-CE1 4.01Å; K107-F194 HydrophobicContact CG-CZ 4.23Å; R190-F194 WeakPolarHBondContact O-CB 3.43Å; R190-F194 PolarHBondContact O-N 3.02Å; R191-F194 PolarHBondContact O-N 3.48Å; F192-F194 VanDerWaalsContact C-N 3.33Å; F192-F194 PolarHBondContact O-N 3.22Å; F194-V196 PolarHBondContact O-N 3.41Å; F194-D197 PolarHBondContact O-N 2.95Å; F194-K198 HydrophobicContact CD2-CG 4.26Å; F194-K198 HydrophobicContact CE1-CG 4.48Å; F194-K198 HydrophobicContact CE2-CD 4.25Å; F194-K198 VanDerWaalsContact CE2-CE 3.42Å; F194-K198 HydrophobicContact CE2-CG 3.83Å; F194-K198 HydrophobicContact CZ-CG 3.93Å; F194-K198 WeakPolarHBondContact O-CG 3.49Å; F194-K198 PolarHBondContact O-N 3.36Å; F194-K198 VanDerWaalsContact O-N 3.08Å; F194-Y432 HydrophobicContact CB-CE1 4.13Å
195L98.4Very high98.2Very high32 Ų3258.9 Ų58.917%0.16830%0.299CS..Hα-helixtrans-62.9-43.5178.5-178.560.5000112F23 L27 L30 L104 R191 F192 K198 H199F23-L195 HydrophobicContact CE2-CD2 4.33Å; L27-L195 HydrophobicContact CD1-CD1 3.87Å; L30-L195 HydrophobicContact CD2-CD1 3.8Å; L104-L195 HydrophobicContact CD1-CD1 4.35Å; L104-L195 HydrophobicContact CD2-CD1 4.17Å; R191-L195 PolarHBondContact O-N 3.46Å; F192-L195 PolarHBondContact O-N 3.25Å; L195-K198 PolarHBondContact O-N 3.3Å; L195-H199 VanDerWaalsContact CD1-CE1 3.43Å; L195-H199 WeakPolarHBondContact CD1-CE1 3.49Å; L195-H199 PolarHBondContact O-N 3.25Å; L195-H199 VanDerWaalsContact O-N 3.13Å; L195-H199 PolarHBondContact O-ND1 3.44Å
196V98.7Very high98.1Very high88 Ų8857.6 Ų57.653%0.53329%0.29SS..Hα-helixtrans-62.7-48.5176.4170.10000110.7F192 C193 F194 K198 H199 C200F192-V196 WeakPolarHBondContact O-CG2 3.13Å; F192-V196 PolarHBondContact O-N 3.2Å; C193-V196 PolarHBondContact O-N 3.4Å; F194-V196 PolarHBondContact O-N 3.41Å; V196-K198 VanDerWaalsContact C-N 3.29Å; V196-K198 PolarHBondContact O-N 3.46Å; V196-H199 CarbonylContact O-C 3.59Å; V196-H199 PolarHBondContact O-N 2.77Å; V196-C200 PolarHBondContact O-N 3.34Å; V196-C200 PolarHBondContact O-SG 3.11Å; V196-C200 VanDerWaalsContact O-SG 3.36Å
197D98.4Very high98.1Very high73 Ų7357.6 Ų57.639%0.3930%0.299SS..Hα-helixtrans-54.1-46.2178.2179.158.4000111.8C193 F194 H199 C200 L201C193-D197 WeakPolarHBondContact O-CB 3.26Å; C193-D197 PolarHBondContact O-N 3.33Å; F194-D197 PolarHBondContact O-N 2.95Å; D197-H199 PolarHBondContact O-N 3.23Å; D197-C200 WeakPolarHBondContact O-CB 3.46Å; D197-C200 PolarHBondContact O-N 3.07Å; D197-L201 PolarHBondContact O-N 3.2Å
198K98.2Very high98.1Very high31 Ų3159 Ų5914%0.13531%0.309CS..Hα-helixtrans-61.2-40.6175.5-69.2-59.6-178.31760113.3E99 I100 L104 F194 L195 V196 L201 L202E99-K198 WeakPolarHBondContact O-CD 3.35Å; E99-K198 PolarHBondContact O-NZ 3.37Å; I100-K198 HydrophobicContact CD1-CB 4.07Å; I100-K198 HydrophobicContact CD1-CD 4.01Å; I100-K198 WeakPolarHBondContact CD1-O 3.35Å; I100-K198 HydrophobicContact CG2-CB 4.39Å; L104-K198 HydrophobicContact CD2-CG 4.28Å; F194-K198 HydrophobicContact CD2-CG 4.26Å; F194-K198 HydrophobicContact CE1-CG 4.48Å; F194-K198 HydrophobicContact CE2-CD 4.25Å; F194-K198 VanDerWaalsContact CE2-CE 3.42Å; F194-K198 HydrophobicContact CE2-CG 3.83Å; F194-K198 HydrophobicContact CZ-CG 3.93Å; F194-K198 WeakPolarHBondContact O-CG 3.49Å; F194-K198 PolarHBondContact O-N 3.36Å; F194-K198 VanDerWaalsContact O-N 3.08Å; L195-K198 PolarHBondContact O-N 3.3Å; V196-K198 VanDerWaalsContact C-N 3.29Å; V196-K198 PolarHBondContact O-N 3.46Å; K198-L201 WeakPolarHBondContact O-CB 3.45Å; K198-L201 PolarHBondContact O-N 2.88Å; K198-L202 PolarHBondContact O-N 3.34Å
199H98.1Very high98.1Very high61 Ų6158 Ų5828%0.28230%0.303SS..Hα-helixtrans-78.5-25.6178.9-72.876000113.3L195 V196 D197 L202 T203L195-H199 VanDerWaalsContact CD1-CE1 3.43Å; L195-H199 WeakPolarHBondContact CD1-CE1 3.49Å; L195-H199 PolarHBondContact O-N 3.25Å; L195-H199 VanDerWaalsContact O-N 3.13Å; L195-H199 PolarHBondContact O-ND1 3.44Å; V196-H199 CarbonylContact O-C 3.59Å; V196-H199 PolarHBondContact O-N 2.77Å; D197-H199 PolarHBondContact O-N 3.23Å; H199-L202 PolarHBondContact O-N 3.22Å; H199-T203 WeakPolarHBondContact O-CB 3.32Å; H199-T203 PolarHBondContact O-N 3Å; H199-T203 PolarHBondContact O-OG1 2.92Å
200C98.5Very high98Very high75 Ų7556.8 Ų56.851%0.50730%0.299SS..Hα-helixtrans-63-44.3167-71.50000110.8V196 D197 T203 Y204V196-C200 PolarHBondContact O-N 3.34Å; V196-C200 PolarHBondContact O-SG 3.11Å; V196-C200 VanDerWaalsContact O-SG 3.36Å; D197-C200 WeakPolarHBondContact O-CB 3.46Å; D197-C200 PolarHBondContact O-N 3.07Å; C200-T203 PolarHBondContact O-N 3.49Å; C200-Y204 PolarHBondContact O-N 3.12Å
201L97.9Very high98Very high56 Ų5659.5 Ų59.529%0.29331%0.314SS..Hα-helixtrans-61.1-44.3175-179.160.9000112E99 I100 D197 K198 T203 Y204 H205E99-L201 HydrophobicContact CB-CD2 4.21Å; E99-L201 WeakPolarHBondContact OE2-CD2 3.46Å; I100-L201 HydrophobicContact CD1-CB 4.37Å; I100-L201 HydrophobicContact CD1-CD2 4.14Å; I100-L201 HydrophobicContact CD1-CG 4.42Å; D197-L201 PolarHBondContact O-N 3.2Å; K198-L201 WeakPolarHBondContact O-CB 3.45Å; K198-L201 PolarHBondContact O-N 2.88Å; L201-T203 VanDerWaalsContact C-N 3.35Å; L201-T203 PolarHBondContact O-N 3.11Å; L201-Y204 WeakPolarHBondContact O-CB 3.4Å; L201-Y204 PolarHBondContact O-N 3.43Å; L201-H205 PolarHBondContact O-CD2 2.98Å; L201-H205 PolarHBondContact O-N 3.34Å
202L97.6Very high97.9Very high22 Ų2264.4 Ų64.412%0.11534%0.335CS..Hα-helixtrans-58.4-46.7173.9179.657.2000112.1F96 I100 K198 H199 Y204 H205 F206F96-L202 HydrophobicContact CB-CD1 4.18Å; F96-L202 HydrophobicContact CD2-CD1 3.5Å; F96-L202 VanDerWaalsContact CD2-CD1 3.5Å; F96-L202 HydrophobicContact CD2-CD2 3.88Å; F96-L202 HydrophobicContact CD2-CG 4.27Å; F96-L202 HydrophobicContact CE2-CD1 4.22Å; F96-L202 HydrophobicContact CE2-CD2 3.74Å; F96-L202 HydrophobicContact CG-CD1 4.16Å; I100-L202 HydrophobicContact CG1-CB 4.43Å; K198-L202 PolarHBondContact O-N 3.34Å; H199-L202 PolarHBondContact O-N 3.22Å; L202-Y204 VanDerWaalsContact C-N 3.29Å; L202-Y204 PolarHBondContact O-N 3.38Å; L202-H205 PolarHBondContact O-N 3.49Å; L202-F206 HydrophobicContact CD1-CD2 3.75Å; L202-F206 HydrophobicContact CD1-CE2 3.5Å; L202-F206 HydrophobicContact CD2-CE2 4.42Å; L202-F206 HydrophobicContact CG-CD2 3.93Å; L202-F206 HydrophobicContact CG-CE2 3.89Å; L202-F206 WeakPolarHBondContact O-CD2 3.27Å; L202-F206 PolarHBondContact O-N 3.43Å
203T98.2Very high97.9Very high93 Ų9360.6 Ų60.657%0.57132%0.32SS*.Hα-helixtrans-61.5-39.9179.7-57.40000111.2H199 C200 L201 F206 A207H199-T203 WeakPolarHBondContact O-CB 3.32Å; H199-T203 PolarHBondContact O-N 3Å; H199-T203 PolarHBondContact O-OG1 2.92Å; C200-T203 PolarHBondContact O-N 3.49Å; L201-T203 VanDerWaalsContact C-N 3.35Å; L201-T203 PolarHBondContact O-N 3.11Å; T203-F206 PolarHBondContact O-N 2.77Å; T203-A207 WeakPolarHBondContact O-CB 3.42Å; T203-A207 PolarHBondContact O-N 2.87Å
204Y97.9Very high97.8Very high156 Ų15663.6 Ų63.661%0.61232%0.322SS*.Hα-helixtrans-60.7-45.6174.2171.8-95.2000112.2C200 L201 L202 F206 A207 S208C200-Y204 PolarHBondContact O-N 3.12Å; L201-Y204 WeakPolarHBondContact O-CB 3.4Å; L201-Y204 PolarHBondContact O-N 3.43Å; L202-Y204 VanDerWaalsContact C-N 3.29Å; L202-Y204 PolarHBondContact O-N 3.38Å; Y204-F206 VanDerWaalsContact C-N 3.35Å; Y204-F206 PolarHBondContact O-N 3.43Å; Y204-A207 PolarHBondContact O-N 3.28Å; Y204-S208 PolarHBondContact O-N 3.13Å
205H97.1Very high97.8Very high18 Ų1866.1 Ų66.18%0.08334%0.336CS..Hα-helixtrans-61-43.1177.3-68.1-48.1000111.8E99 L201 L202 S208 Y209E99-H205 IonicContact OE2-CD2 2.69Å; E99-H205 IonicContact OE2-CE1 3.03Å; E99-H205 IonicContact OE2-NE2 3.54Å; E99-H205 PolarHBondContact OE2-NE2 2.62Å; L201-H205 PolarHBondContact O-CD2 2.98Å; L201-H205 PolarHBondContact O-N 3.34Å; L202-H205 PolarHBondContact O-N 3.49Å; H205-S208 PolarHBondContact O-N 3.32Å; H205-Y209 WeakPolarHBondContact O-CB 3.45Å; H205-Y209 PolarHBondContact O-N 3.39Å
206F97.5Very high97.6Very high40 Ų4066.5 Ų66.518%0.17534%0.338CS..Hα-helixtrans-64.1-42.1174.5-86.7-70.3000113.1Y37 M89 F93 L202 T203 Y204 S208 Y209 H210Y37-F206 HydrophobicContact CE1-CZ 4.42Å; M89-F206 HydrophobicContact CE-CE1 4.5Å; M89-F206 HydrophobicContact SD-CE1 4.23Å; F93-F206 HydrophobicContact CE2-CE1 4.05Å; F93-F206 AromaticContact CE2-CZ 3.71Å; F93-F206 HydrophobicContact CE2-CZ 3.71Å; F93-F206 HydrophobicContact CZ-CE1 4.49Å; F93-F206 AromaticContact CZ-CZ 3.77Å; F93-F206 HydrophobicContact CZ-CZ 3.77Å; L202-F206 HydrophobicContact CD1-CD2 3.75Å; L202-F206 HydrophobicContact CD1-CE2 3.5Å; L202-F206 HydrophobicContact CD2-CE2 4.42Å; L202-F206 HydrophobicContact CG-CD2 3.93Å; L202-F206 HydrophobicContact CG-CE2 3.89Å; L202-F206 WeakPolarHBondContact O-CD2 3.27Å; L202-F206 PolarHBondContact O-N 3.43Å; T203-F206 PolarHBondContact O-N 2.77Å; Y204-F206 VanDerWaalsContact C-N 3.35Å; Y204-F206 PolarHBondContact O-N 3.43Å; F206-S208 VanDerWaalsContact C-N 3.35Å; F206-S208 PolarHBondContact O-N 3.46Å; F206-Y209 WeakPolarHBondContact O-CB 3.47Å; F206-Y209 PolarHBondContact O-N 2.91Å; F206-H210 AromaticContact CD1-NE2 3.98Å; F206-H210 PolarHBondContact O-CD2 3.36Å; F206-H210 PolarHBondContact O-N 2.86Å
207A98.4Very high97.5Very high58 Ų5864.8 Ų64.848%0.47933%0.326SS..Hα-helixtrans-59.8-47.1176.600000111.1T203 Y204 Y209 H210 E211T203-A207 WeakPolarHBondContact O-CB 3.42Å; T203-A207 PolarHBondContact O-N 2.87Å; Y204-A207 PolarHBondContact O-N 3.28Å; A207-Y209 VanDerWaalsContact C-N 3.34Å; A207-Y209 PolarHBondContact O-N 3.21Å; A207-H210 PolarHBondContact O-N 3.37Å; A207-E211 WeakPolarHBondContact O-CB 3.29Å; A207-E211 PolarHBondContact O-N 3.02Å
208S97.5Very high97.4Very high31 Ų3164.6 Ų64.622%0.21733%0.33CS..Hα-helixtrans-62.6-40.1177.1-175.60000112.3Y204 H205 F206 K212Y204-S208 PolarHBondContact O-N 3.13Å; H205-S208 PolarHBondContact O-N 3.32Å; F206-S208 VanDerWaalsContact C-N 3.35Å; F206-S208 PolarHBondContact O-N 3.46Å; S208-K212 VanDerWaalsContact O-CG 3.31Å; S208-K212 WeakPolarHBondContact O-CG 3.48Å; S208-K212 PolarHBondContact O-N 2.93Å; S208-K212 VanDerWaalsContact O-N 3.08Å
209Y97.5Very high97.3Very high17 Ų1768.3 Ų68.37%0.06736%0.355CS..Hα-helixtrans-59.2-51.2174.4170.7-107.7000112.8A85 E88 M89 N92 H205 F206 A207 E211 K212 T213A85-Y209 WeakPolarHBondContact O-CE2 3.44Å; A85-Y209 PolarHBondContact O-OH 3.39Å; E88-Y209 HydrophobicContact CB-CD2 4.09Å; E88-Y209 HydrophobicContact CB-CE2 4.03Å; M89-Y209 HydrophobicContact CB-CE2 3.77Å; M89-Y209 HydrophobicContact CE-CD1 3.85Å; M89-Y209 HydrophobicContact CE-CE1 3.17Å; M89-Y209 HydrophobicContact CE-CE2 4.42Å; M89-Y209 HydrophobicContact SD-CD1 4.21Å; M89-Y209 HydrophobicContact SD-CE1 3.95Å; M89-Y209 HydrophobicContact SD-CE2 4.42Å; N92-Y209 VanDerWaalsContact ND2-CB 3.3Å; N92-Y209 WeakPolarHBondContact ND2-CB 3.05Å; N92-Y209 VanDerWaalsContact ND2-CD2 3.35Å; N92-Y209 WeakPolarHBondContact ND2-CD2 3.42Å; H205-Y209 WeakPolarHBondContact O-CB 3.45Å; H205-Y209 PolarHBondContact O-N 3.39Å; F206-Y209 WeakPolarHBondContact O-CB 3.47Å; F206-Y209 PolarHBondContact O-N 2.91Å; A207-Y209 VanDerWaalsContact C-N 3.34Å; A207-Y209 PolarHBondContact O-N 3.21Å; Y209-E211 VanDerWaalsContact C-N 3.33Å; Y209-E211 PolarHBondContact O-N 3.31Å; Y209-K212 PolarHBondContact O-N 3.31Å; Y209-T213 VanDerWaalsContact CE2-OG1 3.3Å; Y209-T213 WeakPolarHBondContact CE2-OG1 3.45Å; Y209-T213 WeakPolarHBondContact O-CB 3.3Å; Y209-T213 PolarHBondContact O-N 3.44Å; Y209-T213 PolarHBondContact O-OG1 2.98Å
