A0A087YJN5_POEFO Loading...

Tetratricopeptide repeat protein 29

Axonemal protein which is implicated in axonemal and/or peri-axonemal structure assembly and regulates flagellum assembly and beating and therefore sperm motility.

AlphaFold DB , UniProt , Accession A0A087YJN5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 379 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1F45.1Very low75.3Confident253 Ų253102.1 Ų102.1100%1.1148%0.477SS*.  0112.50-73-92.6000108.1N3F1-N3 PolarHBondContact O-N 3.05Å
2R50.5Low76.6Confident249 Ų24997.3 Ų97.394%0.9445%0.454SS*.  trans-78.5114.1168.8-86.5-177.9173.3176.5-2.4106.3T4R2-T4 PolarHBondContact O-N 3.39Å
3N61.1Low78Confident99 Ų9989.8 Ų89.853%0.52942%0.419SS..  trans-58.1131.2175.5-71.1-16.6000108.7F1 Q7F1-N3 PolarHBondContact O-N 3.05Å; N3-Q7 HydrophobicContact CB-CB 4.21Å
4T77.1Confident79.2Confident66 Ų6689.2 Ų89.241%0.40542%0.42SS..  trans-65.6154.7172.260.90000109.5R2 K6 Q7 Y8R2-T4 PolarHBondContact O-N 3.39Å; T4-K6 PolarHBondContact O-N 2.98Å; T4-K6 VanDerWaalsContact O-N 3.15Å; T4-Q7 VanDerWaalsContact N-OE1 3.07Å; T4-Q7 WeakPolarHBondContact O-CB 3.3Å; T4-Q7 PolarHBondContact O-N 2.76Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.28Å; T4-Q7 PolarHBondContact OG1-N 3.1Å; T4-Y8 PolarHBondContact O-N 2.99Å
5P74.5Confident80.2Confident66 Ų6693.5 Ų93.543%0.42944%0.439SS..Hα-helixtrans-50.6-40.7177.7-28.835.5000112.9Q7 Y8 M9 R55P5-Q7 PolarHBondContact O-N 3.34Å; P5-Y8 PolarHBondContact O-N 3.4Å; P5-M9 HydrophobicContact CB-CE 4.19Å; P5-M9 VanDerWaalsContact O-CG 3.29Å; P5-M9 WeakPolarHBondContact O-CG 3.46Å; P5-M9 PolarHBondContact O-N 3.18Å; P5-R55 HydrophobicContact CB-CG 4.47Å
6K84.5Confident81Confident59 Ų5993.3 Ų93.326%0.25744%0.442SS..Hα-helixtrans-53.8-50.5171.1179.8-170.3-178.6-179.60113.1T4 M9 C10 L29 L58T4-K6 PolarHBondContact O-N 2.98Å; T4-K6 VanDerWaalsContact O-N 3.15Å; K6-M9 PolarHBondContact O-N 2.99Å; K6-C10 WeakPolarHBondContact O-CB 3.36Å; K6-C10 PolarHBondContact O-N 2.83Å; K6-C10 PolarHBondContact O-SG 3.08Å; K6-L29 HydrophobicContact CD-CD1 4.34Å; K6-L29 HydrophobicContact CD-CD2 4.44Å; K6-L29 VanDerWaalsContact CE-CD1 3.41Å; K6-L29 HydrophobicContact CG-CD1 4.25Å; K6-L58 HydrophobicContact CB-CD1 4.22Å
7Q85.1Confident81.8Confident96 Ų9689.6 Ų89.645%0.44944%0.435SS..Hα-helixtrans-65.2-42-178.8-75.4170.7-1800111.7N3 T4 P5 C10 V11N3-Q7 HydrophobicContact CB-CB 4.21Å; T4-Q7 VanDerWaalsContact N-OE1 3.07Å; T4-Q7 WeakPolarHBondContact O-CB 3.3Å; T4-Q7 PolarHBondContact O-N 2.76Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.28Å; T4-Q7 PolarHBondContact OG1-N 3.1Å; P5-Q7 PolarHBondContact O-N 3.34Å; Q7-C10 PolarHBondContact O-N 3.01Å; Q7-V11 VanDerWaalsContact O-CG2 3.3Å; Q7-V11 WeakPolarHBondContact O-CG2 3.34Å; Q7-V11 PolarHBondContact O-N 3.44Å
8Y84.6Confident82.6Confident141 Ų14186.9 Ų86.955%0.55342%0.42SS*.Hα-helixtrans-59.4-49.8176.8-179.1-90.1000111.2T4 P5 C10 V11 E12T4-Y8 PolarHBondContact O-N 2.99Å; P5-Y8 PolarHBondContact O-N 3.4Å; Y8-C10 PolarHBondContact O-N 3.02Å; Y8-V11 PolarHBondContact O-N 3.02Å; Y8-E12 WeakPolarHBondContact CE1-OE2 3.43Å; Y8-E12 WeakPolarHBondContact O-CB 3.38Å; Y8-E12 PolarHBondContact O-N 2.89Å
9M86.6Confident83.3Confident9 Ų987.6 Ų87.64%0.04442%0.422CS..Hα-helixtrans-60.5-43.9178.9-70.4175-156.500112.6P5 K6 V11 E12 M13 R55 L58 E59P5-M9 HydrophobicContact CB-CE 4.19Å; P5-M9 VanDerWaalsContact O-CG 3.29Å; P5-M9 WeakPolarHBondContact O-CG 3.46Å; P5-M9 PolarHBondContact O-N 3.18Å; K6-M9 PolarHBondContact O-N 2.99Å; M9-V11 VanDerWaalsContact C-N 3.34Å; M9-V11 PolarHBondContact O-N 3.37Å; M9-E12 PolarHBondContact O-N 2.82Å; M9-M13 VanDerWaalsContact O-CG 3.24Å; M9-M13 WeakPolarHBondContact O-CG 3.44Å; M9-M13 PolarHBondContact O-N 3.37Å; M9-R55 HydrophobicContact CE-CG 4.1Å; M9-L58 HydrophobicContact CE-CB 4.22Å; M9-L58 HydrophobicContact SD-CB 3.55Å; M9-L58 VanDerWaalsContact SD-CB 3.55Å; M9-E59 HydrophobicContact CE-CG 3.33Å; M9-E59 HydrophobicContact SD-CG 4.18Å
10C89.1Confident83.9Confident17 Ų1790.3 Ų90.312%0.11543%0.427CS..Hα-helixtrans-60.6-42.8177.5-73.40000112.3K6 Q7 Y8 L14 F22K6-C10 WeakPolarHBondContact O-CB 3.36Å; K6-C10 PolarHBondContact O-N 2.83Å; K6-C10 PolarHBondContact O-SG 3.08Å; Q7-C10 PolarHBondContact O-N 3.01Å; Y8-C10 PolarHBondContact O-N 3.02Å; C10-L14 WeakPolarHBondContact O-CG 3.34Å; C10-L14 PolarHBondContact O-N 3.05Å; C10-F22 HydrophobicContact CB-CD2 4.01Å; C10-F22 HydrophobicContact CB-CE2 3.71Å
11V90.6Very high84.5Confident68 Ų6886.1 Ų86.141%0.41241%0.408SS..Hα-helixtrans-67-44.7178.7170.80000110.8Q7 Y8 M9 M13 L14 Q15Q7-V11 VanDerWaalsContact O-CG2 3.3Å; Q7-V11 WeakPolarHBondContact O-CG2 3.34Å; Q7-V11 PolarHBondContact O-N 3.44Å; Y8-V11 PolarHBondContact O-N 3.02Å; M9-V11 VanDerWaalsContact C-N 3.34Å; M9-V11 PolarHBondContact O-N 3.37Å; V11-M13 PolarHBondContact O-N 3.27Å; V11-L14 PolarHBondContact O-N 3.33Å; V11-Q15 HydrophobicContact CG1-CG 4.22Å; V11-Q15 WeakPolarHBondContact O-CG 3.36Å; V11-Q15 PolarHBondContact O-N 3.37Å
12E90.3Very high87Confident44 Ų4476.2 Ų76.221%0.20636%0.364CS..Hα-helixtrans-58.8-47.2178.4-169-174.8165.800111.4Y8 M9 L14 Q15 D16 R62Y8-E12 WeakPolarHBondContact CE1-OE2 3.43Å; Y8-E12 WeakPolarHBondContact O-CB 3.38Å; Y8-E12 PolarHBondContact O-N 2.89Å; M9-E12 PolarHBondContact O-N 2.82Å; E12-L14 VanDerWaalsContact C-N 3.3Å; E12-L14 PolarHBondContact O-N 3.33Å; E12-Q15 PolarHBondContact O-N 3Å; E12-D16 WeakPolarHBondContact O-CB 3.25Å; E12-D16 PolarHBondContact O-N 2.93Å; E12-R62 IonicContact OE1-CZ 3.87Å; E12-R62 IonicContact OE1-NH1 2.78Å; E12-R62 PolarHBondContact OE1-NH1 3.18Å; E12-R62 IonicContact OE1-NH2 2.83Å; E12-R62 IonicContact OE2-CZ 2.77Å; E12-R62 IonicContact OE2-NH1 3.68Å; E12-R62 PolarHBondContact OE2-NH1 3.42Å; E12-R62 IonicContact OE2-NH2 3.82Å
13M94.5Very high89.2Confident0 Ų067.3 Ų67.30%034%0.34CS..Hα-helixtrans-57.4-42.6177-68.5173.684.700112.5M9 V11 G17 Y18 F22 L25 R62M9-M13 VanDerWaalsContact O-CG 3.24Å; M9-M13 WeakPolarHBondContact O-CG 3.44Å; M9-M13 PolarHBondContact O-N 3.37Å; V11-M13 PolarHBondContact O-N 3.27Å; M13-G17 PolarHBondContact O-N 2.92Å; M13-Y18 WeakPolarHBondContact O-CA 3.43Å; M13-Y18 WeakPolarHBondContact O-CB 3.48Å; M13-Y18 PolarHBondContact O-N 3.33Å; M13-F22 HydrophobicContact CB-CB 4.32Å; M13-L25 HydrophobicContact CE-CD2 4.49Å; M13-L25 HydrophobicContact SD-CD2 3.73Å; M13-R62 HydrophobicContact CE-CG 4.35Å; M13-R62 HydrophobicContact CG-CG 3.76Å; M13-R62 HydrophobicContact SD-CB 4.39Å; M13-R62 HydrophobicContact SD-CG 3.76Å
14L94.7Very high90.9Very high82 Ų8264.2 Ų64.243%0.42932%0.322SS..Hα-helixtrans-70.6-39.2179-71.5173.3000112.3C10 V11 E12 D16 G17 F22C10-L14 WeakPolarHBondContact O-CG 3.34Å; C10-L14 PolarHBondContact O-N 3.05Å; V11-L14 PolarHBondContact O-N 3.33Å; E12-L14 VanDerWaalsContact C-N 3.3Å; E12-L14 PolarHBondContact O-N 3.33Å; L14-D16 VanDerWaalsContact C-N 3.31Å; L14-D16 PolarHBondContact O-N 2.87Å; L14-G17 WeakPolarHBondContact O-CA 3.37Å; L14-G17 PolarHBondContact O-N 2.65Å; L14-F22 HydrophobicContact CD1-CD1 4.3Å; L14-F22 HydrophobicContact CD1-CD2 4.11Å; L14-F22 HydrophobicContact CD1-CE1 4.21Å; L14-F22 HydrophobicContact CD1-CE2 4.03Å; L14-F22 HydrophobicContact CD1-CG 4.25Å; L14-F22 HydrophobicContact CD1-CZ 4.07Å; L14-F22 HydrophobicContact CD2-CB 4Å; L14-F22 HydrophobicContact CD2-CD1 3.67Å; L14-F22 HydrophobicContact CD2-CD2 4.36Å; L14-F22 HydrophobicContact CD2-CE1 4.26Å; L14-F22 HydrophobicContact CD2-CG 3.71Å; L14-F22 HydrophobicContact CG-CB 4.3Å; L14-F22 HydrophobicContact CG-CD1 4.17Å; L14-F22 HydrophobicContact CG-CD2 4Å; L14-F22 HydrophobicContact CG-CE2 4.43Å; L14-F22 HydrophobicContact CG-CG 3.86Å
15Q94.1Very high91.9Very high153 Ų15361.2 Ų61.272%0.71530%0.304SS*.Hα-helixtrans-62.7-39.5176.2-75.6177.8-26.700111.9V11 E12 G17V11-Q15 HydrophobicContact CG1-CG 4.22Å; V11-Q15 WeakPolarHBondContact O-CG 3.36Å; V11-Q15 PolarHBondContact O-N 3.37Å; E12-Q15 PolarHBondContact O-N 3Å; Q15-G17 PolarHBondContact O-N 3.1Å
16D93.1Very high92.9Very high91 Ų9163.1 Ų63.149%0.48731%0.306SS..THydrogen-bonded Turntrans-79.2-0.4175.9-65-16.8000112.9E12 L14 Y18E12-D16 WeakPolarHBondContact O-CB 3.25Å; E12-D16 PolarHBondContact O-N 2.93Å; L14-D16 VanDerWaalsContact C-N 3.31Å; L14-D16 PolarHBondContact O-N 2.87Å; D16-Y18 HydrophobicContact CB-CD2 3.51Å; D16-Y18 HydrophobicContact CB-CE2 3.5Å; D16-Y18 VanDerWaalsContact CB-CE2 3.5Å
17G94.5Very high93.4Very high30 Ų3064.5 Ų64.531%0.30932%0.319SS..THydrogen-bonded Turntrans83.1717500000115.4M13 L14 Q15 H19 R73M13-G17 PolarHBondContact O-N 2.92Å; L14-G17 WeakPolarHBondContact O-CA 3.37Å; L14-G17 PolarHBondContact O-N 2.65Å; Q15-G17 PolarHBondContact O-N 3.1Å; G17-H19 PolarHBondContact O-N 3.04Å; G17-H19 PolarHBondContact O-ND1 2.87Å; G17-H19 VanDerWaalsContact O-ND1 3.14Å; G17-R73 PolarHBondContact O-NH2 3.03Å
18Y96.8Very high94Very high42 Ų4260.2 Ų60.217%0.16530%0.3CS..  trans-77.258.4179.5-59.4-65.4000113.3M13 D16 R20 F22 C66 E69 K70M13-Y18 WeakPolarHBondContact O-CA 3.43Å; M13-Y18 WeakPolarHBondContact O-CB 3.48Å; M13-Y18 PolarHBondContact O-N 3.33Å; D16-Y18 HydrophobicContact CB-CD2 3.51Å; D16-Y18 HydrophobicContact CB-CE2 3.5Å; D16-Y18 VanDerWaalsContact CB-CE2 3.5Å; Y18-R20 PolarHBondContact O-N 3.41Å; Y18-F22 WeakPolarHBondContact O-CB 3.29Å; Y18-F22 PolarHBondContact O-N 3.4Å; Y18-C66 HydrophobicContact CD1-CB 4.21Å; Y18-C66 HydrophobicContact CD2-CB 3.93Å; Y18-C66 VanDerWaalsContact CD2-SG 3.55Å; Y18-C66 HydrophobicContact CE1-CB 4.29Å; Y18-C66 WeakPolarHBondContact CE1-O 3.29Å; Y18-C66 HydrophobicContact CE2-CB 4Å; Y18-C66 HydrophobicContact CG-CB 4.04Å; Y18-E69 VanDerWaalsContact C-OE2 3.31Å; Y18-E69 WeakPolarHBondContact CA-OE2 3.47Å; Y18-E69 HydrophobicContact CD1-CB 4.21Å; Y18-E69 HydrophobicContact CD1-CG 4.18Å; Y18-K70 HydrophobicContact CE1-CB 4.07Å
19H95.9Very high94.5Very high99 Ų9953.7 Ų53.746%0.45827%0.274SS..Hα-helixtrans-66.8-31.7-17563.1-77.3000113.7G17 S23 E69G17-H19 PolarHBondContact O-N 3.04Å; G17-H19 PolarHBondContact O-ND1 2.87Å; G17-H19 VanDerWaalsContact O-ND1 3.14Å; H19-S23 WeakPolarHBondContact O-CB 3.31Å; H19-S23 PolarHBondContact O-N 2.77Å; H19-S23 PolarHBondContact O-OG 3.03Å; H19-E69 IonicContact CE1-OE1 3.11Å; H19-E69 IonicContact ND1-OE1 2.8Å
20R95.8Very high94.9Very high142 Ų14255.5 Ų55.554%0.53629%0.288SS..Hα-helixtrans-72.6-46.2178.1-61.7-175.1177.1-179-2110.8Y18 F22 S23 E24 E69 E72Y18-R20 PolarHBondContact O-N 3.41Å; R20-F22 VanDerWaalsContact C-N 3.3Å; R20-F22 PolarHBondContact O-N 3.3Å; R20-S23 PolarHBondContact O-N 2.9Å; R20-S23 VanDerWaalsContact O-N 3.16Å; R20-E24 PolarHBondContact O-N 3.34Å; R20-E69 HydrophobicContact CB-CG 4.49Å; R20-E69 PolarHBondContact N-OE1 3Å; R20-E69 PolarHBondContact N-OE2 3.21Å; R20-E72 IonicContact NH1-OE1 2.66Å; R20-E72 PolarHBondContact NH1-OE1 3.32Å
21S97.1Very high95.2Very high2 Ų258.6 Ų58.61%0.01430%0.299CS..Hα-helixtrans-59.1-42.6175-57.50000111.2E24 L25 L65 E69S21-E24 PolarHBondContact O-N 3.05Å; S21-L25 WeakPolarHBondContact O-CB 2.97Å; S21-L25 PolarHBondContact O-N 3.41Å; S21-L65 VanDerWaalsContact OG-C 3.27Å; S21-L65 PolarHBondContact OG-O 3.38Å; S21-E69 WeakPolarHBondContact CB-OE2 3.48Å; S21-E69 PolarHBondContact N-OE2 3.48Å; S21-E69 VanDerWaalsContact OG-CB 3.26Å; S21-E69 WeakPolarHBondContact OG-CB 3.47Å; S21-E69 PolarHBondContact OG-OE2 3.46Å
22F96.9Very high95.4Very high46 Ų4655.8 Ų55.820%0.20228%0.282CS..Hα-helixtrans-59.8-48.2174.2165.4-97000111.5C10 M13 L14 Y18 R20 E24 L25 F26C10-F22 HydrophobicContact CB-CD2 4.01Å; C10-F22 HydrophobicContact CB-CE2 3.71Å; M13-F22 HydrophobicContact CB-CB 4.32Å; L14-F22 HydrophobicContact CD1-CD1 4.3Å; L14-F22 HydrophobicContact CD1-CD2 4.11Å; L14-F22 HydrophobicContact CD1-CE1 4.21Å; L14-F22 HydrophobicContact CD1-CE2 4.03Å; L14-F22 HydrophobicContact CD1-CG 4.25Å; L14-F22 HydrophobicContact CD1-CZ 4.07Å; L14-F22 HydrophobicContact CD2-CB 4Å; L14-F22 HydrophobicContact CD2-CD1 3.67Å; L14-F22 HydrophobicContact CD2-CD2 4.36Å; L14-F22 HydrophobicContact CD2-CE1 4.26Å; L14-F22 HydrophobicContact CD2-CG 3.71Å; L14-F22 HydrophobicContact CG-CB 4.3Å; L14-F22 HydrophobicContact CG-CD1 4.17Å; L14-F22 HydrophobicContact CG-CD2 4Å; L14-F22 HydrophobicContact CG-CE2 4.43Å; L14-F22 HydrophobicContact CG-CG 3.86Å; Y18-F22 WeakPolarHBondContact O-CB 3.29Å; Y18-F22 PolarHBondContact O-N 3.4Å; R20-F22 VanDerWaalsContact C-N 3.3Å; R20-F22 PolarHBondContact O-N 3.3Å; F22-E24 VanDerWaalsContact C-N 3.31Å; F22-E24 PolarHBondContact O-N 3.3Å; F22-L25 PolarHBondContact O-N 3.47Å; F22-F26 HydrophobicContact CZ-CD2 4.4Å; F22-F26 WeakPolarHBondContact O-CB 3.25Å; F22-F26 PolarHBondContact O-N 3.42Å
23S96.8Very high95.6Very high62 Ų6258 Ų5843%0.43430%0.295SS..Hα-helixtrans-62.3-40-178.3-58.40000111.8H19 R20 T27H19-S23 WeakPolarHBondContact O-CB 3.31Å; H19-S23 PolarHBondContact O-N 2.77Å; H19-S23 PolarHBondContact O-OG 3.03Å; R20-S23 PolarHBondContact O-N 2.9Å; R20-S23 VanDerWaalsContact O-N 3.16Å; S23-T27 PolarHBondContact O-N 2.8Å; S23-T27 PolarHBondContact O-OG1 2.93Å
24E97.4Very high95.6Very high33 Ų3363.6 Ų63.615%0.15432%0.321CS..Hα-helixtrans-66.2-50.8175.5-175.7173.1176.300111.8R20 S21 F22 F26 T27 L28 L65 R84 H102R20-E24 PolarHBondContact O-N 3.34Å; S21-E24 PolarHBondContact O-N 3.05Å; F22-E24 VanDerWaalsContact C-N 3.31Å; F22-E24 PolarHBondContact O-N 3.3Å; E24-F26 VanDerWaalsContact C-N 3.25Å; E24-F26 PolarHBondContact O-N 3.02Å; E24-T27 WeakPolarHBondContact O-CA 3.31Å; E24-T27 WeakPolarHBondContact O-CB 3.46Å; E24-T27 PolarHBondContact O-N 3.49Å; E24-L28 HydrophobicContact CG-CD1 4.43Å; E24-L28 WeakPolarHBondContact O-CG 3.26Å; E24-L28 PolarHBondContact O-N 3.34Å; E24-L65 HydrophobicContact CB-CD1 4.36Å; E24-L65 HydrophobicContact CG-CD1 4.3Å; E24-R84 VanDerWaalsContact CD-NH1 3.3Å; E24-R84 IonicContact OE1-CZ 3.81Å; E24-R84 IonicContact OE1-NH1 3.58Å; E24-R84 PolarHBondContact OE1-NH1 3.29Å; E24-R84 IonicContact OE1-NH2 3.04Å; E24-R84 IonicContact OE2-CZ 3.6Å; E24-R84 VanDerWaalsContact OE2-CZ 3.31Å; E24-R84 IonicContact OE2-NH1 3.45Å; E24-R84 PolarHBondContact OE2-NH1 3.31Å; E24-R84 VanDerWaalsContact OE2-NH1 3.13Å; E24-R84 IonicContact OE2-NH2 2.66Å; E24-R84 PolarHBondContact OE2-NH2 3.35Å; E24-H102 IonicContact OE1-CD2 3.8Å; E24-H102 IonicContact OE1-CE1 3.13Å; E24-H102 IonicContact OE1-NE2 3.8Å; E24-H102 PolarHBondContact OE1-NE2 3Å
25L96.6Very high95.5Very high3 Ų363 Ų632%0.01632%0.316CS..Hα-helixtrans-55.9-42.717617460000111.3M13 S21 F22 T27 L28 L29 L58 I61 L65M13-L25 HydrophobicContact CE-CD2 4.49Å; M13-L25 HydrophobicContact SD-CD2 3.73Å; S21-L25 WeakPolarHBondContact O-CB 2.97Å; S21-L25 PolarHBondContact O-N 3.41Å; F22-L25 PolarHBondContact O-N 3.47Å; L25-T27 VanDerWaalsContact C-N 3.32Å; L25-T27 PolarHBondContact O-N 3.47Å; L25-L28 PolarHBondContact O-N 3.48Å; L25-L29 HydrophobicContact CD1-CD1 4.06Å; L25-L29 HydrophobicContact CD1-CG 4.2Å; L25-L29 HydrophobicContact CG-CD1 3.92Å; L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 WeakPolarHBondContact O-CD1 3.3Å; L25-L29 VanDerWaalsContact O-CG 3.24Å; L25-L29 WeakPolarHBondContact O-CG 3.46Å; L25-L29 PolarHBondContact O-N 3.42Å; L25-L58 HydrophobicContact CD1-CD2 4.04Å; L25-I61 HydrophobicContact CD1-CB 4.38Å; L25-I61 HydrophobicContact CD1-CG2 3.77Å; L25-L65 HydrophobicContact CB-CD1 4.34Å
26F95.2Very high95.4Very high106 Ų10657.5 Ų57.547%0.46529%0.289SS..Hα-helixtrans-62.2-39.1176.8-173.6-91.7000112.4F22 E24 L29 S30F22-F26 HydrophobicContact CZ-CD2 4.4Å; F22-F26 WeakPolarHBondContact O-CB 3.25Å; F22-F26 PolarHBondContact O-N 3.42Å; E24-F26 VanDerWaalsContact C-N 3.25Å; E24-F26 PolarHBondContact O-N 3.02Å; F26-L29 PolarHBondContact O-N 3.39Å; F26-S30 WeakPolarHBondContact O-CB 3.26Å; F26-S30 PolarHBondContact O-N 2.86Å; F26-S30 PolarHBondContact O-OG 3.29Å
27T96.8Very high95.4Very high89 Ų8957 Ų5755%0.54630%0.297SS..Hα-helixtrans-64.9-46.3176.2-560000110.9S23 E24 L25 L29 S30 F31S23-T27 PolarHBondContact O-N 2.8Å; S23-T27 PolarHBondContact O-OG1 2.93Å; E24-T27 WeakPolarHBondContact O-CA 3.31Å; E24-T27 WeakPolarHBondContact O-CB 3.46Å; E24-T27 PolarHBondContact O-N 3.49Å; L25-T27 VanDerWaalsContact C-N 3.32Å; L25-T27 PolarHBondContact O-N 3.47Å; T27-L29 VanDerWaalsContact C-N 3.34Å; T27-L29 PolarHBondContact O-N 2.98Å; T27-S30 PolarHBondContact O-N 2.85Å; T27-S30 VanDerWaalsContact O-N 3.15Å; T27-F31 WeakPolarHBondContact O-CB 3.12Å; T27-F31 PolarHBondContact O-N 3.37Å
28L96.9Very high95.3Very high6 Ų661.4 Ų61.43%0.03131%0.314CS..Hα-helixtrans-60.7-42.7177.1-63.3175.2000112.1E24 L25 S30 F31 D32 W98 L99 F103E24-L28 HydrophobicContact CG-CD1 4.43Å; E24-L28 WeakPolarHBondContact O-CG 3.26Å; E24-L28 PolarHBondContact O-N 3.34Å; L25-L28 PolarHBondContact O-N 3.48Å; L28-S30 VanDerWaalsContact C-N 3.32Å; L28-S30 PolarHBondContact O-N 3.43Å; L28-F31 PolarHBondContact O-N 3.4Å; L28-D32 PolarHBondContact O-N 2.95Å; L28-W98 HydrophobicContact CB-CH2 4.31Å; L28-W98 HydrophobicContact CD2-CH2 4.34Å; L28-W98 HydrophobicContact CD2-CZ3 3.76Å; L28-L99 HydrophobicContact CB-CD2 4.45Å; L28-L99 HydrophobicContact CD1-CD2 4.13Å; L28-L99 HydrophobicContact CD2-CD2 4.08Å; L28-L99 HydrophobicContact CG-CD2 4.45Å; L28-F103 HydrophobicContact CD1-CE1 4.12Å; L28-F103 HydrophobicContact CD1-CE2 4.34Å; L28-F103 HydrophobicContact CD1-CZ 3.53Å
29L95.4Very high95Very high3 Ų360.4 Ų60.42%0.01631%0.314CS..Hα-helixtrans-62.6-38.7175.5-75.1162.2000112.5K6 L25 F26 T27 L33 L51 L58K6-L29 HydrophobicContact CD-CD1 4.34Å; K6-L29 HydrophobicContact CD-CD2 4.44Å; K6-L29 VanDerWaalsContact CE-CD1 3.41Å; K6-L29 HydrophobicContact CG-CD1 4.25Å; L25-L29 HydrophobicContact CD1-CD1 4.06Å; L25-L29 HydrophobicContact CD1-CG 4.2Å; L25-L29 HydrophobicContact CG-CD1 3.92Å; L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 WeakPolarHBondContact O-CD1 3.3Å; L25-L29 VanDerWaalsContact O-CG 3.24Å; L25-L29 WeakPolarHBondContact O-CG 3.46Å; L25-L29 PolarHBondContact O-N 3.42Å; F26-L29 PolarHBondContact O-N 3.39Å; T27-L29 VanDerWaalsContact C-N 3.34Å; T27-L29 PolarHBondContact O-N 2.98Å; L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 3Å; L29-L51 HydrophobicContact CD2-CB 4.44Å; L29-L51 HydrophobicContact CD2-CD2 4.47Å; L29-L51 HydrophobicContact CD2-CG 4.26Å; L29-L58 HydrophobicContact CD2-CD2 3.91Å
30S95.1Very high94.8Very high48 Ų4860 Ų6034%0.33632%0.32SS..Hα-helixtrans-70.2-41.5179-57.30000110.8F26 T27 L28 L33 E34F26-S30 WeakPolarHBondContact O-CB 3.26Å; F26-S30 PolarHBondContact O-N 2.86Å; F26-S30 PolarHBondContact O-OG 3.29Å; T27-S30 PolarHBondContact O-N 2.85Å; T27-S30 VanDerWaalsContact O-N 3.15Å; L28-S30 VanDerWaalsContact C-N 3.32Å; L28-S30 PolarHBondContact O-N 3.43Å; S30-L33 PolarHBondContact O-N 3Å; S30-E34 PolarHBondContact O-N 3Å