210H97.6Very high97.1Very high108 Ų10869 Ų6950%0.536%0.358SS..Hα-helixtrans-66.4-38-177.3-73.6-55.3000111.6F206 A207 T213 R214F206-H210 AromaticContact CD1-NE2 3.98Å; F206-H210 PolarHBondContact O-CD2 3.36Å; F206-H210 PolarHBondContact O-N 2.86Å; A207-H210 PolarHBondContact O-N 3.37Å; H210-T213 PolarHBondContact O-N 3.04Å; H210-R214 VanDerWaalsContact O-CB 3.24Å; H210-R214 WeakPolarHBondContact O-CB 3.46Å; H210-R214 PolarHBondContact O-N 3.22Å
211E98Very high97Very high103 Ų10369.5 Ų69.548%0.48136%0.355SS..Hα-helixtrans-58.5-53.7172.6175.8165.5-138.600111.6A207 Y209 T213 R214 D215A207-E211 WeakPolarHBondContact O-CB 3.29Å; A207-E211 PolarHBondContact O-N 3.02Å; Y209-E211 VanDerWaalsContact C-N 3.33Å; Y209-E211 PolarHBondContact O-N 3.31Å; E211-T213 VanDerWaalsContact C-N 3.3Å; E211-T213 PolarHBondContact O-N 3.07Å; E211-R214 WeakPolarHBondContact O-CB 3.38Å; E211-R214 PolarHBondContact O-N 3.38Å; E211-R214 IonicContact OE1-NH2 3.3Å; E211-D215 VanDerWaalsContact O-CG 3.23Å; E211-D215 PolarHBondContact O-N 3.24Å
212K96.3Very high96.9Very high104 Ų10470.4 Ų70.445%0.45237%0.366SS..Hα-helixtrans-58.4-42177.8-71.4172177.5-178.20112.7E88 S208 Y209 D215 L216E88-K212 IonicContact OE2-NZ 2.74Å; E88-K212 PolarHBondContact OE2-NZ 3.35Å; S208-K212 VanDerWaalsContact O-CG 3.31Å; S208-K212 WeakPolarHBondContact O-CG 3.48Å; S208-K212 PolarHBondContact O-N 2.93Å; S208-K212 VanDerWaalsContact O-N 3.08Å; Y209-K212 PolarHBondContact O-N 3.31Å; K212-D215 PolarHBondContact O-N 3.08Å; K212-L216 WeakPolarHBondContact O-CB 3.33Å; K212-L216 PolarHBondContact O-N 3.43Å
213T96.8Very high96.8Very high19 Ų1971.8 Ų71.812%0.11738%0.377CS..Hα-helixtrans-68.6-41.9-178.9-58.80000111.1A85 Y209 H210 E211 D215 L216 L217A85-T213 HydrophobicContact CB-CG2 3.89Å; Y209-T213 VanDerWaalsContact CE2-OG1 3.3Å; Y209-T213 WeakPolarHBondContact CE2-OG1 3.45Å; Y209-T213 WeakPolarHBondContact O-CB 3.3Å; Y209-T213 PolarHBondContact O-N 3.44Å; Y209-T213 PolarHBondContact O-OG1 2.98Å; H210-T213 PolarHBondContact O-N 3.04Å; E211-T213 VanDerWaalsContact C-N 3.3Å; E211-T213 PolarHBondContact O-N 3.07Å; T213-D215 VanDerWaalsContact C-N 3.33Å; T213-D215 PolarHBondContact O-N 3.13Å; T213-L216 PolarHBondContact O-N 3.08Å; T213-L217 HydrophobicContact CG2-CD1 3.85Å; T213-L217 HydrophobicContact CG2-CG 4.48Å; T213-L217 WeakPolarHBondContact O-CB 3.35Å; T213-L217 WeakPolarHBondContact O-CG 3.46Å; T213-L217 PolarHBondContact O-N 3.39Å
214R97.4Very high96.6Very high132 Ų13268 Ų6850%0.49835%0.353SS..Hα-helixtrans-57.2-48.9172.9177.5-16167.7-158.8-3.2110.5H210 E211 L216 L217 S218H210-R214 VanDerWaalsContact O-CB 3.24Å; H210-R214 WeakPolarHBondContact O-CB 3.46Å; H210-R214 PolarHBondContact O-N 3.22Å; E211-R214 WeakPolarHBondContact O-CB 3.38Å; E211-R214 PolarHBondContact O-N 3.38Å; E211-R214 IonicContact OE1-NH2 3.3Å; R214-L216 VanDerWaalsContact C-N 3.35Å; R214-L216 PolarHBondContact O-N 3.11Å; R214-L217 PolarHBondContact O-N 2.77Å; R214-S218 VanDerWaalsContact O-CB 3.22Å; R214-S218 WeakPolarHBondContact O-CB 3.27Å; R214-S218 PolarHBondContact O-N 2.89Å; R214-S218 PolarHBondContact O-OG 3.31Å
215D96.9Very high96.5Very high72 Ų7265.7 Ų65.739%0.38535%0.347SS..Hα-helixtrans-64.7-41.7-177-64.7-8.4000111.1E211 K212 T213 L217 T219E211-D215 VanDerWaalsContact O-CG 3.23Å; E211-D215 PolarHBondContact O-N 3.24Å; K212-D215 PolarHBondContact O-N 3.08Å; T213-D215 VanDerWaalsContact C-N 3.33Å; T213-D215 PolarHBondContact O-N 3.13Å; D215-L217 PolarHBondContact O-N 3.23Å; D215-T219 WeakPolarHBondContact O-CB 3.31Å; D215-T219 PolarHBondContact O-N 3.31Å; D215-T219 VanDerWaalsContact O-N 3.14Å; D215-T219 PolarHBondContact O-OG1 3.19Å
216L94.9Very high96.2Very high40 Ų4070.1 Ų70.121%0.20937%0.372CS..Hα-helixtrans-59.8-46.4176.2-17568.7000112.2V81 K84 A85 K212 T213 R214V81-L216 HydrophobicContact CG1-CD2 3.88Å; V81-L216 HydrophobicContact CG1-CG 3.79Å; V81-L216 HydrophobicContact CG2-CG 4.48Å; V81-L216 WeakPolarHBondContact O-CD2 3.4Å; K84-L216 HydrophobicContact CB-CD2 4.14Å; K84-L216 HydrophobicContact CD-CD1 4.19Å; K84-L216 HydrophobicContact CD-CD2 4.07Å; K84-L216 HydrophobicContact CG-CD2 4.17Å; A85-L216 HydrophobicContact CB-CD2 4.49Å; K212-L216 WeakPolarHBondContact O-CB 3.33Å; K212-L216 PolarHBondContact O-N 3.43Å; T213-L216 PolarHBondContact O-N 3.08Å; R214-L216 VanDerWaalsContact C-N 3.35Å; R214-L216 PolarHBondContact O-N 3.11Å
217L96Very high95.8Very high51 Ų5172.5 Ų72.527%0.26738%0.383SS..Hα-helixtrans-71.5-47.5-179.4-70.2167.3000111.9V81 T213 R214 D215 T219 K220 L221V81-L217 HydrophobicContact CG1-CD2 3.71Å; V81-L217 HydrophobicContact CG1-CG 4.45Å; T213-L217 HydrophobicContact CG2-CD1 3.85Å; T213-L217 HydrophobicContact CG2-CG 4.48Å; T213-L217 WeakPolarHBondContact O-CB 3.35Å; T213-L217 WeakPolarHBondContact O-CG 3.46Å; T213-L217 PolarHBondContact O-N 3.39Å; R214-L217 PolarHBondContact O-N 2.77Å; D215-L217 PolarHBondContact O-N 3.23Å; L217-T219 VanDerWaalsContact C-N 3.25Å; L217-T219 PolarHBondContact O-N 3.05Å; L217-K220 PolarHBondContact O-N 3.26Å; L217-K220 VanDerWaalsContact O-N 3.09Å; L217-L221 WeakPolarHBondContact O-CB 3.45Å; L217-L221 PolarHBondContact O-N 3.3Å
218S96.3Very high95.3Very high70 Ų7073 Ų7349%0.4938%0.383SS..Hα-helixtrans-65.8-30.6-174.1-53.30000112.1R214 K220R214-S218 VanDerWaalsContact O-CB 3.22Å; R214-S218 WeakPolarHBondContact O-CB 3.27Å; R214-S218 PolarHBondContact O-N 2.89Å; R214-S218 PolarHBondContact O-OG 3.31Å; S218-K220 PolarHBondContact O-N 3.23Å
219T95.9Very high94.8Very high108 Ų10877.4 Ų77.466%0.66340%0.404SS*.Hα-helixtrans-64.9-25.9177-58.50000112.6D215 L217D215-T219 WeakPolarHBondContact O-CB 3.31Å; D215-T219 PolarHBondContact O-N 3.31Å; D215-T219 VanDerWaalsContact O-N 3.14Å; D215-T219 PolarHBondContact O-OG1 3.19Å; L217-T219 VanDerWaalsContact C-N 3.25Å; L217-T219 PolarHBondContact O-N 3.05Å
220K95.1Very high94.2Very high77 Ų7781 Ų8134%0.33542%0.424SS..Hα-helixtrans-110.2-29-172.7-63.4-64.6-173.7165.60114.1E77 V81 L217 S218 S222 S223 W224E77-K220 WeakPolarHBondContact OE1-CD 3.24Å; E77-K220 WeakPolarHBondContact OE1-CE 3.4Å; E77-K220 IonicContact OE1-NZ 3.64Å; E77-K220 PolarHBondContact OE1-NZ 2.84Å; V81-K220 HydrophobicContact CG2-CG 4.37Å; L217-K220 PolarHBondContact O-N 3.26Å; L217-K220 VanDerWaalsContact O-N 3.09Å; S218-K220 PolarHBondContact O-N 3.23Å; K220-S222 PolarHBondContact O-N 2.81Å; K220-S223 WeakPolarHBondContact O-CB 3.43Å; K220-S223 PolarHBondContact O-N 2.86Å; K220-S223 VanDerWaalsContact O-N 3.1Å; K220-W224 HydrophobicContact CB-CD2 3.98Å; K220-W224 HydrophobicContact CB-CE3 4.2Å; K220-W224 HydrophobicContact CB-CH2 3.63Å; K220-W224 HydrophobicContact CB-CZ2 3.36Å; K220-W224 HydrophobicContact CB-CZ3 4.04Å; K220-W224 HydrophobicContact CG-CH2 4.39Å; K220-W224 HydrophobicContact CG-CZ2 3.95Å; K220-W224 PolarHBondContact O-N 2.59Å; K220-W224 VanDerWaalsContact O-N 3.1Å
221L96.1Very high93.7Very high85 Ų8581 Ų8145%0.44544%0.442SS..Hα-helixtrans-52.6-49.7-170.5-17860.3000113.6L217 S223 W224 Q225L217-L221 WeakPolarHBondContact O-CB 3.45Å; L217-L221 PolarHBondContact O-N 3.3Å; L221-S223 VanDerWaalsContact C-N 3.35Å; L221-S223 PolarHBondContact O-N 3.23Å; L221-W224 PolarHBondContact O-N 3.07Å; L221-Q225 HydrophobicContact CD1-CG 4.47Å; L221-Q225 WeakPolarHBondContact O-CG 3.29Å; L221-Q225 PolarHBondContact O-N 3.37Å
222S95.3Very high93.1Very high74 Ų7481.7 Ų81.752%0.51745%0.454SS..Hα-helixtrans-62.2-42.7-179-48.90000111.9K220 W224 Q225 D226K220-S222 PolarHBondContact O-N 2.81Å; S222-W224 VanDerWaalsContact C-N 3.3Å; S222-W224 PolarHBondContact O-N 3.47Å; S222-Q225 PolarHBondContact O-N 3.17Å; S222-D226 VanDerWaalsContact O-CG 3.29Å; S222-D226 PolarHBondContact O-N 3.05Å
223S94.9Very high92.5Very high51 Ų5182.3 Ų82.336%0.35746%0.462SS..Hα-helixtrans-62.3-37.8178.11790000112.1K220 L221 Q227K220-S223 WeakPolarHBondContact O-CB 3.43Å; K220-S223 PolarHBondContact O-N 2.86Å; K220-S223 VanDerWaalsContact O-N 3.1Å; L221-S223 VanDerWaalsContact C-N 3.35Å; L221-S223 PolarHBondContact O-N 3.23Å; S223-Q227 VanDerWaalsContact O-CG 3.32Å; S223-Q227 WeakPolarHBondContact O-CG 3.21Å; S223-Q227 PolarHBondContact O-N 3.42Å; S223-Q227 PolarHBondContact OG-NE2 3.41Å
224W95.8Very high91.9Very high15 Ų1584.3 Ų84.36%0.05747%0.471CS..Hα-helixtrans-68.1-41.4176.8-62.3-27.5000112V74 E77 I78 V81 K220 L221 S222 Q227 C228V74-W224 HydrophobicContact CG1-CB 3.88Å; V74-W224 HydrophobicContact CG1-CG 3.89Å; E77-W224 HydrophobicContact CB-CZ2 4.33Å; E77-W224 HydrophobicContact CG-CZ2 4.01Å; E77-W224 PolarHBondContact OE2-NE1 3Å; I78-W224 HydrophobicContact CB-CH2 4.42Å; I78-W224 HydrophobicContact CD1-CD2 4.31Å; I78-W224 HydrophobicContact CD1-CE3 4.3Å; I78-W224 HydrophobicContact CG1-CD2 3.64Å; I78-W224 HydrophobicContact CG1-CE3 3.64Å; I78-W224 HydrophobicContact CG1-CG 4.27Å; I78-W224 HydrophobicContact CG1-CH2 3.92Å; I78-W224 HydrophobicContact CG1-CZ2 3.92Å; I78-W224 HydrophobicContact CG1-CZ3 3.79Å; V81-W224 HydrophobicContact CB-CH2 3.85Å; V81-W224 HydrophobicContact CB-CZ2 4.31Å; V81-W224 HydrophobicContact CG1-CH2 3.94Å; V81-W224 HydrophobicContact CG2-CH2 3.85Å; V81-W224 HydrophobicContact CG2-CZ2 3.89Å; K220-W224 HydrophobicContact CB-CD2 3.98Å; K220-W224 HydrophobicContact CB-CE3 4.2Å; K220-W224 HydrophobicContact CB-CH2 3.63Å; K220-W224 HydrophobicContact CB-CZ2 3.36Å; K220-W224 HydrophobicContact CB-CZ3 4.04Å; K220-W224 HydrophobicContact CG-CH2 4.39Å; K220-W224 HydrophobicContact CG-CZ2 3.95Å; K220-W224 PolarHBondContact O-N 2.59Å; K220-W224 VanDerWaalsContact O-N 3.1Å; L221-W224 PolarHBondContact O-N 3.07Å; S222-W224 VanDerWaalsContact C-N 3.3Å; S222-W224 PolarHBondContact O-N 3.47Å; W224-Q227 PolarHBondContact O-N 2.95Å; W224-C228 PolarHBondContact O-N 2.83Å; W224-C228 PolarHBondContact O-SG 3.11Å
225Q94.5Very high91.4Very high106 Ų10680.9 Ų80.950%0.49547%0.466SS..Hα-helixtrans-61-47176-70.7174.4-34.800111L221 S222 Q227 C228 N229L221-Q225 HydrophobicContact CD1-CG 4.47Å; L221-Q225 WeakPolarHBondContact O-CG 3.29Å; L221-Q225 PolarHBondContact O-N 3.37Å; S222-Q225 PolarHBondContact O-N 3.17Å; Q225-Q227 VanDerWaalsContact C-N 3.29Å; Q225-Q227 PolarHBondContact O-N 3.23Å; Q225-C228 PolarHBondContact O-N 3.46Å; Q225-N229 PolarHBondContact O-N 2.97Å; Q225-N229 PolarHBondContact O-ND2 3.28Å; Q225-N229 PolarHBondContact O-OD1 3.09Å; Q225-N229 VanDerWaalsContact O-OD1 3.08Å
226D92.1Very high90.9Very high112 Ų11284 Ų8460%0.59948%0.483SS*.Hα-helixtrans-58.3-40.4179.5-69.7-23.3000112.6S222 C228 N229S222-D226 VanDerWaalsContact O-CG 3.29Å; S222-D226 PolarHBondContact O-N 3.05Å; D226-C228 PolarHBondContact O-N 3.44Å; D226-N229 WeakPolarHBondContact CA-ND2 3.47Å; D226-N229 PolarHBondContact O-N 3.49Å
227Q88.8Confident90.6Very high89 Ų8984.9 Ų84.942%0.41650%0.502SS..Hα-helixtrans-71.8-15.4179.2-70.2177.539.500114L71 V74 S223 W224 Q225L71-Q227 WeakPolarHBondContact CD2-O 3.31Å; V74-Q227 HydrophobicContact CG2-CB 3.94Å; V74-Q227 HydrophobicContact CG2-CG 4.47Å; S223-Q227 VanDerWaalsContact O-CG 3.32Å; S223-Q227 WeakPolarHBondContact O-CG 3.21Å; S223-Q227 PolarHBondContact O-N 3.42Å; S223-Q227 PolarHBondContact OG-NE2 3.41Å; W224-Q227 PolarHBondContact O-N 2.95Å; Q225-Q227 VanDerWaalsContact C-N 3.29Å; Q225-Q227 PolarHBondContact O-N 3.23Å