31F95.4Very high94.4Very high81 Ų8158.9 Ų58.936%0.35533%0.331SS..Hα-helixtrans-63.6-41.1176.5-175.9-103000112.8T27 L28 L33 E34 Q35 W98T27-F31 WeakPolarHBondContact O-CB 3.12Å; T27-F31 PolarHBondContact O-N 3.37Å; L28-F31 PolarHBondContact O-N 3.4Å; F31-L33 VanDerWaalsContact C-N 3.32Å; F31-L33 PolarHBondContact O-N 2.87Å; F31-E34 PolarHBondContact O-N 3.32Å; F31-Q35 HydrophobicContact CD1-CG 4.01Å; F31-Q35 HydrophobicContact CE1-CG 3.7Å; F31-Q35 HydrophobicContact CE2-CG 4.27Å; F31-Q35 HydrophobicContact CG-CG 4.46Å; F31-Q35 HydrophobicContact CZ-CG 3.84Å; F31-Q35 WeakPolarHBondContact O-CB 3.46Å; F31-Q35 VanDerWaalsContact O-CG 3.25Å; F31-Q35 WeakPolarHBondContact O-CG 3.32Å; F31-Q35 PolarHBondContact O-N 2.88Å; F31-W98 HydrophobicContact CD1-CD2 4.1Å; F31-W98 AromaticContact CD1-CE3 3.53Å; F31-W98 HydrophobicContact CD1-CE3 3.53Å; F31-W98 AromaticContact CD1-CH2 3.83Å; F31-W98 HydrophobicContact CD1-CH2 3.83Å; F31-W98 HydrophobicContact CD1-CZ2 4.38Å; F31-W98 AromaticContact CD1-CZ3 3.39Å; F31-W98 HydrophobicContact CD1-CZ3 3.39Å; F31-W98 AromaticContact CE1-CD2 3.93Å; F31-W98 HydrophobicContact CE1-CD2 3.93Å; F31-W98 AromaticContact CE1-CE3 3.57Å; F31-W98 HydrophobicContact CE1-CE3 3.57Å; F31-W98 HydrophobicContact CE1-CG 4.45Å; F31-W98 AromaticContact CE1-CZ3 3.95Å; F31-W98 HydrophobicContact CE1-CZ3 3.95Å; F31-W98 HydrophobicContact CG-CZ3 4.38Å
32D95.1Very high93.9Very high9 Ų969.2 Ų69.25%0.04837%0.37CS..Hα-helixtrans-57.9-45.2173177.158.1000111.5L28 E34 Q35 R36 L51 W98L28-D32 PolarHBondContact O-N 2.95Å; D32-E34 VanDerWaalsContact C-N 3.35Å; D32-E34 PolarHBondContact O-N 2.97Å; D32-Q35 PolarHBondContact O-N 3.17Å; D32-R36 WeakPolarHBondContact O-CB 3.33Å; D32-R36 WeakPolarHBondContact O-CG 3.42Å; D32-R36 PolarHBondContact O-N 3.16Å; D32-L51 HydrophobicContact CB-CB 4.01Å; D32-L51 WeakPolarHBondContact OD2-CB 3.4Å; D32-L51 PolarHBondContact OD2-N 3.01Å; D32-W98 HydrophobicContact CB-CH2 4.46Å; D32-W98 HydrophobicContact CB-CZ2 4.11Å
33L94Very high93.5Very high91 Ų9168 Ų6848%0.47637%0.367SS..Hα-helixtrans-64.8-38.5178.5-68.6174000112.4L29 S30 F31 R36 A37L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 3Å; S30-L33 PolarHBondContact O-N 3Å; F31-L33 VanDerWaalsContact C-N 3.32Å; F31-L33 PolarHBondContact O-N 2.87Å; L33-R36 PolarHBondContact O-N 3.47Å; L33-A37 WeakPolarHBondContact O-CB 3.3Å; L33-A37 PolarHBondContact O-N 2.85Å
34E94.6Very high93.1Very high117 Ų11769 Ų6955%0.54737%0.372SS..Hα-helixtrans-65.4-48176.2-176.3175.5-168.700111.8S30 F31 D32 R36 A37 N38S30-E34 PolarHBondContact O-N 3Å; F31-E34 PolarHBondContact O-N 3.32Å; D32-E34 VanDerWaalsContact C-N 3.35Å; D32-E34 PolarHBondContact O-N 2.97Å; E34-R36 PolarHBondContact O-N 3.15Å; E34-A37 PolarHBondContact O-N 2.98Å; E34-A37 VanDerWaalsContact O-N 3.13Å; E34-N38 PolarHBondContact O-N 3.05Å; E34-N38 PolarHBondContact O-ND2 3.33Å
35Q91.4Very high92.6Very high69 Ų6969.5 Ų69.532%0.32237%0.373SS..Hα-helixtrans-56.5-39.2174.8-72.2-92.448.400111.6F31 D32 A39F31-Q35 HydrophobicContact CD1-CG 4.01Å; F31-Q35 HydrophobicContact CE1-CG 3.7Å; F31-Q35 HydrophobicContact CE2-CG 4.27Å; F31-Q35 HydrophobicContact CG-CG 4.46Å; F31-Q35 HydrophobicContact CZ-CG 3.84Å; F31-Q35 WeakPolarHBondContact O-CB 3.46Å; F31-Q35 VanDerWaalsContact O-CG 3.25Å; F31-Q35 WeakPolarHBondContact O-CG 3.32Å; F31-Q35 PolarHBondContact O-N 2.88Å; D32-Q35 PolarHBondContact O-N 3.17Å; Q35-A39 WeakPolarHBondContact O-CB 3.34Å; Q35-A39 PolarHBondContact O-N 3.36Å
36R92.4Very high92.3Very high38 Ų3872.8 Ų72.814%0.14339%0.39CS..Hα-helixtrans-70.6-41176.6-70172.879.2101.38.9112.2D32 L33 E34 N38 A39 R45 L46 E48 P49D32-R36 WeakPolarHBondContact O-CB 3.33Å; D32-R36 WeakPolarHBondContact O-CG 3.42Å; D32-R36 PolarHBondContact O-N 3.16Å; L33-R36 PolarHBondContact O-N 3.47Å; E34-R36 PolarHBondContact O-N 3.15Å; R36-N38 PolarHBondContact O-N 3.39Å; R36-A39 WeakPolarHBondContact O-CB 3.39Å; R36-A39 PolarHBondContact O-N 3.28Å; R36-R45 HydrophobicContact CG-CG 3.95Å; R36-R45 VanDerWaalsContact CZ-O 3.31Å; R36-R45 PolarHBondContact NH1-O 3.23Å; R36-R45 VanDerWaalsContact NH1-O 3.15Å; R36-R45 PolarHBondContact NH2-O 3.04Å; R36-L46 HydrophobicContact CB-CD2 4.2Å; R36-E48 VanDerWaalsContact CZ-O 3.26Å; R36-E48 PolarHBondContact NH1-O 3.39Å; R36-E48 PolarHBondContact NH2-O 3.39Å; R36-P49 VanDerWaalsContact NH1-C 3.34Å; R36-P49 PolarHBondContact NH1-O 2.87Å; R36-P49 VanDerWaalsContact NH1-O 3.09Å
37A92.8Very high91.9Very high81 Ų8174.8 Ų74.867%0.66940%0.401SS*.Hα-helixtrans-62.4-33.517700000112.3L33 E34L33-A37 WeakPolarHBondContact O-CB 3.3Å; L33-A37 PolarHBondContact O-N 2.85Å; E34-A37 PolarHBondContact O-N 2.98Å; E34-A37 VanDerWaalsContact O-N 3.13Å
38N92.6Very high91.5Very high123 Ų12373.2 Ų73.266%0.65839%0.387SS*.THydrogen-bonded Turntrans-87.8-4.4178.7-65.9-33.7000114E34 R36E34-N38 PolarHBondContact O-N 3.05Å; E34-N38 PolarHBondContact O-ND2 3.33Å; R36-N38 PolarHBondContact O-N 3.39Å
39A91.1Very high91.2Very high20 Ų2076.1 Ų76.117%0.16541%0.407CS..SBendtrans-77.2143.3-175.600000112.2Q35 R36 L46Q35-A39 WeakPolarHBondContact O-CB 3.34Å; Q35-A39 PolarHBondContact O-N 3.36Å; R36-A39 WeakPolarHBondContact O-CB 3.39Å; R36-A39 PolarHBondContact O-N 3.28Å; A39-L46 HydrophobicContact CB-CG 4.26Å
40P92.1Very high91Very high91 Ų9176.8 Ų76.859%0.59141%0.411SS*.PPolyproline II helixtrans-57146.9175.3-24.833.2000112.6R42 S43 L46P40-R42 PolarHBondContact O-N 3.5Å; P40-S43 VanDerWaalsContact O-CB 3.22Å; P40-S43 WeakPolarHBondContact O-CB 3.17Å; P40-S43 PolarHBondContact O-N 3.18Å; P40-S43 VanDerWaalsContact O-N 3.09Å; P40-S43 PolarHBondContact O-OG 2.95Å; P40-L46 WeakPolarHBondContact O-CD1 3.41Å
41P87.6Confident90.9Very high118 Ų11874.7 Ų74.777%0.76640%0.396SS*.THydrogen-bonded Turntrans-54.3136.5174.7-24.733.6000111.5S43P41-S43 PolarHBondContact O-N 3.35Å
42R85.2Confident90.7Very high220 Ų22071.5 Ų71.583%0.8339%0.387SS*.THydrogen-bonded Turntrans65.510.2-177.5-52.9178.6173.9174.1-2116P40 Q47P40-R42 PolarHBondContact O-N 3.5Å; R42-Q47 PolarHBondContact O-NE2 3.06Å; R42-Q47 VanDerWaalsContact O-NE2 3.07Å
43S89.3Confident90.4Very high20 Ų2077.6 Ų77.614%0.1442%0.415CS..  trans-56.8149.3170.858.80000111.4P40 P41 R45 L46P40-S43 VanDerWaalsContact O-CB 3.22Å; P40-S43 WeakPolarHBondContact O-CB 3.17Å; P40-S43 PolarHBondContact O-N 3.18Å; P40-S43 VanDerWaalsContact O-N 3.09Å; P40-S43 PolarHBondContact O-OG 2.95Å; P41-S43 PolarHBondContact O-N 3.35Å; S43-R45 PolarHBondContact O-N 3.29Å; S43-R45 VanDerWaalsContact O-N 3.14Å; S43-L46 PolarHBondContact O-N 3.34Å
44P87.3Confident90.3Very high84 Ų8474.9 Ų74.955%0.54540%0.4SS..Hα-helixtrans-52.2-36.8177.8-27.735.1000113.1L46 Q47 E48P44-L46 VanDerWaalsContact C-N 3.26Å; P44-L46 PolarHBondContact O-N 3.46Å; P44-Q47 WeakPolarHBondContact O-CB 3.48Å; P44-Q47 PolarHBondContact O-N 2.92Å; P44-E48 PolarHBondContact O-N 3.19Å
45R88.4Confident90.2Very high43 Ų4376.4 Ų76.416%0.16240%0.4CS..Hα-helixtrans-57.2-34.6177-174.2176.1-66.5-72.1-4.4113.5R36 S43 M95R36-R45 HydrophobicContact CG-CG 3.95Å; R36-R45 VanDerWaalsContact CZ-O 3.31Å; R36-R45 PolarHBondContact NH1-O 3.23Å; R36-R45 VanDerWaalsContact NH1-O 3.15Å; R36-R45 PolarHBondContact NH2-O 3.04Å; S43-R45 PolarHBondContact O-N 3.29Å; S43-R45 VanDerWaalsContact O-N 3.14Å; R45-M95 HydrophobicContact CB-SD 4Å; R45-M95 PolarHBondContact NH1-O 3.19Å; R45-M95 PolarHBondContact NH2-O 3.21Å
46L89Confident90.3Very high71 Ų7180.2 Ų80.237%0.37242%0.418SS..Hα-helixtrans-81.1-16.1178.1-67.2178.9000113.2R36 A39 P40 S43 P44R36-L46 HydrophobicContact CB-CD2 4.2Å; A39-L46 HydrophobicContact CB-CG 4.26Å; P40-L46 WeakPolarHBondContact O-CD1 3.41Å; S43-L46 PolarHBondContact O-N 3.34Å; P44-L46 VanDerWaalsContact C-N 3.26Å; P44-L46 PolarHBondContact O-N 3.46Å
47Q88.1Confident90.5Very high149 Ų14979.7 Ų79.770%0.69642%0.417SS*.Hα-helixtrans-82.7-27.4179-58.5177.916.300111.9R42 P44R42-Q47 PolarHBondContact O-NE2 3.06Å; R42-Q47 VanDerWaalsContact O-NE2 3.07Å; P44-Q47 WeakPolarHBondContact O-CB 3.48Å; P44-Q47 PolarHBondContact O-N 2.92Å
48E87.3Confident90.6Very high55 Ų5575.9 Ų75.926%0.25739%0.385SS..SBendtrans-82.9150.8175.4-72178.7-157.700112.3R36 P44 H93R36-E48 VanDerWaalsContact CZ-O 3.26Å; R36-E48 PolarHBondContact NH1-O 3.39Å; R36-E48 PolarHBondContact NH2-O 3.39Å; P44-E48 PolarHBondContact O-N 3.19Å; E48-H93 IonicContact OE1-CE1 3.8Å; E48-H93 PolarHBondContact OE1-CE1 3.44Å; E48-H93 IonicContact OE1-ND1 2.61Å; E48-H93 IonicContact OE1-NE2 2.87Å; E48-H93 IonicContact OE2-CE1 3.63Å
49P90.8Very high90.7Very high68 Ų6873.4 Ų73.444%0.44237%0.37SS..PPolyproline II helixtrans-60152.7172.725.1-33.3000111.9R36 E53 Q54R36-P49 VanDerWaalsContact NH1-C 3.34Å; R36-P49 PolarHBondContact NH1-O 2.87Å; R36-P49 VanDerWaalsContact NH1-O 3.09Å; P49-E53 HydrophobicContact CB-CB 4.08Å; P49-Q54 HydrophobicContact CB-CG 4.17Å; P49-Q54 HydrophobicContact CG-CG 3.75Å; P49-Q54 PolarHBondContact O-NE2 2.91Å
50S91.9Very high91Very high16 Ų1673.7 Ų73.711%0.11237%0.37CS..PPolyproline II helixtrans-64.4156.9175.963.40000111.6G52 E53 Q54S50-G52 PolarHBondContact O-N 2.89Å; S50-G52 VanDerWaalsContact O-N 3.1Å; S50-E53 PolarHBondContact N-OE2 3.35Å; S50-E53 PolarHBondContact O-N 2.95Å; S50-E53 VanDerWaalsContact OG-CD 3.23Å; S50-E53 WeakPolarHBondContact OG-CG 3.24Å; S50-E53 PolarHBondContact OG-OE2 3.36Å; S50-Q54 WeakPolarHBondContact O-CG 3.48Å; S50-Q54 PolarHBondContact O-N 3.45Å
51L92.9Very high91.2Very high4 Ų469.4 Ų69.42%0.02134%0.341CS..G310 helixtrans-54.1-35.3176.2-179.961.6000111.1L29 D32 E53 Q54 K57 L58 I61 W98 L99L29-L51 HydrophobicContact CD2-CB 4.44Å; L29-L51 HydrophobicContact CD2-CD2 4.47Å; L29-L51 HydrophobicContact CD2-CG 4.26Å; D32-L51 HydrophobicContact CB-CB 4.01Å; D32-L51 WeakPolarHBondContact OD2-CB 3.4Å; D32-L51 PolarHBondContact OD2-N 3.01Å; L51-E53 PolarHBondContact O-N 3.39Å; L51-Q54 PolarHBondContact O-N 2.87Å; L51-K57 HydrophobicContact CD1-CB 4.01Å; L51-K57 HydrophobicContact CD1-CD 4.08Å; L51-L58 HydrophobicContact CG-CD2 4.25Å; L51-L58 WeakPolarHBondContact O-CD2 3.34Å; L51-L58 WeakPolarHBondContact O-CG 3.08Å; L51-I61 HydrophobicContact CD1-CD1 4.23Å; L51-I61 HydrophobicContact CD2-CD1 4.42Å; L51-W98 HydrophobicContact CD2-CH2 4.33Å; L51-W98 HydrophobicContact CD2-CZ2 4.36Å; L51-L99 HydrophobicContact CD1-CD1 4.24Å; L51-L99 HydrophobicContact CD2-CD1 4.33Å; L51-L99 HydrophobicContact CD2-CD2 4.38Å
52G90Very high91.6Very high15 Ų1566.4 Ų66.416%0.15532%0.315CS..G310 helixtrans-64.7-17.1176.100000115.7S50 L58S50-G52 PolarHBondContact O-N 2.89Å; S50-G52 VanDerWaalsContact O-N 3.1Å; G52-L58 WeakPolarHBondContact O-CD1 3.22Å
53E90.6Very high92.2Very high136 Ų13659.4 Ų59.464%0.63629%0.294SS*.G310 helixtrans-102.7-12178.5-68162.914600112.1P49 S50 L51 R55P49-E53 HydrophobicContact CB-CB 4.08Å; S50-E53 PolarHBondContact N-OE2 3.35Å; S50-E53 PolarHBondContact O-N 2.95Å; S50-E53 VanDerWaalsContact OG-CD 3.23Å; S50-E53 WeakPolarHBondContact OG-CG 3.24Å; S50-E53 PolarHBondContact OG-OE2 3.36Å; L51-E53 PolarHBondContact O-N 3.39Å; E53-R55 PolarHBondContact O-N 3.39Å
54Q91.9Very high92.7Very high35 Ų3559.9 Ų59.916%0.16429%0.293CS..  trans-89.283.3-177.9-66.8-174.15200111.2P49 S50 L51 E56 K57 L58P49-Q54 HydrophobicContact CB-CG 4.17Å; P49-Q54 HydrophobicContact CG-CG 3.75Å; P49-Q54 PolarHBondContact O-NE2 2.91Å; S50-Q54 WeakPolarHBondContact O-CG 3.48Å; S50-Q54 PolarHBondContact O-N 3.45Å; L51-Q54 PolarHBondContact O-N 2.87Å; Q54-E56 PolarHBondContact O-N 3.17Å; Q54-K57 HydrophobicContact CB-CB 4.26Å; Q54-K57 HydrophobicContact CB-CD 4.11Å; Q54-K57 HydrophobicContact CB-CG 4.27Å; Q54-K57 PolarHBondContact O-N 2.95Å; Q54-L58 WeakPolarHBondContact O-CG 3.24Å; Q54-L58 PolarHBondContact O-N 3.25Å; Q54-L58 VanDerWaalsContact O-N 3.11Å
55R92.4Very high93.2Very high149 Ų14955.9 Ų55.956%0.56227%0.267SS*.Hα-helixtrans-51.3-48.6-172.2-176.7176.4177.1175-2114.3P5 M9 E53 K57 L58 E59P5-R55 HydrophobicContact CB-CG 4.47Å; M9-R55 HydrophobicContact CE-CG 4.1Å; E53-R55 PolarHBondContact O-N 3.39Å; R55-K57 VanDerWaalsContact C-N 3.33Å; R55-K57 PolarHBondContact O-N 3.02Å; R55-L58 PolarHBondContact O-N 3.14Å; R55-E59 HydrophobicContact CG-CG 4.34Å; R55-E59 IonicContact CZ-OE1 3.41Å; R55-E59 IonicContact NE-OE1 3.9Å; R55-E59 PolarHBondContact NE-OE1 3.13Å; R55-E59 IonicContact NH2-OE1 3.64Å; R55-E59 PolarHBondContact NH2-OE1 3.37Å; R55-E59 WeakPolarHBondContact O-CG 3.4Å; R55-E59 PolarHBondContact O-N 3.32Å
56E93.6Very high93.6Very high148 Ų14854.4 Ų54.469%0.69226%0.264SS*.Hα-helixtrans-62.7-40.6-176.6-65.6178.5-17900112Q54 E59 T60Q54-E56 PolarHBondContact O-N 3.17Å; E56-E59 PolarHBondContact O-N 2.96Å; E56-T60 WeakPolarHBondContact O-CB 3.47Å; E56-T60 PolarHBondContact O-N 3.27Å; E56-T60 PolarHBondContact O-OG1 3.01Å
57K95Very high94.1Very high27 Ų2757 Ų5712%0.11727%0.268CS..Hα-helixtrans-64.1-44.7175.8-65.2-172.7175.6167.20111L51 Q54 R55 T60 I61 Y90 F91 D96L51-K57 HydrophobicContact CD1-CB 4.01Å; L51-K57 HydrophobicContact CD1-CD 4.08Å; Q54-K57 HydrophobicContact CB-CB 4.26Å; Q54-K57 HydrophobicContact CB-CD 4.11Å; Q54-K57 HydrophobicContact CB-CG 4.27Å; Q54-K57 PolarHBondContact O-N 2.95Å; R55-K57 VanDerWaalsContact C-N 3.33Å; R55-K57 PolarHBondContact O-N 3.02Å; K57-T60 PolarHBondContact O-N 3.35Å; K57-I61 VanDerWaalsContact O-CG1 3.26Å; K57-I61 WeakPolarHBondContact O-CG1 3.36Å; K57-I61 PolarHBondContact O-N 3.48Å; K57-Y90 HydrophobicContact CG-CE1 4.13Å; K57-F91 HydrophobicContact CB-CE1 4.15Å; K57-F91 HydrophobicContact CD-CD1 4.47Å; K57-F91 HydrophobicContact CD-CE1 3.94Å; K57-F91 HydrophobicContact CG-CE1 4.04Å; K57-D96 WeakPolarHBondContact CE-OD2 3.42Å; K57-D96 IonicContact NZ-OD1 2.96Å; K57-D96 PolarHBondContact NZ-OD1 3.12Å; K57-D96 IonicContact NZ-OD2 2.74Å; K57-D96 PolarHBondContact NZ-OD2 3Å
58L95Very high94.5Very high2 Ų249.9 Ų49.91%0.0124%0.236CC..Hα-helixtrans-64.3-41.2178-64.1176000112.5K6 M9 L25 L29 L51 G52 Q54 R55 T60 I61 R62K6-L58 HydrophobicContact CB-CD1 4.22Å; M9-L58 HydrophobicContact CE-CB 4.22Å; M9-L58 HydrophobicContact SD-CB 3.55Å; M9-L58 VanDerWaalsContact SD-CB 3.55Å; L25-L58 HydrophobicContact CD1-CD2 4.04Å; L29-L58 HydrophobicContact CD2-CD2 3.91Å; L51-L58 HydrophobicContact CG-CD2 4.25Å; L51-L58 WeakPolarHBondContact O-CD2 3.34Å; L51-L58 WeakPolarHBondContact O-CG 3.08Å; G52-L58 WeakPolarHBondContact O-CD1 3.22Å; Q54-L58 WeakPolarHBondContact O-CG 3.24Å; Q54-L58 PolarHBondContact O-N 3.25Å; Q54-L58 VanDerWaalsContact O-N 3.11Å; R55-L58 PolarHBondContact O-N 3.14Å; L58-T60 VanDerWaalsContact C-N 3.3Å; L58-T60 PolarHBondContact O-N 3Å; L58-I61 PolarHBondContact O-N 3.33Å; L58-R62 WeakPolarHBondContact O-CB 3.4Å; L58-R62 PolarHBondContact O-N 2.89Å
59E95.1Very high95Very high71 Ų7147.7 Ų47.733%0.33223%0.225SC..Hα-helixtrans-62.1-41.4176.1-73.9178.6174.900111M9 R55 E56 L63M9-E59 HydrophobicContact CE-CG 3.33Å; M9-E59 HydrophobicContact SD-CG 4.18Å; R55-E59 HydrophobicContact CG-CG 4.34Å; R55-E59 IonicContact CZ-OE1 3.41Å; R55-E59 IonicContact NE-OE1 3.9Å; R55-E59 PolarHBondContact NE-OE1 3.13Å; R55-E59 IonicContact NH2-OE1 3.64Å; R55-E59 PolarHBondContact NH2-OE1 3.37Å; R55-E59 WeakPolarHBondContact O-CG 3.4Å; R55-E59 PolarHBondContact O-N 3.32Å; E56-E59 PolarHBondContact O-N 2.96Å; E59-L63 VanDerWaalsContact O-CB 3.28Å; E59-L63 WeakPolarHBondContact O-CB 3.47Å; E59-L63 PolarHBondContact O-N 3.09Å
60T97Very high95.4Very high26 Ų2649.9 Ų49.916%0.1623%0.228CC..Hα-helixtrans-65.6-49.8177.3-56.20000111.7E56 K57 L58 R62 L63 H64 L87 Y90E56-T60 WeakPolarHBondContact O-CB 3.47Å; E56-T60 PolarHBondContact O-N 3.27Å; E56-T60 PolarHBondContact O-OG1 3.01Å; K57-T60 PolarHBondContact O-N 3.35Å; L58-T60 VanDerWaalsContact C-N 3.3Å; L58-T60 PolarHBondContact O-N 3Å; T60-R62 PolarHBondContact O-N 3.41Å; T60-L63 PolarHBondContact O-N 3.05Å; T60-H64 PolarHBondContact O-CD2 3.37Å; T60-H64 VanDerWaalsContact O-CD2 3.29Å; T60-H64 PolarHBondContact O-N 3.38Å; T60-H64 VanDerWaalsContact O-N 3.17Å; T60-L87 HydrophobicContact CG2-CD2 4.19Å; T60-Y90 HydrophobicContact CG2-CD1 3.91Å; T60-Y90 HydrophobicContact CG2-CD2 3.84Å; T60-Y90 HydrophobicContact CG2-CE1 4.02Å; T60-Y90 HydrophobicContact CG2-CE2 3.95Å; T60-Y90 HydrophobicContact CG2-CG 3.82Å
61I97.2Very high95.6Very high0 Ų049.4 Ų49.40%023%0.225CC..Hα-helixtrans-56.8-50.6176.4-66.4165.9000110.2L25 L51 K57 L58 L63 L65 L87 F91 F103L25-I61 HydrophobicContact CD1-CB 4.38Å; L25-I61 HydrophobicContact CD1-CG2 3.77Å; L51-I61 HydrophobicContact CD1-CD1 4.23Å; L51-I61 HydrophobicContact CD2-CD1 4.42Å; K57-I61 VanDerWaalsContact O-CG1 3.26Å; K57-I61 WeakPolarHBondContact O-CG1 3.36Å; K57-I61 PolarHBondContact O-N 3.48Å; L58-I61 PolarHBondContact O-N 3.33Å; I61-L63 PolarHBondContact O-N 2.89Å; I61-L65 HydrophobicContact CG2-CD1 3.48Å; I61-L65 VanDerWaalsContact CG2-CD1 3.48Å; I61-L65 HydrophobicContact CG2-CG 3.98Å; I61-L65 VanDerWaalsContact O-CB 3.24Å; I61-L65 WeakPolarHBondContact O-CB 3.5Å; I61-L65 VanDerWaalsContact O-CG 3.25Å; I61-L65 WeakPolarHBondContact O-CG 3.48Å; I61-L65 PolarHBondContact O-N 2.66Å; I61-L87 HydrophobicContact CB-CD2 4.49Å; I61-L87 HydrophobicContact CG1-CD2 4.26Å; I61-F91 HydrophobicContact CD1-CZ 3.77Å; I61-F91 HydrophobicContact CG1-CE2 4.16Å; I61-F91 HydrophobicContact CG1-CZ 3.65Å; I61-F103 HydrophobicContact CG1-CE2 4.42Å; I61-F103 HydrophobicContact CG1-CZ 4.33Å; I61-F103 HydrophobicContact CG2-CZ 4.21Å
62R96.6Very high95.8Very high56 Ų5651.3 Ų51.321%0.21123%0.234CC..Hα-helixtrans-56.5-50.8179.5-179-174.680.9104.8-8.5111.5E12 M13 L58 T60 H64 C66E12-R62 IonicContact OE1-CZ 3.87Å; E12-R62 IonicContact OE1-NH1 2.78Å; E12-R62 PolarHBondContact OE1-NH1 3.18Å; E12-R62 IonicContact OE1-NH2 2.83Å; E12-R62 IonicContact OE2-CZ 2.77Å; E12-R62 IonicContact OE2-NH1 3.68Å; E12-R62 PolarHBondContact OE2-NH1 3.42Å; E12-R62 IonicContact OE2-NH2 3.82Å; M13-R62 HydrophobicContact CE-CG 4.35Å; M13-R62 HydrophobicContact CG-CG 3.76Å; M13-R62 HydrophobicContact SD-CB 4.39Å; M13-R62 HydrophobicContact SD-CG 3.76Å; L58-R62 WeakPolarHBondContact O-CB 3.4Å; L58-R62 PolarHBondContact O-N 2.89Å; T60-R62 PolarHBondContact O-N 3.41Å; R62-H64 PolarHBondContact O-N 2.99Å; R62-C66 WeakPolarHBondContact O-CB 3.24Å; R62-C66 PolarHBondContact O-N 3.1Å; R62-C66 PolarHBondContact O-SG 3.4Å
63L97.2Very high96.1Very high73 Ų7356.6 Ų56.638%0.38225%0.249SC..Hα-helixtrans-56.5-54.4-175.717763.9000111.4E59 T60 I61 R67E59-L63 VanDerWaalsContact O-CB 3.28Å; E59-L63 WeakPolarHBondContact O-CB 3.47Å; E59-L63 PolarHBondContact O-N 3.09Å; T60-L63 PolarHBondContact O-N 3.05Å; I61-L63 PolarHBondContact O-N 2.89Å; L63-R67 VanDerWaalsContact O-CG 3.29Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 3.36Å; L63-R67 VanDerWaalsContact O-N 3.1Å
64H98.4Very high96.3Very high29 Ų2955.1 Ų55.113%0.13425%0.246CC..Hα-helixtrans-74.3-35.1-175-69.7-68000112.4T60 R62 R67 A68 E83 L87T60-H64 PolarHBondContact O-CD2 3.37Å; T60-H64 VanDerWaalsContact O-CD2 3.29Å; T60-H64 PolarHBondContact O-N 3.38Å; T60-H64 VanDerWaalsContact O-N 3.17Å; R62-H64 PolarHBondContact O-N 2.99Å; H64-R67 PolarHBondContact O-N 2.91Å; H64-A68 VanDerWaalsContact O-CB 3.3Å; H64-A68 WeakPolarHBondContact O-CB 3.44Å; H64-A68 PolarHBondContact O-N 2.94Å; H64-E83 IonicContact CE1-OE2 3.66Å; H64-E83 IonicContact CG-OE2 3.95Å; H64-E83 IonicContact ND1-OE2 2.67Å; H64-E83 PolarHBondContact ND1-OE2 3.07Å; H64-L87 HydrophobicContact CB-CD1 3.64Å; H64-L87 HydrophobicContact CB-CD2 3.83Å; H64-L87 HydrophobicContact CB-CG 3.5Å; H64-L87 VanDerWaalsContact CB-CG 3.5Å
65L98.1Very high96.5Very high0 Ų055.3 Ų55.30%026%0.257CS..Hα-helixtrans-63.5-47173.7-73.5-175.4000111.7S21 E24 L25 I61 R67 A68 E69 L87 F103S21-L65 VanDerWaalsContact OG-C 3.27Å; S21-L65 PolarHBondContact OG-O 3.38Å; E24-L65 HydrophobicContact CB-CD1 4.36Å; E24-L65 HydrophobicContact CG-CD1 4.3Å; L25-L65 HydrophobicContact CB-CD1 4.34Å; I61-L65 HydrophobicContact CG2-CD1 3.48Å; I61-L65 VanDerWaalsContact CG2-CD1 3.48Å; I61-L65 HydrophobicContact CG2-CG 3.98Å; I61-L65 VanDerWaalsContact O-CB 3.24Å; I61-L65 WeakPolarHBondContact O-CB 3.5Å; I61-L65 VanDerWaalsContact O-CG 3.25Å; I61-L65 WeakPolarHBondContact O-CG 3.48Å; I61-L65 PolarHBondContact O-N 2.66Å; L65-R67 VanDerWaalsContact C-N 3.32Å; L65-R67 PolarHBondContact O-N 3.49Å; L65-A68 PolarHBondContact O-N 3.1Å; L65-E69 PolarHBondContact O-N 3.31Å; L65-L87 HydrophobicContact CD2-CD1 3.95Å; L65-L87 HydrophobicContact CG-CD1 4.05Å; L65-F103 HydrophobicContact CD2-CE1 4.04Å