228C87.3Confident90.3Very high70 Ų7083.8 Ų83.847%0.47350%0.497SS..THydrogen-bonded Turntrans-104.83.3-179.3-600000113.5L71 W224 Q225 D226 D230L71-C228 HydrophobicContact CD2-CB 4.4Å; W224-C228 PolarHBondContact O-N 2.83Å; W224-C228 PolarHBondContact O-SG 3.11Å; Q225-C228 PolarHBondContact O-N 3.46Å; D226-C228 PolarHBondContact O-N 3.44Å; C228-D230 PolarHBondContact O-N 3.48Å
229N88.1Confident89.9Confident123 Ų12384.1 Ų84.166%0.65849%0.493SS*.SBendtrans-76.5-16.5-169.1-80.9-22.3000115.2Q225 D226Q225-N229 PolarHBondContact O-N 2.97Å; Q225-N229 PolarHBondContact O-ND2 3.28Å; Q225-N229 PolarHBondContact O-OD1 3.09Å; Q225-N229 VanDerWaalsContact O-OD1 3.08Å; D226-N229 WeakPolarHBondContact CA-ND2 3.47Å; D226-N229 PolarHBondContact O-N 3.49Å
230D83.4Confident89.7Confident92 Ų9282 Ų8249%0.49248%0.483SS..  trans-132.3103.5179.4-173.9-1.7000111.9C228 T232 N233C228-D230 PolarHBondContact O-N 3.48Å; D230-T232 VanDerWaalsContact C-N 3.27Å; D230-T232 PolarHBondContact O-N 3.3Å; D230-T232 WeakPolarHBondContact OD1-CA 3.43Å; D230-T232 WeakPolarHBondContact OD1-CB 3.44Å; D230-T232 PolarHBondContact OD1-N 3.11Å; D230-T232 PolarHBondContact OD1-OG1 3.07Å; D230-N233 HydrophobicContact CB-CB 4.38Å; D230-N233 PolarHBondContact OD1-N 3.45Å
231A87Confident89.5Confident107 Ų10783.4 Ų83.488%0.88449%0.492SS*.THydrogen-bonded Turntrans-80.2-3.8178.500000114
232T85.9Confident89.2Confident119 Ų11981.5 Ų81.573%0.7348%0.481SS*.THydrogen-bonded Turntrans-100.8-12.1-178.865.60000113.3D230 M234D230-T232 VanDerWaalsContact C-N 3.27Å; D230-T232 PolarHBondContact O-N 3.3Å; D230-T232 WeakPolarHBondContact OD1-CA 3.43Å; D230-T232 WeakPolarHBondContact OD1-CB 3.44Å; D230-T232 PolarHBondContact OD1-N 3.11Å; D230-T232 PolarHBondContact OD1-OG1 3.07Å; T232-M234 PolarHBondContact O-N 2.78Å
233N83.7Confident89Confident117 Ų11781.5 Ų81.563%0.62648%0.475SS*.  trans-67.8127.3-179.6-167.315.3000111.2D230D230-N233 HydrophobicContact CB-CB 4.38Å; D230-N233 PolarHBondContact OD1-N 3.45Å
234M84.3Confident88.7Confident61 Ų6185.2 Ų85.230%0.349%0.487SS..  trans-124.7142.3174.3-69.5-150-59.200109.7V67 T232 V238 L239 I242V67-M234 HydrophobicContact CG1-CG 4.24Å; V67-M234 HydrophobicContact CG1-SD 3.92Å; T232-M234 PolarHBondContact O-N 2.78Å; M234-V238 HydrophobicContact CE-CG1 4.23Å; M234-V238 HydrophobicContact SD-CG1 4.26Å; M234-L239 HydrophobicContact CB-CD2 4.2Å; M234-L239 HydrophobicContact CB-CG 4.09Å; M234-L239 HydrophobicContact CE-CD2 3.69Å; M234-L239 HydrophobicContact CE-CG 4.48Å; M234-L239 WeakPolarHBondContact O-CD1 3.48Å; M234-I242 HydrophobicContact CE-CD1 3.63Å
235P87.3Confident88.2Confident60 Ų6091.3 Ų91.339%0.3952%0.52SS..  trans-59.8142.2178.8-28.239.5000112.7P66 G237 V238 L239P66-P235 WeakPolarHBondContact O-CG 3.34Å; P235-G237 PolarHBondContact O-N 2.87Å; P235-G237 VanDerWaalsContact O-N 3.07Å; P235-V238 WeakPolarHBondContact O-CB 3.48Å; P235-V238 PolarHBondContact O-N 3.38Å; P235-L239 PolarHBondContact O-N 2.79Å; P235-L239 VanDerWaalsContact O-N 3.16Å
236D87.1Confident87.9Confident137 Ų13794.8 Ų94.873%0.73353%0.529SS*.Hα-helixtrans-53.1-35.5-176.1-66.7-34.9000113.2V238 L239 S240D236-V238 VanDerWaalsContact C-N 3.31Å; D236-V238 PolarHBondContact O-N 3.39Å; D236-L239 PolarHBondContact O-N 3.03Å; D236-S240 WeakPolarHBondContact O-CB 3.32Å; D236-S240 PolarHBondContact O-N 2.97Å
237G88.3Confident87.5Confident59 Ų5995.3 Ų95.361%0.60853%0.526SS*.Hα-helixtrans-61.2-37.8176.300000113.3P235 M241P235-G237 PolarHBondContact O-N 2.87Å; P235-G237 VanDerWaalsContact O-N 3.07Å; G237-M241 PolarHBondContact O-N 2.88Å; G237-M241 VanDerWaalsContact O-N 3.17Å
238V88.9Confident86.5Confident28 Ų2897 Ų9717%0.1754%0.544CS..Hα-helixtrans-73.7-42176.5179.10000110.2P66 V67 M234 P235 D236 S240 M241 I242P66-V238 HydrophobicContact CB-CG2 4.18Å; V67-V238 HydrophobicContact CG1-CG1 4.34Å; V67-V238 HydrophobicContact CG1-CG2 4.26Å; M234-V238 HydrophobicContact CE-CG1 4.23Å; M234-V238 HydrophobicContact SD-CG1 4.26Å; P235-V238 WeakPolarHBondContact O-CB 3.48Å; P235-V238 PolarHBondContact O-N 3.38Å; D236-V238 VanDerWaalsContact C-N 3.31Å; D236-V238 PolarHBondContact O-N 3.39Å; V238-S240 PolarHBondContact O-N 3.45Å; V238-M241 PolarHBondContact O-N 2.83Å; V238-I242 HydrophobicContact CG1-CD1 3.92Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.32Å; V238-I242 PolarHBondContact O-N 3.41Å
239L89.1Confident85.7Confident76 Ų7699.7 Ų99.740%0.39856%0.558SS.*Hα-helixtrans-61.2-43.8176.5-70.9172.5000111.9M234 P235 D236 I242 D243M234-L239 HydrophobicContact CB-CD2 4.2Å; M234-L239 HydrophobicContact CB-CG 4.09Å; M234-L239 HydrophobicContact CE-CD2 3.69Å; M234-L239 HydrophobicContact CE-CG 4.48Å; M234-L239 WeakPolarHBondContact O-CD1 3.48Å; P235-L239 PolarHBondContact O-N 2.79Å; P235-L239 VanDerWaalsContact O-N 3.16Å; D236-L239 PolarHBondContact O-N 3.03Å; L239-I242 PolarHBondContact O-N 3.42Å; L239-D243 PolarHBondContact O-N 2.84Å
240S90.3Very high84.4Confident65 Ų6598.3 Ų98.346%0.45556%0.564SS.*Hα-helixtrans-61.9-44.3176.5-172.30000111.9D236 V238 I242 D243 E244D236-S240 WeakPolarHBondContact O-CB 3.32Å; D236-S240 PolarHBondContact O-N 2.97Å; V238-S240 PolarHBondContact O-N 3.45Å; S240-I242 VanDerWaalsContact C-N 3.31Å; S240-I242 PolarHBondContact O-N 2.67Å; S240-D243 PolarHBondContact O-N 3.16Å; S240-E244 PolarHBondContact O-N 2.91Å
241M91.1Very high83.3Confident106 Ų106101 Ų10152%0.52258%0.577SS.*Hα-helixtrans-60.5-40.9176.2-177.1-171.970.600111.7G237 V238 L245G237-M241 PolarHBondContact O-N 2.88Å; G237-M241 VanDerWaalsContact O-N 3.17Å; V238-M241 PolarHBondContact O-N 2.83Å; M241-L245 WeakPolarHBondContact O-CG 3.31Å; M241-L245 PolarHBondContact O-N 2.97Å
242I90.1Very high81.9Confident44 Ų4499.5 Ų99.523%0.22656%0.564CS.*Hα-helixtrans-69.4-38.4177.6-64.6166.3000110.9M234 V238 L239 S240 L245 R246M234-I242 HydrophobicContact CE-CD1 3.63Å; V238-I242 HydrophobicContact CG1-CD1 3.92Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.32Å; V238-I242 PolarHBondContact O-N 3.41Å; L239-I242 PolarHBondContact O-N 3.42Å; S240-I242 VanDerWaalsContact C-N 3.31Å; S240-I242 PolarHBondContact O-N 2.67Å; I242-L245 PolarHBondContact O-N 3.29Å; I242-R246 WeakPolarHBondContact O-CG 3.49Å; I242-R246 PolarHBondContact O-N 3.4Å; I242-R246 VanDerWaalsContact O-N 3.16Å
243D90.6Very high80.1Confident74 Ų7499.7 Ų99.740%0.39657%0.568SS.*Hα-helixtrans-62.5-41176-174.766.7000112.1L239 S240 L245 R246 K247L239-D243 PolarHBondContact O-N 2.84Å; S240-D243 PolarHBondContact O-N 3.16Å; D243-L245 VanDerWaalsContact C-N 3.31Å; D243-L245 PolarHBondContact O-N 2.87Å; D243-R246 PolarHBondContact O-N 3.07Å; D243-R246 VanDerWaalsContact O-N 3.1Å; D243-K247 PolarHBondContact O-N 3.49Å; D243-K247 WeakPolarHBondContact OD2-CE 3.48Å; D243-K247 IonicContact OD2-NZ 3.3Å; D243-K247 PolarHBondContact OD2-NZ 3.27Å
244E89.1Confident78.8Confident130 Ų130101.9 Ų101.961%0.60758%0.576SS**Hα-helixtrans-58.8-41.9174-74.8-175.3173.100112.4S240 R246 K247S240-E244 PolarHBondContact O-N 2.91Å; E244-R246 VanDerWaalsContact C-N 3.25Å; E244-R246 PolarHBondContact O-N 2.89Å; E244-K247 PolarHBondContact O-N 2.59Å
245L86Confident77.1Confident143 Ų143104.5 Ų104.575%0.74960%0.597SS**Hα-helixtrans-68.5-23176.8-67.4173.2000113.4M241 I242 D243M241-L245 WeakPolarHBondContact O-CG 3.31Å; M241-L245 PolarHBondContact O-N 2.97Å; I242-L245 PolarHBondContact O-N 3.29Å; D243-L245 VanDerWaalsContact C-N 3.31Å; D243-L245 PolarHBondContact O-N 2.87Å
246R86.6Confident75.1Confident179 Ų179107 Ų10768%0.67562%0.616SS**Hα-helixtrans-81.1-15.4177.7-74.5-179.7-177132.1-0.3113.3I242 D243 E244I242-R246 WeakPolarHBondContact O-CG 3.49Å; I242-R246 PolarHBondContact O-N 3.4Å; I242-R246 VanDerWaalsContact O-N 3.16Å; D243-R246 PolarHBondContact O-N 3.07Å; D243-R246 VanDerWaalsContact O-N 3.1Å; E244-R246 VanDerWaalsContact C-N 3.25Å; E244-R246 PolarHBondContact O-N 2.89Å
247K83.8Confident73.2Confident123 Ų123106.3 Ų106.354%0.53562%0.62SS.*SBendtrans-72.1127178.8-71.8169.1-173.2152.30109.7D243 E244 V249D243-K247 PolarHBondContact O-N 3.49Å; D243-K247 WeakPolarHBondContact OD2-CE 3.48Å; D243-K247 IonicContact OD2-NZ 3.3Å; D243-K247 PolarHBondContact OD2-NZ 3.27Å; E244-K247 PolarHBondContact O-N 2.59Å; K247-V249 PolarHBondContact O-N 3.31Å
248P69.7Low71.3Confident124 Ų124109.6 Ų109.681%0.80563%0.628SS**  trans-59.5129.5178.6-17.627.7000110.3A250P248-A250 PolarHBondContact O-N 3.24Å
249V69.9Low69.3Low127 Ų127114.7 Ų114.777%0.7766%0.661SS**  trans-63109.5168.1176.90000107.2K247 I251K247-V249 PolarHBondContact O-N 3.31Å; V249-I251 VanDerWaalsContact C-N 3.32Å; V249-I251 HydrophobicContact CG1-CG1 4.41Å; V249-I251 PolarHBondContact O-N 3.5Å
250A60.4Low66.8Low93 Ų93116.5 Ų116.577%0.76968%0.68SS**  trans-67.19516900000107.9P248 A252P248-A250 PolarHBondContact O-N 3.24Å; A250-A252 VanDerWaalsContact C-N 3.27Å; A250-A252 PolarHBondContact O-N 3.33Å
251I59.4Low64.6Low150 Ų150124.3 Ų124.377%0.76970%0.7SS**  trans-67.694.8165.2-58.5171.9000105.7V249V249-I251 VanDerWaalsContact C-N 3.32Å; V249-I251 HydrophobicContact CG1-CG1 4.41Å; V249-I251 PolarHBondContact O-N 3.5Å
252A57.8Low62.3Low74 Ų74128 Ų12861%0.61272%0.716SS**  trans-57.3137.9162.800000107.8A250 M254A250-A252 VanDerWaalsContact C-N 3.27Å; A250-A252 PolarHBondContact O-N 3.33Å; A252-M254 PolarHBondContact O-N 3.2Å
253P49.1Very low59.7Low124 Ų124131 Ų13181%0.80574%0.74SS**  trans-60.5114.9177.7-14.426.9000108.5
254M56.1Low57.4Low162 Ų162135.7 Ų135.780%0.79876%0.762SS**PPolyproline II helixtrans-59128.3169.9-72.4-72.4-68.700108.3A252 S256A252-M254 PolarHBondContact O-N 3.2Å; M254-S256 PolarHBondContact O-N 3.31Å
255P49.4Very low55.2Low116 Ų116135 Ų13575%0.75377%0.772SS**PPolyproline II helixtrans-64.2131.2174.425.2-30.5000109.4
256S45.3Very low53.2Low112 Ų112132.7 Ų132.778%0.78377%0.773SS**PPolyproline II helixtrans-56.9132.7178.2-50.40000111.3M254M254-S256 PolarHBondContact O-N 3.31Å
257P47.5Very low51.2Low124 Ų124130.2 Ų130.281%0.80578%0.78SS**PPolyproline II helixtrans-77.1128.8169.529.5-29000109.7
258T48.2Very low49.5Very low127 Ų127130.7 Ų130.778%0.77979%0.793SS**PPolyproline II helixtrans-56.9147172.243.20000112.4S260T258-S260 PolarHBondContact O-N 2.92Å
259P45.5Very low48.4Very low135 Ų135129.8 Ų129.888%0.87779%0.787SS**  trans-80115.9-17832.2-30.2000110
260S38Very low47.4Very low114 Ų114129.7 Ų129.780%0.79779%0.789SS**  trans-123.1115.5161.6-173.80000109.4T258 H262T258-S260 PolarHBondContact O-N 2.92Å; S260-H262 PolarHBondContact O-N 2.83Å
261R44.3Very low46.3Very low229 Ų229131.7 Ų131.786%0.86479%0.791SS**  trans-55.9120.9165.5-88.1172.2155.5179.5-5.9108.6
262H41Very low45.6Very low184 Ų184129.4 Ų129.485%0.85279%0.787SS**  -169.1128.2120.8-94.211.6000110.2S260S260-H262 PolarHBondContact O-N 2.83Å
263S37.2Very low45.1Very low107 Ų107132 Ų13275%0.74880%0.797SS**  trans-65.7131.7173.8168.70000110.3
264M40.4Very low44.7Very low173 Ų173134.3 Ų134.385%0.85280%0.802SS**  -160.5132.1125.5-82.6-39.3-16300110.4
265S43.3Very low44Very low116 Ų116136 Ų13681%0.81181%0.805SS**  trans-57.5135.3175.348.30000114.2
266A44.5Very low43.4Very low94 Ų94135 Ų13578%0.77781%0.806SS**  trans-148.3151.1157.400000110.8
267P45.1Very low43.2Very low126 Ų126139 Ų13982%0.81881%0.813SS**PPolyproline II helixtrans-86.1146.8-159.1-2.121.6000113.5
268V46.5Very low42.9Very low134 Ų134139.5 Ų139.581%0.81281%0.813SS**PPolyproline II helixtrans-72.5132170.8178.20000109.8
269P47.8Very low42.8Very low104 Ų104137 Ų13768%0.67580%0.801SS**PPolyproline II helixtrans-79.8145.8169.331.8-30.5000110.8
270P48.4Very low43Very low125 Ų125136.5 Ų136.581%0.81280%0.798SS**PPolyproline II helixtrans-76.2135.9-177.730.2-31.4000111.7
271V37.4Very low43.5Very low135 Ų135137.5 Ų137.582%0.81879%0.794SS**PPolyproline II helixtrans-71.9134.2169.7172.70000109.4
272P44.6Very low43.4Very low103 Ų103130.8 Ų130.867%0.66979%0.787SS**PPolyproline II helixtrans-74.6141.8174.1-1.616.3000111.2L274P272-L274 PolarHBondContact O-N 3Å; P272-L274 VanDerWaalsContact O-N 3.17Å
273P47.2Very low43.7Very low127 Ų127129.6 Ų129.683%0.82579%0.787SS**  trans-75.7106.1173.529.5-30.3000110.1K275P273-K275 PolarHBondContact O-N 2.89Å
274L40.5Very low44Very low174 Ų174132 Ų13291%0.91179%0.788SS**PPolyproline II helixtrans-69.4117164.2-83155.9000108.5P272 A276P272-L274 PolarHBondContact O-N 3Å; P272-L274 VanDerWaalsContact O-N 3.17Å; L274-A276 PolarHBondContact O-N 2.92Å
275K41.5Very low44.2Very low197 Ų197132.8 Ų132.886%0.85779%0.787SS**PPolyproline II helixtrans-64.3123.6170.2-68.7-179.1178.3179.10108.7P273 Q277P273-K275 PolarHBondContact O-N 2.89Å; K275-Q277 PolarHBondContact O-N 3.22Å
276A36.3Very low44.1Very low96 Ų96134.6 Ų134.679%0.79379%0.788SS**PPolyproline II helixtrans-59.3119.3167.800000109.2L274 T278L274-A276 PolarHBondContact O-N 2.92Å; A276-T278 PolarHBondContact O-N 3.32Å
277Q42.6Very low43.8Very low196 Ų196139.6 Ų139.692%0.91680%0.795SS**  trans-74.7112.6166.7-75.4-163.3-18.300108.2K275K275-Q277 PolarHBondContact O-N 3.22Å
278T41.4Very low43.3Very low133 Ų133142 Ų14282%0.81680%0.795SS**  trans-75.3134.4168.754.90000109.2A276A276-T278 PolarHBondContact O-N 3.32Å
279S45.8Very low42.6Very low74 Ų74142 Ų14252%0.51779%0.79SS.*  trans-51.7146.6178163.90000113.4L281S279-L281 PolarHBondContact O-N 2.98Å; S279-L281 PolarHBondContact OG-N 3.35Å
280P48.2Very low41.7Very low126 Ų126142.7 Ų142.782%0.81880%0.798SS**G310 helixtrans-71.1-6.2-179.3-10.426.2000114.6
281L49.8Very low40.8Very low135 Ų135144.4 Ų144.471%0.70780%0.8SS**G310 helixtrans-85.3-9.3-171.6-90.7104.1000115.6S279 N283S279-L281 PolarHBondContact O-N 2.98Å; S279-L281 PolarHBondContact OG-N 3.35Å; L281-N283 VanDerWaalsContact C-N 3.31Å; L281-N283 PolarHBondContact O-N 3.25Å
282A42.3Very low40.4Very low87 Ų87144.1 Ų144.172%0.71980%0.799SS**G310 helixtrans-77.4-9.1-173.500000115
283N46.5Very low39.8Very low160 Ų160146.7 Ų146.786%0.85681%0.807SS**G310 helixtrans-96.47.3-173.5-82.54.7000115.4L281L281-N283 VanDerWaalsContact C-N 3.31Å; L281-N283 PolarHBondContact O-N 3.25Å
284M43.3Very low38.9Very low157 Ų157146.4 Ų146.477%0.77381%0.808SS**SBendtrans-99.9-3.5-173.4-137.6-176.7-62.900115.5
285F45.1Very low38.3Very low190 Ų190144.3 Ų144.383%0.83380%0.802SS**SBendtrans-122.46.7-171.8-84.5-77.5000117.1
286N41.6Very low37.7Very low153 Ų153141.1 Ų141.182%0.81880%0.799SS**  trans-108.382.4175.5-96.528.7000112.5
287H37.4Very low37.2Very low199 Ų199140.1 Ų140.192%0.92179%0.791SS**  trans-139.196.4149.1-80.7-56.2000109
288Q34.2Very low36.4Very low176 Ų176141.3 Ų141.382%0.82279%0.789SS**  trans-127.3115.5161.5-170.2138.438.100109.5
289D32.5Very low35.9Very low135 Ų135141.7 Ų141.772%0.72279%0.791SS**  trans21120.8145.4-53-42.3000118.6
290S30Very low35.4Very low118 Ų118143.8 Ų143.883%0.82580%0.803SS**  trans-177104.9134.2-79.90000110.6
291N28.8Very low34.5Very low161 Ų161145.2 Ų145.286%0.86181%0.809SS**  trans-111.7100.7164.1-156.631000107.7
292T29.6Very low33.5Very low130 Ų130147.6 Ų147.680%0.79881%0.814SS**  trans-116.4122.2168.649.70000109.8
293N30.8Very low33Very low157 Ų157150.6 Ų150.684%0.8482%0.818SS**  trans-50.8139.3171-74.7-33000113.2
294S28.9Very low32.2Very low121 Ų121147.2 Ų147.285%0.84681%0.807SS**  trans-157.2137.1137.962.90000112.5
295V27.9Very low31.6Very low130 Ų130146.5 Ų146.579%0.78881%0.805SS**  trans-73.5151-172.7-1710000112
296T28Very low30.9Very low129 Ų129144.6 Ų144.679%0.79180%0.803SS**  140.5125.6120.2-43.10000116.5
297A26.5Very low30.4Very low75 Ų75145.2 Ų145.262%0.6280%0.801SS**  trans72.5108.3144.200000124.9
298Y26Very low30Very low221 Ų221143.1 Ų143.187%0.86779%0.792SS**  14.8129129.5-50.9-81.5000121.5
299T30.7Very low29.8Very low142 Ų142142.3 Ų142.387%0.87179%0.793SS**  -174.6150.6110.325.70000111.6
300P35.2Very low29.7Very low118 Ų118139.4 Ų139.477%0.76680%0.795SS**  trans-111.7144.4-17237.5-25.3000113.7
301T29Very low29.9Very low155 Ų155141.3 Ų141.395%0.95180%0.796SS**  trans-146.8154.7162.1300000112.8
302K30.2Very low30.1Very low185 Ų185142.2 Ų142.280%0.80480%0.795SS**  trans-97.5162.1-152.6-97177.7174.4175.80114.8
303N29.9Very low30.6Very low151 Ų151142.7 Ų142.781%0.80779%0.793SS**  trans74.2145.4151.8-60.8-3.9000116.3
304S30.6Very low30.8Very low89 Ų89142.2 Ų142.262%0.62279%0.79SS**  cis-174.2139.610.9143.80000109.5
305I31.3Very low31.2Very low141 Ų141144.2 Ų144.272%0.72379%0.79SS**  trans50.7117.6135.9-49.5168.8000120
306D29.4Very low31.4Very low151 Ų151143.5 Ų143.581%0.80780%0.798SS**  -177.6151.2105.2-103.3-37.9000115.2
307H31.4Very low31.7Very low166 Ų166148.4 Ų148.477%0.76980%0.802SS**  trans-55.8165.4178.9-85.64.6000115.2
308E29.5Very low32.2Very low155 Ų155150.2 Ų150.272%0.72481%0.81SS**  cis-174.8156.831.1-135.2167.1-157.900112
309N30Very low32.5Very low158 Ų158145.9 Ų145.985%0.84581%0.806SS**  trans71.1128152.2-80.3-11.5000124.7
310G30.6Very low32.7Very low74 Ų74144.8 Ų144.876%0.76380%0.804SS**  trans150102.7152.700000114.2
311D33.8Very low32.8Very low159 Ų159144.8 Ų144.885%0.8580%0.802SS**  trans-57.4142.6-177.8-57.7-65000115.4
312E33.9Very low33.3Very low180 Ų180142.4 Ų142.484%0.84180%0.798SS**  160137.2119.3-79-130.1138.600112.6
313N39.8Very low33.8Very low140 Ų140139.6 Ų139.675%0.74980%0.797SS**  trans-13.1124.6164.4-76.8-24000117.3
314N33.8Very low33.9Very low147 Ų147135.7 Ų135.779%0.78679%0.792SS**  177.2140.2120.7-96.7-57.9000113.4
315L37.3Very low34.1Very low162 Ų162138.9 Ų138.985%0.84880%0.801SS**  trans75.396155.4-59.4156.3000118R317L315-R317 PolarHBondContact O-N 3.17Å
316A31.8Very low34.5Very low116 Ų116139.1 Ų139.196%0.95980%0.804SS**  trans-65.8115.3166.800000111.1
317R34.6Very low34.6Very low232 Ų232137.4 Ų137.488%0.87580%0.804SS**  trans-81.3150.3175.2-164.8177.2-158.9152.83.5110.6L315L315-R317 PolarHBondContact O-N 3.17Å
318S38.2Very low35Very low112 Ų112138.3 Ų138.378%0.78381%0.811SS**  trans-33.9132.8174.6-47.70000115.8
319V31.4Very low35.9Very low130 Ų130135.1 Ų135.179%0.78881%0.811SS**  trans-111.8105.7161.9-76.10000110
320S34Very low37.5Very low119 Ų119135.4 Ų135.483%0.83280%0.8SS**  trans-73.3114157.1-43.10000107.4
321V38.7Very low39.8Very low118 Ų118138.9 Ų138.972%0.71579%0.79SS**  trans-115.2100.6163.7-77.40000108.8T323V321-T323 PolarHBondContact O-N 3.48Å
322A39.5Very low42.4Very low106 Ų106134.6 Ų134.688%0.87677%0.771SS**  trans-65.9119.9153.500000107.1
323T39.5Very low45.2Very low126 Ų126128.9 Ų128.977%0.77374%0.742SS**  trans-132.5104.3165.4-40.50000107.6V321V321-T323 PolarHBondContact O-N 3.48Å
324G33.8Very low47.8Very low69 Ų69122.7 Ų122.771%0.71171%0.709SS**  trans-73.5154.3161.700000110.7
325L34.6Very low50.8Low155 Ų155122 Ų12281%0.81270%0.696SS**SBendtrans91.287.4158.2-13869000118.5
326N38.7Very low53.5Low146 Ų146114.4 Ų114.478%0.78166%0.656SS**  70.286.2129.5-51.4-7.2000119.7
327S31.8Very low56.5Low115 Ų115110.9 Ų110.980%0.80462%0.62SS**  -151.9148.4128.373.60000109.8A329S327-A329 VanDerWaalsContact C-N 3.3Å; S327-A329 PolarHBondContact O-N 3.45Å
328M38.8Very low59.3Low185 Ų185105.2 Ų105.291%0.91160%0.602SS**  trans-71.166.1-165.8-64159.7-177.800114.1R330M328-R330 VanDerWaalsContact C-N 3.29Å; M328-R330 PolarHBondContact O-N 3.12Å
329A48.7Very low61.9Low88 Ų88103.5 Ų103.573%0.72759%0.589SS**  trans-75.187.2160.800000107.9S327 R331S327-A329 VanDerWaalsContact C-N 3.3Å; S327-A329 PolarHBondContact O-N 3.45Å; A329-R331 PolarHBondContact O-N 2.89Å
330R65.3Low64.8Low164 Ų16498.8 Ų98.862%0.61956%0.558SS**  trans-55.4113.4172.5-69.7-175.4-179.6-133.34.8107.2M328 E392M328-R330 VanDerWaalsContact C-N 3.29Å; M328-R330 PolarHBondContact O-N 3.12Å; R330-E392 WeakPolarHBondContact CD-OE2 3.48Å; R330-E392 IonicContact CZ-OE1 2.73Å; R330-E392 IonicContact CZ-OE2 2.71Å; R330-E392 IonicContact NE-OE2 3.04Å; R330-E392 PolarHBondContact NE-OE2 2.73Å; R330-E392 IonicContact NH1-OE1 2.75Å; R330-E392 PolarHBondContact NH1-OE1 3.18Å; R330-E392 IonicContact NH1-OE2 3.08Å; R330-E392 PolarHBondContact NH1-OE2 2.75Å
331R77Confident67.6Low148 Ų14897.4 Ų97.456%0.55855%0.554SS**  trans-52.2138.5173.3-75.4-178.2-177162.11108.1A329 R333 I358A329-R331 PolarHBondContact O-N 2.89Å; R331-R333 PolarHBondContact O-N 3.3Å; R331-I358 HydrophobicContact CB-CG2 3.44Å; R331-I358 VanDerWaalsContact CB-CG2 3.44Å; R331-I358 HydrophobicContact CG-CG2 4.29Å
332P89.4Confident69.7Low69 Ų6992.3 Ų92.345%0.44852%0.524SS..  trans-52132.2-178.8-25.333.2000110.8L359P332-L359 HydrophobicContact CB-CB 4.33Å; P332-L359 HydrophobicContact CB-CD1 4.13Å; P332-L359 HydrophobicContact CB-CG 4.48Å; P332-L359 WeakPolarHBondContact O-CB 3.41Å; P332-L359 PolarHBondContact O-N 2.84Å
333R93.4Very high71.8Confident59 Ų5990.8 Ų90.822%0.22352%0.518CS..EExtended strand (participates in β ladder)trans-112.8141.5-179.5-75.7164.785.2-151-0.2109.6R331 I356 I357 I358 E374 V390 E392R331-R333 PolarHBondContact O-N 3.3Å; R333-I356 HydrophobicContact CB-CG2 4.17Å; R333-I356 HydrophobicContact CG-CG2 4.29Å; R333-I357 WeakPolarHBondContact CA-O 3.37Å; R333-I358 HydrophobicContact CG-CG1 3.99Å; R333-E374 IonicContact CZ-OE1 2.61Å; R333-E374 IonicContact CZ-OE2 3.59Å; R333-E374 IonicContact NE-OE1 2.83Å; R333-E374 PolarHBondContact NE-OE1 3.44Å; R333-E374 IonicContact NH2-OE1 3.16Å; R333-E374 PolarHBondContact NH2-OE1 2.89Å; R333-E374 IonicContact NH2-OE2 3.64Å; R333-E374 PolarHBondContact NH2-OE2 2.62Å; R333-V390 HydrophobicContact CB-CB 4.15Å; R333-V390 HydrophobicContact CB-CG2 4.33Å; R333-V390 PolarHBondContact O-N 3.33Å; R333-E392 IonicContact NH1-OE1 2.75Å
334V94.3Very high73.9Confident10 Ų1092.7 Ų92.76%0.06152%0.524CS..EExtended strand (participates in β ladder)trans-124.4146174.6-58.10000109.5I356 I357 L359 M369 F382 C387 R388V334-I356 WeakPolarHBondContact O-CA 3.49Å; V334-I357 HydrophobicContact CG2-CB 3.86Å; V334-I357 PolarHBondContact N-O 2.68Å; V334-I357 PolarHBondContact O-N 3.01Å; V334-L359 HydrophobicContact CG1-CD1 3.92Å; V334-L359 HydrophobicContact CG1-CD2 4.27Å; V334-L359 HydrophobicContact CG1-CG 4.11Å; V334-L359 HydrophobicContact CG2-CD2 4.12Å; V334-M369 HydrophobicContact CG1-CE 4.39Å; V334-M369 HydrophobicContact CG2-CE 4.42Å; V334-F382 HydrophobicContact CG2-CE2 4.08Å; V334-F382 HydrophobicContact CG2-CZ 4Å; V334-C387 HydrophobicContact CB-CB 3.98Å; V334-C387 HydrophobicContact CG2-CB 3.89Å; V334-R388 CarbonylContact C-O 3.5Å; V334-R388 WeakPolarHBondContact CA-O 3.25Å
335R96.2Very high76.3Confident133 Ų13392.6 Ų92.650%0.50251%0.507SS..EExtended strand (participates in β ladder)trans-105.2131.5173.5179.2177.8-64.2155.82.5108.8D355 I356 C387 R388 V390R335-D355 CarbonylContact C-O 3.57Å; R335-D355 WeakPolarHBondContact CA-O 3.17Å; R335-I356 HydrophobicContact CB-CD1 3.7Å; R335-I356 HydrophobicContact CG-CD1 3.87Å; R335-C387 CarbonylContact O-C 3.58Å; R335-C387 VanDerWaalsContact O-CA 3.31Å; R335-C387 WeakPolarHBondContact O-CA 3.45Å; R335-R388 PolarHBondContact N-O 3.3Å; R335-R388 PolarHBondContact O-N 3.02Å; R335-V390 HydrophobicContact CB-CG2 3.75Å