66C97.8Very high96.7Very high13 Ų1350.4 Ų50.49%0.08825%0.245CC..Hα-helixtrans-62.2-39.7178-70.20000112.1Y18 R62 E69 K70Y18-C66 HydrophobicContact CD1-CB 4.21Å; Y18-C66 HydrophobicContact CD2-CB 3.93Å; Y18-C66 VanDerWaalsContact CD2-SG 3.55Å; Y18-C66 HydrophobicContact CE1-CB 4.29Å; Y18-C66 WeakPolarHBondContact CE1-O 3.29Å; Y18-C66 HydrophobicContact CE2-CB 4Å; Y18-C66 HydrophobicContact CG-CB 4.04Å; R62-C66 WeakPolarHBondContact O-CB 3.24Å; R62-C66 PolarHBondContact O-N 3.1Å; R62-C66 PolarHBondContact O-SG 3.4Å; C66-E69 PolarHBondContact O-N 2.9Å; C66-K70 WeakPolarHBondContact O-CB 3.44Å; C66-K70 PolarHBondContact O-N 3.38Å
67R98.2Very high96.8Very high124 Ų12446.9 Ų46.947%0.46823%0.226SC..Hα-helixtrans-64-44174.4-74.8177.4178.6-169.81.9111.9L63 H64 L65 K70 A71 E83L63-R67 VanDerWaalsContact O-CG 3.29Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 3.36Å; L63-R67 VanDerWaalsContact O-N 3.1Å; H64-R67 PolarHBondContact O-N 2.91Å; L65-R67 VanDerWaalsContact C-N 3.32Å; L65-R67 PolarHBondContact O-N 3.49Å; R67-K70 PolarHBondContact O-N 2.85Å; R67-A71 WeakPolarHBondContact O-CB 3.49Å; R67-A71 PolarHBondContact O-N 2.92Å; R67-E83 HydrophobicContact CB-CG 3.85Å; R67-E83 WeakPolarHBondContact CD-OE1 3.47Å; R67-E83 WeakPolarHBondContact CD-OE2 3.44Å; R67-E83 IonicContact NH1-OE1 3.9Å
68A97.8Very high96.7Very high1 Ų149.4 Ų49.41%0.00824%0.243CC..Hα-helixtrans-61.5-46175.800000111.6H64 L65 K70 A71 E72 V80 E83H64-A68 VanDerWaalsContact O-CB 3.3Å; H64-A68 WeakPolarHBondContact O-CB 3.44Å; H64-A68 PolarHBondContact O-N 2.94Å; L65-A68 PolarHBondContact O-N 3.1Å; A68-K70 VanDerWaalsContact C-N 3.35Å; A68-K70 PolarHBondContact O-N 3.33Å; A68-A71 PolarHBondContact O-N 3.28Å; A68-E72 WeakPolarHBondContact O-CB 3.37Å; A68-E72 PolarHBondContact O-N 2.66Å; A68-V80 HydrophobicContact CB-CG1 4.34Å; A68-E83 HydrophobicContact CB-CB 3.96Å
69E97.7Very high96.8Very high8 Ų852.5 Ų52.54%0.03726%0.26CS..Hα-helixtrans-65.6-37.9178180172.9176.600112.1Y18 H19 R20 S21 L65 C66 E72 R73Y18-E69 VanDerWaalsContact C-OE2 3.31Å; Y18-E69 WeakPolarHBondContact CA-OE2 3.47Å; Y18-E69 HydrophobicContact CD1-CB 4.21Å; Y18-E69 HydrophobicContact CD1-CG 4.18Å; H19-E69 IonicContact CE1-OE1 3.11Å; H19-E69 IonicContact ND1-OE1 2.8Å; R20-E69 HydrophobicContact CB-CG 4.49Å; R20-E69 PolarHBondContact N-OE1 3Å; R20-E69 PolarHBondContact N-OE2 3.21Å; S21-E69 WeakPolarHBondContact CB-OE2 3.48Å; S21-E69 PolarHBondContact N-OE2 3.48Å; S21-E69 VanDerWaalsContact OG-CB 3.26Å; S21-E69 WeakPolarHBondContact OG-CB 3.47Å; S21-E69 PolarHBondContact OG-OE2 3.46Å; L65-E69 PolarHBondContact O-N 3.31Å; C66-E69 PolarHBondContact O-N 2.9Å; E69-E72 PolarHBondContact O-N 3.41Å; E69-R73 WeakPolarHBondContact O-CG 3.37Å; E69-R73 PolarHBondContact O-N 3.5Å; E69-R73 VanDerWaalsContact O-N 3.11Å; E69-R73 IonicContact OE1-CZ 2.75Å; E69-R73 IonicContact OE1-NE 3.24Å; E69-R73 IonicContact OE1-NH2 2.98Å; E69-R73 PolarHBondContact OE1-NH2 3.45Å
70K97.9Very high97Very high115 Ų11549.1 Ų49.150%0.524%0.244SC..Hα-helixtrans-60.6-51.4172.6-172.9179.9176-179.10111Y18 C66 R67 A68 E72 R73 D74Y18-K70 HydrophobicContact CE1-CB 4.07Å; C66-K70 WeakPolarHBondContact O-CB 3.44Å; C66-K70 PolarHBondContact O-N 3.38Å; R67-K70 PolarHBondContact O-N 2.85Å; A68-K70 VanDerWaalsContact C-N 3.35Å; A68-K70 PolarHBondContact O-N 3.33Å; K70-E72 PolarHBondContact O-N 3.36Å; K70-R73 WeakPolarHBondContact O-CB 3.43Å; K70-R73 PolarHBondContact O-N 2.9Å; K70-R73 VanDerWaalsContact O-N 3.08Å; K70-D74 PolarHBondContact O-N 3.24Å
71A97.4Very high97Very high6 Ų647.9 Ų47.95%0.0524%0.236CC..Hα-helixtrans-60.2-35.4178.900000112.5R67 A68 D74 G75 S76 I79 V80R67-A71 WeakPolarHBondContact O-CB 3.49Å; R67-A71 PolarHBondContact O-N 2.92Å; A68-A71 PolarHBondContact O-N 3.28Å; A71-D74 CarbonylContact O-C 3.56Å; A71-D74 PolarHBondContact O-N 3.48Å; A71-G75 PolarHBondContact O-N 3.24Å; A71-S76 PolarHBondContact O-N 3.09Å; A71-I79 HydrophobicContact CB-CB 3.89Å; A71-I79 HydrophobicContact CB-CG2 3.71Å; A71-V80 HydrophobicContact CB-CG2 3.84Å
72E96.1Very high97Very high43 Ų4351.9 Ų51.920%0.20126%0.255CS..Hα-helixtrans-63.3-41.9174.1169.8161.3173.800112R20 A68 E69 K70 D74 G75 W77 V80 R110R20-E72 IonicContact NH1-OE1 2.66Å; R20-E72 PolarHBondContact NH1-OE1 3.32Å; A68-E72 WeakPolarHBondContact O-CB 3.37Å; A68-E72 PolarHBondContact O-N 2.66Å; E69-E72 PolarHBondContact O-N 3.41Å; K70-E72 PolarHBondContact O-N 3.36Å; E72-D74 VanDerWaalsContact C-N 3.27Å; E72-D74 PolarHBondContact O-N 3Å; E72-G75 PolarHBondContact O-N 3.02Å; E72-G75 VanDerWaalsContact O-N 3.16Å; E72-W77 HydrophobicContact CB-CZ3 4.02Å; E72-W77 HydrophobicContact CG-CH2 3.76Å; E72-W77 HydrophobicContact CG-CZ3 3.53Å; E72-V80 HydrophobicContact CB-CG2 3.92Å; E72-R110 IonicContact OE1-NH2 3.83Å; E72-R110 IonicContact OE2-CZ 3.88Å; E72-R110 IonicContact OE2-NH2 3.62Å; E72-R110 PolarHBondContact OE2-NH2 3.18Å
73R96.1Very high97.1Very high126 Ų12650.2 Ų50.248%0.47525%0.249SC..Hα-helixtrans-64.9-34.7173.8-66.1170.2-169.7-178.41112.2G17 E69 K70 G75G17-R73 PolarHBondContact O-NH2 3.03Å; E69-R73 WeakPolarHBondContact O-CG 3.37Å; E69-R73 PolarHBondContact O-N 3.5Å; E69-R73 VanDerWaalsContact O-N 3.11Å; E69-R73 IonicContact OE1-CZ 2.75Å; E69-R73 IonicContact OE1-NE 3.24Å; E69-R73 IonicContact OE1-NH2 2.98Å; E69-R73 PolarHBondContact OE1-NH2 3.45Å; K70-R73 WeakPolarHBondContact O-CB 3.43Å; K70-R73 PolarHBondContact O-N 2.9Å; K70-R73 VanDerWaalsContact O-N 3.08Å; R73-G75 PolarHBondContact O-N 2.95Å
74D96.3Very high97.2Very high106 Ų10647.6 Ų47.657%0.56723%0.234SC*.THydrogen-bonded Turntrans-80.50.2178-60.9-22.4000112.4K70 A71 E72 S76K70-D74 PolarHBondContact O-N 3.24Å; A71-D74 CarbonylContact O-C 3.56Å; A71-D74 PolarHBondContact O-N 3.48Å; E72-D74 VanDerWaalsContact C-N 3.27Å; E72-D74 PolarHBondContact O-N 3Å; D74-S76 PolarHBondContact O-N 3.39Å
75G95.4Very high97.1Very high39 Ų3946.4 Ų46.440%0.40223%0.229SC..THydrogen-bonded Turntrans70.411.6-179.200000115A71 E72 R73 W77A71-G75 PolarHBondContact O-N 3.24Å; E72-G75 PolarHBondContact O-N 3.02Å; E72-G75 VanDerWaalsContact O-N 3.16Å; R73-G75 PolarHBondContact O-N 2.95Å; G75-W77 VanDerWaalsContact O-CD1 3.25Å; G75-W77 PolarHBondContact O-N 3.15Å; G75-W77 PolarHBondContact O-NE1 2.88Å
76S96.4Very high97.1Very high45 Ų4550.9 Ų50.932%0.31525%0.25SC..  trans-89.573.4-175.8-660000111.9A71 D74 T78 I79 V80A71-S76 PolarHBondContact O-N 3.09Å; D74-S76 PolarHBondContact O-N 3.39Å; S76-T78 VanDerWaalsContact C-N 3.31Å; S76-T78 PolarHBondContact O-N 3.02Å; S76-I79 PolarHBondContact O-N 3.29Å; S76-V80 PolarHBondContact O-N 3.4Å
77W95.8Very high97.2Very high74 Ų7450.2 Ų50.228%0.2825%0.245SC..Hα-helixtrans-65.7-25.2-172-54.8110.6000115.7E72 G75 V80 C81 F112E72-W77 HydrophobicContact CB-CZ3 4.02Å; E72-W77 HydrophobicContact CG-CH2 3.76Å; E72-W77 HydrophobicContact CG-CZ3 3.53Å; G75-W77 VanDerWaalsContact O-CD1 3.25Å; G75-W77 PolarHBondContact O-N 3.15Å; G75-W77 PolarHBondContact O-NE1 2.88Å; W77-V80 HydrophobicContact CE3-CG2 4.14Å; W77-V80 PolarHBondContact O-N 2.91Å; W77-C81 PolarHBondContact O-N 3.06Å; W77-C81 PolarHBondContact O-SG 2.69Å; W77-F112 HydrophobicContact CB-CB 4.33Å; W77-F112 HydrophobicContact CD2-CB 3.38Å; W77-F112 HydrophobicContact CD2-CG 4.23Å; W77-F112 AromaticContact CE2-CG 3.92Å; W77-F112 HydrophobicContact CE3-CB 3.78Å; W77-F112 HydrophobicContact CG-CB 3.63Å; W77-F112 HydrophobicContact CH2-CB 4.45Å; W77-F112 HydrophobicContact CH2-CD2 4.16Å; W77-F112 HydrophobicContact CZ2-CB 4.13Å; W77-F112 AromaticContact CZ2-CD2 3.99Å; W77-F112 HydrophobicContact CZ2-CD2 3.99Å; W77-F112 HydrophobicContact CZ2-CG 4.11Å; W77-F112 HydrophobicContact CZ3-CB 4.29Å
78T94.1Very high97.1Very high80 Ų8044.3 Ų44.349%0.49122%0.223SC..Hα-helixtrans-64.6-47.417448.30000110.6S76 V80 C81 E82S76-T78 VanDerWaalsContact C-N 3.31Å; S76-T78 PolarHBondContact O-N 3.02Å; T78-V80 VanDerWaalsContact C-N 3.29Å; T78-V80 PolarHBondContact O-N 2.61Å; T78-C81 PolarHBondContact O-N 2.87Å; T78-C81 VanDerWaalsContact O-N 3.08Å; T78-E82 WeakPolarHBondContact O-CG 3.45Å; T78-E82 PolarHBondContact O-N 2.98Å
79I96.8Very high97.1Very high68 Ų6849.2 Ų49.235%0.34924%0.241SC..Hα-helixtrans-62.3-39177.1-59.4177.3000110.4A71 S76 C81 E82 E83A71-I79 HydrophobicContact CB-CB 3.89Å; A71-I79 HydrophobicContact CB-CG2 3.71Å; S76-I79 PolarHBondContact O-N 3.29Å; I79-C81 VanDerWaalsContact C-N 3.3Å; I79-C81 PolarHBondContact O-N 3.08Å; I79-E82 PolarHBondContact O-N 3.14Å; I79-E83 HydrophobicContact CG2-CG 4.13Å; I79-E83 VanDerWaalsContact O-CG 3.29Å; I79-E83 WeakPolarHBondContact O-CG 3.26Å; I79-E83 PolarHBondContact O-N 3.09Å
80V97.8Very high97.1Very high0 Ų053.1 Ų53.10%026%0.256CS..Hα-helixtrans-54.9-48.7173.6-1790000110.6A68 A71 E72 S76 W77 T78 E83 R84A68-V80 HydrophobicContact CB-CG1 4.34Å; A71-V80 HydrophobicContact CB-CG2 3.84Å; E72-V80 HydrophobicContact CB-CG2 3.92Å; S76-V80 PolarHBondContact O-N 3.4Å; W77-V80 HydrophobicContact CE3-CG2 4.14Å; W77-V80 PolarHBondContact O-N 2.91Å; T78-V80 VanDerWaalsContact C-N 3.29Å; T78-V80 PolarHBondContact O-N 2.61Å; V80-E83 PolarHBondContact O-N 3.26Å; V80-R84 VanDerWaalsContact O-CG 3.27Å; V80-R84 WeakPolarHBondContact O-CG 3.38Å; V80-R84 PolarHBondContact O-N 2.95Å; V80-R84 VanDerWaalsContact O-N 3.11Å
81C97.8Very high97Very high0 Ų048 Ų480%023%0.234CC..Hα-helixtrans-68.2-37.4-180-600000112.1W77 T78 I79 R84 L85 C107 G113 S116W77-C81 PolarHBondContact O-N 3.06Å; W77-C81 PolarHBondContact O-SG 2.69Å; T78-C81 PolarHBondContact O-N 2.87Å; T78-C81 VanDerWaalsContact O-N 3.08Å; I79-C81 VanDerWaalsContact C-N 3.3Å; I79-C81 PolarHBondContact O-N 3.08Å; C81-R84 PolarHBondContact O-N 3.4Å; C81-L85 VanDerWaalsContact O-CB 3.27Å; C81-L85 WeakPolarHBondContact O-CB 3.3Å; C81-L85 PolarHBondContact O-N 3.35Å; C81-C107 PolarHBondContact O-SG 3.15Å; C81-G113 VanDerWaalsContact SG-C 3.56Å; C81-G113 PolarHBondContact SG-O 3.26Å; C81-G113 VanDerWaalsContact SG-O 3.32Å; C81-S116 WeakPolarHBondContact CB-OG 3.43Å
82E97.7Very high96.8Very high83 Ų8353.4 Ų53.439%0.38827%0.266SS..Hα-helixtrans-58.9-51.6174.1-71.9169.9-174.500111.2T78 I79 R84 L85 H86 S118T78-E82 WeakPolarHBondContact O-CG 3.45Å; T78-E82 PolarHBondContact O-N 2.98Å; I79-E82 PolarHBondContact O-N 3.14Å; E82-R84 VanDerWaalsContact C-N 3.31Å; E82-R84 PolarHBondContact O-N 3.35Å; E82-L85 WeakPolarHBondContact O-CB 3.33Å; E82-L85 PolarHBondContact O-N 2.95Å; E82-H86 PolarHBondContact O-N 2.89Å; E82-H86 PolarHBondContact O-ND1 3.05Å; E82-S118 WeakPolarHBondContact CG-OG 3.41Å
83E98.4Very high96.5Very high22 Ų2255.2 Ų55.210%0.10328%0.275CS..Hα-helixtrans-62.7-37.1-179.3-64.6-68158.600111.9H64 R67 A68 I79 V80 H86 L87H64-E83 IonicContact CE1-OE2 3.66Å; H64-E83 IonicContact CG-OE2 3.95Å; H64-E83 IonicContact ND1-OE2 2.67Å; H64-E83 PolarHBondContact ND1-OE2 3.07Å; R67-E83 HydrophobicContact CB-CG 3.85Å; R67-E83 WeakPolarHBondContact CD-OE1 3.47Å; R67-E83 WeakPolarHBondContact CD-OE2 3.44Å; R67-E83 IonicContact NH1-OE1 3.9Å; A68-E83 HydrophobicContact CB-CB 3.96Å; I79-E83 HydrophobicContact CG2-CG 4.13Å; I79-E83 VanDerWaalsContact O-CG 3.29Å; I79-E83 WeakPolarHBondContact O-CG 3.26Å; I79-E83 PolarHBondContact O-N 3.09Å; V80-E83 PolarHBondContact O-N 3.26Å; E83-H86 PolarHBondContact O-N 3.45Å; E83-L87 PolarHBondContact O-N 2.88Å
84R98.3Very high96.2Very high18 Ų1853.3 Ų53.37%0.06828%0.279CS..Hα-helixtrans-68.8-39.7174-65.3-58.6-175.7134.7-13.7112.7E24 V80 C81 E82 H86 L87 G88 S106 C107E24-R84 VanDerWaalsContact CD-NH1 3.3Å; E24-R84 IonicContact OE1-CZ 3.81Å; E24-R84 IonicContact OE1-NH1 3.58Å; E24-R84 PolarHBondContact OE1-NH1 3.29Å; E24-R84 IonicContact OE1-NH2 3.04Å; E24-R84 IonicContact OE2-CZ 3.6Å; E24-R84 VanDerWaalsContact OE2-CZ 3.31Å; E24-R84 IonicContact OE2-NH1 3.45Å; E24-R84 PolarHBondContact OE2-NH1 3.31Å; E24-R84 VanDerWaalsContact OE2-NH1 3.13Å; E24-R84 IonicContact OE2-NH2 2.66Å; E24-R84 PolarHBondContact OE2-NH2 3.35Å; V80-R84 VanDerWaalsContact O-CG 3.27Å; V80-R84 WeakPolarHBondContact O-CG 3.38Å; V80-R84 PolarHBondContact O-N 2.95Å; V80-R84 VanDerWaalsContact O-N 3.11Å; C81-R84 PolarHBondContact O-N 3.4Å; E82-R84 VanDerWaalsContact C-N 3.31Å; E82-R84 PolarHBondContact O-N 3.35Å; R84-H86 VanDerWaalsContact C-N 3.32Å; R84-H86 PolarHBondContact O-N 3.28Å; R84-L87 PolarHBondContact O-N 3.43Å; R84-G88 PolarHBondContact O-N 3.44Å; R84-S106 WeakPolarHBondContact CD-OG 3.33Å; R84-S106 PolarHBondContact NH1-OG 3.15Å; R84-C107 HydrophobicContact CB-CB 3.67Å
85L98.1Very high95.8Very high4 Ų450.4 Ų50.42%0.02126%0.262CS..Hα-helixtrans-62.7-39.4176178.869.2000111.6C81 E82 L87 G88 R89 Y104 E121 A122C81-L85 VanDerWaalsContact O-CB 3.27Å; C81-L85 WeakPolarHBondContact O-CB 3.3Å; C81-L85 PolarHBondContact O-N 3.35Å; E82-L85 WeakPolarHBondContact O-CB 3.33Å; E82-L85 PolarHBondContact O-N 2.95Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 2.88Å; L85-G88 PolarHBondContact O-N 3.13Å; L85-R89 WeakPolarHBondContact O-CG 3.4Å; L85-R89 PolarHBondContact O-N 2.77Å; L85-Y104 HydrophobicContact CD1-CD1 4.21Å; L85-Y104 HydrophobicContact CD1-CE1 3.89Å; L85-E121 HydrophobicContact CD1-CB 4.21Å; L85-E121 HydrophobicContact CD2-CB 4.08Å; L85-E121 VanDerWaalsContact CD2-OE2 3.31Å; L85-E121 WeakPolarHBondContact CD2-OE2 3.41Å; L85-A122 HydrophobicContact CD1-CB 3.98Å
86H98.1Very high95.6Very high93 Ų9349.2 Ų49.243%0.43125%0.247SC..Hα-helixtrans-58.8-43.2174.1-74.392.1000111.6E82 E83 R84 R89 Y90E82-H86 PolarHBondContact O-N 2.89Å; E82-H86 PolarHBondContact O-ND1 3.05Å; E83-H86 PolarHBondContact O-N 3.45Å; R84-H86 VanDerWaalsContact C-N 3.32Å; R84-H86 PolarHBondContact O-N 3.28Å; H86-R89 PolarHBondContact O-N 3.13Å; H86-Y90 WeakPolarHBondContact O-CB 3.41Å; H86-Y90 PolarHBondContact O-N 3.23Å
87L98.3Very high95.5Very high0 Ų049.2 Ų49.20%024%0.243CC..Hα-helixtrans-64.2-43.3175.6-73.6171.3000112.6T60 I61 H64 L65 E83 R84 L85 R89 Y90 F91 F103T60-L87 HydrophobicContact CG2-CD2 4.19Å; I61-L87 HydrophobicContact CB-CD2 4.49Å; I61-L87 HydrophobicContact CG1-CD2 4.26Å; H64-L87 HydrophobicContact CB-CD1 3.64Å; H64-L87 HydrophobicContact CB-CD2 3.83Å; H64-L87 HydrophobicContact CB-CG 3.5Å; H64-L87 VanDerWaalsContact CB-CG 3.5Å; L65-L87 HydrophobicContact CD2-CD1 3.95Å; L65-L87 HydrophobicContact CG-CD1 4.05Å; E83-L87 PolarHBondContact O-N 2.88Å; R84-L87 PolarHBondContact O-N 3.43Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 2.88Å; L87-R89 VanDerWaalsContact C-N 3.3Å; L87-R89 PolarHBondContact O-N 3.27Å; L87-Y90 PolarHBondContact O-N 3.02Å; L87-F91 HydrophobicContact CD2-CE2 4.47Å; L87-F91 WeakPolarHBondContact O-CD2 3.49Å; L87-F103 HydrophobicContact CB-CB 3.95Å; L87-F103 HydrophobicContact CB-CD1 3.89Å; L87-F103 HydrophobicContact CB-CD2 3.62Å; L87-F103 HydrophobicContact CB-CE1 4.33Å; L87-F103 HydrophobicContact CB-CE2 4.06Å; L87-F103 HydrophobicContact CB-CG 3.53Å; L87-F103 HydrophobicContact CB-CZ 4.39Å; L87-F103 HydrophobicContact CD1-CD1 3.8Å; L87-F103 HydrophobicContact CD1-CE1 3.63Å; L87-F103 HydrophobicContact CD1-CE2 4.44Å; L87-F103 HydrophobicContact CD1-CG 4.32Å; L87-F103 HydrophobicContact CD1-CZ 3.96Å; L87-F103 HydrophobicContact CG-CD1 4.48Å
88G97.6Very high95.5Very high0 Ų047.5 Ų47.50%024%0.236CC..Hα-helixtrans-58.9-41.4176.700000112.8R84 L85 S100 Y104R84-G88 PolarHBondContact O-N 3.44Å; L85-G88 PolarHBondContact O-N 3.13Å; G88-S100 WeakPolarHBondContact O-CB 3.33Å; G88-Y104 VanDerWaalsContact C-CE1 3.5Å; G88-Y104 VanDerWaalsContact C-OH 3.25Å; G88-Y104 VanDerWaalsContact CA-CE1 3.48Å; G88-Y104 PolarHBondContact O-OH 3.18Å
89R97.2Very high95.7Very high104 Ų10443.7 Ų43.739%0.39221%0.213SC..Hα-helixtrans-73.1-26.7179.3-72.8177172162.40.6114.2L85 H86 L87 Y104 E121 H125L85-R89 WeakPolarHBondContact O-CG 3.4Å; L85-R89 PolarHBondContact O-N 2.77Å; H86-R89 PolarHBondContact O-N 3.13Å; L87-R89 VanDerWaalsContact C-N 3.3Å; L87-R89 PolarHBondContact O-N 3.27Å; R89-Y104 WeakPolarHBondContact CA-OH 3.43Å; R89-Y104 HydrophobicContact CG-CE1 4.28Å; R89-Y104 WeakPolarHBondContact CG-OH 3.46Å; R89-Y104 PolarHBondContact N-OH 3.29Å; R89-E121 IonicContact CZ-OE2 2.74Å; R89-E121 IonicContact NH1-OE2 3.36Å; R89-E121 IonicContact NH2-OE2 2.74Å; R89-E121 PolarHBondContact NH2-OE2 3.37Å; R89-H125 PolarHBondContact NE-NE2 3.44Å
90Y97.8Very high95.7Very high90 Ų9040.6 Ų40.635%0.35320%0.197SC..Hα-helixtrans-68-36.2-174.9176.2-98.9000112.6K57 T60 H86 L87 T92K57-Y90 HydrophobicContact CG-CE1 4.13Å; T60-Y90 HydrophobicContact CG2-CD1 3.91Å; T60-Y90 HydrophobicContact CG2-CD2 3.84Å; T60-Y90 HydrophobicContact CG2-CE1 4.02Å; T60-Y90 HydrophobicContact CG2-CE2 3.95Å; T60-Y90 HydrophobicContact CG2-CG 3.82Å; H86-Y90 WeakPolarHBondContact O-CB 3.41Å; H86-Y90 PolarHBondContact O-N 3.23Å; L87-Y90 PolarHBondContact O-N 3.02Å; Y90-T92 PolarHBondContact O-N 3.39Å
91F95.9Very high95.7Very high7 Ų741.6 Ų41.63%0.03120%0.202CC..  trans-88.4100.7-178.2-61.5-70.8000110.8K57 I61 L87 D96 L99 S100 F103K57-F91 HydrophobicContact CB-CE1 4.15Å; K57-F91 HydrophobicContact CD-CD1 4.47Å; K57-F91 HydrophobicContact CD-CE1 3.94Å; K57-F91 HydrophobicContact CG-CE1 4.04Å; I61-F91 HydrophobicContact CD1-CZ 3.77Å; I61-F91 HydrophobicContact CG1-CE2 4.16Å; I61-F91 HydrophobicContact CG1-CZ 3.65Å; L87-F91 HydrophobicContact CD2-CE2 4.47Å; L87-F91 WeakPolarHBondContact O-CD2 3.49Å; F91-D96 HydrophobicContact CB-CB 3.85Å; F91-D96 HydrophobicContact CD1-CB 3.84Å; F91-D96 HydrophobicContact CG-CB 4.19Å; F91-L99 HydrophobicContact CB-CB 4.27Å; F91-L99 HydrophobicContact CD1-CB 4.32Å; F91-L99 HydrophobicContact CD1-CD1 3.71Å; F91-L99 HydrophobicContact CD2-CB 3.61Å; F91-L99 HydrophobicContact CD2-CD1 4.28Å; F91-L99 HydrophobicContact CE1-CD1 3.59Å; F91-L99 HydrophobicContact CE2-CB 4.04Å; F91-L99 HydrophobicContact CE2-CD1 4.21Å; F91-L99 HydrophobicContact CG-CB 3.79Å; F91-L99 HydrophobicContact CG-CD1 4.07Å; F91-L99 HydrophobicContact CZ-CD1 3.87Å; F91-S100 VanDerWaalsContact CB-OG 3.3Å; F91-S100 WeakPolarHBondContact CB-OG 3.34Å; F91-S100 PolarHBondContact O-OG 3.21Å; F91-F103 HydrophobicContact CD2-CD2 4.07Å; F91-F103 HydrophobicContact CD2-CE2 4.15Å; F91-F103 AromaticContact CE2-CD2 3.89Å; F91-F103 HydrophobicContact CE2-CD2 3.89Å; F91-F103 AromaticContact CE2-CE2 3.56Å; F91-F103 HydrophobicContact CE2-CE2 3.56Å; F91-F103 HydrophobicContact CZ-CE2 4.46Å
92T91.9Very high95.7Very high119 Ų11944.8 Ų44.873%0.7322%0.216SC*.  trans-112.1-13.6178.757.30000113.2Y90Y90-T92 PolarHBondContact O-N 3.39Å
93H90.8Very high95.7Very high82 Ų8240.8 Ų40.838%0.3820%0.198SC..SBendtrans-70.4138.5-179.6-166.2-95.7000110.7E48 M95 D96 I97E48-H93 IonicContact OE1-CE1 3.8Å; E48-H93 PolarHBondContact OE1-CE1 3.44Å; E48-H93 IonicContact OE1-ND1 2.61Å; E48-H93 IonicContact OE1-NE2 2.87Å; E48-H93 IonicContact OE2-CE1 3.63Å; H93-M95 PolarHBondContact ND1-N 2.8Å; H93-M95 PolarHBondContact O-N 2.98Å; H93-D96 HydrophobicContact CB-CB 4.48Å; H93-D96 VanDerWaalsContact CB-OD2 3.32Å; H93-D96 WeakPolarHBondContact CB-OD2 3.44Å; H93-D96 WeakPolarHBondContact O-CA 3.45Å; H93-D96 PolarHBondContact O-N 3.23Å; H93-I97 PolarHBondContact O-N 3.47Å