336T94.7Very high78.7Confident2 Ų290.6 Ų90.61%0.01251%0.506CS..EExtended strand (participates in β ladder)trans-72137.1177.162.80000109.7F351 D352 G354 D355 I357 Y386T336-F351 HydrophobicContact CG2-CB 4.23Å; T336-F351 HydrophobicContact CG2-CD1 4.28Å; T336-F351 HydrophobicContact CG2-CD2 3.2Å; T336-F351 HydrophobicContact CG2-CE1 4.49Å; T336-F351 HydrophobicContact CG2-CE2 3.46Å; T336-F351 VanDerWaalsContact CG2-CE2 3.46Å; T336-F351 HydrophobicContact CG2-CG 3.64Å; T336-F351 HydrophobicContact CG2-CZ 4.12Å; T336-D352 WeakPolarHBondContact CB-O 3.43Å; T336-D352 PolarHBondContact OG1-O 3.35Å; T336-G354 WeakPolarHBondContact O-CA 3.35Å; T336-G354 PolarHBondContact O-N 3.17Å; T336-G354 PolarHBondContact OG1-N 3.04Å; T336-D355 HydrophobicContact CG2-CB 4.12Å; T336-D355 PolarHBondContact N-O 2.87Å; T336-D355 PolarHBondContact OG1-N 2.88Å; T336-D355 PolarHBondContact OG1-O 3.3Å; T336-I357 HydrophobicContact CG2-CD1 3.61Å; T336-I357 HydrophobicContact CG2-CG1 4.22Å; T336-Y386 CarbonylContact C-O 3.58Å; T336-Y386 VanDerWaalsContact CA-O 3.31Å; T336-Y386 WeakPolarHBondContact CA-O 3.48Å
337I94.8Very high81.2Confident42 Ų4287.2 Ų87.222%0.21549%0.491CS..SBendtrans-113.4-7.2179.755.4165.8000112.4Y386 R388I337-Y386 VanDerWaalsContact CG1-O 3.27Å; I337-Y386 WeakPolarHBondContact CG1-O 3.44Å; I337-Y386 PolarHBondContact N-O 3.24Å; I337-R388 HydrophobicContact CG2-CB 4.14Å
338F91.9Very high84.1Confident114 Ų11483.8 Ų83.850%0.546%0.463SS..SBendtrans-146.3151.8172.7-62.1-66.9000108.7F351 Y386F338-F351 VanDerWaalsContact O-CE2 3.32Å; F338-F351 WeakPolarHBondContact O-CE2 3.47Å; F338-Y386 HydrophobicContact CB-CD2 3.4Å; F338-Y386 HydrophobicContact CB-CE2 3.76Å; F338-Y386 HydrophobicContact CB-CG 4.31Å; F338-Y386 HydrophobicContact CG-CD2 4.42Å
339P93.6Very high86.7Confident76 Ų7675.1 Ų75.149%0.49442%0.421SS..  trans-74.7151.1176.630.8-35000112.3F351 Y386P339-F351 WeakPolarHBondContact CA-O 3.32Å; P339-Y386 WeakPolarHBondContact O-CE2 3.46Å
340H92.5Very high88.9Confident30 Ų3073.4 Ų73.414%0.13940%0.403CS..BIsolated β-bridgetrans-136.9127.2175.1177.9-103.7000110.5L349 S350 F351 Y386H340-L349 PolarHBondContact CE1-O 3.42Å; H340-L349 PolarHBondContact ND1-O 2.89Å; H340-S350 CarbonylContact O-C 3.52Å; H340-S350 WeakPolarHBondContact O-CA 3.46Å; H340-F351 HydrophobicContact CB-CD1 4.31Å; H340-F351 HydrophobicContact CB-CD2 4.09Å; H340-F351 HydrophobicContact CB-CE1 3.79Å; H340-F351 HydrophobicContact CB-CE2 3.57Å; H340-F351 HydrophobicContact CB-CG 4.46Å; H340-F351 HydrophobicContact CB-CZ 3.41Å; H340-F351 VanDerWaalsContact CB-CZ 3.41Å; H340-F351 PolarHBondContact N-O 3.43Å; H340-F351 PolarHBondContact O-N 3.34Å; H340-Y386 HydrophobicContact CB-CD2 4.47Å
341A91.7Very high90.3Very high90 Ų9066 Ų6674%0.74438%0.375SS*.  trans-114.4110.6178.700000110.5G343A341-G343 PolarHBondContact O-N 2.89Å
342A83.2Confident91.2Very high12 Ų1263.7 Ų63.710%0.09937%0.374CS..  trans-75.8-5.9-179.200000114.4N344 N345 L348 S350A342-N344 PolarHBondContact O-N 3.49Å; A342-N345 WeakPolarHBondContact O-CB 3.32Å; A342-N345 PolarHBondContact O-N 2.9Å; A342-N345 VanDerWaalsContact O-N 3.13Å; A342-L348 HydrophobicContact CB-CB 3.44Å; A342-L348 VanDerWaalsContact CB-CB 3.44Å; A342-L348 WeakPolarHBondContact CB-O 3.41Å; A342-S350 WeakPolarHBondContact CB-OG 3.36Å; A342-S350 PolarHBondContact N-OG 2.87Å
343G83.2Confident91.4Very high73 Ų7366.7 Ų66.775%0.75338%0.383SS*.THydrogen-bonded Turntrans58-124.3-174.800000112.1A341A341-G343 PolarHBondContact O-N 2.89Å
344N83.7Confident91.3Very high167 Ų16765.8 Ų65.889%0.89339%0.391SS*.THydrogen-bonded Turntrans-95.48.1179.564.2-10.9000113.9A342 S346A342-N344 PolarHBondContact O-N 3.49Å; N344-S346 PolarHBondContact O-N 2.7Å
345N85.7Confident91.4Very high67 Ų6766.3 Ų66.336%0.35839%0.394SS..  trans-84113.1-177.7-170.2-25.3000111.3A342 T347 L348A342-N345 WeakPolarHBondContact O-CB 3.32Å; A342-N345 PolarHBondContact O-N 2.9Å; A342-N345 VanDerWaalsContact O-N 3.13Å; N345-T347 PolarHBondContact O-N 3.27Å; N345-T347 WeakPolarHBondContact OD1-CB 3.5Å; N345-T347 PolarHBondContact OD1-N 3.5Å; N345-T347 PolarHBondContact OD1-OG1 2.77Å; N345-L348 HydrophobicContact CB-CB 4.27Å; N345-L348 HydrophobicContact CB-CD1 4.07Å; N345-L348 HydrophobicContact CB-CG 4.12Å; N345-L348 PolarHBondContact O-N 2.84Å
346S85.2Confident91.4Very high113 Ų11361.1 Ų61.179%0.7938%0.376SS*.THydrogen-bonded Turntrans-71.9-12.8-18057.90000114.5N344N344-S346 PolarHBondContact O-N 2.7Å
347T90.4Very high91.4Very high75 Ų7561 Ų6146%0.4638%0.375SS..THydrogen-bonded Turntrans-89.7-14.7177.967.90000113N345 G380 W381N345-T347 PolarHBondContact O-N 3.27Å; N345-T347 WeakPolarHBondContact OD1-CB 3.5Å; N345-T347 PolarHBondContact OD1-N 3.5Å; N345-T347 PolarHBondContact OD1-OG1 2.77Å; T347-G380 CarbonylContact O-C 3.41Å; T347-G380 WeakPolarHBondContact O-CA 3.49Å; T347-W381 PolarHBondContact O-N 2.74Å
348L93Very high91.4Very high43 Ų4360.9 Ų60.923%0.22537%0.374CS..BIsolated β-bridgetrans-104.6144.9-176.3-65.8-175.1000111.3A342 N345 W368 W381A342-L348 HydrophobicContact CB-CB 3.44Å; A342-L348 VanDerWaalsContact CB-CB 3.44Å; A342-L348 WeakPolarHBondContact CB-O 3.41Å; N345-L348 HydrophobicContact CB-CB 4.27Å; N345-L348 HydrophobicContact CB-CD1 4.07Å; N345-L348 HydrophobicContact CB-CG 4.12Å; N345-L348 PolarHBondContact O-N 2.84Å; L348-W368 HydrophobicContact CD2-CE3 4.32Å; L348-W368 HydrophobicContact CD2-CH2 4.03Å; L348-W368 HydrophobicContact CD2-CZ3 3.6Å; L348-W381 CarbonylContact C-O 3.58Å; L348-W381 WeakPolarHBondContact CA-O 3.44Å; L348-W381 HydrophobicContact CD2-CB 3.93Å
349L94Very high91.6Very high3 Ų356 Ų562%0.01635%0.354CS..  trans-96.7122179.9-172.162.1000110.6H340 F351 I357 M373 K378 W381 F382H340-L349 PolarHBondContact CE1-O 3.42Å; H340-L349 PolarHBondContact ND1-O 2.89Å; L349-F351 HydrophobicContact CD2-CD1 4.49Å; L349-F351 HydrophobicContact CG-CD1 4.23Å; L349-I357 HydrophobicContact CD2-CD1 3.94Å; L349-I357 HydrophobicContact CD2-CG1 4.21Å; L349-I357 HydrophobicContact CD2-CG2 4.09Å; L349-M373 HydrophobicContact CD1-CB 4.3Å; L349-M373 HydrophobicContact CD1-CE 3.72Å; L349-M373 HydrophobicContact CD2-CB 4.37Å; L349-M373 HydrophobicContact CG-CE 4.19Å; L349-K378 HydrophobicContact CD1-CB 3.79Å; L349-K378 VanDerWaalsContact CD1-O 3.24Å; L349-K378 WeakPolarHBondContact CD1-O 3.34Å; L349-W381 PolarHBondContact N-O 2.81Å; L349-F382 HydrophobicContact CB-CB 4.42Å; L349-F382 HydrophobicContact CB-CD1 4.44Å; L349-F382 HydrophobicContact CD2-CD1 4.01Å; L349-F382 HydrophobicContact CD2-CE1 4.42Å
350S93.8Very high91.4Very high52 Ų5254.9 Ų54.936%0.36434%0.343SS..  trans-90.3139.6171.7-55.60000111.1H340 A342 M373H340-S350 CarbonylContact O-C 3.52Å; H340-S350 WeakPolarHBondContact O-CA 3.46Å; A342-S350 WeakPolarHBondContact CB-OG 3.36Å; A342-S350 PolarHBondContact N-OG 2.87Å; S350-M373 WeakPolarHBondContact O-CE 3.49Å
351F95.4Very high91.3Very high7 Ų756.4 Ų56.43%0.03135%0.352CS..BIsolated β-bridgetrans-156.4162.4177.349.3-98.4000111.6T336 F338 P339 H340 L349 D355 I357 M373 F382T336-F351 HydrophobicContact CG2-CB 4.23Å; T336-F351 HydrophobicContact CG2-CD1 4.28Å; T336-F351 HydrophobicContact CG2-CD2 3.2Å; T336-F351 HydrophobicContact CG2-CE1 4.49Å; T336-F351 HydrophobicContact CG2-CE2 3.46Å; T336-F351 VanDerWaalsContact CG2-CE2 3.46Å; T336-F351 HydrophobicContact CG2-CG 3.64Å; T336-F351 HydrophobicContact CG2-CZ 4.12Å; F338-F351 VanDerWaalsContact O-CE2 3.32Å; F338-F351 WeakPolarHBondContact O-CE2 3.47Å; P339-F351 WeakPolarHBondContact CA-O 3.32Å; H340-F351 HydrophobicContact CB-CD1 4.31Å; H340-F351 HydrophobicContact CB-CD2 4.09Å; H340-F351 HydrophobicContact CB-CE1 3.79Å; H340-F351 HydrophobicContact CB-CE2 3.57Å; H340-F351 HydrophobicContact CB-CG 4.46Å; H340-F351 HydrophobicContact CB-CZ 3.41Å; H340-F351 VanDerWaalsContact CB-CZ 3.41Å; H340-F351 PolarHBondContact N-O 3.43Å; H340-F351 PolarHBondContact O-N 3.34Å; L349-F351 HydrophobicContact CD2-CD1 4.49Å; L349-F351 HydrophobicContact CG-CD1 4.23Å; F351-D355 HydrophobicContact CB-CB 4.16Å; F351-D355 WeakPolarHBondContact CB-OD2 3.45Å; F351-I357 HydrophobicContact CD1-CD1 3.74Å; F351-I357 HydrophobicContact CE1-CD1 3.92Å; F351-I357 HydrophobicContact CG-CD1 4.22Å; F351-M373 HydrophobicContact CB-CE 4.37Å; F351-F382 HydrophobicContact CE1-CB 3.44Å; F351-F382 VanDerWaalsContact CE1-CB 3.44Å; F351-F382 HydrophobicContact CE1-CD2 4.14Å; F351-F382 AromaticContact CE1-CG 3.91Å; F351-F382 HydrophobicContact CE1-CG 3.91Å; F351-F382 HydrophobicContact CZ-CB 4.01Å; F351-F382 HydrophobicContact CZ-CD2 4.27Å; F351-F382 HydrophobicContact CZ-CG 4.44Å
352D95Very high90.7Very high100 Ų10056.2 Ų56.254%0.53534%0.343SS..  trans-98167.7173.2-59-59000110.2T336 D355 K375T336-D352 WeakPolarHBondContact CB-O 3.43Å; T336-D352 PolarHBondContact OG1-O 3.35Å; D352-D355 PolarHBondContact N-OD2 2.94Å; D352-D355 PolarHBondContact O-N 3.27Å; D352-K375 IonicContact OD2-NZ 2.68Å
353E93.7Very high90.5Very high133 Ų13360.8 Ų60.862%0.62137%0.365SS*.THydrogen-bonded Turntrans-62.7134.8172.3-176.9178.7163.800111
354G91.8Very high90.6Very high39 Ų3962.3 Ų62.340%0.40235%0.353SS..THydrogen-bonded Turntrans92.5-9.3179.600000115.6T336T336-G354 WeakPolarHBondContact O-CA 3.35Å; T336-G354 PolarHBondContact O-N 3.17Å; T336-G354 PolarHBondContact OG1-N 3.04Å
355D95.1Very high90.7Very high21 Ų2162 Ų6211%0.11234%0.339CS..  trans-62.4147.8174.8-77.1-26.2000112.3R335 T336 F351 D352 K375R335-D355 CarbonylContact C-O 3.57Å; R335-D355 WeakPolarHBondContact CA-O 3.17Å; T336-D355 HydrophobicContact CG2-CB 4.12Å; T336-D355 PolarHBondContact N-O 2.87Å; T336-D355 PolarHBondContact OG1-N 2.88Å; T336-D355 PolarHBondContact OG1-O 3.3Å; F351-D355 HydrophobicContact CB-CB 4.16Å; F351-D355 WeakPolarHBondContact CB-OD2 3.45Å; D352-D355 PolarHBondContact N-OD2 2.94Å; D352-D355 PolarHBondContact O-N 3.27Å; D355-K375 VanDerWaalsContact CG-CE 3.48Å; D355-K375 WeakPolarHBondContact OD1-CD 3.49Å; D355-K375 WeakPolarHBondContact OD1-CE 3.1Å; D355-K375 IonicContact OD1-NZ 3.69Å; D355-K375 PolarHBondContact OD1-NZ 3.38Å; D355-K375 WeakPolarHBondContact OD2-CE 3.14Å; D355-K375 IonicContact OD2-NZ 2.93Å; D355-K375 PolarHBondContact OD2-NZ 3.32Å
356I96.3Very high90.7Very high25 Ų2566.5 Ų66.513%0.12836%0.363CS..EExtended strand (participates in β ladder)trans-102.8130176-53.4-56.6000110.1R333 V334 R335 E374 V390R333-I356 HydrophobicContact CB-CG2 4.17Å; R333-I356 HydrophobicContact CG-CG2 4.29Å; V334-I356 WeakPolarHBondContact O-CA 3.49Å; R335-I356 HydrophobicContact CB-CD1 3.7Å; R335-I356 HydrophobicContact CG-CD1 3.87Å; I356-E374 HydrophobicContact CB-CB 4.28Å; I356-E374 WeakPolarHBondContact O-CB 3.16Å; I356-E374 PolarHBondContact O-N 3.48Å; I356-V390 HydrophobicContact CD1-CG2 4.03Å