94P88.9Confident95.7Very high85 Ų8540.4 Ų40.455%0.55220%0.195SC*.THydrogen-bonded Turntrans-53-32.7-176.9-30.436.1000115.1D96P94-D96 VanDerWaalsContact C-N 3.3Å; P94-D96 PolarHBondContact O-N 3.16Å
95M88.3Confident95.7Very high46 Ų4641.8 Ų41.823%0.22720%0.202CC..THydrogen-bonded Turntrans-76-15.6178.4-66.5-61.191.600114.6R45 H93 W98R45-M95 HydrophobicContact CB-SD 4Å; R45-M95 PolarHBondContact NH1-O 3.19Å; R45-M95 PolarHBondContact NH2-O 3.21Å; H93-M95 PolarHBondContact ND1-N 2.8Å; H93-M95 PolarHBondContact O-N 2.98Å; M95-W98 PolarHBondContact O-NE1 3.26Å
96D92.4Very high95.6Very high13 Ų1342.7 Ų42.77%0.0721%0.209CC..THydrogen-bonded Turntrans-106.3-4.3-178.7-56.3-47.1000113.5K57 F91 H93 P94 W98 L99 S100K57-D96 WeakPolarHBondContact CE-OD2 3.42Å; K57-D96 IonicContact NZ-OD1 2.96Å; K57-D96 PolarHBondContact NZ-OD1 3.12Å; K57-D96 IonicContact NZ-OD2 2.74Å; K57-D96 PolarHBondContact NZ-OD2 3Å; F91-D96 HydrophobicContact CB-CB 3.85Å; F91-D96 HydrophobicContact CD1-CB 3.84Å; F91-D96 HydrophobicContact CG-CB 4.19Å; H93-D96 HydrophobicContact CB-CB 4.48Å; H93-D96 VanDerWaalsContact CB-OD2 3.32Å; H93-D96 WeakPolarHBondContact CB-OD2 3.44Å; H93-D96 WeakPolarHBondContact O-CA 3.45Å; H93-D96 PolarHBondContact O-N 3.23Å; P94-D96 VanDerWaalsContact C-N 3.3Å; P94-D96 PolarHBondContact O-N 3.16Å; D96-W98 PolarHBondContact O-N 3.08Å; D96-L99 HydrophobicContact CB-CD1 4.33Å; D96-L99 WeakPolarHBondContact O-CA 3.41Å; D96-L99 VanDerWaalsContact O-CB 3.28Å; D96-L99 WeakPolarHBondContact O-CB 3.24Å; D96-L99 PolarHBondContact O-N 3.03Å; D96-S100 PolarHBondContact O-N 3.28Å
97I93.8Very high95.6Very high46 Ų4638.3 Ų38.324%0.23619%0.189CC..Hα-helixtrans-52.5-30.8-177.1-71.3173.9000112.3H93 L99 S100 F101 L129H93-I97 PolarHBondContact O-N 3.47Å; I97-L99 VanDerWaalsContact C-N 3.28Å; I97-L99 PolarHBondContact O-N 3.37Å; I97-S100 WeakPolarHBondContact O-CA 3.48Å; I97-S100 VanDerWaalsContact O-CB 3.31Å; I97-S100 WeakPolarHBondContact O-CB 3.22Å; I97-S100 PolarHBondContact O-N 3.45Å; I97-S100 VanDerWaalsContact O-N 3.08Å; I97-S100 PolarHBondContact O-OG 2.86Å; I97-F101 HydrophobicContact CG2-CD2 3.76Å; I97-F101 HydrophobicContact CG2-CE2 3.74Å; I97-F101 WeakPolarHBondContact O-CD2 3.48Å; I97-F101 PolarHBondContact O-N 3.05Å; I97-L129 HydrophobicContact CG2-CD2 4.02Å
98W95.6Very high95.5Very high38 Ų3838.3 Ų38.314%0.14419%0.189CC..Hα-helixtrans-62.5-31.3175.170.9-87.8000113.4L28 F31 D32 L51 M95 D96 H102L28-W98 HydrophobicContact CB-CH2 4.31Å; L28-W98 HydrophobicContact CD2-CH2 4.34Å; L28-W98 HydrophobicContact CD2-CZ3 3.76Å; F31-W98 HydrophobicContact CD1-CD2 4.1Å; F31-W98 AromaticContact CD1-CE3 3.53Å; F31-W98 HydrophobicContact CD1-CE3 3.53Å; F31-W98 AromaticContact CD1-CH2 3.83Å; F31-W98 HydrophobicContact CD1-CH2 3.83Å; F31-W98 HydrophobicContact CD1-CZ2 4.38Å; F31-W98 AromaticContact CD1-CZ3 3.39Å; F31-W98 HydrophobicContact CD1-CZ3 3.39Å; F31-W98 AromaticContact CE1-CD2 3.93Å; F31-W98 HydrophobicContact CE1-CD2 3.93Å; F31-W98 AromaticContact CE1-CE3 3.57Å; F31-W98 HydrophobicContact CE1-CE3 3.57Å; F31-W98 HydrophobicContact CE1-CG 4.45Å; F31-W98 AromaticContact CE1-CZ3 3.95Å; F31-W98 HydrophobicContact CE1-CZ3 3.95Å; F31-W98 HydrophobicContact CG-CZ3 4.38Å; D32-W98 HydrophobicContact CB-CH2 4.46Å; D32-W98 HydrophobicContact CB-CZ2 4.11Å; L51-W98 HydrophobicContact CD2-CH2 4.33Å; L51-W98 HydrophobicContact CD2-CZ2 4.36Å; M95-W98 PolarHBondContact O-NE1 3.26Å; D96-W98 PolarHBondContact O-N 3.08Å; W98-H102 WeakPolarHBondContact O-CB 3.41Å; W98-H102 PolarHBondContact O-N 2.9Å
99L97.4Very high95.3Very high0 Ų042.2 Ų42.20%021%0.21CC..Hα-helixtrans-68.5-40.4171.6-71.1166000110.3L28 L51 F91 D96 I97 H102 F103L28-L99 HydrophobicContact CB-CD2 4.45Å; L28-L99 HydrophobicContact CD1-CD2 4.13Å; L28-L99 HydrophobicContact CD2-CD2 4.08Å; L28-L99 HydrophobicContact CG-CD2 4.45Å; L51-L99 HydrophobicContact CD1-CD1 4.24Å; L51-L99 HydrophobicContact CD2-CD1 4.33Å; L51-L99 HydrophobicContact CD2-CD2 4.38Å; F91-L99 HydrophobicContact CB-CB 4.27Å; F91-L99 HydrophobicContact CD1-CB 4.32Å; F91-L99 HydrophobicContact CD1-CD1 3.71Å; F91-L99 HydrophobicContact CD2-CB 3.61Å; F91-L99 HydrophobicContact CD2-CD1 4.28Å; F91-L99 HydrophobicContact CE1-CD1 3.59Å; F91-L99 HydrophobicContact CE2-CB 4.04Å; F91-L99 HydrophobicContact CE2-CD1 4.21Å; F91-L99 HydrophobicContact CG-CB 3.79Å; F91-L99 HydrophobicContact CG-CD1 4.07Å; F91-L99 HydrophobicContact CZ-CD1 3.87Å; D96-L99 HydrophobicContact CB-CD1 4.33Å; D96-L99 WeakPolarHBondContact O-CA 3.41Å; D96-L99 VanDerWaalsContact O-CB 3.28Å; D96-L99 WeakPolarHBondContact O-CB 3.24Å; D96-L99 PolarHBondContact O-N 3.03Å; I97-L99 VanDerWaalsContact C-N 3.28Å; I97-L99 PolarHBondContact O-N 3.37Å; L99-H102 PolarHBondContact O-N 3.21Å; L99-F103 HydrophobicContact CB-CD2 4.33Å; L99-F103 HydrophobicContact CB-CE2 4.21Å; L99-F103 HydrophobicContact CD2-CE2 4.12Å; L99-F103 WeakPolarHBondContact O-CD2 3.29Å; L99-F103 PolarHBondContact O-N 3.13Å
100S97.8Very high95Very high3 Ų340 Ų402%0.02120%0.201CC..Hα-helixtrans-60-48.9175.5-35.60000110.7G88 F91 D96 I97 H102 F103 Y104G88-S100 WeakPolarHBondContact O-CB 3.33Å; F91-S100 VanDerWaalsContact CB-OG 3.3Å; F91-S100 WeakPolarHBondContact CB-OG 3.34Å; F91-S100 PolarHBondContact O-OG 3.21Å; D96-S100 PolarHBondContact O-N 3.28Å; I97-S100 WeakPolarHBondContact O-CA 3.48Å; I97-S100 VanDerWaalsContact O-CB 3.31Å; I97-S100 WeakPolarHBondContact O-CB 3.22Å; I97-S100 PolarHBondContact O-N 3.45Å; I97-S100 VanDerWaalsContact O-N 3.08Å; I97-S100 PolarHBondContact O-OG 2.86Å; S100-H102 PolarHBondContact O-N 3.4Å; S100-F103 PolarHBondContact O-N 2.99Å; S100-Y104 WeakPolarHBondContact O-CB 3.49Å; S100-Y104 WeakPolarHBondContact O-CD2 3.29Å; S100-Y104 VanDerWaalsContact O-CG 3.28Å; S100-Y104 PolarHBondContact O-N 3.17Å
101F97.6Very high94.7Very high21 Ų2142 Ų429%0.09222%0.223CC..Hα-helixtrans-53.2-52.9172.3-91.2-75.8000111.8I97 F103 Y104 H105 L126 L129 Y130 Q133I97-F101 HydrophobicContact CG2-CD2 3.76Å; I97-F101 HydrophobicContact CG2-CE2 3.74Å; I97-F101 WeakPolarHBondContact O-CD2 3.48Å; I97-F101 PolarHBondContact O-N 3.05Å; F101-F103 VanDerWaalsContact C-N 3.34Å; F101-F103 PolarHBondContact O-N 3.43Å; F101-Y104 PolarHBondContact O-N 3.22Å; F101-H105 WeakPolarHBondContact O-CB 3.48Å; F101-H105 PolarHBondContact O-CD2 3.34Å; F101-H105 VanDerWaalsContact O-CD2 3.23Å; F101-H105 PolarHBondContact O-N 3.44Å; F101-L126 HydrophobicContact CD1-CD2 3.81Å; F101-L126 HydrophobicContact CE1-CD2 4.32Å; F101-L129 HydrophobicContact CD1-CD1 4.43Å; F101-L129 HydrophobicContact CD2-CB 4.49Å; F101-L129 HydrophobicContact CD2-CD1 4.03Å; F101-L129 HydrophobicContact CE1-CB 3.83Å; F101-L129 HydrophobicContact CE1-CD1 4.45Å; F101-L129 HydrophobicContact CE2-CB 3.7Å; F101-L129 HydrophobicContact CE2-CD1 4.03Å; F101-L129 HydrophobicContact CE2-CG 4.32Å; F101-L129 HydrophobicContact CG-CD1 4.24Å; F101-L129 HydrophobicContact CZ-CB 3.35Å; F101-L129 HydrophobicContact CZ-CD1 4.29Å; F101-L129 HydrophobicContact CZ-CG 4.39Å; F101-Y130 HydrophobicContact CD1-CE2 4.37Å; F101-Y130 AromaticContact CE1-CD1 3.96Å; F101-Y130 HydrophobicContact CE1-CD1 3.96Å; F101-Y130 HydrophobicContact CE1-CD2 4.01Å; F101-Y130 AromaticContact CE1-CE1 3.78Å; F101-Y130 HydrophobicContact CE1-CE1 3.78Å; F101-Y130 AromaticContact CE1-CE2 3.81Å; F101-Y130 HydrophobicContact CE1-CE2 3.81Å; F101-Y130 HydrophobicContact CE1-CG 4.07Å; F101-Y130 AromaticContact CE1-CZ 3.69Å; F101-Y130 HydrophobicContact CZ-CD1 4.32Å; F101-Y130 HydrophobicContact CZ-CE1 4.43Å; F101-Q133 HydrophobicContact CZ-CG 4.4Å
102H97.9Very high94.2Very high66 Ų6647.4 Ų47.431%0.30625%0.247SC..Hα-helixtrans-55-49.6179.5172.878.4000111.6E24 W98 L99 S100 S106E24-H102 IonicContact OE1-CD2 3.8Å; E24-H102 IonicContact OE1-CE1 3.13Å; E24-H102 IonicContact OE1-NE2 3.8Å; E24-H102 PolarHBondContact OE1-NE2 3Å; W98-H102 WeakPolarHBondContact O-CB 3.41Å; W98-H102 PolarHBondContact O-N 2.9Å; L99-H102 PolarHBondContact O-N 3.21Å; S100-H102 PolarHBondContact O-N 3.4Å; H102-S106 VanDerWaalsContact O-CB 3.3Å; H102-S106 WeakPolarHBondContact O-CB 3.43Å; H102-S106 PolarHBondContact O-N 3.36Å
103F98.4Very high94Very high0 Ų042.8 Ų42.80%022%0.223CC..Hα-helixtrans-72.3-37.5-176.2-70.4-55.4000113.1L28 I61 L65 L87 F91 L99 S100 F101 S106 C107L28-F103 HydrophobicContact CD1-CE1 4.12Å; L28-F103 HydrophobicContact CD1-CE2 4.34Å; L28-F103 HydrophobicContact CD1-CZ 3.53Å; I61-F103 HydrophobicContact CG1-CE2 4.42Å; I61-F103 HydrophobicContact CG1-CZ 4.33Å; I61-F103 HydrophobicContact CG2-CZ 4.21Å; L65-F103 HydrophobicContact CD2-CE1 4.04Å; L87-F103 HydrophobicContact CB-CB 3.95Å; L87-F103 HydrophobicContact CB-CD1 3.89Å; L87-F103 HydrophobicContact CB-CD2 3.62Å; L87-F103 HydrophobicContact CB-CE1 4.33Å; L87-F103 HydrophobicContact CB-CE2 4.06Å; L87-F103 HydrophobicContact CB-CG 3.53Å; L87-F103 HydrophobicContact CB-CZ 4.39Å; L87-F103 HydrophobicContact CD1-CD1 3.8Å; L87-F103 HydrophobicContact CD1-CE1 3.63Å; L87-F103 HydrophobicContact CD1-CE2 4.44Å; L87-F103 HydrophobicContact CD1-CG 4.32Å; L87-F103 HydrophobicContact CD1-CZ 3.96Å; L87-F103 HydrophobicContact CG-CD1 4.48Å; F91-F103 HydrophobicContact CD2-CD2 4.07Å; F91-F103 HydrophobicContact CD2-CE2 4.15Å; F91-F103 AromaticContact CE2-CD2 3.89Å; F91-F103 HydrophobicContact CE2-CD2 3.89Å; F91-F103 AromaticContact CE2-CE2 3.56Å; F91-F103 HydrophobicContact CE2-CE2 3.56Å; F91-F103 HydrophobicContact CZ-CE2 4.46Å; L99-F103 HydrophobicContact CB-CD2 4.33Å; L99-F103 HydrophobicContact CB-CE2 4.21Å; L99-F103 HydrophobicContact CD2-CE2 4.12Å; L99-F103 WeakPolarHBondContact O-CD2 3.29Å; L99-F103 PolarHBondContact O-N 3.13Å; S100-F103 PolarHBondContact O-N 2.99Å; F101-F103 VanDerWaalsContact C-N 3.34Å; F101-F103 PolarHBondContact O-N 3.43Å; F103-S106 WeakPolarHBondContact CA-OG 3.49Å; F103-S106 PolarHBondContact O-N 3.23Å; F103-S106 PolarHBondContact O-OG 3.16Å; F103-C107 WeakPolarHBondContact O-CB 3.42Å; F103-C107 PolarHBondContact O-N 2.86Å
104Y98.4Very high93.9Very high13 Ų1339 Ų395%0.05121%0.206CC..Hα-helixtrans-65.9-42.2174.4-65.8-46.2000112.1L85 G88 R89 S100 F101 C107 A108 A122 H125 L129L85-Y104 HydrophobicContact CD1-CD1 4.21Å; L85-Y104 HydrophobicContact CD1-CE1 3.89Å; G88-Y104 VanDerWaalsContact C-CE1 3.5Å; G88-Y104 VanDerWaalsContact C-OH 3.25Å; G88-Y104 VanDerWaalsContact CA-CE1 3.48Å; G88-Y104 PolarHBondContact O-OH 3.18Å; R89-Y104 WeakPolarHBondContact CA-OH 3.43Å; R89-Y104 HydrophobicContact CG-CE1 4.28Å; R89-Y104 WeakPolarHBondContact CG-OH 3.46Å; R89-Y104 PolarHBondContact N-OH 3.29Å; S100-Y104 WeakPolarHBondContact O-CB 3.49Å; S100-Y104 WeakPolarHBondContact O-CD2 3.29Å; S100-Y104 VanDerWaalsContact O-CG 3.28Å; S100-Y104 PolarHBondContact O-N 3.17Å; F101-Y104 PolarHBondContact O-N 3.22Å; Y104-C107 WeakPolarHBondContact O-CB 3.34Å; Y104-C107 PolarHBondContact O-N 3.21Å; Y104-C107 VanDerWaalsContact O-N 3.15Å; Y104-A108 VanDerWaalsContact O-CB 3.31Å; Y104-A108 WeakPolarHBondContact O-CB 3.42Å; Y104-A108 PolarHBondContact O-N 2.84Å; Y104-A122 HydrophobicContact CD1-CB 3.89Å; Y104-H125 HydrophobicContact CD1-CB 4.07Å; Y104-H125 HydrophobicContact CD2-CB 3.79Å; Y104-H125 HydrophobicContact CE1-CB 3.75Å; Y104-H125 AromaticContact CE1-CD2 3.81Å; Y104-H125 AromaticContact CE1-CG 3.84Å; Y104-H125 HydrophobicContact CE2-CB 3.46Å; Y104-H125 VanDerWaalsContact CE2-CB 3.46Å; Y104-H125 HydrophobicContact CG-CB 4.09Å; Y104-H125 VanDerWaalsContact CZ-CB 3.41Å; Y104-H125 AromaticContact CZ-CD2 3.87Å; Y104-H125 AromaticContact CZ-CG 3.5Å; Y104-L129 HydrophobicContact CD2-CD1 3.78Å; Y104-L129 HydrophobicContact CE2-CD1 3.87Å
105H97.8Very high94.1Very high47 Ų4744.1 Ų44.122%0.21822%0.215CC..Hα-helixtrans-60.6-45.8171.1-83.3-66000111.5F101 C107 A108 D109 Y130 H142F101-H105 WeakPolarHBondContact O-CB 3.48Å; F101-H105 PolarHBondContact O-CD2 3.34Å; F101-H105 VanDerWaalsContact O-CD2 3.23Å; F101-H105 PolarHBondContact O-N 3.44Å; H105-C107 PolarHBondContact O-N 2.93Å; H105-C107 VanDerWaalsContact O-N 3.09Å; H105-A108 PolarHBondContact O-N 2.66Å; H105-D109 IonicContact CE1-OD2 3.93Å; H105-D109 IonicContact CG-OD2 3.52Å; H105-D109 IonicContact ND1-OD2 3.57Å; H105-D109 PolarHBondContact ND1-OD2 3.19Å; H105-D109 PolarHBondContact O-N 2.99Å; H105-Y130 PolarHBondContact CE1-OH 2.92Å; H105-Y130 AromaticContact NE2-CE2 3.73Å; H105-Y130 AromaticContact NE2-CZ 3.7Å; H105-Y130 PolarHBondContact NE2-OH 3.1Å; H105-H142 AromaticContact CE1-CE1 3.8Å; H105-H142 AromaticContact CE1-NE2 3.55Å
106S96.1Very high94.5Very high24 Ų2442.7 Ų42.717%0.16821%0.209CC..Hα-helixtrans-62.4-19.5177.684.30000113.8R84 H102 F103 R110R84-S106 WeakPolarHBondContact CD-OG 3.33Å; R84-S106 PolarHBondContact NH1-OG 3.15Å; H102-S106 VanDerWaalsContact O-CB 3.3Å; H102-S106 WeakPolarHBondContact O-CB 3.43Å; H102-S106 PolarHBondContact O-N 3.36Å; F103-S106 WeakPolarHBondContact CA-OG 3.49Å; F103-S106 PolarHBondContact O-N 3.23Å; F103-S106 PolarHBondContact O-OG 3.16Å; S106-R110 WeakPolarHBondContact O-CD 3.49Å; S106-R110 WeakPolarHBondContact O-CG 3.4Å
107C97.4Very high94.7Very high0 Ų045.5 Ų45.50%022%0.221CC..Hα-helixtrans-88.5-52.6174.5-173.90000111.4C81 R84 F103 Y104 H105 A122C81-C107 PolarHBondContact O-SG 3.15Å; R84-C107 HydrophobicContact CB-CB 3.67Å; F103-C107 WeakPolarHBondContact O-CB 3.42Å; F103-C107 PolarHBondContact O-N 2.86Å; Y104-C107 WeakPolarHBondContact O-CB 3.34Å; Y104-C107 PolarHBondContact O-N 3.21Å; Y104-C107 VanDerWaalsContact O-N 3.15Å; H105-C107 PolarHBondContact O-N 2.93Å; H105-C107 VanDerWaalsContact O-N 3.09Å; C107-A122 HydrophobicContact CB-CB 3.75Å
108A96.1Very high94.8Very high0 Ų043.9 Ų43.90%021%0.214CC..Hα-helixtrans-67.7-50.3-173.500000112.3Y104 H105 R110 A122 R123 L126Y104-A108 VanDerWaalsContact O-CB 3.31Å; Y104-A108 WeakPolarHBondContact O-CB 3.42Å; Y104-A108 PolarHBondContact O-N 2.84Å; H105-A108 PolarHBondContact O-N 2.66Å; A108-R110 PolarHBondContact O-N 2.95Å; A108-R110 VanDerWaalsContact O-N 3.12Å; A108-A122 HydrophobicContact CB-CB 4.5Å; A108-R123 HydrophobicContact CB-CG 3.49Å; A108-R123 VanDerWaalsContact CB-CG 3.49Å; A108-R123 PolarHBondContact O-NH1 3.48Å; A108-R123 PolarHBondContact O-NH2 3.06Å; A108-L126 HydrophobicContact CB-CD1 4.04Å
109D94.1Very high94.9Very high83 Ų8342.1 Ų42.144%0.44421%0.207SC..THydrogen-bonded Turntrans-86.214.2-163.9-59.1-33.9000113.6H105 R123H105-D109 IonicContact CE1-OD2 3.93Å; H105-D109 IonicContact CG-OD2 3.52Å; H105-D109 IonicContact ND1-OD2 3.57Å; H105-D109 PolarHBondContact ND1-OD2 3.19Å; H105-D109 PolarHBondContact O-N 2.99Å; D109-R123 IonicContact OD1-NH2 2.74Å
110R90.9Very high94.9Very high56 Ų5642.1 Ų42.121%0.21121%0.207CC..  trans-72.8137.3178.9-60-171.269.790.9-5.3111.7E72 S106 A108 F112 G114E72-R110 IonicContact OE1-NH2 3.83Å; E72-R110 IonicContact OE2-CZ 3.88Å; E72-R110 IonicContact OE2-NH2 3.62Å; E72-R110 PolarHBondContact OE2-NH2 3.18Å; S106-R110 WeakPolarHBondContact O-CD 3.49Å; S106-R110 WeakPolarHBondContact O-CG 3.4Å; A108-R110 PolarHBondContact O-N 2.95Å; A108-R110 VanDerWaalsContact O-N 3.12Å; R110-F112 VanDerWaalsContact C-N 3.32Å; R110-F112 VanDerWaalsContact CB-O 3.3Å; R110-F112 WeakPolarHBondContact CB-O 3.49Å; R110-F112 PolarHBondContact O-N 3.39Å; R110-G114 VanDerWaalsContact O-CA 3.32Å; R110-G114 WeakPolarHBondContact O-CA 3.49Å; R110-G114 PolarHBondContact O-N 3.34Å
111V90.2Very high94.9Very high134 Ų13442.9 Ų42.981%0.81221%0.21SC*.THydrogen-bonded Turntrans-59.8-44.4171.4179.60000111
112F86.6Confident94.9Very high120 Ų12041.9 Ų41.953%0.52621%0.205SC..THydrogen-bonded Turntrans-105.2131.1177.5-55.4-71.5000110.5W77 R110 G114W77-F112 HydrophobicContact CB-CB 4.33Å; W77-F112 HydrophobicContact CD2-CB 3.38Å; W77-F112 HydrophobicContact CD2-CG 4.23Å; W77-F112 AromaticContact CE2-CG 3.92Å; W77-F112 HydrophobicContact CE3-CB 3.78Å; W77-F112 HydrophobicContact CG-CB 3.63Å; W77-F112 HydrophobicContact CH2-CB 4.45Å; W77-F112 HydrophobicContact CH2-CD2 4.16Å; W77-F112 HydrophobicContact CZ2-CB 4.13Å; W77-F112 AromaticContact CZ2-CD2 3.99Å; W77-F112 HydrophobicContact CZ2-CD2 3.99Å; W77-F112 HydrophobicContact CZ2-CG 4.11Å; W77-F112 HydrophobicContact CZ3-CB 4.29Å; R110-F112 VanDerWaalsContact C-N 3.32Å; R110-F112 VanDerWaalsContact CB-O 3.3Å; R110-F112 WeakPolarHBondContact CB-O 3.49Å; R110-F112 PolarHBondContact O-N 3.39Å; F112-G114 PolarHBondContact O-N 2.92Å
113G87.8Confident94.9Very high21 Ų2139.7 Ų39.722%0.21620%0.195CC..THydrogen-bonded Turntrans81.1-9.3-176.700000114.8C81 R115 S116 A119C81-G113 VanDerWaalsContact SG-C 3.56Å; C81-G113 PolarHBondContact SG-O 3.26Å; C81-G113 VanDerWaalsContact SG-O 3.32Å; G113-R115 PolarHBondContact O-N 3.15Å; G113-S116 WeakPolarHBondContact O-CB 3.47Å; G113-S116 PolarHBondContact O-N 3.44Å; G113-S116 PolarHBondContact O-OG 2.98Å; G113-A119 WeakPolarHBondContact O-CB 3.42Å
114G88.9Confident94.9Very high4 Ų439.7 Ų39.74%0.04120%0.195CC..THydrogen-bonded Turntrans-65.1-6.7-178.500000115.8R110 F112 A119 R123R110-G114 VanDerWaalsContact O-CA 3.32Å; R110-G114 WeakPolarHBondContact O-CA 3.49Å; R110-G114 PolarHBondContact O-N 3.34Å; F112-G114 PolarHBondContact O-N 2.92Å; G114-A119 WeakPolarHBondContact O-CB 3.47Å; G114-R123 PolarHBondContact O-NH1 3.49Å
115R92.4Very high94.9Very high192 Ų19241.1 Ų41.173%0.72520%0.202SC*.THydrogen-bonded Turntrans-110.317.1169.6-60.6-169.6-177.5-1602.2112.8G113 W155G113-R115 PolarHBondContact O-N 3.15Å; R115-W155 WeakPolarHBondContact O-CH2 3.33Å
116S96.1Very high94.9Very high16 Ų1638.9 Ų38.911%0.11219%0.191CC..SBendtrans-74.8163.5173.464.40000110.8C81 G113 S118 A119 T120C81-S116 WeakPolarHBondContact CB-OG 3.43Å; G113-S116 WeakPolarHBondContact O-CB 3.47Å; G113-S116 PolarHBondContact O-N 3.44Å; G113-S116 PolarHBondContact O-OG 2.98Å; S116-S118 VanDerWaalsContact C-N 3.26Å; S116-S118 PolarHBondContact O-N 3.36Å; S116-A119 PolarHBondContact O-N 2.86Å; S116-A119 WeakPolarHBondContact OG-CB 3.47Å; S116-A119 PolarHBondContact OG-N 3.4Å; S116-T120 PolarHBondContact O-N 3.21Å; S116-T120 PolarHBondContact O-OG1 2.88Å
117K96.9Very high95Very high72 Ų7237.8 Ų37.831%0.31318%0.183SC..Hα-helixtrans-51.6-47.2170.3-179.7179.6166.31760111.2A119 T120 E121 W155 L156 L163K117-A119 PolarHBondContact O-N 3.24Å; K117-T120 WeakPolarHBondContact O-CB 3.4Å; K117-T120 PolarHBondContact O-N 3.25Å; K117-T120 VanDerWaalsContact O-N 3.15Å; K117-E121 WeakPolarHBondContact CE-OE1 3.5Å; K117-E121 IonicContact NZ-OE1 3.82Å; K117-E121 WeakPolarHBondContact O-CG 3.45Å; K117-E121 PolarHBondContact O-N 2.93Å; K117-W155 HydrophobicContact CB-CD2 3.74Å; K117-W155 HydrophobicContact CB-CE3 4.16Å; K117-W155 HydrophobicContact CB-CG 3.94Å; K117-W155 HydrophobicContact CD-CB 4.07Å; K117-W155 HydrophobicContact CD-CG 4.14Å; K117-W155 HydrophobicContact CG-CB 4.17Å; K117-W155 HydrophobicContact CG-CD2 4.14Å; K117-W155 HydrophobicContact CG-CE3 4.43Å; K117-W155 HydrophobicContact CG-CG 4.01Å; K117-L156 VanDerWaalsContact CE-O 3.31Å; K117-L156 WeakPolarHBondContact CE-O 3.49Å; K117-L156 PolarHBondContact NZ-O 2.96Å; K117-L163 HydrophobicContact CG-CD2 4.39Å
118S96.9Very high95Very high12 Ų1239.6 Ų39.68%0.08419%0.192CC..Hα-helixtrans-66.2-38.1-177.4-46.70000113.5E82 S116 T120 A122E82-S118 WeakPolarHBondContact CG-OG 3.41Å; S116-S118 VanDerWaalsContact C-N 3.26Å; S116-S118 PolarHBondContact O-N 3.36Å; S118-T120 VanDerWaalsContact C-N 3.32Å; S118-A122 WeakPolarHBondContact O-CB 3.44Å; S118-A122 PolarHBondContact O-N 2.99Å
119A97.3Very high95Very high0 Ų040.7 Ų40.70%020%0.198CC..Hα-helixtrans-68-34.1173.900000112G113 G114 S116 K117 A122 R123G113-A119 WeakPolarHBondContact O-CB 3.42Å; G114-A119 WeakPolarHBondContact O-CB 3.47Å; S116-A119 PolarHBondContact O-N 2.86Å; S116-A119 WeakPolarHBondContact OG-CB 3.47Å; S116-A119 PolarHBondContact OG-N 3.4Å; K117-A119 PolarHBondContact O-N 3.24Å; A119-A122 PolarHBondContact O-N 3.44Å; A119-R123 PolarHBondContact O-N 3.31Å; A119-R123 VanDerWaalsContact O-N 3.07Å
120T97.6Very high95.2Very high0 Ų038.5 Ų38.50%018%0.184CC..Hα-helixtrans-68.4-45.9175.5-52.90000111.1S116 K117 S118 A122 R123 F124 A146 Q149 A150 W155 L163S116-T120 PolarHBondContact O-N 3.21Å; S116-T120 PolarHBondContact O-OG1 2.88Å; K117-T120 WeakPolarHBondContact O-CB 3.4Å; K117-T120 PolarHBondContact O-N 3.25Å; K117-T120 VanDerWaalsContact O-N 3.15Å; S118-T120 VanDerWaalsContact C-N 3.32Å; T120-A122 VanDerWaalsContact C-N 3.3Å; T120-A122 PolarHBondContact O-N 2.89Å; T120-R123 WeakPolarHBondContact O-CB 3.31Å; T120-R123 PolarHBondContact O-N 2.95Å; T120-R123 VanDerWaalsContact O-N 3.1Å; T120-F124 HydrophobicContact CG2-CD2 4.43Å; T120-F124 HydrophobicContact CG2-CE2 3.86Å; T120-F124 HydrophobicContact CG2-CZ 4.39Å; T120-F124 WeakPolarHBondContact O-CD2 3.27Å; T120-F124 PolarHBondContact O-N 3.05Å; T120-F124 VanDerWaalsContact O-N 3.1Å; T120-A146 HydrophobicContact CG2-CB 4.23Å; T120-A146 VanDerWaalsContact CG2-O 3.24Å; T120-A146 WeakPolarHBondContact CG2-O 3.45Å; T120-Q149 HydrophobicContact CG2-CB 3.83Å; T120-Q149 WeakPolarHBondContact OG1-CB 3.19Å; T120-Q149 PolarHBondContact OG1-OE1 3.45Å; T120-A150 HydrophobicContact CG2-CB 4.11Å; T120-W155 HydrophobicContact CG2-CZ3 4.1Å; T120-W155 WeakPolarHBondContact OG1-CZ3 3.47Å; T120-L163 HydrophobicContact CG2-CD2 4.24Å
121E97.5Very high95.5Very high19 Ų1938 Ų389%0.08918%0.181CC..Hα-helixtrans-60.1-39.8173.2-70.5179.4-174.500111.8L85 R89 K117 R123 F124 H125 L163 W166L85-E121 HydrophobicContact CD1-CB 4.21Å; L85-E121 HydrophobicContact CD2-CB 4.08Å; L85-E121 VanDerWaalsContact CD2-OE2 3.31Å; L85-E121 WeakPolarHBondContact CD2-OE2 3.41Å; R89-E121 IonicContact CZ-OE2 2.74Å; R89-E121 IonicContact NH1-OE2 3.36Å; R89-E121 IonicContact NH2-OE2 2.74Å; R89-E121 PolarHBondContact NH2-OE2 3.37Å; K117-E121 WeakPolarHBondContact CE-OE1 3.5Å; K117-E121 IonicContact NZ-OE1 3.82Å; K117-E121 WeakPolarHBondContact O-CG 3.45Å; K117-E121 PolarHBondContact O-N 2.93Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.27Å; E121-F124 PolarHBondContact O-N 3.37Å; E121-H125 PolarHBondContact O-CD2 3.11Å; E121-H125 PolarHBondContact O-N 3.5Å; E121-H125 VanDerWaalsContact O-N 3.07Å; E121-L163 HydrophobicContact CG-CD1 4.15Å; E121-L163 HydrophobicContact CG-CD2 4.19Å; E121-W166 HydrophobicContact CB-CZ3 4.25Å; E121-W166 HydrophobicContact CG-CZ3 4.19Å
122A98Very high95.7Very high0 Ų037.2 Ų37.20%017%0.169CC..Hα-helixtrans-62-37.2174.500000112.2L85 Y104 C107 A108 S118 A119 T120 H125 L126L85-A122 HydrophobicContact CD1-CB 3.98Å; Y104-A122 HydrophobicContact CD1-CB 3.89Å; C107-A122 HydrophobicContact CB-CB 3.75Å; A108-A122 HydrophobicContact CB-CB 4.5Å; S118-A122 WeakPolarHBondContact O-CB 3.44Å; S118-A122 PolarHBondContact O-N 2.99Å; A119-A122 PolarHBondContact O-N 3.44Å; T120-A122 VanDerWaalsContact C-N 3.3Å; T120-A122 PolarHBondContact O-N 2.89Å; A122-H125 PolarHBondContact O-N 3.31Å; A122-L126 WeakPolarHBondContact O-CG 3.32Å; A122-L126 PolarHBondContact O-N 3.32Å
123R98Very high96.1Very high21 Ų2137.4 Ų37.48%0.07917%0.172CC..Hα-helixtrans-67.4-37.9174.7-74.7-171.4176.482.99.4113.1A108 D109 G114 A119 T120 E121 H125 L126 A127 A146 Q149A108-R123 HydrophobicContact CB-CG 3.49Å; A108-R123 VanDerWaalsContact CB-CG 3.49Å; A108-R123 PolarHBondContact O-NH1 3.48Å; A108-R123 PolarHBondContact O-NH2 3.06Å; D109-R123 IonicContact OD1-NH2 2.74Å; G114-R123 PolarHBondContact O-NH1 3.49Å; A119-R123 PolarHBondContact O-N 3.31Å; A119-R123 VanDerWaalsContact O-N 3.07Å; T120-R123 WeakPolarHBondContact O-CB 3.31Å; T120-R123 PolarHBondContact O-N 2.95Å; T120-R123 VanDerWaalsContact O-N 3.1Å; E121-R123 VanDerWaalsContact C-N 3.3Å; E121-R123 PolarHBondContact O-N 3.27Å; R123-H125 VanDerWaalsContact C-N 3.3Å; R123-H125 PolarHBondContact O-N 2.98Å; R123-L126 WeakPolarHBondContact O-CB 3.41Å; R123-L126 PolarHBondContact O-N 3.33Å; R123-A127 PolarHBondContact O-N 3.31Å; R123-A146 HydrophobicContact CB-CB 3.64Å; R123-Q149 VanDerWaalsContact NH1-CD 3.33Å
124F97.8Very high96.5Very high0 Ų038.9 Ų38.90%019%0.187CC..Hα-helixtrans-62.6-40.6172.8-69.7-51.1000111.5T120 E121 L126 A127 E128 A146 A150 L163 W166T120-F124 HydrophobicContact CG2-CD2 4.43Å; T120-F124 HydrophobicContact CG2-CE2 3.86Å; T120-F124 HydrophobicContact CG2-CZ 4.39Å; T120-F124 WeakPolarHBondContact O-CD2 3.27Å; T120-F124 PolarHBondContact O-N 3.05Å; T120-F124 VanDerWaalsContact O-N 3.1Å; E121-F124 PolarHBondContact O-N 3.37Å; F124-L126 VanDerWaalsContact C-N 3.35Å; F124-L126 PolarHBondContact O-N 3.35Å; F124-A127 WeakPolarHBondContact O-CB 3.25Å; F124-A127 PolarHBondContact O-N 3.39Å; F124-E128 PolarHBondContact O-N 3.05Å; F124-A146 HydrophobicContact CD1-CB 3.47Å; F124-A146 VanDerWaalsContact CD1-CB 3.47Å; F124-A146 HydrophobicContact CD2-CB 4.25Å; F124-A146 HydrophobicContact CE1-CB 3.24Å; F124-A146 HydrophobicContact CE2-CB 4.08Å; F124-A146 HydrophobicContact CG-CB 3.96Å; F124-A146 HydrophobicContact CZ-CB 3.59Å; F124-A150 HydrophobicContact CE2-CB 4.26Å; F124-A150 HydrophobicContact CZ-CB 4.15Å; F124-L163 HydrophobicContact CE2-CD1 4.47Å; F124-L163 HydrophobicContact CE2-CD2 4.28Å; F124-L163 HydrophobicContact CE2-CG 4Å; F124-W166 HydrophobicContact CB-CD2 3.87Å; F124-W166 HydrophobicContact CB-CE3 3.99Å; F124-W166 HydrophobicContact CB-CH2 3.53Å; F124-W166 HydrophobicContact CB-CZ2 3.44Å; F124-W166 VanDerWaalsContact CB-CZ2 3.44Å; F124-W166 HydrophobicContact CB-CZ3 3.84Å; F124-W166 AromaticContact CD2-CD2 3.95Å; F124-W166 HydrophobicContact CD2-CD2 3.95Å; F124-W166 AromaticContact CD2-CE3 3.62Å; F124-W166 HydrophobicContact CD2-CE3 3.62Å; F124-W166 HydrophobicContact CD2-CG 4.47Å; F124-W166 AromaticContact CD2-CZ3 3.93Å; F124-W166 HydrophobicContact CD2-CZ3 3.93Å; F124-W166 HydrophobicContact CE2-CE3 4.44Å; F124-W166 AromaticContact CG-CD2 3.99Å; F124-W166 HydrophobicContact CG-CD2 3.99Å; F124-W166 HydrophobicContact CG-CE3 4.06Å; F124-W166 HydrophobicContact CG-CG 4.44Å; F124-W166 HydrophobicContact CG-CH2 4.45Å; F124-W166 HydrophobicContact CG-CZ2 4.44Å; F124-W166 HydrophobicContact CG-CZ3 4.3Å
125H97.8Very high96.8Very high43 Ų4342 Ų4220%0.19920%0.203CC..Hα-helixtrans-62.7-38.5172.6-75.5-61.9000113R89 Y104 E121 A122 R123 E128 L129 W166R89-H125 PolarHBondContact NE-NE2 3.44Å; Y104-H125 HydrophobicContact CD1-CB 4.07Å; Y104-H125 HydrophobicContact CD2-CB 3.79Å; Y104-H125 HydrophobicContact CE1-CB 3.75Å; Y104-H125 AromaticContact CE1-CD2 3.81Å; Y104-H125 AromaticContact CE1-CG 3.84Å; Y104-H125 HydrophobicContact CE2-CB 3.46Å; Y104-H125 VanDerWaalsContact CE2-CB 3.46Å; Y104-H125 HydrophobicContact CG-CB 4.09Å; Y104-H125 VanDerWaalsContact CZ-CB 3.41Å; Y104-H125 AromaticContact CZ-CD2 3.87Å; Y104-H125 AromaticContact CZ-CG 3.5Å; E121-H125 PolarHBondContact O-CD2 3.11Å; E121-H125 PolarHBondContact O-N 3.5Å; E121-H125 VanDerWaalsContact O-N 3.07Å; A122-H125 PolarHBondContact O-N 3.31Å; R123-H125 VanDerWaalsContact C-N 3.3Å; R123-H125 PolarHBondContact O-N 2.98Å; H125-E128 PolarHBondContact O-N 2.98Å; H125-L129 VanDerWaalsContact O-CG 3.3Å; H125-L129 WeakPolarHBondContact O-CG 3.35Å; H125-L129 PolarHBondContact O-N 3.13Å; H125-W166 AromaticContact CD2-CH2 3.76Å; H125-W166 AromaticContact CE1-CH2 3.7Å; H125-W166 AromaticContact NE2-CH2 3.44Å; H125-W166 WeakPolarHBondContact NE2-CH2 3.5Å
126L98.2Very high97Very high0 Ų034.3 Ų34.30%018%0.176CC..Hα-helixtrans-62.6-44.4173-73.8170.1000111.7F101 A108 A122 R123 F124 E128 L129 Y130 H142F101-L126 HydrophobicContact CD1-CD2 3.81Å; F101-L126 HydrophobicContact CE1-CD2 4.32Å; A108-L126 HydrophobicContact CB-CD1 4.04Å; A122-L126 WeakPolarHBondContact O-CG 3.32Å; A122-L126 PolarHBondContact O-N 3.32Å; R123-L126 WeakPolarHBondContact O-CB 3.41Å; R123-L126 PolarHBondContact O-N 3.33Å; F124-L126 VanDerWaalsContact C-N 3.35Å; F124-L126 PolarHBondContact O-N 3.35Å; L126-E128 VanDerWaalsContact C-N 3.3Å; L126-E128 PolarHBondContact O-N 3.15Å; L126-L129 PolarHBondContact O-N 3.35Å; L126-Y130 HydrophobicContact CB-CD2 4.38Å; L126-Y130 HydrophobicContact CB-CE2 4.44Å; L126-Y130 HydrophobicContact CD2-CE2 4.4Å; L126-Y130 WeakPolarHBondContact O-CD2 3.48Å; L126-Y130 PolarHBondContact O-N 2.74Å; L126-H142 HydrophobicContact CB-CB 4.36Å
127A98.3Very high97Very high0 Ų037.1 Ų37.10%019%0.192CC..Hα-helixtrans-57.2-46.2177.500000111.6R123 F124 Y130 R131 A139 H142 A143 I174R123-A127 PolarHBondContact O-N 3.31Å; F124-A127 WeakPolarHBondContact O-CB 3.25Å; F124-A127 PolarHBondContact O-N 3.39Å; A127-Y130 PolarHBondContact O-N 2.84Å; A127-R131 VanDerWaalsContact O-CB 3.28Å; A127-R131 WeakPolarHBondContact O-CB 3.39Å; A127-R131 PolarHBondContact O-N 3.18Å; A127-A139 WeakPolarHBondContact CB-O 3.46Å; A127-A139 WeakPolarHBondContact O-CB 3.15Å; A127-H142 HydrophobicContact CB-CB 4Å; A127-A143 HydrophobicContact CB-CB 3.73Å; A127-I174 HydrophobicContact CB-CD1 4.46Å
128E97.1Very high97Very high39 Ų3937.4 Ų37.418%0.18220%0.195CC..Hα-helixtrans-62.5-44.8177.3175.157.5-171.900112.1F124 H125 L126 R131 Q132F124-E128 PolarHBondContact O-N 3.05Å; H125-E128 PolarHBondContact O-N 2.98Å; L126-E128 VanDerWaalsContact C-N 3.3Å; L126-E128 PolarHBondContact O-N 3.15Å; E128-R131 WeakPolarHBondContact O-CB 3.45Å; E128-R131 PolarHBondContact O-N 3.04Å; E128-R131 IonicContact OE1-CZ 3.06Å; E128-R131 IonicContact OE1-NH2 3.81Å; E128-R131 PolarHBondContact OE1-NH2 3.5Å; E128-R131 IonicContact OE2-CZ 3.89Å; E128-R131 IonicContact OE2-NE 2.67Å; E128-R131 PolarHBondContact OE2-NE 3.46Å; E128-R131 IonicContact OE2-NH2 3.5Å; E128-R131 PolarHBondContact OE2-NH2 2.84Å; E128-Q132 VanDerWaalsContact O-CG 3.31Å; E128-Q132 WeakPolarHBondContact O-CG 3.36Å; E128-Q132 PolarHBondContact O-N 3.43Å; E128-Q132 PolarHBondContact OE1-NE2 3.48Å
129L96.9Very high97.1Very high22 Ų2236.9 Ų36.912%0.11519%0.191CC..Hα-helixtrans-65.7-42.2179.1-71176000112.7I97 F101 Y104 H125 L126 R131 Q132 Q133I97-L129 HydrophobicContact CG2-CD2 4.02Å; F101-L129 HydrophobicContact CD1-CD1 4.43Å; F101-L129 HydrophobicContact CD2-CB 4.49Å; F101-L129 HydrophobicContact CD2-CD1 4.03Å; F101-L129 HydrophobicContact CE1-CB 3.83Å; F101-L129 HydrophobicContact CE1-CD1 4.45Å; F101-L129 HydrophobicContact CE2-CB 3.7Å; F101-L129 HydrophobicContact CE2-CD1 4.03Å; F101-L129 HydrophobicContact CE2-CG 4.32Å; F101-L129 HydrophobicContact CG-CD1 4.24Å; F101-L129 HydrophobicContact CZ-CB 3.35Å; F101-L129 HydrophobicContact CZ-CD1 4.29Å; F101-L129 HydrophobicContact CZ-CG 4.39Å; Y104-L129 HydrophobicContact CD2-CD1 3.78Å; Y104-L129 HydrophobicContact CE2-CD1 3.87Å; H125-L129 VanDerWaalsContact O-CG 3.3Å; H125-L129 WeakPolarHBondContact O-CG 3.35Å; H125-L129 PolarHBondContact O-N 3.13Å; L126-L129 PolarHBondContact O-N 3.35Å; L129-R131 VanDerWaalsContact C-N 3.34Å; L129-Q132 PolarHBondContact O-N 3.02Å; L129-Q133 WeakPolarHBondContact O-CG 3.43Å; L129-Q133 PolarHBondContact O-N 3.44Å; L129-Q133 VanDerWaalsContact O-N 3.09Å
130Y97.9Very high97.1Very high38 Ų3840.6 Ų40.615%0.14921%0.205CC..Hα-helixtrans-64.4-39.9175.1-81.4-62000111.5F101 H105 L126 A127 Q132 Q133 G134 D135 E138 H142F101-Y130 HydrophobicContact CD1-CE2 4.37Å; F101-Y130 AromaticContact CE1-CD1 3.96Å; F101-Y130 HydrophobicContact CE1-CD1 3.96Å; F101-Y130 HydrophobicContact CE1-CD2 4.01Å; F101-Y130 AromaticContact CE1-CE1 3.78Å; F101-Y130 HydrophobicContact CE1-CE1 3.78Å; F101-Y130 AromaticContact CE1-CE2 3.81Å; F101-Y130 HydrophobicContact CE1-CE2 3.81Å; F101-Y130 HydrophobicContact CE1-CG 4.07Å; F101-Y130 AromaticContact CE1-CZ 3.69Å; F101-Y130 HydrophobicContact CZ-CD1 4.32Å; F101-Y130 HydrophobicContact CZ-CE1 4.43Å; H105-Y130 PolarHBondContact CE1-OH 2.92Å; H105-Y130 AromaticContact NE2-CE2 3.73Å; H105-Y130 AromaticContact NE2-CZ 3.7Å; H105-Y130 PolarHBondContact NE2-OH 3.1Å; L126-Y130 HydrophobicContact CB-CD2 4.38Å; L126-Y130 HydrophobicContact CB-CE2 4.44Å; L126-Y130 HydrophobicContact CD2-CE2 4.4Å; L126-Y130 WeakPolarHBondContact O-CD2 3.48Å; L126-Y130 PolarHBondContact O-N 2.74Å; A127-Y130 PolarHBondContact O-N 2.84Å; Y130-Q132 PolarHBondContact O-N 2.91Å; Y130-Q133 CarbonylContact O-C 3.58Å; Y130-Q133 PolarHBondContact O-N 2.92Å; Y130-Q133 VanDerWaalsContact O-N 3.15Å; Y130-G134 PolarHBondContact O-N 3.28Å; Y130-G134 VanDerWaalsContact O-N 3.09Å; Y130-D135 HydrophobicContact CD1-CB 4.06Å; Y130-D135 PolarHBondContact O-N 2.99Å; Y130-E138 HydrophobicContact CD1-CB 3.81Å; Y130-E138 HydrophobicContact CD2-CB 3.97Å; Y130-E138 HydrophobicContact CE1-CB 4.09Å; Y130-E138 HydrophobicContact CE1-CG 4.4Å; Y130-E138 HydrophobicContact CE2-CB 4.25Å; Y130-E138 HydrophobicContact CG-CB 3.76Å; Y130-H142 AromaticContact CD2-CD2 3.57Å; Y130-H142 AromaticContact CE2-CD2 3.5Å; Y130-H142 AromaticContact CE2-NE2 3.48Å; Y130-H142 WeakPolarHBondContact CE2-NE2 3.49Å
131R96.9Very high97.1Very high44 Ų4442.5 Ų42.517%0.16622%0.215CC..Hα-helixtrans-60.2-45175-172.2-172.269.583.1-8.3111.5A127 E128 L129 Q133 G134 L136 A139 E173 I174 L177A127-R131 VanDerWaalsContact O-CB 3.28Å; A127-R131 WeakPolarHBondContact O-CB 3.39Å; A127-R131 PolarHBondContact O-N 3.18Å; E128-R131 WeakPolarHBondContact O-CB 3.45Å; E128-R131 PolarHBondContact O-N 3.04Å; E128-R131 IonicContact OE1-CZ 3.06Å; E128-R131 IonicContact OE1-NH2 3.81Å; E128-R131 PolarHBondContact OE1-NH2 3.5Å; E128-R131 IonicContact OE2-CZ 3.89Å; E128-R131 IonicContact OE2-NE 2.67Å; E128-R131 PolarHBondContact OE2-NE 3.46Å; E128-R131 IonicContact OE2-NH2 3.5Å; E128-R131 PolarHBondContact OE2-NH2 2.84Å; L129-R131 VanDerWaalsContact C-N 3.34Å; R131-Q133 VanDerWaalsContact C-N 3.28Å; R131-Q133 PolarHBondContact O-N 3.34Å; R131-G134 PolarHBondContact O-N 3.22Å; R131-L136 HydrophobicContact CG-CD2 4.09Å; R131-A139 HydrophobicContact CB-CB 3.99Å; R131-E173 IonicContact CZ-OE1 3.61Å; R131-E173 IonicContact CZ-OE2 3.85Å; R131-E173 VanDerWaalsContact NH1-CD 3.27Å; R131-E173 IonicContact NH1-OE1 3.78Å; R131-E173 PolarHBondContact NH1-OE1 3.46Å; R131-E173 IonicContact NH1-OE2 3.26Å; R131-E173 IonicContact NH2-OE1 3.76Å; R131-E173 IonicContact NH2-OE2 2.94Å; R131-I174 HydrophobicContact CB-CG1 4.49Å; R131-I174 HydrophobicContact CG-CG1 4.15Å; R131-L177 HydrophobicContact CG-CD1 4.13Å
132Q94.9Very high97.2Very high119 Ų11941.9 Ų41.956%0.55621%0.212SC*.Hα-helixtrans-63.9-30.5175.9-71.5176.39.600113.2E128 L129 Y130 G134E128-Q132 VanDerWaalsContact O-CG 3.31Å; E128-Q132 WeakPolarHBondContact O-CG 3.36Å; E128-Q132 PolarHBondContact O-N 3.43Å; E128-Q132 PolarHBondContact OE1-NE2 3.48Å; L129-Q132 PolarHBondContact O-N 3.02Å; Y130-Q132 PolarHBondContact O-N 2.91Å; Q132-G134 VanDerWaalsContact C-N 3.27Å
133Q94.8Very high97.1Very high123 Ų12341.9 Ų41.958%0.57521%0.212SC*.Hα-helixtrans-77.4-12.1172.6-71.5-176.1-900113.4F101 L129 Y130 R131F101-Q133 HydrophobicContact CZ-CG 4.4Å; L129-Q133 WeakPolarHBondContact O-CG 3.43Å; L129-Q133 PolarHBondContact O-N 3.44Å; L129-Q133 VanDerWaalsContact O-N 3.09Å; Y130-Q133 CarbonylContact O-C 3.58Å; Y130-Q133 PolarHBondContact O-N 2.92Å; Y130-Q133 VanDerWaalsContact O-N 3.15Å; R131-Q133 VanDerWaalsContact C-N 3.28Å; R131-Q133 PolarHBondContact O-N 3.34Å
134G95.3Very high97.1Very high53 Ų5344.4 Ų44.455%0.54623%0.225SC..THydrogen-bonded Turntrans85.34.3-175.600000114.3Y130 R131 Q132 L136Y130-G134 PolarHBondContact O-N 3.28Å; Y130-G134 VanDerWaalsContact O-N 3.09Å; R131-G134 PolarHBondContact O-N 3.22Å; Q132-G134 VanDerWaalsContact C-N 3.27Å; G134-L136 VanDerWaalsContact C-N 3.27Å; G134-L136 PolarHBondContact O-N 3.33Å
135D97Very high97.1Very high68 Ų6850.3 Ų50.336%0.36425%0.247SC..  trans-82.477.3172.6-164.4-24000110Y130 V137 E138 A139Y130-D135 HydrophobicContact CD1-CB 4.06Å; Y130-D135 PolarHBondContact O-N 2.99Å; D135-V137 PolarHBondContact O-N 2.91Å; D135-V137 PolarHBondContact OD1-N 3.05Å; D135-E138 PolarHBondContact OD1-N 3.38Å; D135-A139 WeakPolarHBondContact O-CB 3.38Å; D135-A139 PolarHBondContact O-N 3.48Å
136L96.8Very high97.1Very high31 Ų3148.3 Ų48.316%0.16224%0.238CC..Hα-helixtrans-68.6-20-175.3-60.7179.3000113.2R131 G134 R140 L177 L178R131-L136 HydrophobicContact CG-CD2 4.09Å; G134-L136 VanDerWaalsContact C-N 3.27Å; G134-L136 PolarHBondContact O-N 3.33Å; L136-R140 WeakPolarHBondContact O-CB 3.36Å; L136-R140 PolarHBondContact O-N 3.46Å; L136-R140 VanDerWaalsContact O-N 3.1Å; L136-L177 HydrophobicContact CD1-CB 3.76Å; L136-L177 HydrophobicContact CD2-CB 4.14Å; L136-L177 HydrophobicContact CD2-CD1 4Å; L136-L178 HydrophobicContact CB-CD1 4.47Å; L136-L178 HydrophobicContact CB-CD2 3.45Å; L136-L178 VanDerWaalsContact CB-CD2 3.45Å; L136-L178 HydrophobicContact CB-CG 3.79Å; L136-L178 HydrophobicContact CD1-CD2 3.95Å; L136-L178 HydrophobicContact CD1-CG 4.11Å; L136-L178 HydrophobicContact CG-CD2 4.37Å
137V95.9Very high97Very high76 Ų7649 Ų4946%0.46124%0.242SC..Hα-helixtrans-76.7-48.8-179.7178.10000110.2D135 A139 R140 D141D135-V137 PolarHBondContact O-N 2.91Å; D135-V137 PolarHBondContact OD1-N 3.05Å; V137-A139 VanDerWaalsContact C-N 3.33Å; V137-R140 PolarHBondContact O-N 3.26Å; V137-D141 PolarHBondContact O-N 3.38Å; V137-D141 VanDerWaalsContact O-N 3.12Å
138E96.9Very high97Very high78 Ų7855.4 Ų55.436%0.36427%0.27SS..Hα-helixtrans-65.4-39.5174.2-69-59.8133.800111.1Y130 D135 R140 D141 H142Y130-E138 HydrophobicContact CD1-CB 3.81Å; Y130-E138 HydrophobicContact CD2-CB 3.97Å; Y130-E138 HydrophobicContact CE1-CB 4.09Å; Y130-E138 HydrophobicContact CE1-CG 4.4Å; Y130-E138 HydrophobicContact CE2-CB 4.25Å; Y130-E138 HydrophobicContact CG-CB 3.76Å; D135-E138 PolarHBondContact OD1-N 3.38Å; E138-R140 VanDerWaalsContact C-N 3.32Å; E138-R140 PolarHBondContact O-N 2.92Å; E138-D141 PolarHBondContact O-N 3.02Å; E138-H142 PolarHBondContact O-CD2 2.74Å; E138-H142 VanDerWaalsContact O-CD2 3.31Å; E138-H142 PolarHBondContact O-N 3.23Å
139A98.2Very high97Very high0 Ų054.7 Ų54.70%027%0.266CS..Hα-helixtrans-55.6-47.517500000111.9A127 R131 D135 V137 A143 I174A127-A139 WeakPolarHBondContact CB-O 3.46Å; A127-A139 WeakPolarHBondContact O-CB 3.15Å; R131-A139 HydrophobicContact CB-CB 3.99Å; D135-A139 WeakPolarHBondContact O-CB 3.38Å; D135-A139 PolarHBondContact O-N 3.48Å; V137-A139 VanDerWaalsContact C-N 3.33Å; A139-A143 WeakPolarHBondContact O-CB 3.22Å; A139-A143 PolarHBondContact O-N 3.17Å; A139-I174 HydrophobicContact CB-CD1 3.89Å; A139-I174 HydrophobicContact CB-CG1 4.22Å