357I95.8Very high90.9Very high0 Ų062.4 Ų62.40%034%0.339CS..EExtended strand (participates in β ladder)trans-119.6130.2177.4-56.5167.5000108.7R333 V334 T336 L349 F351 F382R333-I357 WeakPolarHBondContact CA-O 3.37Å; V334-I357 HydrophobicContact CG2-CB 3.86Å; V334-I357 PolarHBondContact N-O 2.68Å; V334-I357 PolarHBondContact O-N 3.01Å; T336-I357 HydrophobicContact CG2-CD1 3.61Å; T336-I357 HydrophobicContact CG2-CG1 4.22Å; L349-I357 HydrophobicContact CD2-CD1 3.94Å; L349-I357 HydrophobicContact CD2-CG1 4.21Å; L349-I357 HydrophobicContact CD2-CG2 4.09Å; F351-I357 HydrophobicContact CD1-CD1 3.74Å; F351-I357 HydrophobicContact CE1-CD1 3.92Å; F351-I357 HydrophobicContact CG-CD1 4.22Å; I357-F382 HydrophobicContact CB-CZ 4.23Å; I357-F382 HydrophobicContact CD1-CD1 4.27Å; I357-F382 HydrophobicContact CD1-CD2 4.12Å; I357-F382 HydrophobicContact CD1-CE1 4.13Å; I357-F382 HydrophobicContact CD1-CE2 3.95Å; I357-F382 HydrophobicContact CD1-CG 4.27Å; I357-F382 HydrophobicContact CD1-CZ 3.95Å; I357-F382 HydrophobicContact CG2-CD1 4.49Å; I357-F382 HydrophobicContact CG2-CE1 3.6Å; I357-F382 HydrophobicContact CG2-CZ 3.7Å
358I95.6Very high91.1Very high39 Ų3963.4 Ų63.420%0.233%0.334CS..EExtended strand (participates in β ladder)trans-89.1120.8173.7-57.6169.8000107.6R331 R333 L360 G371 E372R331-I358 HydrophobicContact CB-CG2 3.44Å; R331-I358 VanDerWaalsContact CB-CG2 3.44Å; R331-I358 HydrophobicContact CG-CG2 4.29Å; R333-I358 HydrophobicContact CG-CG1 3.99Å; I358-L360 PolarHBondContact O-N 2.85Å; I358-G371 CarbonylContact O-C 3.52Å; I358-G371 WeakPolarHBondContact O-CA 3.28Å; I358-E372 PolarHBondContact N-O 3.23Å; I358-E372 PolarHBondContact O-N 3.39Å
359L94.4Very high91.2Very high12 Ų1262.2 Ų62.26%0.06333%0.328CS..EExtended strand (participates in β ladder)trans-71.6125.4178.9-62.8-174.5000110.4P332 V334 M369 F382P332-L359 HydrophobicContact CB-CB 4.33Å; P332-L359 HydrophobicContact CB-CD1 4.13Å; P332-L359 HydrophobicContact CB-CG 4.48Å; P332-L359 WeakPolarHBondContact O-CB 3.41Å; P332-L359 PolarHBondContact O-N 2.84Å; V334-L359 HydrophobicContact CG1-CD1 3.92Å; V334-L359 HydrophobicContact CG1-CD2 4.27Å; V334-L359 HydrophobicContact CG1-CG 4.11Å; V334-L359 HydrophobicContact CG2-CD2 4.12Å; L359-M369 HydrophobicContact CD1-SD 4.09Å; L359-M369 HydrophobicContact CD2-CB 4.18Å; L359-M369 HydrophobicContact CD2-CE 4.5Å; L359-M369 HydrophobicContact CD2-SD 3.98Å; L359-F382 HydrophobicContact CD2-CE1 4.34Å; L359-F382 HydrophobicContact CD2-CZ 3.69Å
360L90.9Very high91.2Very high52 Ų5265.4 Ų65.427%0.27234%0.34SS..SBendtrans-91.5-29.1171.9-64.2-178.8000110.9I358 Y370 E372 R379I358-L360 PolarHBondContact O-N 2.85Å; L360-Y370 HydrophobicContact CB-CD1 3.97Å; L360-Y370 HydrophobicContact CB-CE1 4.42Å; L360-Y370 HydrophobicContact CD1-CD1 4.12Å; L360-Y370 HydrophobicContact CD1-CE1 3.79Å; L360-Y370 PolarHBondContact N-O 2.97Å; L360-E372 HydrophobicContact CD1-CB 4.22Å; L360-E372 HydrophobicContact CD2-CB 4.48Å; L360-E372 HydrophobicContact CG-CB 4.31Å; L360-R379 HydrophobicContact CD1-CG 4.11Å
361I89.4Confident91.3Very high62 Ų6262.9 Ų62.932%0.31832%0.323SS..SBendtrans-116.7114.3169.6-57.6179.9000107.1D363 Y370 W381I361-D363 VanDerWaalsContact C-N 3.32Å; I361-D363 PolarHBondContact O-N 2.81Å; I361-Y370 HydrophobicContact CD1-CD1 4.28Å; I361-Y370 HydrophobicContact CD1-CG 4.35Å; I361-Y370 HydrophobicContact CG1-CD1 4.33Å; I361-Y370 PolarHBondContact N-O 3.03Å; I361-W381 HydrophobicContact CD1-CH2 4.03Å; I361-W381 HydrophobicContact CD1-CZ2 4.44Å
362P79Confident91.3Very high86 Ų8664.7 Ų64.756%0.55833%0.331SS*.  trans-68.3-29.6-177.2-20.432.2000114
363D79.9Confident91.3Very high107 Ų10760 Ų6057%0.57231%0.306SS*.SBendtrans-91132.3-175.4-61-38.7000111.6I361I361-D363 VanDerWaalsContact C-N 3.32Å; I361-D363 PolarHBondContact O-N 2.81Å
364E85.1Confident91.2Very high106 Ų10658 Ų5850%0.49530%0.297SS..  trans-69.1135.6171.7-175177.9170.100111.1G367 S384E364-G367 WeakPolarHBondContact OE1-CA 3.21Å; E364-S384 VanDerWaalsContact CD-CB 3.42Å; E364-S384 VanDerWaalsContact OE1-CB 3.29Å; E364-S384 WeakPolarHBondContact OE1-CB 2.85Å; E364-S384 PolarHBondContact OE1-OG 3.3Å
365R84.5Confident91.1Very high160 Ų16061.8 Ų61.860%0.60430%0.302SS*.BIsolated β-bridgetrans-122.4112.1175.3-65-68.3-172.8-177.9-2108.6G367 W368R365-G367 VanDerWaalsContact C-N 3.29Å; R365-G367 PolarHBondContact O-N 3.04Å; R365-W368 PolarHBondContact N-O 2.61Å; R365-W368 WeakPolarHBondContact O-CB 3.15Å; R365-W368 PolarHBondContact O-N 2.71Å
366D87.1Confident90.8Very high161 Ų16164.5 Ų64.586%0.86132%0.317SS*.THydrogen-bonded Turntrans52.838.4174.3-54.8-30.9000115.1W368D366-W368 VanDerWaalsContact O-CD1 3.32Å
367G89.5Confident90.5Very high27 Ų2764.9 Ų64.928%0.27833%0.327SS..THydrogen-bonded Turntrans87.50.6-178.200000114.7E364 R365 P383 S384E364-G367 WeakPolarHBondContact OE1-CA 3.21Å; R365-G367 VanDerWaalsContact C-N 3.29Å; R365-G367 PolarHBondContact O-N 3.04Å; G367-P383 CarbonylContact O-C 3.6Å; G367-P383 WeakPolarHBondContact O-CA 3.3Å; G367-S384 PolarHBondContact O-N 2.68Å; G367-S384 PolarHBondContact O-OG 3.2Å
368W94.4Very high90.4Very high96 Ų9671.3 Ų71.336%0.36436%0.355SS..EExtended strand (participates in β ladder)trans-117.6144.7-177.5-64.485.3000112.3L348 R365 D366 W381 F382 P383L348-W368 HydrophobicContact CD2-CE3 4.32Å; L348-W368 HydrophobicContact CD2-CH2 4.03Å; L348-W368 HydrophobicContact CD2-CZ3 3.6Å; R365-W368 PolarHBondContact N-O 2.61Å; R365-W368 WeakPolarHBondContact O-CB 3.15Å; R365-W368 PolarHBondContact O-N 2.71Å; D366-W368 VanDerWaalsContact O-CD1 3.32Å; W368-W381 HydrophobicContact CB-CE3 3.89Å; W368-W381 HydrophobicContact CB-CZ3 4.37Å; W368-W381 HydrophobicContact CE3-CB 4.01Å; W368-F382 WeakPolarHBondContact CA-O 3.33Å; W368-P383 HydrophobicContact CE3-CG 4.38Å; W368-P383 HydrophobicContact CH2-CG 4.09Å; W368-P383 HydrophobicContact CZ3-CG 3.92Å
369M94.9Very high90.3Very high19 Ų1976.1 Ų76.19%0.09437%0.37CS..EExtended strand (participates in β ladder)trans-121.3150.2172.6-64.4-166.4-71.700110V334 L359 W381 F382 C387V334-M369 HydrophobicContact CG1-CE 4.39Å; V334-M369 HydrophobicContact CG2-CE 4.42Å; L359-M369 HydrophobicContact CD1-SD 4.09Å; L359-M369 HydrophobicContact CD2-CB 4.18Å; L359-M369 HydrophobicContact CD2-CE 4.5Å; L359-M369 HydrophobicContact CD2-SD 3.98Å; M369-W381 CarbonylContact O-C 3.57Å; M369-W381 WeakPolarHBondContact O-CA 3.14Å; M369-F382 HydrophobicContact CB-CD2 4.44Å; M369-F382 HydrophobicContact CB-CE1 4.01Å; M369-F382 HydrophobicContact CB-CE2 3.92Å; M369-F382 HydrophobicContact CB-CZ 3.68Å; M369-F382 HydrophobicContact CE-CD2 4.31Å; M369-F382 HydrophobicContact CE-CE2 3.4Å; M369-F382 VanDerWaalsContact CE-CE2 3.4Å; M369-F382 HydrophobicContact CE-CZ 3.94Å; M369-F382 PolarHBondContact N-O 3.32Å; M369-F382 VanDerWaalsContact O-CD1 3.31Å; M369-F382 WeakPolarHBondContact O-CD1 3.44Å; M369-F382 PolarHBondContact O-N 2.98Å; M369-C387 HydrophobicContact CE-CB 3.92Å
370Y94.6Very high90.3Very high69 Ų6975.6 Ų75.627%0.27137%0.368SS..EExtended strand (participates in β ladder)trans-114.4124.9175.7-169.1-104.6000110.4L360 I361 G380 W381L360-Y370 HydrophobicContact CB-CD1 3.97Å; L360-Y370 HydrophobicContact CB-CE1 4.42Å; L360-Y370 HydrophobicContact CD1-CD1 4.12Å; L360-Y370 HydrophobicContact CD1-CE1 3.79Å; L360-Y370 PolarHBondContact N-O 2.97Å; I361-Y370 HydrophobicContact CD1-CD1 4.28Å; I361-Y370 HydrophobicContact CD1-CG 4.35Å; I361-Y370 HydrophobicContact CG1-CD1 4.33Å; I361-Y370 PolarHBondContact N-O 3.03Å; Y370-G380 VanDerWaalsContact CD2-C 3.41Å; Y370-G380 WeakPolarHBondContact CD2-O 3.42Å; Y370-W381 AromaticContact CD2-CD1 3.73Å; Y370-W381 AromaticContact CD2-CD2 3.69Å; Y370-W381 HydrophobicContact CD2-CD2 3.69Å; Y370-W381 AromaticContact CD2-CE2 3.62Å; Y370-W381 HydrophobicContact CD2-CE3 4.35Å; Y370-W381 AromaticContact CD2-CG 3.77Å; Y370-W381 HydrophobicContact CD2-CG 3.77Å; Y370-W381 HydrophobicContact CD2-CZ2 4.23Å; Y370-W381 AromaticContact CD2-NE1 3.62Å; Y370-W381 HydrophobicContact CE2-CG 4.47Å; Y370-W381 AromaticContact CE2-NE1 3.98Å; Y370-W381 HydrophobicContact CG-CD2 4.28Å; Y370-W381 HydrophobicContact CG-CZ2 4.36Å
371G95.1Very high90.6Very high0 Ų077 Ų770%037%0.369CS..EExtended strand (participates in β ladder)trans-154.5174.4-173.100000113.9I358 R379 G380I358-G371 CarbonylContact O-C 3.52Å; I358-G371 WeakPolarHBondContact O-CA 3.28Å; G371-R379 WeakPolarHBondContact O-CA 3.44Å; G371-G380 PolarHBondContact N-O 3.29Å; G371-G380 PolarHBondContact O-N 3.16Å
372E95.6Very high90.9Very high44 Ų4474 Ų7421%0.20635%0.354CS..EExtended strand (participates in β ladder)trans-117.4126.6178.3-174.5175.6148.200109.2I358 L360 K378 R379I358-E372 PolarHBondContact N-O 3.23Å; I358-E372 PolarHBondContact O-N 3.39Å; L360-E372 HydrophobicContact CD1-CB 4.22Å; L360-E372 HydrophobicContact CD2-CB 4.48Å; L360-E372 HydrophobicContact CG-CB 4.31Å; E372-K378 WeakPolarHBondContact CA-O 3.38Å; E372-R379 HydrophobicContact CB-CG 3.88Å; E372-R379 HydrophobicContact CG-CG 3.81Å; E372-R379 IonicContact OE2-CZ 3.7Å; E372-R379 IonicContact OE2-NE 2.81Å; E372-R379 PolarHBondContact OE2-NE 3.41Å; E372-R379 IonicContact OE2-NH2 3.63Å; E372-R379 PolarHBondContact OE2-NH2 3.24Å
373M93.7Very high91.7Very high2 Ų270.8 Ų70.81%0.0133%0.333CS..EExtended strand (participates in β ladder)trans-74.1131.3178.2-168-167.4-40.500110.8L349 S350 F351 K375 N376 G377 K378L349-M373 HydrophobicContact CD1-CB 4.3Å; L349-M373 HydrophobicContact CD1-CE 3.72Å; L349-M373 HydrophobicContact CD2-CB 4.37Å; L349-M373 HydrophobicContact CG-CE 4.19Å; S350-M373 WeakPolarHBondContact O-CE 3.49Å; F351-M373 HydrophobicContact CB-CE 4.37Å; M373-K375 HydrophobicContact CG-CG 3.93Å; M373-K375 PolarHBondContact O-N 2.83Å; M373-K375 HydrophobicContact SD-CD 3.94Å; M373-K375 WeakPolarHBondContact SD-CE 3.44Å; M373-K375 HydrophobicContact SD-CG 3.48Å; M373-K375 WeakPolarHBondContact SD-CG 3.31Å; M373-N376 WeakPolarHBondContact CB-OD1 3.39Å; M373-N376 WeakPolarHBondContact CE-ND2 3.33Å; M373-N376 WeakPolarHBondContact CE-OD1 3.44Å; M373-N376 PolarHBondContact SD-ND2 3.13Å; M373-N376 PolarHBondContact SD-OD1 2.83Å; M373-G377 VanDerWaalsContact O-CA 3.27Å; M373-G377 WeakPolarHBondContact O-CA 3.45Å; M373-G377 PolarHBondContact O-N 3.28Å; M373-K378 HydrophobicContact CE-CB 4.42Å; M373-K378 PolarHBondContact N-O 3.1Å
374E92.5Very high92.3Very high90 Ų9066.7 Ų66.742%0.42131%0.313SS..THydrogen-bonded Turntrans-68.4-34.8-172.6-174.1167.4-100.900113.4R333 I356R333-E374 IonicContact CZ-OE1 2.61Å; R333-E374 IonicContact CZ-OE2 3.59Å; R333-E374 IonicContact NE-OE1 2.83Å; R333-E374 PolarHBondContact NE-OE1 3.44Å; R333-E374 IonicContact NH2-OE1 3.16Å; R333-E374 PolarHBondContact NH2-OE1 2.89Å; R333-E374 IonicContact NH2-OE2 3.64Å; R333-E374 PolarHBondContact NH2-OE2 2.62Å; I356-E374 HydrophobicContact CB-CB 4.28Å; I356-E374 WeakPolarHBondContact O-CB 3.16Å; I356-E374 PolarHBondContact O-N 3.48Å
375K90.3Very high92.8Very high120 Ų12065.5 Ų65.552%0.52232%0.316SS..THydrogen-bonded Turntrans-74.1-29.4-175.665.2179179-170.20114.5D352 D355 M373D352-K375 IonicContact OD2-NZ 2.68Å; D355-K375 VanDerWaalsContact CG-CE 3.48Å; D355-K375 WeakPolarHBondContact OD1-CD 3.49Å; D355-K375 WeakPolarHBondContact OD1-CE 3.1Å; D355-K375 IonicContact OD1-NZ 3.69Å; D355-K375 PolarHBondContact OD1-NZ 3.38Å; D355-K375 WeakPolarHBondContact OD2-CE 3.14Å; D355-K375 IonicContact OD2-NZ 2.93Å; D355-K375 PolarHBondContact OD2-NZ 3.32Å; M373-K375 HydrophobicContact CG-CG 3.93Å; M373-K375 PolarHBondContact O-N 2.83Å; M373-K375 HydrophobicContact SD-CD 3.94Å; M373-K375 WeakPolarHBondContact SD-CE 3.44Å; M373-K375 HydrophobicContact SD-CG 3.48Å; M373-K375 WeakPolarHBondContact SD-CG 3.31Å