140R97.9Very high97Very high79 Ų7953.8 Ų53.830%0.29826%0.261SS..Hα-helixtrans-61.4-49.1178.1-176.2-170.463.6-169-2.2111.8L136 V137 E138 H142 A143 E144 L171 I174 Y175 L178L136-R140 WeakPolarHBondContact O-CB 3.36Å; L136-R140 PolarHBondContact O-N 3.46Å; L136-R140 VanDerWaalsContact O-N 3.1Å; V137-R140 PolarHBondContact O-N 3.26Å; E138-R140 VanDerWaalsContact C-N 3.32Å; E138-R140 PolarHBondContact O-N 2.92Å; R140-H142 VanDerWaalsContact C-N 3.33Å; R140-H142 PolarHBondContact O-N 3.44Å; R140-A143 PolarHBondContact O-N 3.42Å; R140-E144 VanDerWaalsContact CD-OE1 3.3Å; R140-E144 WeakPolarHBondContact CD-OE1 3.47Å; R140-E144 HydrophobicContact CG-CG 4.11Å; R140-E144 VanDerWaalsContact CG-OE1 3.26Å; R140-E144 WeakPolarHBondContact CG-OE1 3.32Å; R140-E144 IonicContact NE-OE1 3.96Å; R140-E144 WeakPolarHBondContact O-CB 3.34Å; R140-E144 WeakPolarHBondContact O-CG 3.37Å; R140-E144 PolarHBondContact O-N 2.96Å; R140-L171 HydrophobicContact CG-CD2 4.44Å; R140-I174 HydrophobicContact CB-CG2 3.79Å; R140-I174 HydrophobicContact CG-CG2 4.47Å; R140-Y175 HydrophobicContact CG-CE1 4.07Å; R140-L178 HydrophobicContact CB-CD1 4.39Å
141D97.6Very high96.9Very high39 Ų3956.6 Ų56.621%0.20928%0.276CS..Hα-helixtrans-59.4-44.8-178.4177.480.1000111.7V137 E138 R145V137-D141 PolarHBondContact O-N 3.38Å; V137-D141 VanDerWaalsContact O-N 3.12Å; E138-D141 PolarHBondContact O-N 3.02Å; D141-R145 VanDerWaalsContact CG-NE 3.29Å; D141-R145 WeakPolarHBondContact O-CB 3.42Å; D141-R145 VanDerWaalsContact O-CG 3.23Å; D141-R145 WeakPolarHBondContact O-CG 3.48Å; D141-R145 PolarHBondContact O-N 3.31Å; D141-R145 VanDerWaalsContact O-N 3.12Å; D141-R145 IonicContact OD1-CZ 3.77Å; D141-R145 IonicContact OD1-NE 3.92Å; D141-R145 PolarHBondContact OD1-NE 3.2Å; D141-R145 IonicContact OD1-NH2 3.85Å; D141-R145 PolarHBondContact OD1-NH2 2.78Å; D141-R145 WeakPolarHBondContact OD2-CD 3.21Å; D141-R145 IonicContact OD2-CZ 3.84Å; D141-R145 IonicContact OD2-NE 3.75Å; D141-R145 PolarHBondContact OD2-NE 2.91Å; D141-R145 IonicContact OD2-NH1 2.56Å; D141-R145 PolarHBondContact OD2-NH1 3.07Å; D141-R145 IonicContact OD2-NH2 2.82Å; D141-R145 PolarHBondContact OD2-NH2 3.09Å
142H98.1Very high96.9Very high6 Ų660 Ų603%0.02830%0.297CS..Hα-helixtrans-62.8-44.8176.2-81.6-65.3000112.4H105 L126 A127 Y130 E138 R140 A146H105-H142 AromaticContact CE1-CE1 3.8Å; H105-H142 AromaticContact CE1-NE2 3.55Å; L126-H142 HydrophobicContact CB-CB 4.36Å; A127-H142 HydrophobicContact CB-CB 4Å; Y130-H142 AromaticContact CD2-CD2 3.57Å; Y130-H142 AromaticContact CE2-CD2 3.5Å; Y130-H142 AromaticContact CE2-NE2 3.48Å; Y130-H142 WeakPolarHBondContact CE2-NE2 3.49Å; E138-H142 PolarHBondContact O-CD2 2.74Å; E138-H142 VanDerWaalsContact O-CD2 3.31Å; E138-H142 PolarHBondContact O-N 3.23Å; R140-H142 VanDerWaalsContact C-N 3.33Å; R140-H142 PolarHBondContact O-N 3.44Å; H142-A146 WeakPolarHBondContact O-CB 3.49Å; H142-A146 PolarHBondContact O-N 3.43Å
143A97.8Very high96.9Very high0 Ų055.6 Ų55.60%029%0.285CS..Hα-helixtrans-68.1-41.7-179.300000112.8A127 A139 R140 A146 L147 L171 I174A127-A143 HydrophobicContact CB-CB 3.73Å; A139-A143 WeakPolarHBondContact O-CB 3.22Å; A139-A143 PolarHBondContact O-N 3.17Å; R140-A143 PolarHBondContact O-N 3.42Å; A143-A146 PolarHBondContact O-N 2.98Å; A143-L147 WeakPolarHBondContact O-CB 3.42Å; A143-L147 PolarHBondContact O-N 2.84Å; A143-L171 HydrophobicContact CB-CD2 3.46Å; A143-L171 VanDerWaalsContact CB-CD2 3.46Å; A143-L171 HydrophobicContact CB-CG 3.73Å; A143-I174 HydrophobicContact CB-CD1 3.89Å
144E97.9Very high96.9Very high75 Ų7552.7 Ų52.735%0.3529%0.288SS..Hα-helixtrans-62.4-46.1176.7-75.6177.7-176.300111.5R140 A146 L147 K148 L171 Y175R140-E144 VanDerWaalsContact CD-OE1 3.3Å; R140-E144 WeakPolarHBondContact CD-OE1 3.47Å; R140-E144 HydrophobicContact CG-CG 4.11Å; R140-E144 VanDerWaalsContact CG-OE1 3.26Å; R140-E144 WeakPolarHBondContact CG-OE1 3.32Å; R140-E144 IonicContact NE-OE1 3.96Å; R140-E144 WeakPolarHBondContact O-CB 3.34Å; R140-E144 WeakPolarHBondContact O-CG 3.37Å; R140-E144 PolarHBondContact O-N 2.96Å; E144-A146 VanDerWaalsContact C-N 3.34Å; E144-A146 PolarHBondContact O-N 3.38Å; E144-L147 PolarHBondContact O-N 3.06Å; E144-K148 PolarHBondContact O-N 3.45Å; E144-K148 VanDerWaalsContact O-N 3.11Å; E144-L171 HydrophobicContact CG-CD1 4.34Å; E144-L171 HydrophobicContact CG-CD2 3.84Å; E144-Y175 PolarHBondContact OE1-OH 3.12Å
145R96.7Very high97Very high124 Ų12453.3 Ų53.347%0.46827%0.273SS..Hα-helixtrans-63.5-42.2177-70.3174.6-172.8-176.68.3111.4D141 Q149D141-R145 VanDerWaalsContact CG-NE 3.29Å; D141-R145 WeakPolarHBondContact O-CB 3.42Å; D141-R145 VanDerWaalsContact O-CG 3.23Å; D141-R145 WeakPolarHBondContact O-CG 3.48Å; D141-R145 PolarHBondContact O-N 3.31Å; D141-R145 VanDerWaalsContact O-N 3.12Å; D141-R145 IonicContact OD1-CZ 3.77Å; D141-R145 IonicContact OD1-NE 3.92Å; D141-R145 PolarHBondContact OD1-NE 3.2Å; D141-R145 IonicContact OD1-NH2 3.85Å; D141-R145 PolarHBondContact OD1-NH2 2.78Å; D141-R145 WeakPolarHBondContact OD2-CD 3.21Å; D141-R145 IonicContact OD2-CZ 3.84Å; D141-R145 IonicContact OD2-NE 3.75Å; D141-R145 PolarHBondContact OD2-NE 2.91Å; D141-R145 IonicContact OD2-NH1 2.56Å; D141-R145 PolarHBondContact OD2-NH1 3.07Å; D141-R145 IonicContact OD2-NH2 2.82Å; D141-R145 PolarHBondContact OD2-NH2 3.09Å; R145-Q149 VanDerWaalsContact O-CG 3.28Å; R145-Q149 WeakPolarHBondContact O-CG 3.34Å; R145-Q149 PolarHBondContact O-N 3.44Å; R145-Q149 VanDerWaalsContact O-N 3.1Å
146A97.4Very high96.9Very high0 Ų054.4 Ų54.40%028%0.279CS..Hα-helixtrans-67-42.7179.100000112.1T120 R123 F124 H142 A143 E144 K148 Q149 A150T120-A146 HydrophobicContact CG2-CB 4.23Å; T120-A146 VanDerWaalsContact CG2-O 3.24Å; T120-A146 WeakPolarHBondContact CG2-O 3.45Å; R123-A146 HydrophobicContact CB-CB 3.64Å; F124-A146 HydrophobicContact CD1-CB 3.47Å; F124-A146 VanDerWaalsContact CD1-CB 3.47Å; F124-A146 HydrophobicContact CD2-CB 4.25Å; F124-A146 HydrophobicContact CE1-CB 3.24Å; F124-A146 HydrophobicContact CE2-CB 4.08Å; F124-A146 HydrophobicContact CG-CB 3.96Å; F124-A146 HydrophobicContact CZ-CB 3.59Å; H142-A146 WeakPolarHBondContact O-CB 3.49Å; H142-A146 PolarHBondContact O-N 3.43Å; A143-A146 PolarHBondContact O-N 2.98Å; E144-A146 VanDerWaalsContact C-N 3.34Å; E144-A146 PolarHBondContact O-N 3.38Å; A146-K148 PolarHBondContact O-N 3.03Å; A146-Q149 PolarHBondContact O-N 3.01Å; A146-A150 WeakPolarHBondContact O-CB 3.28Å; A146-A150 PolarHBondContact O-N 3.42Å
147L97.6Very high96.6Very high16 Ų1654.9 Ų54.98%0.08428%0.282CS..Hα-helixtrans-58-50.1176176.359.8000110.6A143 E144 Q149 A150 E151 R164 L171 M201A143-L147 WeakPolarHBondContact O-CB 3.42Å; A143-L147 PolarHBondContact O-N 2.84Å; E144-L147 PolarHBondContact O-N 3.06Å; L147-Q149 VanDerWaalsContact C-N 3.29Å; L147-Q149 PolarHBondContact O-N 3.45Å; L147-A150 WeakPolarHBondContact O-CB 3.47Å; L147-A150 PolarHBondContact O-N 3Å; L147-A150 VanDerWaalsContact O-N 3.08Å; L147-E151 HydrophobicContact CD1-CG 4.26Å; L147-E151 WeakPolarHBondContact O-CG 3.3Å; L147-E151 PolarHBondContact O-N 3.11Å; L147-R164 HydrophobicContact CD1-CB 3.78Å; L147-R164 WeakPolarHBondContact CD1-O 3.23Å; L147-L171 HydrophobicContact CB-CD1 4.11Å; L147-L171 HydrophobicContact CD2-CD1 3.56Å; L147-L171 HydrophobicContact CG-CD1 4.46Å; L147-M201 HydrophobicContact CD2-SD 4.14Å
148K97.2Very high96.2Very high134 Ų13457 Ų5758%0.58330%0.3SS*.Hα-helixtrans-57-42.8177.2-176.7172.6-176.21710112.3E144 A146 E151 D152E144-K148 PolarHBondContact O-N 3.45Å; E144-K148 VanDerWaalsContact O-N 3.11Å; A146-K148 PolarHBondContact O-N 3.03Å; K148-E151 PolarHBondContact O-N 3.43Å; K148-D152 WeakPolarHBondContact O-CB 3.48Å; K148-D152 VanDerWaalsContact O-CG 3.29Å; K148-D152 PolarHBondContact O-N 3.48Å
149Q96.4Very high95.9Very high24 Ų2460.8 Ų60.811%0.11232%0.318CS..Hα-helixtrans-65.4-40.2176.5-73173.8-8.200112.3T120 R123 R145 A146 L147 E151 D152 G153 W155T120-Q149 HydrophobicContact CG2-CB 3.83Å; T120-Q149 WeakPolarHBondContact OG1-CB 3.19Å; T120-Q149 PolarHBondContact OG1-OE1 3.45Å; R123-Q149 VanDerWaalsContact NH1-CD 3.33Å; R145-Q149 VanDerWaalsContact O-CG 3.28Å; R145-Q149 WeakPolarHBondContact O-CG 3.34Å; R145-Q149 PolarHBondContact O-N 3.44Å; R145-Q149 VanDerWaalsContact O-N 3.1Å; A146-Q149 PolarHBondContact O-N 3.01Å; L147-Q149 VanDerWaalsContact C-N 3.29Å; L147-Q149 PolarHBondContact O-N 3.45Å; Q149-E151 VanDerWaalsContact C-N 3.33Å; Q149-D152 PolarHBondContact O-N 2.89Å; Q149-G153 PolarHBondContact O-N 2.77Å; Q149-W155 HydrophobicContact CB-CZ3 4.43Å; Q149-W155 WeakPolarHBondContact O-CZ3 3.34Å
150A97.2Very high95.6Very high2 Ų262.7 Ų62.72%0.01734%0.337CS..Hα-helixtrans-65.4-37.2177.600000111.9T120 F124 A146 L147 G154 L163 R164T120-A150 HydrophobicContact CG2-CB 4.11Å; F124-A150 HydrophobicContact CE2-CB 4.26Å; F124-A150 HydrophobicContact CZ-CB 4.15Å; A146-A150 WeakPolarHBondContact O-CB 3.28Å; A146-A150 PolarHBondContact O-N 3.42Å; L147-A150 WeakPolarHBondContact O-CB 3.47Å; L147-A150 PolarHBondContact O-N 3Å; L147-A150 VanDerWaalsContact O-N 3.08Å; A150-G154 PolarHBondContact O-N 2.88Å; A150-L163 HydrophobicContact CB-CB 4.31Å; A150-L163 HydrophobicContact CB-CD2 4.21Å; A150-L163 HydrophobicContact CB-CG 4.23Å; A150-R164 HydrophobicContact CB-CB 4.32Å
151E96.4Very high95.4Very high98 Ų9863.4 Ų63.446%0.45834%0.344SS..Hα-helixtrans-66.1-49.7173.1-70179.5151.500111.9L147 K148 Q149 G153 G154 R164L147-E151 HydrophobicContact CD1-CG 4.26Å; L147-E151 WeakPolarHBondContact O-CG 3.3Å; L147-E151 PolarHBondContact O-N 3.11Å; K148-E151 PolarHBondContact O-N 3.43Å; Q149-E151 VanDerWaalsContact C-N 3.33Å; E151-G153 VanDerWaalsContact C-N 3.25Å; E151-G153 PolarHBondContact O-N 3.06Å; E151-G154 PolarHBondContact O-N 3.32Å; E151-R164 HydrophobicContact CG-CB 4.14Å
152D96.1Very high95.3Very high114 Ų11463.9 Ų63.961%0.6135%0.349SS*.Hα-helixtrans-59.7-37.6177.2-73.9-17000111.7K148 Q149K148-D152 WeakPolarHBondContact O-CB 3.48Å; K148-D152 VanDerWaalsContact O-CG 3.29Å; K148-D152 PolarHBondContact O-N 3.48Å; Q149-D152 PolarHBondContact O-N 2.89Å
153G95.1Very high95.2Very high28 Ų2863.7 Ų63.729%0.28935%0.348SS..Hα-helixtrans-82.2-23.9-177.200000114.8Q149 E151 W155Q149-G153 PolarHBondContact O-N 2.77Å; E151-G153 VanDerWaalsContact C-N 3.25Å; E151-G153 PolarHBondContact O-N 3.06Å; G153-W155 PolarHBondContact O-N 3.06Å
154G95.8Very high95.1Very high62 Ų6268.1 Ų68.164%0.63937%0.365SS*.THydrogen-bonded Turntrans57.528-177.600000113.9A150 E151A150-G154 PolarHBondContact O-N 2.88Å; E151-G154 PolarHBondContact O-N 3.32Å
155W96.4Very high95Very high65 Ų6565.3 Ų65.325%0.24635%0.352CS..  trans-76.1153.3-173.9-57.4-54.5000112.4R115 K117 T120 Q149 G153 L163R115-W155 WeakPolarHBondContact O-CH2 3.33Å; K117-W155 HydrophobicContact CB-CD2 3.74Å; K117-W155 HydrophobicContact CB-CE3 4.16Å; K117-W155 HydrophobicContact CB-CG 3.94Å; K117-W155 HydrophobicContact CD-CB 4.07Å; K117-W155 HydrophobicContact CD-CG 4.14Å; K117-W155 HydrophobicContact CG-CB 4.17Å; K117-W155 HydrophobicContact CG-CD2 4.14Å; K117-W155 HydrophobicContact CG-CE3 4.43Å; K117-W155 HydrophobicContact CG-CG 4.01Å; T120-W155 HydrophobicContact CG2-CZ3 4.1Å; T120-W155 WeakPolarHBondContact OG1-CZ3 3.47Å; Q149-W155 HydrophobicContact CB-CZ3 4.43Å; Q149-W155 WeakPolarHBondContact O-CZ3 3.34Å; G153-W155 PolarHBondContact O-N 3.06Å; W155-L163 HydrophobicContact CB-CB 4.31Å; W155-L163 HydrophobicContact CB-CD2 4.28Å; W155-L163 HydrophobicContact CE3-CD2 4.01Å; W155-L163 WeakPolarHBondContact O-CB 3.43Å; W155-L163 PolarHBondContact O-N 2.93Å
156L95.9Very high94.8Very high91 Ų9162.3 Ų62.348%0.47634%0.341SS..BIsolated β-bridgetrans-102.1149.2169.4-54.3179000110.1K117 Q161 P162K117-L156 VanDerWaalsContact CE-O 3.31Å; K117-L156 WeakPolarHBondContact CE-O 3.49Å; K117-L156 PolarHBondContact NZ-O 2.96Å; L156-Q161 CarbonylContact C-O 3.45Å; L156-Q161 WeakPolarHBondContact CA-O 3.41Å; L156-P162 HydrophobicContact CD2-CG 4.38Å
157D91.1Very high94.7Very high42 Ų4262.3 Ų62.323%0.22534%0.341CS..  trans-77.2-172.5171.16815.7000112.1E159 G160 Q161 L163D157-E159 PolarHBondContact O-N 3.47Å; D157-E159 WeakPolarHBondContact OD1-CA 3.36Å; D157-E159 PolarHBondContact OD1-N 3.35Å; D157-G160 PolarHBondContact O-N 2.93Å; D157-G160 PolarHBondContact OD1-N 3.39Å; D157-Q161 PolarHBondContact N-O 3.15Å; D157-Q161 PolarHBondContact OD1-N 3.04Å; D157-Q161 WeakPolarHBondContact OD2-CB 3.18Å; D157-L163 HydrophobicContact CB-CD1 4.25Å
158S87.1Confident94.6Very high121 Ų12161.5 Ų61.585%0.84634%0.337SS*.THydrogen-bonded Turntrans-66.7-20.3178.547.30000114.1
159E89.5Confident94.5Very high157 Ų15762 Ų6273%0.73434%0.335SS*.THydrogen-bonded Turntrans-950.9179.4-61.9178.5-170.800111.8D157 Q161D157-E159 PolarHBondContact O-N 3.47Å; D157-E159 WeakPolarHBondContact OD1-CA 3.36Å; D157-E159 PolarHBondContact OD1-N 3.35Å; E159-Q161 VanDerWaalsContact C-N 3.3Å; E159-Q161 HydrophobicContact CB-CG 4.45Å
160G93.1Very high94.4Very high39 Ų3962 Ų6240%0.40234%0.335SS..SBendtrans78.710.6-178.200000113.8D157D157-G160 PolarHBondContact O-N 2.93Å; D157-G160 PolarHBondContact OD1-N 3.39Å
161Q93.3Very high94.4Very high94 Ų9462 Ų6244%0.43934%0.335SS..SBendtrans-84.2151174.7-58.6-61.8-5800110.6L156 D157 E159 L163 L165L156-Q161 CarbonylContact C-O 3.45Å; L156-Q161 WeakPolarHBondContact CA-O 3.41Å; D157-Q161 PolarHBondContact N-O 3.15Å; D157-Q161 PolarHBondContact OD1-N 3.04Å; D157-Q161 WeakPolarHBondContact OD2-CB 3.18Å; E159-Q161 VanDerWaalsContact C-N 3.3Å; E159-Q161 HydrophobicContact CB-CG 4.45Å; Q161-L163 PolarHBondContact O-N 3.23Å; Q161-L165 HydrophobicContact CB-CD1 4.38Å
162P95.8Very high94.4Very high50 Ų5057.6 Ų57.633%0.32532%0.316SS..BIsolated β-bridgetrans-58125.4174-23.233.4000111.5L156 R164 L165L156-P162 HydrophobicContact CD2-CG 4.38Å; P162-R164 HydrophobicContact CB-CG 4.12Å; P162-R164 PolarHBondContact O-N 2.8Å; P162-L165 HydrophobicContact CB-CG 4.31Å; P162-L165 WeakPolarHBondContact O-CB 3.49Å; P162-L165 WeakPolarHBondContact O-CG 3.32Å; P162-L165 PolarHBondContact O-N 2.92Å
163L95.9Very high94.3Very high1 Ų156 Ų561%0.00531%0.305CS..THydrogen-bonded Turntrans-58.2-28.5-177.1-173.568000112.3K117 T120 E121 F124 A150 W155 D157 Q161 L165 W166K117-L163 HydrophobicContact CG-CD2 4.39Å; T120-L163 HydrophobicContact CG2-CD2 4.24Å; E121-L163 HydrophobicContact CG-CD1 4.15Å; E121-L163 HydrophobicContact CG-CD2 4.19Å; F124-L163 HydrophobicContact CE2-CD1 4.47Å; F124-L163 HydrophobicContact CE2-CD2 4.28Å; F124-L163 HydrophobicContact CE2-CG 4Å; A150-L163 HydrophobicContact CB-CB 4.31Å; A150-L163 HydrophobicContact CB-CD2 4.21Å; A150-L163 HydrophobicContact CB-CG 4.23Å; W155-L163 HydrophobicContact CB-CB 4.31Å; W155-L163 HydrophobicContact CB-CD2 4.28Å; W155-L163 HydrophobicContact CE3-CD2 4.01Å; W155-L163 WeakPolarHBondContact O-CB 3.43Å; W155-L163 PolarHBondContact O-N 2.93Å; D157-L163 HydrophobicContact CB-CD1 4.25Å; Q161-L163 PolarHBondContact O-N 3.23Å; L163-L165 PolarHBondContact O-N 2.99Å; L163-L165 VanDerWaalsContact O-N 3.16Å; L163-W166 HydrophobicContact CD1-CE3 3.86Å; L163-W166 HydrophobicContact CD1-CZ3 4.46Å; L163-W166 WeakPolarHBondContact O-CB 3.48Å; L163-W166 PolarHBondContact O-N 3.42Å; L163-W166 VanDerWaalsContact O-N 3.1Å
164R96Very high94.4Very high93 Ų9354.7 Ų54.735%0.35129%0.291SS..Hα-helixtrans-56.1-29.7175.177178.9-17390.67.6113.1L147 A150 E151 P162 W166 G167 C168L147-R164 HydrophobicContact CD1-CB 3.78Å; L147-R164 WeakPolarHBondContact CD1-O 3.23Å; A150-R164 HydrophobicContact CB-CB 4.32Å; E151-R164 HydrophobicContact CG-CB 4.14Å; P162-R164 HydrophobicContact CB-CG 4.12Å; P162-R164 PolarHBondContact O-N 2.8Å; R164-W166 PolarHBondContact O-N 2.97Å; R164-G167 PolarHBondContact O-N 3.04Å; R164-G167 VanDerWaalsContact O-N 3.1Å; R164-C168 PolarHBondContact O-N 3.38Å; R164-C168 PolarHBondContact O-SG 3.43Å; R164-C168 VanDerWaalsContact O-SG 3.35Å
165L95.2Very high94.5Very high17 Ų1752.8 Ų52.89%0.08926%0.264CS..Hα-helixtrans-63.1-34.2179.7-62.6-175.8000111.5Q161 P162 L163 C168 R169 E204Q161-L165 HydrophobicContact CB-CD1 4.38Å; P162-L165 HydrophobicContact CB-CG 4.31Å; P162-L165 WeakPolarHBondContact O-CB 3.49Å; P162-L165 WeakPolarHBondContact O-CG 3.32Å; P162-L165 PolarHBondContact O-N 2.92Å; L163-L165 PolarHBondContact O-N 2.99Å; L163-L165 VanDerWaalsContact O-N 3.16Å; L165-C168 PolarHBondContact O-N 2.9Å; L165-R169 VanDerWaalsContact O-CG 3.31Å; L165-R169 WeakPolarHBondContact O-CG 3.34Å; L165-R169 PolarHBondContact O-N 3.29Å; L165-R169 VanDerWaalsContact O-N 3.07Å; L165-E204 WeakPolarHBondContact CD2-O 3.29Å
166W93.2Very high94.5Very high60 Ų6049.9 Ų49.923%0.22725%0.254CS..Hα-helixtrans-61.3-49.9172.4-175.69.6000110.4E121 F124 H125 L163 R164 C168 R169 E170E121-W166 HydrophobicContact CB-CZ3 4.25Å; E121-W166 HydrophobicContact CG-CZ3 4.19Å; F124-W166 HydrophobicContact CB-CD2 3.87Å; F124-W166 HydrophobicContact CB-CE3 3.99Å; F124-W166 HydrophobicContact CB-CH2 3.53Å; F124-W166 HydrophobicContact CB-CZ2 3.44Å; F124-W166 VanDerWaalsContact CB-CZ2 3.44Å; F124-W166 HydrophobicContact CB-CZ3 3.84Å; F124-W166 AromaticContact CD2-CD2 3.95Å; F124-W166 HydrophobicContact CD2-CD2 3.95Å; F124-W166 AromaticContact CD2-CE3 3.62Å; F124-W166 HydrophobicContact CD2-CE3 3.62Å; F124-W166 HydrophobicContact CD2-CG 4.47Å; F124-W166 AromaticContact CD2-CZ3 3.93Å; F124-W166 HydrophobicContact CD2-CZ3 3.93Å; F124-W166 HydrophobicContact CE2-CE3 4.44Å; F124-W166 AromaticContact CG-CD2 3.99Å; F124-W166 HydrophobicContact CG-CD2 3.99Å; F124-W166 HydrophobicContact CG-CE3 4.06Å; F124-W166 HydrophobicContact CG-CG 4.44Å; F124-W166 HydrophobicContact CG-CH2 4.45Å; F124-W166 HydrophobicContact CG-CZ2 4.44Å; F124-W166 HydrophobicContact CG-CZ3 4.3Å; H125-W166 AromaticContact CD2-CH2 3.76Å; H125-W166 AromaticContact CE1-CH2 3.7Å; H125-W166 AromaticContact NE2-CH2 3.44Å; H125-W166 WeakPolarHBondContact NE2-CH2 3.5Å; L163-W166 HydrophobicContact CD1-CE3 3.86Å; L163-W166 HydrophobicContact CD1-CZ3 4.46Å; L163-W166 WeakPolarHBondContact O-CB 3.48Å; L163-W166 PolarHBondContact O-N 3.42Å; L163-W166 VanDerWaalsContact O-N 3.1Å; R164-W166 PolarHBondContact O-N 2.97Å; W166-C168 VanDerWaalsContact C-N 3.34Å; W166-C168 PolarHBondContact O-N 3.2Å; W166-R169 PolarHBondContact O-N 3.02Å; W166-R169 VanDerWaalsContact O-N 3.11Å; W166-E170 PolarHBondContact NE1-OE1 3.41Å; W166-E170 WeakPolarHBondContact O-CG 3.49Å; W166-E170 PolarHBondContact O-N 3.04Å
167G94.3Very high94.6Very high0 Ų047.9 Ų47.90%024%0.244CC..Hα-helixtrans-58.9-40.4177.300000114.2R164 E170 L171R164-G167 PolarHBondContact O-N 3.04Å; R164-G167 VanDerWaalsContact O-N 3.1Å; G167-E170 PolarHBondContact O-N 3.49Å; G167-L171 WeakPolarHBondContact O-CB 3.38Å; G167-L171 WeakPolarHBondContact O-CG 3.36Å; G167-L171 PolarHBondContact O-N 2.9Å
168C96.3Very high94.9Very high0 Ų046.5 Ų46.50%024%0.236CC..Hα-helixtrans-62-42.9174.5-65.90000111.8R164 L165 W166 G172 M201 E204R164-C168 PolarHBondContact O-N 3.38Å; R164-C168 PolarHBondContact O-SG 3.43Å; R164-C168 VanDerWaalsContact O-SG 3.35Å; L165-C168 PolarHBondContact O-N 2.9Å; W166-C168 VanDerWaalsContact C-N 3.34Å; W166-C168 PolarHBondContact O-N 3.2Å; C168-G172 PolarHBondContact O-N 2.85Å; C168-M201 WeakPolarHBondContact O-CB 3.43Å; C168-E204 HydrophobicContact CB-CB 4.34Å
169R94.1Very high95.3Very high143 Ų14340.7 Ų40.754%0.5420%0.196SC..Hα-helixtrans-63.7-48177.9-69.3171.4-169.9-175.82111.7L165 W166 G172 E173 G205L165-R169 VanDerWaalsContact O-CG 3.31Å; L165-R169 WeakPolarHBondContact O-CG 3.34Å; L165-R169 PolarHBondContact O-N 3.29Å; L165-R169 VanDerWaalsContact O-N 3.07Å; W166-R169 PolarHBondContact O-N 3.02Å; W166-R169 VanDerWaalsContact O-N 3.11Å; R169-G172 PolarHBondContact O-N 3.25Å; R169-E173 PolarHBondContact O-N 3.05Å; R169-G205 PolarHBondContact NE-O 2.99Å; R169-G205 PolarHBondContact NH2-O 3.47Å