376N89.3Confident93.3Very high77 Ų7761.7 Ų61.741%0.41230%0.303SS..THydrogen-bonded Turntrans-136.40.7-17266.820.1000114.7M373 K378M373-N376 WeakPolarHBondContact CB-OD1 3.39Å; M373-N376 WeakPolarHBondContact CE-ND2 3.33Å; M373-N376 WeakPolarHBondContact CE-OD1 3.44Å; M373-N376 PolarHBondContact SD-ND2 3.13Å; M373-N376 PolarHBondContact SD-OD1 2.83Å; N376-K378 PolarHBondContact O-N 3.39Å; N376-K378 VanDerWaalsContact O-N 3.11Å; N376-K378 VanDerWaalsContact OD1-CB 3.3Å; N376-K378 WeakPolarHBondContact OD1-CB 3.47Å; N376-K378 WeakPolarHBondContact OD1-CG 3.18Å; N376-K378 PolarHBondContact OD1-N 2.99Å
377G89.8Confident93.6Very high33 Ų3354.9 Ų54.934%0.3427%0.268SS..  trans66.77.3178.200000115M373M373-G377 VanDerWaalsContact O-CA 3.27Å; M373-G377 WeakPolarHBondContact O-CA 3.45Å; M373-G377 PolarHBondContact O-N 3.28Å
378K92.1Very high93.8Very high136 Ų13661.7 Ų61.759%0.59129%0.285SS*.  trans-67.6138.6177.7-70.1-174.2178-176.50109.7L349 E372 M373 N376L349-K378 HydrophobicContact CD1-CB 3.79Å; L349-K378 VanDerWaalsContact CD1-O 3.24Å; L349-K378 WeakPolarHBondContact CD1-O 3.34Å; E372-K378 WeakPolarHBondContact CA-O 3.38Å; M373-K378 HydrophobicContact CE-CB 4.42Å; M373-K378 PolarHBondContact N-O 3.1Å; N376-K378 PolarHBondContact O-N 3.39Å; N376-K378 VanDerWaalsContact O-N 3.11Å; N376-K378 VanDerWaalsContact OD1-CB 3.3Å; N376-K378 WeakPolarHBondContact OD1-CB 3.47Å; N376-K378 WeakPolarHBondContact OD1-CG 3.18Å; N376-K378 PolarHBondContact OD1-N 2.99Å
379R94.9Very high93.5Very high139 Ų13960.6 Ų60.653%0.52530%0.296SS..EExtended strand (participates in β ladder)trans-114.2147.4-179.6-63.9178.1177.9162.84.4110.3L360 G371 E372L360-R379 HydrophobicContact CD1-CG 4.11Å; G371-R379 WeakPolarHBondContact O-CA 3.44Å; E372-R379 HydrophobicContact CB-CG 3.88Å; E372-R379 HydrophobicContact CG-CG 3.81Å; E372-R379 IonicContact OE2-CZ 3.7Å; E372-R379 IonicContact OE2-NE 2.81Å; E372-R379 PolarHBondContact OE2-NE 3.41Å; E372-R379 IonicContact OE2-NH2 3.63Å; E372-R379 PolarHBondContact OE2-NH2 3.24Å
380G94.8Very high93.2Very high1 Ų161.5 Ų61.51%0.0130%0.302CS..EExtended strand (participates in β ladder)trans171.4173.8176.500000112.2T347 Y370 G371T347-G380 CarbonylContact O-C 3.41Å; T347-G380 WeakPolarHBondContact O-CA 3.49Å; Y370-G380 VanDerWaalsContact CD2-C 3.41Å; Y370-G380 WeakPolarHBondContact CD2-O 3.42Å; G371-G380 PolarHBondContact N-O 3.29Å; G371-G380 PolarHBondContact O-N 3.16Å
381W95.6Very high91.9Very high81 Ų8165.1 Ų65.131%0.30733%0.327SS..EExtended strand (participates in β ladder)trans-79.9143.5172.3-6797.6000111T347 L348 L349 I361 W368 M369 Y370T347-W381 PolarHBondContact O-N 2.74Å; L348-W381 CarbonylContact C-O 3.58Å; L348-W381 WeakPolarHBondContact CA-O 3.44Å; L348-W381 HydrophobicContact CD2-CB 3.93Å; L349-W381 PolarHBondContact N-O 2.81Å; I361-W381 HydrophobicContact CD1-CH2 4.03Å; I361-W381 HydrophobicContact CD1-CZ2 4.44Å; W368-W381 HydrophobicContact CB-CE3 3.89Å; W368-W381 HydrophobicContact CB-CZ3 4.37Å; W368-W381 HydrophobicContact CE3-CB 4.01Å; M369-W381 CarbonylContact O-C 3.57Å; M369-W381 WeakPolarHBondContact O-CA 3.14Å; Y370-W381 AromaticContact CD2-CD1 3.73Å; Y370-W381 AromaticContact CD2-CD2 3.69Å; Y370-W381 HydrophobicContact CD2-CD2 3.69Å; Y370-W381 AromaticContact CD2-CE2 3.62Å; Y370-W381 HydrophobicContact CD2-CE3 4.35Å; Y370-W381 AromaticContact CD2-CG 3.77Å; Y370-W381 HydrophobicContact CD2-CG 3.77Å; Y370-W381 HydrophobicContact CD2-CZ2 4.23Å; Y370-W381 AromaticContact CD2-NE1 3.62Å; Y370-W381 HydrophobicContact CE2-CG 4.47Å; Y370-W381 AromaticContact CE2-NE1 3.98Å; Y370-W381 HydrophobicContact CG-CD2 4.28Å; Y370-W381 HydrophobicContact CG-CZ2 4.36Å
382F95.4Very high89.6Confident0 Ų070 Ų700%035%0.349CS..EExtended strand (participates in β ladder)trans-147.6154.717460.8-82.1000111.8V334 L349 F351 I357 L359 W368 M369 C387V334-F382 HydrophobicContact CG2-CE2 4.08Å; V334-F382 HydrophobicContact CG2-CZ 4Å; L349-F382 HydrophobicContact CB-CB 4.42Å; L349-F382 HydrophobicContact CB-CD1 4.44Å; L349-F382 HydrophobicContact CD2-CD1 4.01Å; L349-F382 HydrophobicContact CD2-CE1 4.42Å; F351-F382 HydrophobicContact CE1-CB 3.44Å; F351-F382 VanDerWaalsContact CE1-CB 3.44Å; F351-F382 HydrophobicContact CE1-CD2 4.14Å; F351-F382 AromaticContact CE1-CG 3.91Å; F351-F382 HydrophobicContact CE1-CG 3.91Å; F351-F382 HydrophobicContact CZ-CB 4.01Å; F351-F382 HydrophobicContact CZ-CD2 4.27Å; F351-F382 HydrophobicContact CZ-CG 4.44Å; I357-F382 HydrophobicContact CB-CZ 4.23Å; I357-F382 HydrophobicContact CD1-CD1 4.27Å; I357-F382 HydrophobicContact CD1-CD2 4.12Å; I357-F382 HydrophobicContact CD1-CE1 4.13Å; I357-F382 HydrophobicContact CD1-CE2 3.95Å; I357-F382 HydrophobicContact CD1-CG 4.27Å; I357-F382 HydrophobicContact CD1-CZ 3.95Å; I357-F382 HydrophobicContact CG2-CD1 4.49Å; I357-F382 HydrophobicContact CG2-CE1 3.6Å; I357-F382 HydrophobicContact CG2-CZ 3.7Å; L359-F382 HydrophobicContact CD2-CE1 4.34Å; L359-F382 HydrophobicContact CD2-CZ 3.69Å; W368-F382 WeakPolarHBondContact CA-O 3.33Å; M369-F382 HydrophobicContact CB-CD2 4.44Å; M369-F382 HydrophobicContact CB-CE1 4.01Å; M369-F382 HydrophobicContact CB-CE2 3.92Å; M369-F382 HydrophobicContact CB-CZ 3.68Å; M369-F382 HydrophobicContact CE-CD2 4.31Å; M369-F382 HydrophobicContact CE-CE2 3.4Å; M369-F382 VanDerWaalsContact CE-CE2 3.4Å; M369-F382 HydrophobicContact CE-CZ 3.94Å; M369-F382 PolarHBondContact N-O 3.32Å; M369-F382 VanDerWaalsContact O-CD1 3.31Å; M369-F382 WeakPolarHBondContact O-CD1 3.44Å; M369-F382 PolarHBondContact O-N 2.98Å; F382-C387 HydrophobicContact CE2-CB 4.22Å; F382-C387 WeakPolarHBondContact CE2-SG 3.24Å
383P95.8Very high86.9Confident18 Ų1875.9 Ų75.912%0.11738%0.377CS..EExtended strand (participates in β ladder)trans-74.9135.1-176.3-116.3000110.7G367 W368 S385 Y386G367-P383 CarbonylContact O-C 3.6Å; G367-P383 WeakPolarHBondContact O-CA 3.3Å; W368-P383 HydrophobicContact CE3-CG 4.38Å; W368-P383 HydrophobicContact CH2-CG 4.09Å; W368-P383 HydrophobicContact CZ3-CG 3.92Å; P383-S385 VanDerWaalsContact C-N 3.26Å; P383-S385 PolarHBondContact O-N 2.87Å; P383-Y386 HydrophobicContact CB-CD1 3.66Å; P383-Y386 HydrophobicContact CB-CE1 4.02Å; P383-Y386 HydrophobicContact CG-CD1 3.65Å; P383-Y386 HydrophobicContact CG-CE1 3.83Å; P383-Y386 PolarHBondContact O-N 2.86Å
384S94.2Very high84.1Confident22 Ų2283.9 Ų83.915%0.15442%0.419CS..G310 helixtrans-60.8-35.9-175.963.10000112.6E364 G367 Y386 C387E364-S384 VanDerWaalsContact CD-CB 3.42Å; E364-S384 VanDerWaalsContact OE1-CB 3.29Å; E364-S384 WeakPolarHBondContact OE1-CB 2.85Å; E364-S384 PolarHBondContact OE1-OG 3.3Å; G367-S384 PolarHBondContact O-N 2.68Å; G367-S384 PolarHBondContact O-OG 3.2Å; S384-Y386 PolarHBondContact O-N 3.41Å; S384-Y386 VanDerWaalsContact O-N 3.11Å; S384-C387 PolarHBondContact O-N 3.21Å; S384-C387 VanDerWaalsContact O-N 3.07Å
385S94.1Very high81.4Confident80 Ų8085.2 Ų85.256%0.55943%0.433SS*.G310 helixtrans-63.6-15.1-179.362.20000114.4P383 C387P383-S385 VanDerWaalsContact C-N 3.26Å; P383-S385 PolarHBondContact O-N 2.87Å; S385-C387 VanDerWaalsContact C-N 3.29Å
386Y95.4Very high78.5Confident81 Ų8187.2 Ų87.232%0.31845%0.449SS..G310 helixtrans-871.2177.5-74.472.4000112.6T336 I337 F338 P339 H340 P383 S384T336-Y386 CarbonylContact C-O 3.58Å; T336-Y386 VanDerWaalsContact CA-O 3.31Å; T336-Y386 WeakPolarHBondContact CA-O 3.48Å; I337-Y386 VanDerWaalsContact CG1-O 3.27Å; I337-Y386 WeakPolarHBondContact CG1-O 3.44Å; I337-Y386 PolarHBondContact N-O 3.24Å; F338-Y386 HydrophobicContact CB-CD2 3.4Å; F338-Y386 HydrophobicContact CB-CE2 3.76Å; F338-Y386 HydrophobicContact CB-CG 4.31Å; F338-Y386 HydrophobicContact CG-CD2 4.42Å; P339-Y386 WeakPolarHBondContact O-CE2 3.46Å; H340-Y386 HydrophobicContact CB-CD2 4.47Å; P383-Y386 HydrophobicContact CB-CD1 3.66Å; P383-Y386 HydrophobicContact CB-CE1 4.02Å; P383-Y386 HydrophobicContact CG-CD1 3.65Å; P383-Y386 HydrophobicContact CG-CE1 3.83Å; P383-Y386 PolarHBondContact O-N 2.86Å; S384-Y386 PolarHBondContact O-N 3.41Å; S384-Y386 VanDerWaalsContact O-N 3.11Å
387C93.7Very high76Confident18 Ų1889.8 Ų89.812%0.12246%0.463CS..EExtended strand (participates in β ladder)trans-136155-170.1-67.10000113.2V334 R335 M369 F382 S384 S385V334-C387 HydrophobicContact CB-CB 3.98Å; V334-C387 HydrophobicContact CG2-CB 3.89Å; R335-C387 CarbonylContact O-C 3.58Å; R335-C387 VanDerWaalsContact O-CA 3.31Å; R335-C387 WeakPolarHBondContact O-CA 3.45Å; M369-C387 HydrophobicContact CE-CB 3.92Å; F382-C387 HydrophobicContact CE2-CB 4.22Å; F382-C387 WeakPolarHBondContact CE2-SG 3.24Å; S384-C387 PolarHBondContact O-N 3.21Å; S384-C387 VanDerWaalsContact O-N 3.07Å; S385-C387 VanDerWaalsContact C-N 3.29Å
388R93.1Very high73.3Confident170 Ų17095.4 Ų95.464%0.64249%0.485SS*.EExtended strand (participates in β ladder)trans-129.8139.8173.5-172.3178.7-67.1148.31.5110.1V334 R335 I337 V390V334-R388 CarbonylContact C-O 3.5Å; V334-R388 WeakPolarHBondContact CA-O 3.25Å; R335-R388 PolarHBondContact N-O 3.3Å; R335-R388 PolarHBondContact O-N 3.02Å; I337-R388 HydrophobicContact CG2-CB 4.14Å; R388-V390 PolarHBondContact O-N 3.31Å
389A89.6Confident70.4Confident73 Ų7393.8 Ų93.860%0.60349%0.491SS*.EExtended strand (participates in β ladder)trans-57.6135.1177.500000111.9N391A389-N391 PolarHBondContact O-N 3.36Å
390V87.1Confident67.3Low37 Ų3795.4 Ų95.422%0.22450%0.504CS..  trans-86.9100.2174.4-178.90000108.1R333 R335 I356 R388 E392R333-V390 HydrophobicContact CB-CB 4.15Å; R333-V390 HydrophobicContact CB-CG2 4.33Å; R333-V390 PolarHBondContact O-N 3.33Å; R335-V390 HydrophobicContact CB-CG2 3.75Å; I356-V390 HydrophobicContact CD1-CG2 4.03Å; R388-V390 PolarHBondContact O-N 3.31Å; V390-E392 PolarHBondContact O-N 3.11Å
391N68.3Low64.3Low146 Ų146101.2 Ų101.278%0.78154%0.54SS*.  trans-77.3113.4165.6-79.4-11.3000108.5A389 Q393A389-N391 PolarHBondContact O-N 3.36Å; N391-Q393 PolarHBondContact O-N 3.46Å
392E47Very low61.2Low101 Ų101104.1 Ų104.147%0.47257%0.567SS.*  trans-79.188178.1-156.3161.8-138.200109.6R330 R333 V390 L394R330-E392 WeakPolarHBondContact CD-OE2 3.48Å; R330-E392 IonicContact CZ-OE1 2.73Å; R330-E392 IonicContact CZ-OE2 2.71Å; R330-E392 IonicContact NE-OE2 3.04Å; R330-E392 PolarHBondContact NE-OE2 2.73Å; R330-E392 IonicContact NH1-OE1 2.75Å; R330-E392 PolarHBondContact NH1-OE1 3.18Å; R330-E392 IonicContact NH1-OE2 3.08Å; R330-E392 PolarHBondContact NH1-OE2 2.75Å; R333-E392 IonicContact NH1-OE1 2.75Å; V390-E392 PolarHBondContact O-N 3.11Å; E392-L394 PolarHBondContact O-N 3.41Å
393Q38Very low58Low169 Ų169107.6 Ų107.679%0.7960%0.596SS**  trans-74.5112.3158.8-74.4-174.9-31.500107.3N391 V395N391-Q393 PolarHBondContact O-N 3.46Å; Q393-V395 VanDerWaalsContact O-CG2 3.31Å; Q393-V395 WeakPolarHBondContact O-CG2 3.46Å; Q393-V395 PolarHBondContact O-N 2.93Å
394L36.1Very low54.7Low170 Ų170114.5 Ų114.589%0.8963%0.626SS**  trans-59.1101.9168.5-88.4148.3000108.7E392E392-L394 PolarHBondContact O-N 3.41Å
395V34.8Very low51.5Low117 Ų117122 Ų12271%0.70966%0.658SS**PPolyproline II helixtrans-82.1118177.6-161.50000108.4Q393Q393-V395 VanDerWaalsContact O-CG2 3.31Å; Q393-V395 WeakPolarHBondContact O-CG2 3.46Å; Q393-V395 PolarHBondContact O-N 2.93Å
396N29Very low48.7Very low163 Ų163129.1 Ų129.187%0.87267%0.673SS**PPolyproline II helixtrans-98.2119.1155.9-147.554000106.4
397N37Very low45.5Very low130 Ų130130.5 Ų130.570%0.69570%0.695SS**PPolyproline II helixtrans-68.5130.6-175.3-72.9-21000112
398N32.6Very low42.4Very low152 Ų152141.4 Ų141.481%0.81373%0.733SS**  175.9135.5129.1-88.9-9000111.6