170E94.8Very high95.6Very high25 Ų2537.1 Ų37.112%0.11718%0.179CC..Hα-helixtrans-60.8-48.3178.5-66.2-58.2155.400111.7W166 G167 G172 E173 I174W166-E170 PolarHBondContact NE1-OE1 3.41Å; W166-E170 WeakPolarHBondContact O-CG 3.49Å; W166-E170 PolarHBondContact O-N 3.04Å; G167-E170 PolarHBondContact O-N 3.49Å; E170-G172 VanDerWaalsContact C-N 3.32Å; E170-G172 PolarHBondContact O-N 2.94Å; E170-E173 PolarHBondContact O-N 3.48Å; E170-I174 WeakPolarHBondContact O-CD1 3.45Å; E170-I174 VanDerWaalsContact O-CG1 3.26Å; E170-I174 WeakPolarHBondContact O-CG1 3.28Å; E170-I174 PolarHBondContact O-N 3.06Å
171L96.7Very high95.8Very high3 Ų337.7 Ų37.72%0.01618%0.18CC..Hα-helixtrans-64.4-37.2178-77.2173.1000112.4R140 A143 E144 L147 G167 E173 I174 Y175 M201R140-L171 HydrophobicContact CG-CD2 4.44Å; A143-L171 HydrophobicContact CB-CD2 3.46Å; A143-L171 VanDerWaalsContact CB-CD2 3.46Å; A143-L171 HydrophobicContact CB-CG 3.73Å; E144-L171 HydrophobicContact CG-CD1 4.34Å; E144-L171 HydrophobicContact CG-CD2 3.84Å; L147-L171 HydrophobicContact CB-CD1 4.11Å; L147-L171 HydrophobicContact CD2-CD1 3.56Å; L147-L171 HydrophobicContact CG-CD1 4.46Å; G167-L171 WeakPolarHBondContact O-CB 3.38Å; G167-L171 WeakPolarHBondContact O-CG 3.36Å; G167-L171 PolarHBondContact O-N 2.9Å; L171-E173 VanDerWaalsContact C-N 3.29Å; L171-E173 PolarHBondContact O-N 3.15Å; L171-I174 PolarHBondContact O-N 3.49Å; L171-Y175 HydrophobicContact CB-CD2 4.09Å; L171-Y175 HydrophobicContact CB-CE2 3.92Å; L171-Y175 HydrophobicContact CD2-CE2 4.09Å; L171-Y175 HydrophobicContact CG-CE2 4.41Å; L171-Y175 VanDerWaalsContact O-CB 3.3Å; L171-Y175 WeakPolarHBondContact O-CB 3.46Å; L171-Y175 WeakPolarHBondContact O-CD2 3.48Å; L171-Y175 PolarHBondContact O-N 2.95Å; L171-M201 HydrophobicContact CB-CB 4.45Å; L171-M201 HydrophobicContact CB-CG 3.98Å; L171-M201 HydrophobicContact CB-SD 4.35Å; L171-M201 HydrophobicContact CD1-SD 4.32Å
172G96.1Very high95.9Very high5 Ų537 Ų375%0.05217%0.174CC..Hα-helixtrans-56.2-44.9175.200000112.2C168 R169 E170 S176C168-G172 PolarHBondContact O-N 2.85Å; R169-G172 PolarHBondContact O-N 3.25Å; E170-G172 VanDerWaalsContact C-N 3.32Å; E170-G172 PolarHBondContact O-N 2.94Å; G172-S176 WeakPolarHBondContact O-CB 3.46Å; G172-S176 PolarHBondContact O-N 2.89Å; G172-S176 VanDerWaalsContact O-N 3.14Å; G172-S176 PolarHBondContact O-OG 3.36Å
173E94.8Very high95.9Very high81 Ų8136.1 Ų36.138%0.37917%0.166SC..Hα-helixtrans-70.3-46.1176.7-172169.1176.200112.2R131 R169 E170 L171 Y175 S176 L177R131-E173 IonicContact CZ-OE1 3.61Å; R131-E173 IonicContact CZ-OE2 3.85Å; R131-E173 VanDerWaalsContact NH1-CD 3.27Å; R131-E173 IonicContact NH1-OE1 3.78Å; R131-E173 PolarHBondContact NH1-OE1 3.46Å; R131-E173 IonicContact NH1-OE2 3.26Å; R131-E173 IonicContact NH2-OE1 3.76Å; R131-E173 IonicContact NH2-OE2 2.94Å; R169-E173 PolarHBondContact O-N 3.05Å; E170-E173 PolarHBondContact O-N 3.48Å; L171-E173 VanDerWaalsContact C-N 3.29Å; L171-E173 PolarHBondContact O-N 3.15Å; E173-Y175 PolarHBondContact O-N 2.87Å; E173-S176 WeakPolarHBondContact O-CB 3.35Å; E173-S176 PolarHBondContact O-N 3.43Å; E173-L177 HydrophobicContact CG-CD1 4.13Å; E173-L177 HydrophobicContact CG-CG 4.49Å; E173-L177 WeakPolarHBondContact O-CG 3.38Å; E173-L177 PolarHBondContact O-N 3.48Å
174I97.7Very high95.9Very high0 Ų040.1 Ų40.10%020%0.2CC..Hα-helixtrans-60.6-47.5180-67.6162.2000111.2A127 R131 A139 R140 A143 E170 L171 S176 L177 L178A127-I174 HydrophobicContact CB-CD1 4.46Å; R131-I174 HydrophobicContact CB-CG1 4.49Å; R131-I174 HydrophobicContact CG-CG1 4.15Å; A139-I174 HydrophobicContact CB-CD1 3.89Å; A139-I174 HydrophobicContact CB-CG1 4.22Å; R140-I174 HydrophobicContact CB-CG2 3.79Å; R140-I174 HydrophobicContact CG-CG2 4.47Å; A143-I174 HydrophobicContact CB-CD1 3.89Å; E170-I174 WeakPolarHBondContact O-CD1 3.45Å; E170-I174 VanDerWaalsContact O-CG1 3.26Å; E170-I174 WeakPolarHBondContact O-CG1 3.28Å; E170-I174 PolarHBondContact O-N 3.06Å; L171-I174 PolarHBondContact O-N 3.49Å; I174-S176 VanDerWaalsContact C-N 3.31Å; I174-S176 PolarHBondContact O-N 3.07Å; I174-L177 PolarHBondContact O-N 3.39Å; I174-L178 HydrophobicContact CG2-CD1 3.96Å; I174-L178 WeakPolarHBondContact O-CB 3.34Å; I174-L178 WeakPolarHBondContact O-CG 3.39Å; I174-L178 PolarHBondContact O-N 2.8Å
175Y98.2Very high95.9Very high22 Ų2238.5 Ų38.59%0.08621%0.206CC..Hα-helixtrans-63.6-37.5177.2-74.1-46.9000112.4R140 E144 L171 E173 G179 L194 L197 M201R140-Y175 HydrophobicContact CG-CE1 4.07Å; E144-Y175 PolarHBondContact OE1-OH 3.12Å; L171-Y175 HydrophobicContact CB-CD2 4.09Å; L171-Y175 HydrophobicContact CB-CE2 3.92Å; L171-Y175 HydrophobicContact CD2-CE2 4.09Å; L171-Y175 HydrophobicContact CG-CE2 4.41Å; L171-Y175 VanDerWaalsContact O-CB 3.3Å; L171-Y175 WeakPolarHBondContact O-CB 3.46Å; L171-Y175 WeakPolarHBondContact O-CD2 3.48Å; L171-Y175 PolarHBondContact O-N 2.95Å; E173-Y175 PolarHBondContact O-N 2.87Å; Y175-G179 PolarHBondContact O-N 2.91Å; Y175-L194 WeakPolarHBondContact CB-O 3.41Å; Y175-L194 HydrophobicContact CD1-CD2 3.75Å; Y175-L194 HydrophobicContact CE1-CD2 4.22Å; Y175-L197 HydrophobicContact CD1-CB 4.35Å; Y175-L197 HydrophobicContact CD2-CB 3.82Å; Y175-L197 HydrophobicContact CE1-CB 4.5Å; Y175-L197 HydrophobicContact CE1-CD1 4.16Å; Y175-L197 HydrophobicContact CE2-CB 4.01Å; Y175-L197 HydrophobicContact CG-CB 4.02Å; Y175-M201 HydrophobicContact CD2-CG 4Å; Y175-M201 HydrophobicContact CE2-CG 3.96Å
176S96.1Very high95.9Very high4 Ų444.2 Ų44.23%0.02823%0.232CC..Hα-helixtrans-60.6-49.3174.5-64.70000111.6G172 E173 I174 G179 E180 R218G172-S176 WeakPolarHBondContact O-CB 3.46Å; G172-S176 PolarHBondContact O-N 2.89Å; G172-S176 VanDerWaalsContact O-N 3.14Å; G172-S176 PolarHBondContact O-OG 3.36Å; E173-S176 WeakPolarHBondContact O-CB 3.35Å; E173-S176 PolarHBondContact O-N 3.43Å; I174-S176 VanDerWaalsContact C-N 3.31Å; I174-S176 PolarHBondContact O-N 3.07Å; S176-G179 PolarHBondContact O-N 3.39Å; S176-E180 WeakPolarHBondContact O-CG 3.15Å; S176-E180 PolarHBondContact O-N 2.99Å; S176-R218 PolarHBondContact OG-NH1 2.93Å
177L96.8Very high96Very high49 Ų4945.9 Ų45.926%0.25724%0.242SC..Hα-helixtrans-64.4-42.3-179.5-69171.8000112R131 L136 E173 I174 E180 A181R131-L177 HydrophobicContact CG-CD1 4.13Å; L136-L177 HydrophobicContact CD1-CB 3.76Å; L136-L177 HydrophobicContact CD2-CB 4.14Å; L136-L177 HydrophobicContact CD2-CD1 4Å; E173-L177 HydrophobicContact CG-CD1 4.13Å; E173-L177 HydrophobicContact CG-CG 4.49Å; E173-L177 WeakPolarHBondContact O-CG 3.38Å; E173-L177 PolarHBondContact O-N 3.48Å; I174-L177 PolarHBondContact O-N 3.39Å; L177-E180 PolarHBondContact O-N 3.39Å; L177-A181 PolarHBondContact O-N 3.15Å
178L97.4Very high96Very high12 Ų1250 Ų506%0.06326%0.259CS..Hα-helixtrans-61.1-47.9173.3-75.3169.8000110.6L136 R140 I174 E180 A181 Y182 L194L136-L178 HydrophobicContact CB-CD1 4.47Å; L136-L178 HydrophobicContact CB-CD2 3.45Å; L136-L178 VanDerWaalsContact CB-CD2 3.45Å; L136-L178 HydrophobicContact CB-CG 3.79Å; L136-L178 HydrophobicContact CD1-CD2 3.95Å; L136-L178 HydrophobicContact CD1-CG 4.11Å; L136-L178 HydrophobicContact CG-CD2 4.37Å; R140-L178 HydrophobicContact CB-CD1 4.39Å; I174-L178 HydrophobicContact CG2-CD1 3.96Å; I174-L178 WeakPolarHBondContact O-CB 3.34Å; I174-L178 WeakPolarHBondContact O-CG 3.39Å; I174-L178 PolarHBondContact O-N 2.8Å; L178-E180 VanDerWaalsContact C-N 3.35Å; L178-E180 PolarHBondContact O-N 3.25Å; L178-A181 WeakPolarHBondContact O-CB 3.33Å; L178-A181 PolarHBondContact O-N 2.96Å; L178-A181 VanDerWaalsContact O-N 3.13Å; L178-Y182 VanDerWaalsContact O-CD2 3.23Å; L178-Y182 WeakPolarHBondContact O-CD2 3.45Å; L178-Y182 PolarHBondContact O-N 3.39Å; L178-L194 HydrophobicContact CB-CD1 3.92Å
179G97.1Very high95.9Very high0 Ų056.7 Ų56.70%029%0.294CS..Hα-helixtrans-57.1-45.3178.400000112.8Y175 S176 A181 Y182 L183 A191Y175-G179 PolarHBondContact O-N 2.91Å; S176-G179 PolarHBondContact O-N 3.39Å; G179-A181 PolarHBondContact O-N 3.15Å; G179-Y182 PolarHBondContact O-N 3.47Å; G179-L183 WeakPolarHBondContact O-CG 3.44Å; G179-L183 PolarHBondContact O-N 3.09Å; G179-A191 WeakPolarHBondContact O-CB 3.34Å
180E95.9Very high96Very high81 Ų8152.4 Ų52.438%0.37928%0.284SS..Hα-helixtrans-61.7-40.3174.6-73.2175.9-174.300112.5S176 L177 L178 L183 A184 R218S176-E180 WeakPolarHBondContact O-CG 3.15Å; S176-E180 PolarHBondContact O-N 2.99Å; L177-E180 PolarHBondContact O-N 3.39Å; L178-E180 VanDerWaalsContact C-N 3.35Å; L178-E180 PolarHBondContact O-N 3.25Å; E180-L183 WeakPolarHBondContact O-CB 3.33Å; E180-L183 PolarHBondContact O-N 3Å; E180-A184 PolarHBondContact O-N 2.94Å; E180-R218 WeakPolarHBondContact OE1-CD 3.3Å; E180-R218 IonicContact OE1-CZ 3.31Å; E180-R218 IonicContact OE1-NE 3.13Å; E180-R218 PolarHBondContact OE1-NE 3.43Å; E180-R218 IonicContact OE1-NH2 2.68Å
181A95.8Very high96.1Very high52 Ų5251.2 Ų51.243%0.4328%0.278SS..Hα-helixtrans-63.8-43.3175.700000112L177 L178 G179 A184 A185L177-A181 PolarHBondContact O-N 3.15Å; L178-A181 WeakPolarHBondContact O-CB 3.33Å; L178-A181 PolarHBondContact O-N 2.96Å; L178-A181 VanDerWaalsContact O-N 3.13Å; G179-A181 PolarHBondContact O-N 3.15Å; A181-A184 PolarHBondContact O-N 3.09Å; A181-A185 PolarHBondContact O-N 2.94Å
182Y96.4Very high96Very high80 Ų8051.8 Ų51.831%0.31428%0.282SS..Hα-helixtrans-67.7-33.7175-80-79.4000112.3L178 G179 A185 Q186 E187 T190 L194L178-Y182 VanDerWaalsContact O-CD2 3.23Å; L178-Y182 WeakPolarHBondContact O-CD2 3.45Å; L178-Y182 PolarHBondContact O-N 3.39Å; G179-Y182 PolarHBondContact O-N 3.47Å; Y182-A185 CarbonylContact O-C 3.6Å; Y182-A185 PolarHBondContact O-N 2.96Å; Y182-Q186 PolarHBondContact O-N 2.91Å; Y182-Q186 VanDerWaalsContact O-N 3.11Å; Y182-E187 HydrophobicContact CD1-CB 3.78Å; Y182-E187 HydrophobicContact CD1-CG 4.29Å; Y182-E187 WeakPolarHBondContact CD1-OE2 3.31Å; Y182-E187 VanDerWaalsContact CE1-OE2 3.3Å; Y182-E187 WeakPolarHBondContact CE1-OE2 3.47Å; Y182-E187 PolarHBondContact O-N 3.01Å; Y182-T190 HydrophobicContact CD1-CG2 3.86Å; Y182-T190 HydrophobicContact CD2-CG2 4.05Å; Y182-T190 HydrophobicContact CE1-CG2 3.89Å; Y182-T190 HydrophobicContact CE2-CG2 4.11Å; Y182-T190 HydrophobicContact CG-CG2 3.95Å; Y182-L194 HydrophobicContact CD2-CD1 3.42Å; Y182-L194 VanDerWaalsContact CD2-CD1 3.42Å; Y182-L194 HydrophobicContact CE2-CD1 3.77Å; Y182-L194 HydrophobicContact CG-CD1 4.33Å
183L95.1Very high96.1Very high31 Ų3156.8 Ų56.816%0.16231%0.305CS..Hα-helixtrans-61.7-43.9170.7-74.3-177.7000111.8G179 E180 A185 Q186 Y188 A191 L195G179-L183 WeakPolarHBondContact O-CG 3.44Å; G179-L183 PolarHBondContact O-N 3.09Å; E180-L183 WeakPolarHBondContact O-CB 3.33Å; E180-L183 PolarHBondContact O-N 3Å; L183-A185 PolarHBondContact O-N 3.33Å; L183-Q186 PolarHBondContact O-N 3.22Å; L183-Y188 HydrophobicContact CD2-CD1 4.09Å; L183-A191 HydrophobicContact CB-CB 4.39Å; L183-A191 HydrophobicContact CD2-CB 3.39Å; L183-A191 HydrophobicContact CG-CB 3.61Å; L183-L195 HydrophobicContact CD1-CD1 3.73Å; L183-L195 HydrophobicContact CG-CD1 4.17Å
184A95.2Very high96.2Very high85 Ų8553.3 Ų53.370%0.70229%0.289SS*.Hα-helixtrans-63.4-32.9176.600000112E180 A181 Q186E180-A184 PolarHBondContact O-N 2.94Å; A181-A184 PolarHBondContact O-N 3.09Å; A184-Q186 PolarHBondContact O-N 3.34Å
185A96.1Very high96.2Very high58 Ų5853.4 Ų53.448%0.47929%0.29SS..THydrogen-bonded Turntrans-77.6-2.2172.700000114.2A181 Y182 L183 E187A181-A185 PolarHBondContact O-N 2.94Å; Y182-A185 CarbonylContact O-C 3.6Å; Y182-A185 PolarHBondContact O-N 2.96Å; L183-A185 PolarHBondContact O-N 3.33Å; A185-E187 HydrophobicContact CB-CG 4.4Å; A185-E187 PolarHBondContact O-N 2.96Å
186Q95.2Very high96.2Very high137 Ų13756.4 Ų56.464%0.6431%0.305SS*.THydrogen-bonded Turntrans62.624.2-176.2-52.9178.212.500114.1Y182 L183 A184 Y188Y182-Q186 PolarHBondContact O-N 2.91Å; Y182-Q186 VanDerWaalsContact O-N 3.11Å; L183-Q186 PolarHBondContact O-N 3.22Å; A184-Q186 PolarHBondContact O-N 3.34Å; Q186-Y188 HydrophobicContact CB-CE1 4.42Å; Q186-Y188 HydrophobicContact CB-CE2 4.22Å; Q186-Y188 PolarHBondContact O-N 3.46Å
187E96.5Very high96.2Very high96 Ų9659.2 Ų59.245%0.44932%0.319SS..  trans-91.672.3174-70.2-173.8-137.300109.9Y182 A185 D189 T190 A191Y182-E187 HydrophobicContact CD1-CB 3.78Å; Y182-E187 HydrophobicContact CD1-CG 4.29Å; Y182-E187 WeakPolarHBondContact CD1-OE2 3.31Å; Y182-E187 VanDerWaalsContact CE1-OE2 3.3Å; Y182-E187 WeakPolarHBondContact CE1-OE2 3.47Å; Y182-E187 PolarHBondContact O-N 3.01Å; A185-E187 HydrophobicContact CB-CG 4.4Å; A185-E187 PolarHBondContact O-N 2.96Å; E187-D189 PolarHBondContact O-N 2.96Å; E187-T190 PolarHBondContact O-N 2.98Å; E187-A191 VanDerWaalsContact O-CB 3.28Å; E187-A191 WeakPolarHBondContact O-CB 3.49Å; E187-A191 PolarHBondContact O-N 2.94Å
188Y94.4Very high96.3Very high87 Ų8756.9 Ų56.934%0.34131%0.307SS..Hα-helixtrans-63.9-34.9-166.2-57.4-58.8000115.2L183 Q186 T192L183-Y188 HydrophobicContact CD2-CD1 4.09Å; Q186-Y188 HydrophobicContact CB-CE1 4.42Å; Q186-Y188 HydrophobicContact CB-CE2 4.22Å; Q186-Y188 PolarHBondContact O-N 3.46Å; Y188-T192 WeakPolarHBondContact O-CB 3.46Å; Y188-T192 PolarHBondContact O-N 2.82Å; Y188-T192 PolarHBondContact O-OG1 2.99Å
189D93.4Very high96.2Very high140 Ų14056.6 Ų56.675%0.74931%0.306SS*.Hα-helixtrans-68.1-48.4-178.9-67.3-24.8000111.2E187 T192 M193E187-D189 PolarHBondContact O-N 2.96Å; D189-T192 PolarHBondContact O-N 3.49Å; D189-M193 PolarHBondContact O-N 3.2Å; D189-M193 VanDerWaalsContact O-N 3.07Å
190T95.5Very high96.1Very high52 Ų5261.8 Ų61.832%0.31933%0.328SS..Hα-helixtrans-66.1-41.6177.8-56.50000111Y182 E187 M193 L194Y182-T190 HydrophobicContact CD1-CG2 3.86Å; Y182-T190 HydrophobicContact CD2-CG2 4.05Å; Y182-T190 HydrophobicContact CE1-CG2 3.89Å; Y182-T190 HydrophobicContact CE2-CG2 4.11Å; Y182-T190 HydrophobicContact CG-CG2 3.95Å; E187-T190 PolarHBondContact O-N 2.98Å; T190-M193 PolarHBondContact O-N 3.37Å; T190-L194 HydrophobicContact CG2-CD1 3.9Å; T190-L194 WeakPolarHBondContact O-CD1 3.44Å; T190-L194 VanDerWaalsContact O-CG 3.31Å; T190-L194 WeakPolarHBondContact O-CG 3.1Å; T190-L194 PolarHBondContact O-N 3.32Å
191A97Very high96.2Very high0 Ų058.7 Ų58.70%031%0.314CS..Hα-helixtrans-58.1-51.5174.700000112.4G179 L183 E187 M193 L194 L195G179-A191 WeakPolarHBondContact O-CB 3.34Å; L183-A191 HydrophobicContact CB-CB 4.39Å; L183-A191 HydrophobicContact CD2-CB 3.39Å; L183-A191 HydrophobicContact CG-CB 3.61Å; E187-A191 VanDerWaalsContact O-CB 3.28Å; E187-A191 WeakPolarHBondContact O-CB 3.49Å; E187-A191 PolarHBondContact O-N 2.94Å; A191-M193 VanDerWaalsContact C-N 3.33Å; A191-M193 PolarHBondContact O-N 2.67Å; A191-L194 PolarHBondContact O-N 2.81Å; A191-L195 WeakPolarHBondContact O-CB 3.44Å; A191-L195 WeakPolarHBondContact O-CG 3.42Å; A191-L195 PolarHBondContact O-N 3.1Å
192T96.2Very high96.1Very high15 Ų1556.7 Ų56.79%0.09230%0.297CS..Hα-helixtrans-58.9-44.6179.7-600000111.4Y188 D189 L194 L195 Q196 L223Y188-T192 WeakPolarHBondContact O-CB 3.46Å; Y188-T192 PolarHBondContact O-N 2.82Å; Y188-T192 PolarHBondContact O-OG1 2.99Å; D189-T192 PolarHBondContact O-N 3.49Å; T192-L194 PolarHBondContact O-N 3.01Å; T192-L195 PolarHBondContact O-N 3.29Å; T192-Q196 WeakPolarHBondContact O-CB 3.5Å; T192-Q196 VanDerWaalsContact O-CG 3.29Å; T192-Q196 WeakPolarHBondContact O-CG 3.45Å; T192-Q196 PolarHBondContact O-N 2.85Å; T192-L223 HydrophobicContact CG2-CD2 3.67Å; T192-L223 HydrophobicContact CG2-CG 4.2Å
193M96.9Very high95.9Very high110 Ų11056.8 Ų56.854%0.54230%0.303SS..Hα-helixtrans-58.6-47.7176.5-177-159.4-57.900112.1D189 T190 A191 Q196 L197D189-M193 PolarHBondContact O-N 3.2Å; D189-M193 VanDerWaalsContact O-N 3.07Å; T190-M193 PolarHBondContact O-N 3.37Å; A191-M193 VanDerWaalsContact C-N 3.33Å; A191-M193 PolarHBondContact O-N 2.67Å; M193-Q196 PolarHBondContact O-N 3.32Å; M193-L197 HydrophobicContact CG-CD1 4.49Å; M193-L197 WeakPolarHBondContact O-CG 3.22Å; M193-L197 PolarHBondContact O-N 3.09Å
194L97.9Very high95.9Very high9 Ų958.4 Ų58.45%0.04731%0.309CS..Hα-helixtrans-65.8-41.8-179.1-71.3164.8000111.3Y175 L178 Y182 T190 A191 T192 Q196 L197 G198Y175-L194 WeakPolarHBondContact CB-O 3.41Å; Y175-L194 HydrophobicContact CD1-CD2 3.75Å; Y175-L194 HydrophobicContact CE1-CD2 4.22Å; L178-L194 HydrophobicContact CB-CD1 3.92Å; Y182-L194 HydrophobicContact CD2-CD1 3.42Å; Y182-L194 VanDerWaalsContact CD2-CD1 3.42Å; Y182-L194 HydrophobicContact CE2-CD1 3.77Å; Y182-L194 HydrophobicContact CG-CD1 4.33Å; T190-L194 HydrophobicContact CG2-CD1 3.9Å; T190-L194 WeakPolarHBondContact O-CD1 3.44Å; T190-L194 VanDerWaalsContact O-CG 3.31Å; T190-L194 WeakPolarHBondContact O-CG 3.1Å; T190-L194 PolarHBondContact O-N 3.32Å; A191-L194 PolarHBondContact O-N 2.81Å; T192-L194 PolarHBondContact O-N 3.01Å; L194-Q196 VanDerWaalsContact C-N 3.33Å; L194-Q196 PolarHBondContact O-N 3.42Å; L194-L197 WeakPolarHBondContact O-CB 3.39Å; L194-L197 PolarHBondContact O-N 3.44Å; L194-G198 PolarHBondContact O-N 3.37Å
195L97.7Very high95.6Very high1 Ų154.5 Ų54.51%0.00528%0.277CS..Hα-helixtrans-65.3-36.8178.6-65.2167.8000112.2L183 A191 T192 G198 S199 R218 E219L183-L195 HydrophobicContact CD1-CD1 3.73Å; L183-L195 HydrophobicContact CG-CD1 4.17Å; A191-L195 WeakPolarHBondContact O-CB 3.44Å; A191-L195 WeakPolarHBondContact O-CG 3.42Å; A191-L195 PolarHBondContact O-N 3.1Å; T192-L195 PolarHBondContact O-N 3.29Å; L195-G198 PolarHBondContact O-N 3.24Å; L195-S199 PolarHBondContact O-N 2.87Å; L195-R218 WeakPolarHBondContact CD1-O 3.39Å; L195-R218 HydrophobicContact CD2-CB 4.01Å; L195-E219 HydrophobicContact CB-CB 4.41Å
196Q97.3Very high94.6Very high85 Ų8554 Ų5440%0.39728%0.278SS..Hα-helixtrans-64.5-39.5171.3-75.8174.8-10.400112.8T192 M193 L194 G198 S199 K200 E219T192-Q196 WeakPolarHBondContact O-CB 3.5Å; T192-Q196 VanDerWaalsContact O-CG 3.29Å; T192-Q196 WeakPolarHBondContact O-CG 3.45Å; T192-Q196 PolarHBondContact O-N 2.85Å; M193-Q196 PolarHBondContact O-N 3.32Å; L194-Q196 VanDerWaalsContact C-N 3.33Å; L194-Q196 PolarHBondContact O-N 3.42Å; Q196-G198 VanDerWaalsContact C-N 3.32Å; Q196-S199 PolarHBondContact O-OG 3.21Å; Q196-K200 WeakPolarHBondContact O-CB 3.41Å; Q196-K200 PolarHBondContact O-N 3.28Å; Q196-K200 VanDerWaalsContact O-N 3.09Å; Q196-E219 HydrophobicContact CG-CG 3.77Å; Q196-E219 WeakPolarHBondContact CG-OE1 3.44Å
197L97.3Very high93.3Very high63 Ų6349.7 Ų49.733%0.3327%0.27SS..Hα-helixtrans-64.7-40.7172.5-71.6171.1000110.8Y175 M193 L194 K200 M201Y175-L197 HydrophobicContact CD1-CB 4.35Å; Y175-L197 HydrophobicContact CD2-CB 3.82Å; Y175-L197 HydrophobicContact CE1-CB 4.5Å; Y175-L197 HydrophobicContact CE1-CD1 4.16Å; Y175-L197 HydrophobicContact CE2-CB 4.01Å; Y175-L197 HydrophobicContact CG-CB 4.02Å; M193-L197 HydrophobicContact CG-CD1 4.49Å; M193-L197 WeakPolarHBondContact O-CG 3.22Å; M193-L197 PolarHBondContact O-N 3.09Å; L194-L197 WeakPolarHBondContact O-CB 3.39Å; L194-L197 PolarHBondContact O-N 3.44Å; L197-K200 PolarHBondContact O-N 2.56Å; L197-M201 WeakPolarHBondContact O-CB 3.36Å; L197-M201 VanDerWaalsContact O-CG 3.25Å; L197-M201 WeakPolarHBondContact O-CG 3.21Å; L197-M201 PolarHBondContact O-N 3.2Å
198G96.9Very high92.9Very high0 Ų049.5 Ų49.50%027%0.272CS..Hα-helixtrans-59.1-4817600000113L194 L195 Q196 M201 A202L194-G198 PolarHBondContact O-N 3.37Å; L195-G198 PolarHBondContact O-N 3.24Å; Q196-G198 VanDerWaalsContact C-N 3.32Å; G198-M201 PolarHBondContact O-N 3.07Å; G198-A202 PolarHBondContact O-N 3.02Å