399S32.5Very low39.3Very low102 Ų102138.1 Ų138.171%0.71374%0.736SS**  trans51.4123.8148.7-36.60000121.8
400E30.1Very low36.6Very low172 Ų172141.4 Ų141.480%0.80475%0.749SS**  trans50119139.3-67.9-176162.600121.8
401T31.8Very low33.8Very low124 Ų124146.2 Ų146.276%0.76178%0.777SS**  trans70.1147.6140.763.50000120.8
402T29.3Very low31.9Very low142 Ų142146.6 Ų146.687%0.87178%0.779SS**  trans88.8134.7162.3640000119.5
403A28.7Very low31Very low73 Ų73149.8 Ų149.860%0.60380%0.799SS**  trans-85.6172.5-176.400000113
404H27.4Very low30.8Very low162 Ų162148.7 Ų148.775%0.7579%0.793SS**  trans84.4136.9165.8-49.1-65.1000115.1
405H26.7Very low30.6Very low179 Ų179149.3 Ų149.383%0.82979%0.791SS**  -159.9154.751.5-94.4-73.8000115.3
406R34.8Very low30.3Very low230 Ų230151 Ų15187%0.86879%0.792SS**  trans-57.1157.3155.8-67.5175171.8161.4-3.6112.7
407S29Very low30.5Very low111 Ų111150.1 Ų150.178%0.77679%0.787SS**  165.3147.8117.7-79.90000110.5
408R26.8Very low30.2Very low247 Ų247150.5 Ų150.593%0.93279%0.794SS**  -150.614371.8-77.316972.3162.81.9113.9
409S29.2Very low30.7Very low101 Ų101152 Ų15271%0.70680%0.796SS**  trans-91.8155.1170.5156.10000110.9
410V32.8Very low31.3Very low142 Ų142153.6 Ų153.686%0.86180%0.802SS**  trans-147.4119.6134.7-81.70000108.6
411V27.1Very low31.5Very low137 Ų137152.6 Ų152.683%0.8380%0.802SS**  -172.7126.9120.2172.50000106.7
412N29.1Very low31.8Very low154 Ų154156.8 Ų156.882%0.82481%0.813SS**  trans-96.3127.3-178.1-148.120.3000108
413L27.3Very low32.4Very low169 Ų169153.3 Ų153.389%0.88580%0.799SS**  trans-141.3126153.1-164.566.4000109
414H33.8Very low33Very low145 Ų145155.4 Ų155.467%0.67180%0.804SS**  trans-87.7122.7-170.3-168.987.9000109.5
415H31.8Very low33.6Very low183 Ų183155.6 Ų155.685%0.84781%0.807SS**  trans-153.596.5151.5-93.1-28.9000111.2
416Q29.3Very low34.4Very low154 Ų154152.8 Ų152.872%0.7280%0.803SS**  trans14.5121.9131.6-150.9149.725.700119.3
417D33.3Very low34.9Very low144 Ų144144.6 Ų144.677%0.7778%0.776SS**  trans5.9126.3155-58.1-38000119.6
418T30.4Very low35.8Very low137 Ų137142.8 Ų142.884%0.8476%0.762SS**  -155.7107.9129.913.40000108.9T420T418-T420 PolarHBondContact O-N 2.91Å
419E44.4Very low36.7Very low185 Ų185136 Ų13686%0.86475%0.749SS**  trans-58.2126.4156-64.1178.7147.900107.9
420T43.8Very low37.8Very low134 Ų134133.8 Ų133.882%0.82273%0.732SS**  trans133.877163.451.70000112.7T418T418-T420 PolarHBondContact O-N 2.91Å
421D33.8Very low38.7Very low152 Ų152131.3 Ų131.381%0.81371%0.714SS**  trans-163.871.7143.8-133.5-3.1000111.6A423D421-A423 VanDerWaalsContact C-N 3.26Å; D421-A423 PolarHBondContact O-N 3.24Å
422E39.5Very low39.8Very low211 Ų211127.2 Ų127.299%0.98668%0.683SS**  trans-89.821.1178.1-144.4-174.4-164.100113
423A40.6Very low40.4Very low70 Ų70128 Ų12858%0.57968%0.676SS**SBendtrans-136.989.5175.700000109.2D421D421-A423 VanDerWaalsContact C-N 3.26Å; D421-A423 PolarHBondContact O-N 3.24Å
424T41.7Very low40.8Very low117 Ų117127.6 Ų127.672%0.71868%0.675SS**  trans155.477.6139.8-53.70000108.7V426T424-V426 HydrophobicContact CG2-CG2 3.58Å; T424-V426 PolarHBondContact O-N 3.34Å
425M39.5Very low41.3Very low165 Ų165126.9 Ų126.981%0.81368%0.675SS**  trans-70.690158.5-79.3-151.8-175.500108.3R121 L427R121-M425 PolarHBondContact NH2-O 3.38Å; M425-L427 PolarHBondContact O-N 3.35Å; M425-L427 VanDerWaalsContact O-N 3.1Å
426V44.4Very low41.5Very low121 Ų121129.2 Ų129.273%0.73368%0.676SS**  trans-58112.9171.9-179.20000107.7T424T424-V426 HydrophobicContact CG2-CG2 3.58Å; T424-V426 PolarHBondContact O-N 3.34Å
427L45.7Very low41.7Very low58 Ų58126.5 Ų126.530%0.30467%0.674SS.*PPolyproline II helixtrans-66.2141.2171.8-72.3173.4000108.6R121 M425R121-L427 VanDerWaalsContact NH1-CG 3.31Å; R121-L427 VanDerWaalsContact NH2-CG 3.28Å; M425-L427 PolarHBondContact O-N 3.35Å; M425-L427 VanDerWaalsContact O-N 3.1Å
428P47Very low41.7Very low73 Ų73129.6 Ų129.647%0.47468%0.681SS.*PPolyproline II helixtrans-57.8140.5162.825.3-30.7000108.8Y114Y114-P428 HydrophobicContact CD2-CG 4.45Å
429P47Very low41.7Very low103 Ų103128.8 Ų128.867%0.66968%0.678SS**PPolyproline II helixtrans-53.4142.9-178.3-24.932.8000112.6D431P429-D431 PolarHBondContact O-N 3.17Å
430T50.8Low41.2Very low56 Ų56127.9 Ų127.934%0.34468%0.678SS.*  trans-71.792172.13.20000109.2Y114 Y432Y114-T430 HydrophobicContact CE2-CG2 4.27Å; T430-Y432 PolarHBondContact O-N 3Å
431D51.7Low40.5Very low90 Ų90126.8 Ų126.848%0.48168%0.676SS.*G310 helixtrans-67.27-179.9-65.2-22.2000114.3P429 Y433P429-D431 PolarHBondContact O-N 3.17Å; D431-Y433 VanDerWaalsContact C-N 3.3Å; D431-Y433 PolarHBondContact O-N 3.35Å
432Y50.6Low40.3Very low50 Ų50126.2 Ų126.220%0.19668%0.678CS.*G310 helixtrans-78.9-5.1-178.1-79-90.7000114.4K107 D111 R190 R191 F194 T430K107-Y432 WeakPolarHBondContact CE-OH 3.33Å; K107-Y432 VanDerWaalsContact NZ-CD1 3.28Å; D111-Y432 PolarHBondContact OD1-OH 3.37Å; R190-Y432 HydrophobicContact CB-CD1 4.07Å; R190-Y432 HydrophobicContact CB-CE1 4.25Å; R191-Y432 WeakPolarHBondContact CG-OH 3.43Å; F194-Y432 HydrophobicContact CB-CE1 4.13Å; T430-Y432 PolarHBondContact O-N 3Å
433Y41.2Very low39.9Very low170 Ų170122.7 Ų122.767%0.66767%0.671SS**G310 helixtrans-91.9-0.5-173.6-80.5-75.9000116.5D431 I435D431-Y433 VanDerWaalsContact C-N 3.3Å; D431-Y433 PolarHBondContact O-N 3.35Å; Y433-I435 VanDerWaalsContact C-N 3.29Å; Y433-I435 PolarHBondContact O-N 3.36Å; Y433-I435 VanDerWaalsContact O-N 3.08Å
434N37.2Very low39.3Very low162 Ų162124.7 Ų124.787%0.86668%0.681SS**  trans-89.452.3-177.9-95.3-43.1000114.2
435I43.9Very low38.7Very low130 Ų130125.2 Ų125.267%0.66768%0.683SS**  trans-136.175.9164.2-49.7178.9000109.6Y433Y433-I435 VanDerWaalsContact C-N 3.29Å; Y433-I435 PolarHBondContact O-N 3.36Å; Y433-I435 VanDerWaalsContact O-N 3.08Å
436R34.8Very low38.1Very low231 Ų231121.2 Ų121.287%0.87268%0.676SS**SBendtrans-165.1125.2139.6-135.3177.5-170-161.70.1113.6
437S33.7Very low37.4Very low97 Ų97121.4 Ų121.468%0.67868%0.678SS**  trans53.6102.9147.455.10000119P439S437-P439 WeakPolarHBondContact O-CD 3.27Å
438K33.3Very low36.5Very low210 Ų210125.7 Ų125.791%0.91370%0.701SS**PPolyproline II helixtrans-68.1122.9148.5-70.7178.8176.4178.20108.8
439P32Very low35.6Very low119 Ų119128.1 Ų128.177%0.77371%0.71SS**PPolyproline II helixtrans-86.5148.714921.5-4.8000109.6S437S437-P439 WeakPolarHBondContact O-CD 3.27Å
440L31.9Very low34.8Very low166 Ų166130.5 Ų130.587%0.86971%0.712SS**PPolyproline II helixtrans-55.7142.9-179.2-164.866.7000112.2
441S30.7Very low33.8Very low112 Ų112135 Ų13578%0.78373%0.729SS**PPolyproline II helixtrans-55134.6177.7-49.90000113.2
442T29.4Very low32.8Very low140 Ų140138.5 Ų138.586%0.85974%0.742SS**  trans-126.7124.3158.346.90000110.3
443V31.8Very low31.8Very low136 Ų136141.5 Ų141.582%0.82477%0.77SS**  trans-60.1135.9178.4174.30000111V445V443-V445 HydrophobicContact CG1-CG2 4.34Å
444S26.5Very low31.9Very low113 Ų113139.1 Ų139.179%0.7978%0.776SS**  trans-88.9125.3170.752.70000111.3
445V29.1Very low31.6Very low128 Ų128137.3 Ų137.378%0.77677%0.771SS**  trans-138.9114.9158.2179.40000110.6V443V443-V445 HydrophobicContact CG1-CG2 4.34Å
446A28.3Very low31.5Very low80 Ų80136.7 Ų136.766%0.66178%0.776SS**  trans42.6122141.100000123.6
447T28.5Very low31.3Very low126 Ų126131.3 Ų131.377%0.77377%0.773SS**  trans43.5118.6130.660.30000121.1
448N27.4Very low31.1Very low147 Ų147131.2 Ų131.279%0.78678%0.778SS**  171.7142.7101.7-114.2-8.8000113.9
449N28.5Very low30.9Very low124 Ų124126.2 Ų126.266%0.66378%0.776SS**  trans47.5128.7145.5-90.94.3000125.4
450H30.6Very low30.9Very low153 Ų153126 Ų12671%0.70878%0.778SS**  trans70.7123.7135-75.4-30.4000123
451Q29.7Very low30.7Very low150 Ų150123.2 Ų123.270%0.70177%0.772SS**  94.2126.2128.8-84.3-177.36.500121.6
452H30.3Very low30.7Very low164 Ų164124.2 Ų124.276%0.75977%0.773SS**  trans70121.6146.1-63.3-61.9000121.5
453S28.9Very low30.8Very low113 Ų113123.2 Ų123.279%0.7977%0.772SS**  trans-59164.1154.8-37.40000111
454P43.3Very low30.9Very low121 Ų121121.5 Ų121.579%0.78677%0.766SS**  -145.5164.869.633.3-11.6000116.3
455T30.6Very low31.1Very low124 Ų124123.5 Ų123.576%0.76177%0.768SS**  trans-62.9163.1160.140.40000111.7
456P42.6Very low31.4Very low117 Ų117125 Ų12576%0.7677%0.766SS**  -134.2146.976.812.212.9000113.4
457S30.4Very low31.4Very low117 Ų117128.6 Ų128.682%0.81878%0.775SS**  50.4140.587.8-59.50000113.5
458A29.3Very low31.5Very low95 Ų95127.1 Ų127.179%0.78578%0.775SS**  cis176.4142.9-7.500000103.2
459A29.8Very low31.8Very low105 Ų105125.3 Ų125.387%0.86878%0.78SS**  trans-178.9116.8147.400000110.5
460S31.2Very low32Very low116 Ų116123.9 Ų123.981%0.81179%0.786SS**  trans-93.6147168.3-38.70000109.2
461S28.3Very low32.1Very low106 Ų106126 Ų12674%0.74180%0.796SS**  trans164.7113.4140.839.70000108.7
462T31.5Very low32.3Very low133 Ų133123.4 Ų123.482%0.81680%0.795SS**  42.9110.184.157.90000114.5
463S30.1Very low32.5Very low119 Ų119123.5 Ų123.583%0.83280%0.801SS**  167.3152.793.759.50000112.7
464S34.1Very low32.6Very low101 Ų101121.6 Ų121.671%0.70680%0.799SS**  trans-44149.8168.1-25.40000115.8
465D30.2Very low32.2Very low154 Ų154123 Ų12382%0.82481%0.806SS**  -178.8163.4108.6-100.3-21.3000114.8
466Q35.2Very low32.4Very low159 Ų159123.1 Ų123.174%0.74381%0.811SS**  trans-76.6148.1-166.5-55164.2-2.200114.3
467N30Very low32.3Very low157 Ų157129 Ų12984%0.8482%0.819SS**  170.4148.4109-101-38.6000115.8
468A30.7Very low33.3Very low95 Ų95128.9 Ų128.979%0.78582%0.815SS**  trans-31.6145.3176.200000121.5
469A32.4Very low34.4Very low108 Ų108130 Ų13089%0.89381%0.814SS**  -164.5144.7121.400000111.6
470A32.2Very low35.4Very low94 Ų94131.2 Ų131.278%0.77781%0.813SS**  trans-83.2154-17000000114.6
471Q33.7Very low36.1Very low198 Ų198130.5 Ų130.593%0.92581%0.814SS**  -173.3152.9121.2-101.5177.921.200112.9
472S34Very low36.8Very low96 Ų96135.2 Ų135.267%0.67182%0.822SS**  trans-90150.9-163.750.40000114.8
473N33.4Very low37.5Very low165 Ų165136.7 Ų136.788%0.88282%0.824SS**  -172.4119.4122.3-98.2-11.2000111.3
474G31.1Very low38.2Very low73 Ų73138.9 Ų138.975%0.75385%0.849SS**  trans-99.9151.6170.500000111.7
475T35.1Very low38.4Very low151 Ų151140.8 Ų140.893%0.92686%0.856SS**  trans-135.2106.115945.90000108
476S34.6Very low38.8Very low126 Ų126140.1 Ų140.188%0.88186%0.858SS**PPolyproline II helixtrans-92.9134.8176.843.60000111.2
477R40.7Very low39Very low242 Ų242139 Ų13991%0.91386%0.864SS**PPolyproline II helixtrans-95144.1175.7-167.4176-172.2-168.52.1110
478P51.8Low39.6Very low114 Ų114137.9 Ų137.974%0.7487%0.866SS**PPolyproline II helixtrans-85.6164.7-170.734.5-35000113.8
479P53.3Low40.1Very low119 Ų119140.6 Ų140.677%0.77387%0.871SS**PPolyproline II helixtrans-87.6162.5-178.736.1-33.3000113
480P50.3Low40.6Very low130 Ų130142.8 Ų142.884%0.84487%0.869SS**PPolyproline II helixtrans-83.8148.3177.74.613.6000112.9
481A46Very low41.2Very low101 Ų101146.3 Ų146.384%0.83588%0.876SS**PPolyproline II helixtrans-81.9150.1-177.100000114
482F41.8Very low41.8Very low204 Ų204142.3 Ų142.390%0.89587%0.872SS**PPolyproline II helixtrans-72.9141.7163.4-92.2-99000111.6
483L46Very low42.5Very low164 Ų164146.2 Ų146.286%0.85989%0.889SS**  trans-140.7117.8152.3-78.9171.1000105.2
484A45.4Very low43.3Very low165 Ų165144.5 Ų144.5100%1.36489%0.889SS**  69.9083.100000112.1

Retrieved 484 of 484 residues in 492.6 ms (Link to these results)

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