199S95.6Very high92.7Very high6 Ų649 Ų494%0.04227%0.272CS..Hα-helixtrans-64.7-42.1177.866.40000112.4L195 Q196 M201 A202 I203 E219L195-S199 PolarHBondContact O-N 2.87Å; Q196-S199 PolarHBondContact O-OG 3.21Å; S199-M201 VanDerWaalsContact C-N 3.34Å; S199-M201 PolarHBondContact O-N 3.44Å; S199-A202 WeakPolarHBondContact O-CB 3.32Å; S199-A202 PolarHBondContact O-N 3.41Å; S199-I203 WeakPolarHBondContact O-CG1 3.5Å; S199-I203 PolarHBondContact O-N 2.9Å; S199-I203 VanDerWaalsContact O-N 3.14Å; S199-E219 VanDerWaalsContact CB-OE2 3.23Å; S199-E219 WeakPolarHBondContact CB-OE2 3.19Å; S199-E219 PolarHBondContact OG-OE2 3.47Å
200K96.4Very high92.7Very high109 Ų10944.9 Ų44.947%0.47425%0.254SS..Hα-helixtrans-57.3-47.4173.5-177.2-176.3171.2-174.40111.8Q196 L197 I203 E204Q196-K200 WeakPolarHBondContact O-CB 3.41Å; Q196-K200 PolarHBondContact O-N 3.28Å; Q196-K200 VanDerWaalsContact O-N 3.09Å; L197-K200 PolarHBondContact O-N 2.56Å; K200-I203 PolarHBondContact O-N 3.27Å; K200-E204 WeakPolarHBondContact CE-OE1 3.31Å; K200-E204 IonicContact NZ-OE1 2.81Å; K200-E204 WeakPolarHBondContact O-CG 3.37Å; K200-E204 PolarHBondContact O-N 3.19Å; K200-E204 VanDerWaalsContact O-N 3.08Å
201M96.5Very high92.5Very high16 Ų1645.9 Ų45.98%0.07926%0.26CS..Hα-helixtrans-66.2-36.7179.6-69-61.698.200112.2L147 C168 L171 Y175 L197 G198 S199 I203 E204 G205L147-M201 HydrophobicContact CD2-SD 4.14Å; C168-M201 WeakPolarHBondContact O-CB 3.43Å; L171-M201 HydrophobicContact CB-CB 4.45Å; L171-M201 HydrophobicContact CB-CG 3.98Å; L171-M201 HydrophobicContact CB-SD 4.35Å; L171-M201 HydrophobicContact CD1-SD 4.32Å; Y175-M201 HydrophobicContact CD2-CG 4Å; Y175-M201 HydrophobicContact CE2-CG 3.96Å; L197-M201 WeakPolarHBondContact O-CB 3.36Å; L197-M201 VanDerWaalsContact O-CG 3.25Å; L197-M201 WeakPolarHBondContact O-CG 3.21Å; L197-M201 PolarHBondContact O-N 3.2Å; G198-M201 PolarHBondContact O-N 3.07Å; S199-M201 VanDerWaalsContact C-N 3.34Å; S199-M201 PolarHBondContact O-N 3.44Å; M201-I203 VanDerWaalsContact C-N 3.35Å; M201-I203 PolarHBondContact O-N 3.02Å; M201-E204 WeakPolarHBondContact CE-OE2 3.46Å; M201-E204 PolarHBondContact O-N 3.47Å; M201-G205 PolarHBondContact O-N 3.42Å
202A93.9Very high92.4Very high10 Ų1047.5 Ų47.58%0.08327%0.267CS..Hα-helixtrans-59.5-43.8174.800000112.3G198 S199 G205 V211G198-A202 PolarHBondContact O-N 3.02Å; S199-A202 WeakPolarHBondContact O-CB 3.32Å; S199-A202 PolarHBondContact O-N 3.41Å; A202-G205 PolarHBondContact O-N 3Å; A202-V211 HydrophobicContact CB-CG1 4.08Å
203I93.6Very high92.3Very high82 Ų8246.8 Ų46.842%0.42126%0.263SS..Hα-helixtrans-64.6-44.3176.4-61.4161.3000110.7S199 K200 M201 G205 E212 F216S199-I203 WeakPolarHBondContact O-CG1 3.5Å; S199-I203 PolarHBondContact O-N 2.9Å; S199-I203 VanDerWaalsContact O-N 3.14Å; K200-I203 PolarHBondContact O-N 3.27Å; M201-I203 VanDerWaalsContact C-N 3.35Å; M201-I203 PolarHBondContact O-N 3.02Å; I203-G205 VanDerWaalsContact C-N 3.25Å; I203-G205 PolarHBondContact O-N 3.39Å; I203-E212 HydrophobicContact CG1-CG 4.36Å; I203-F216 HydrophobicContact CD1-CE1 4.04Å; I203-F216 HydrophobicContact CD1-CZ 3.65Å; I203-F216 HydrophobicContact CG1-CZ 4.2Å
204E93.6Very high92.3Very high65 Ų6544 Ų4430%0.30425%0.249SC..Hα-helixtrans-68.9-23179.4-71.3179.9-171.600113.2L165 C168 K200 M201 G206L165-E204 WeakPolarHBondContact CD2-O 3.29Å; C168-E204 HydrophobicContact CB-CB 4.34Å; K200-E204 WeakPolarHBondContact CE-OE1 3.31Å; K200-E204 IonicContact NZ-OE1 2.81Å; K200-E204 WeakPolarHBondContact O-CG 3.37Å; K200-E204 PolarHBondContact O-N 3.19Å; K200-E204 VanDerWaalsContact O-N 3.08Å; M201-E204 WeakPolarHBondContact CE-OE2 3.46Å; M201-E204 PolarHBondContact O-N 3.47Å; E204-G206 PolarHBondContact O-N 2.88Å
205G89.5Confident92.2Very high3 Ų343.9 Ų43.93%0.03125%0.249CC..THydrogen-bonded Turntrans-71.3-0.5-179.700000116.1R169 M201 A202 I203R169-G205 PolarHBondContact NE-O 2.99Å; R169-G205 PolarHBondContact NH2-O 3.47Å; M201-G205 PolarHBondContact O-N 3.42Å; A202-G205 PolarHBondContact O-N 3Å; I203-G205 VanDerWaalsContact C-N 3.25Å; I203-G205 PolarHBondContact O-N 3.39Å
206G75.3Confident92.1Very high47 Ų4745.6 Ų45.649%0.48526%0.256SS..  trans93.739.5160.900000116.3E204E204-G206 PolarHBondContact O-N 2.88Å
207G68.6Low92.2Very high47 Ų4742.8 Ų42.849%0.48524%0.243SC..  trans100.420.8148.200000118K209G207-K209 PolarHBondContact O-N 3.31Å; G207-K209 VanDerWaalsContact O-N 3.15Å
208D87.1Confident92.2Very high92 Ų9242.7 Ų42.749%0.49224%0.238SC..  trans-76.697.3160.4-170.4-22.5000109S210 V211 E212D208-S210 PolarHBondContact O-N 3.05Å; D208-S210 VanDerWaalsContact O-N 3.13Å; D208-S210 WeakPolarHBondContact OD1-CA 3.25Å; D208-S210 WeakPolarHBondContact OD1-CB 3.35Å; D208-S210 PolarHBondContact OD1-N 3.29Å; D208-V211 HydrophobicContact CB-CB 4.08Å; D208-V211 HydrophobicContact CB-CG2 3.84Å; D208-V211 WeakPolarHBondContact O-CB 3.46Å; D208-V211 PolarHBondContact O-N 3.37Å; D208-V211 PolarHBondContact OD1-N 3.37Å; D208-E212 PolarHBondContact O-N 3.44Å
209K91.3Very high92.2Very high77 Ų7743.8 Ų43.834%0.33524%0.243SC..Hα-helixtrans-57.1-26.3178.5-72.5-175.9176.1-175.90113.3G207 A213 Y245 L246G207-K209 PolarHBondContact O-N 3.31Å; G207-K209 VanDerWaalsContact O-N 3.15Å; K209-A213 VanDerWaalsContact O-CB 3.29Å; K209-A213 WeakPolarHBondContact O-CB 3.3Å; K209-A213 PolarHBondContact O-N 3.32Å; K209-Y245 HydrophobicContact CD-CD1 3.72Å; K209-Y245 HydrophobicContact CD-CE1 3.57Å; K209-Y245 VanDerWaalsContact NZ-CZ 3.34Å; K209-L246 HydrophobicContact CB-CD1 4.29Å; K209-L246 HydrophobicContact CB-CD2 4.08Å; K209-L246 HydrophobicContact CB-CG 4.46Å
210S92.6Very high92.3Very high54 Ų5443.5 Ų43.538%0.37824%0.241SC..Hα-helixtrans-69.3-44.2175.9-170.90000110.5D208 A213 E214D208-S210 PolarHBondContact O-N 3.05Å; D208-S210 VanDerWaalsContact O-N 3.13Å; D208-S210 WeakPolarHBondContact OD1-CA 3.25Å; D208-S210 WeakPolarHBondContact OD1-CB 3.35Å; D208-S210 PolarHBondContact OD1-N 3.29Å; S210-A213 PolarHBondContact O-N 2.85Å; S210-E214 PolarHBondContact O-N 3.17Å
211V92.1Very high92.3Very high73 Ų7341.2 Ų41.244%0.44223%0.233SC..Hα-helixtrans-65.2-42.5175.3179.10000110.7A202 D208 A213 E214 S215A202-V211 HydrophobicContact CB-CG1 4.08Å; D208-V211 HydrophobicContact CB-CB 4.08Å; D208-V211 HydrophobicContact CB-CG2 3.84Å; D208-V211 WeakPolarHBondContact O-CB 3.46Å; D208-V211 PolarHBondContact O-N 3.37Å; D208-V211 PolarHBondContact OD1-N 3.37Å; V211-A213 PolarHBondContact O-N 3.1Å; V211-E214 PolarHBondContact O-N 3.12Å; V211-S215 WeakPolarHBondContact O-CB 3.48Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 PolarHBondContact O-OG 3.37Å
212E93.6Very high92.3Very high33 Ų3340.5 Ų40.515%0.15423%0.229CC..Hα-helixtrans-57.8-49.3173.7-69.6175.3-167.400111.2I203 D208 E214 S215 F216I203-E212 HydrophobicContact CG1-CG 4.36Å; D208-E212 PolarHBondContact O-N 3.44Å; E212-E214 PolarHBondContact O-N 3.44Å; E212-S215 PolarHBondContact O-N 3.26Å; E212-S215 PolarHBondContact O-OG 2.78Å; E212-F216 HydrophobicContact CB-CE2 4.45Å; E212-F216 WeakPolarHBondContact O-CD2 3.48Å; E212-F216 PolarHBondContact O-N 3.01Å
213A95.6Very high92.4Very high0 Ų040.8 Ų40.80%023%0.229CC..Hα-helixtrans-61-45.7-179.900000112.7K209 S210 V211 S215 F216 F217 L242 F243K209-A213 VanDerWaalsContact O-CB 3.29Å; K209-A213 WeakPolarHBondContact O-CB 3.3Å; K209-A213 PolarHBondContact O-N 3.32Å; S210-A213 PolarHBondContact O-N 2.85Å; V211-A213 PolarHBondContact O-N 3.1Å; A213-S215 VanDerWaalsContact C-N 3.31Å; A213-S215 PolarHBondContact O-N 3.27Å; A213-F216 PolarHBondContact O-N 3.45Å; A213-F217 WeakPolarHBondContact O-CB 3.42Å; A213-F217 PolarHBondContact O-N 3.03Å; A213-L242 HydrophobicContact CB-CB 3.79Å; A213-L242 HydrophobicContact CB-CD1 3.98Å; A213-F243 HydrophobicContact CB-CD1 3.96Å; A213-F243 HydrophobicContact CB-CD2 4.44Å; A213-F243 HydrophobicContact CB-CE1 3.57Å; A213-F243 HydrophobicContact CB-CE2 4.09Å; A213-F243 HydrophobicContact CB-CG 4.38Å; A213-F243 HydrophobicContact CB-CZ 3.64Å
214E95.6Very high92.5Very high53 Ų5337.2 Ų37.225%0.24821%0.211CC..Hα-helixtrans-65.8-36.2177.2-17069.6-167.900111.1S210 V211 E212 F217 R218 K254S210-E214 PolarHBondContact O-N 3.17Å; V211-E214 PolarHBondContact O-N 3.12Å; E212-E214 PolarHBondContact O-N 3.44Å; E214-F217 WeakPolarHBondContact O-CB 3.47Å; E214-F217 PolarHBondContact O-N 3.45Å; E214-R218 WeakPolarHBondContact O-CG 3.46Å; E214-R218 PolarHBondContact O-N 3.01Å; E214-K254 IonicContact OE1-NZ 3.06Å; E214-K254 IonicContact OE2-NZ 2.68Å
215S95.5Very high92.6Very high6 Ų636.1 Ų36.14%0.04221%0.21CC..Hα-helixtrans-65.6-42.117777.70000112.7V211 E212 A213 F217 R218 E219V211-S215 WeakPolarHBondContact O-CB 3.48Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 PolarHBondContact O-OG 3.37Å; E212-S215 PolarHBondContact O-N 3.26Å; E212-S215 PolarHBondContact O-OG 2.78Å; A213-S215 VanDerWaalsContact C-N 3.31Å; A213-S215 PolarHBondContact O-N 3.27Å; S215-F217 VanDerWaalsContact C-N 3.32Å; S215-F217 PolarHBondContact O-N 3.15Å; S215-R218 PolarHBondContact O-N 2.92Å; S215-E219 PolarHBondContact O-N 3.29Å
216F97.2Very high92.8Very high36 Ų3638.5 Ų38.516%0.15823%0.227CC..Hα-helixtrans-65-36.6172.8-72.3-51.3000112.1I203 E212 A213 R218 E219 G220 L235 T238 L242I203-F216 HydrophobicContact CD1-CE1 4.04Å; I203-F216 HydrophobicContact CD1-CZ 3.65Å; I203-F216 HydrophobicContact CG1-CZ 4.2Å; E212-F216 HydrophobicContact CB-CE2 4.45Å; E212-F216 WeakPolarHBondContact O-CD2 3.48Å; E212-F216 PolarHBondContact O-N 3.01Å; A213-F216 PolarHBondContact O-N 3.45Å; F216-R218 VanDerWaalsContact C-N 3.35Å; F216-E219 PolarHBondContact O-N 2.89Å; F216-G220 PolarHBondContact O-N 3.25Å; F216-L235 HydrophobicContact CD1-CD2 3.92Å; F216-T238 HydrophobicContact CD2-CG2 4.21Å; F216-T238 HydrophobicContact CE2-CG2 4.27Å; F216-L242 HydrophobicContact CD2-CD1 3.72Å; F216-L242 HydrophobicContact CE2-CD1 3.96Å
217F97.6Very high93.7Very high27 Ų2738.4 Ų38.412%0.11823%0.225CC..Hα-helixtrans-62.9-44.2176.4-177.5-93.4000110.8A213 E214 S215 G220 M221 F236 C239 K254 A258A213-F217 WeakPolarHBondContact O-CB 3.42Å; A213-F217 PolarHBondContact O-N 3.03Å; E214-F217 WeakPolarHBondContact O-CB 3.47Å; E214-F217 PolarHBondContact O-N 3.45Å; S215-F217 VanDerWaalsContact C-N 3.32Å; S215-F217 PolarHBondContact O-N 3.15Å; F217-G220 PolarHBondContact O-N 3.41Å; F217-M221 HydrophobicContact CD1-CG 4.19Å; F217-M221 HydrophobicContact CE1-CG 3.79Å; F217-M221 HydrophobicContact CE1-SD 4.31Å; F217-M221 HydrophobicContact CZ-CG 4.18Å; F217-M221 HydrophobicContact CZ-SD 4.24Å; F217-M221 WeakPolarHBondContact O-CG 3.28Å; F217-M221 PolarHBondContact O-N 2.85Å; F217-F236 AromaticContact CD2-CD1 3.97Å; F217-F236 HydrophobicContact CD2-CD1 3.97Å; F217-F236 HydrophobicContact CD2-CE1 4Å; F217-F236 HydrophobicContact CE2-CD1 4.26Å; F217-F236 HydrophobicContact CE2-CE1 4.1Å; F217-C239 PolarHBondContact N-SG 3.28Å; F217-K254 HydrophobicContact CE2-CB 3.94Å; F217-K254 HydrophobicContact CZ-CB 4.05Å; F217-A258 HydrophobicContact CE2-CB 3.87Å; F217-A258 HydrophobicContact CZ-CB 4.34Å
218R97.1Very high95Very high61 Ų6139.6 Ų39.623%0.2322%0.221CC..Hα-helixtrans-64.4-44.7176.2-68.2174.1175.6171.6-4.7112S176 E180 L195 E214 S215 F216 G220 M221 G222S176-R218 PolarHBondContact OG-NH1 2.93Å; E180-R218 WeakPolarHBondContact OE1-CD 3.3Å; E180-R218 IonicContact OE1-CZ 3.31Å; E180-R218 IonicContact OE1-NE 3.13Å; E180-R218 PolarHBondContact OE1-NE 3.43Å; E180-R218 IonicContact OE1-NH2 2.68Å; L195-R218 WeakPolarHBondContact CD1-O 3.39Å; L195-R218 HydrophobicContact CD2-CB 4.01Å; E214-R218 WeakPolarHBondContact O-CG 3.46Å; E214-R218 PolarHBondContact O-N 3.01Å; S215-R218 PolarHBondContact O-N 2.92Å; F216-R218 VanDerWaalsContact C-N 3.35Å; R218-G220 VanDerWaalsContact C-N 3.33Å; R218-G220 PolarHBondContact O-N 3.4Å; R218-M221 WeakPolarHBondContact O-CB 3.5Å; R218-M221 PolarHBondContact O-N 3.38Å; R218-M221 VanDerWaalsContact O-N 3.15Å; R218-G222 PolarHBondContact O-N 3.23Å
219E97.3Very high95.5Very high23 Ų2336.9 Ų36.911%0.10721%0.205CC..Hα-helixtrans-58.1-44.9173.9-173.4-171.3154.600112L195 Q196 S199 S215 F216 M221 G222 L223 L235L195-E219 HydrophobicContact CB-CB 4.41Å; Q196-E219 HydrophobicContact CG-CG 3.77Å; Q196-E219 WeakPolarHBondContact CG-OE1 3.44Å; S199-E219 VanDerWaalsContact CB-OE2 3.23Å; S199-E219 WeakPolarHBondContact CB-OE2 3.19Å; S199-E219 PolarHBondContact OG-OE2 3.47Å; S215-E219 PolarHBondContact O-N 3.29Å; F216-E219 PolarHBondContact O-N 2.89Å; E219-M221 VanDerWaalsContact C-N 3.31Å; E219-M221 PolarHBondContact O-N 2.95Å; E219-G222 WeakPolarHBondContact O-CA 3.48Å; E219-G222 PolarHBondContact O-N 3.35Å; E219-G222 VanDerWaalsContact O-N 3.07Å; E219-L223 PolarHBondContact O-N 3.27Å; E219-L235 HydrophobicContact CB-CD1 3.85Å; E219-L235 HydrophobicContact CG-CD1 3.53Å; E219-L235 WeakPolarHBondContact OE1-CD1 3.04Å
220G97.6Very high95.7Very high0 Ų039.2 Ų39.20%022%0.217CC..Hα-helixtrans-60.8-37.617500000113.1F216 F217 R218 G222 L223 Q224 A232 F236F216-G220 PolarHBondContact O-N 3.25Å; F217-G220 PolarHBondContact O-N 3.41Å; R218-G220 VanDerWaalsContact C-N 3.33Å; R218-G220 PolarHBondContact O-N 3.4Å; G220-G222 VanDerWaalsContact C-N 3.31Å; G220-G222 PolarHBondContact O-N 3.21Å; G220-L223 PolarHBondContact O-N 2.76Å; G220-Q224 VanDerWaalsContact O-CB 3.31Å; G220-Q224 WeakPolarHBondContact O-CB 3.26Å; G220-Q224 PolarHBondContact O-N 3.47Å; G220-A232 WeakPolarHBondContact O-CB 3.47Å; G220-F236 WeakPolarHBondContact O-CZ 3.35Å
221M96.5Very high95.9Very high61 Ų6137.9 Ų37.930%0.321%0.209SC..Hα-helixtrans-63-37.6173.1-76.5-71.4-5600112.2F217 R218 E219 S225 F236F217-M221 HydrophobicContact CD1-CG 4.19Å; F217-M221 HydrophobicContact CE1-CG 3.79Å; F217-M221 HydrophobicContact CE1-SD 4.31Å; F217-M221 HydrophobicContact CZ-CG 4.18Å; F217-M221 HydrophobicContact CZ-SD 4.24Å; F217-M221 WeakPolarHBondContact O-CG 3.28Å; F217-M221 PolarHBondContact O-N 2.85Å; R218-M221 WeakPolarHBondContact O-CB 3.5Å; R218-M221 PolarHBondContact O-N 3.38Å; R218-M221 VanDerWaalsContact O-N 3.15Å; E219-M221 VanDerWaalsContact C-N 3.31Å; E219-M221 PolarHBondContact O-N 2.95Å; M221-S225 WeakPolarHBondContact O-CB 3.4Å; M221-S225 PolarHBondContact O-N 3.4Å; M221-S225 PolarHBondContact O-OG 3.43Å; M221-F236 HydrophobicContact CG-CE1 4.42Å; M221-F236 HydrophobicContact CG-CZ 4.46Å
222G96.6Very high96.1Very high0 Ų034.4 Ų34.40%019%0.188CC..Hα-helixtrans-61.7-53174.300000112.2R218 E219 G220 Q224 S225 S226R218-G222 PolarHBondContact O-N 3.23Å; E219-G222 WeakPolarHBondContact O-CA 3.48Å; E219-G222 PolarHBondContact O-N 3.35Å; E219-G222 VanDerWaalsContact O-N 3.07Å; G220-G222 VanDerWaalsContact C-N 3.31Å; G220-G222 PolarHBondContact O-N 3.21Å; G222-Q224 VanDerWaalsContact C-N 3.35Å; G222-Q224 PolarHBondContact O-N 3.42Å; G222-S225 WeakPolarHBondContact O-CB 3.39Å; G222-S225 PolarHBondContact O-N 3.18Å; G222-S226 PolarHBondContact O-N 2.98Å
223L97.1Very high96.3Very high16 Ų1634.1 Ų34.18%0.08419%0.187CC..Hα-helixtrans-61.5-40177.4-69.6169.2000112.8T192 E219 G220 S225 S226 G227 D228 A231 A232 L235T192-L223 HydrophobicContact CG2-CD2 3.67Å; T192-L223 HydrophobicContact CG2-CG 4.2Å; E219-L223 PolarHBondContact O-N 3.27Å; G220-L223 PolarHBondContact O-N 2.76Å; L223-S225 PolarHBondContact O-N 2.97Å; L223-S226 WeakPolarHBondContact CA-OG 3.33Å; L223-S226 PolarHBondContact O-N 3.26Å; L223-S226 PolarHBondContact O-OG 3.31Å; L223-G227 PolarHBondContact O-N 3.42Å; L223-G227 VanDerWaalsContact O-N 3.15Å; L223-D228 HydrophobicContact CB-CB 4.44Å; L223-D228 HydrophobicContact CD2-CB 4.28Å; L223-D228 PolarHBondContact O-N 3.45Å; L223-A231 HydrophobicContact CD1-CB 3.83Å; L223-A231 HydrophobicContact CD2-CB 4.49Å; L223-A232 HydrophobicContact CB-CB 3.94Å; L223-L235 HydrophobicContact CD1-CD1 3.59Å
224Q96.4Very high96.5Very high8 Ų841.2 Ų41.24%0.03722%0.218CC..Hα-helixtrans-62.6-36.1175.2-178.6179.18800111.4G220 G222 G227 A232 F236 A258 K261 S262G220-Q224 VanDerWaalsContact O-CB 3.31Å; G220-Q224 WeakPolarHBondContact O-CB 3.26Å; G220-Q224 PolarHBondContact O-N 3.47Å; G222-Q224 VanDerWaalsContact C-N 3.35Å; G222-Q224 PolarHBondContact O-N 3.42Å; Q224-G227 PolarHBondContact O-N 2.97Å; Q224-A232 HydrophobicContact CB-CB 3.93Å; Q224-F236 HydrophobicContact CB-CE2 4.42Å; Q224-F236 HydrophobicContact CB-CZ 4.46Å; Q224-A258 PolarHBondContact NE2-O 3.28Å; Q224-K261 VanDerWaalsContact OE1-CD 3.28Å; Q224-S262 PolarHBondContact NE2-OG 3.14Å
225S94Very high96.6Very high42 Ų4239.8 Ų39.829%0.29421%0.212SC..Hα-helixtrans-75.6-29.9179.8-56.40000112.5M221 G222 L223 G227M221-S225 WeakPolarHBondContact O-CB 3.4Å; M221-S225 PolarHBondContact O-N 3.4Å; M221-S225 PolarHBondContact O-OG 3.43Å; G222-S225 WeakPolarHBondContact O-CB 3.39Å; G222-S225 PolarHBondContact O-N 3.18Å; L223-S225 PolarHBondContact O-N 2.97Å; S225-G227 PolarHBondContact O-N 3.48Å
226S93.8Very high96.7Very high53 Ų5339.5 Ų39.537%0.37121%0.21SC..Hα-helixtrans-78.6-6171.569.90000113.7G222 L223G222-S226 PolarHBondContact O-N 2.98Å; L223-S226 WeakPolarHBondContact CA-OG 3.33Å; L223-S226 PolarHBondContact O-N 3.26Å; L223-S226 PolarHBondContact O-OG 3.31Å
227G94.2Very high96.7Very high44 Ų4441.3 Ų41.345%0.45422%0.221SC..THydrogen-bonded Turntrans89.72.5179.400000115.1L223 Q224 S225 H229L223-G227 PolarHBondContact O-N 3.42Å; L223-G227 VanDerWaalsContact O-N 3.15Å; Q224-G227 PolarHBondContact O-N 2.97Å; S225-G227 PolarHBondContact O-N 3.48Å; G227-H229 PolarHBondContact O-CD2 3.31Å; G227-H229 PolarHBondContact O-N 2.81Å
228D96.4Very high96.7Very high73 Ų7342.4 Ų42.439%0.3923%0.23SC..  trans-81.671.7172.5-167-16.2000110.7L223 Q230 A231 A232L223-D228 HydrophobicContact CB-CB 4.44Å; L223-D228 HydrophobicContact CD2-CB 4.28Å; L223-D228 PolarHBondContact O-N 3.45Å; D228-Q230 VanDerWaalsContact C-N 3.29Å; D228-Q230 PolarHBondContact O-N 3.16Å; D228-A231 HydrophobicContact CB-CB 4.39Å; D228-A231 PolarHBondContact O-N 2.88Å; D228-A231 VanDerWaalsContact OD1-CB 3.25Å; D228-A231 WeakPolarHBondContact OD1-CB 3.4Å; D228-A231 PolarHBondContact OD1-N 3.4Å; D228-A231 WeakPolarHBondContact OD2-CB 3.37Å; D228-A232 WeakPolarHBondContact O-CB 3.36Å; D228-A232 PolarHBondContact O-N 3.15Å
229H96.8Very high96.7Very high34 Ų3439.5 Ų39.516%0.15722%0.219CC..Hα-helixtrans-63.3-33.7-177.4-67.8-60.1000112.9G227 M233 S262 S265 E266G227-H229 PolarHBondContact O-CD2 3.31Å; G227-H229 PolarHBondContact O-N 2.81Å; H229-M233 WeakPolarHBondContact O-CB 3.28Å; H229-M233 VanDerWaalsContact O-CG 3.28Å; H229-M233 WeakPolarHBondContact O-CG 3.05Å; H229-M233 PolarHBondContact O-N 2.95Å; H229-S262 PolarHBondContact ND1-OG 2.95Å; H229-S265 VanDerWaalsContact CE1-CB 3.45Å; H229-S265 WeakPolarHBondContact CE1-CB 3.46Å; H229-S265 PolarHBondContact CE1-OG 3.24Å; H229-S265 VanDerWaalsContact NE2-CB 3.27Å; H229-S265 WeakPolarHBondContact NE2-CB 3.33Å; H229-E266 HydrophobicContact CB-CG 3.94Å; H229-E266 WeakPolarHBondContact CB-OE1 3.42Å
230Q96.1Very high96.8Very high127 Ų12739.5 Ų39.559%0.59322%0.22SC*.Hα-helixtrans-69.7-45.3-179.9-65.9-172.3-4.300112.1D228 M233 K234 E266D228-Q230 VanDerWaalsContact C-N 3.29Å; D228-Q230 PolarHBondContact O-N 3.16Å; Q230-M233 HydrophobicContact CG-CE 4.5Å; Q230-M233 PolarHBondContact O-N 2.95Å; Q230-K234 PolarHBondContact O-N 3.29Å; Q230-E266 WeakPolarHBondContact CG-OE1 3.44Å
231A96.4Very high96.8Very high25 Ų2546.3 Ų46.321%0.20725%0.252CS..Hα-helixtrans-67.1-41.3175.800000111.1L223 D228 M233 K234 L235L223-A231 HydrophobicContact CD1-CB 3.83Å; L223-A231 HydrophobicContact CD2-CB 4.49Å; D228-A231 HydrophobicContact CB-CB 4.39Å; D228-A231 PolarHBondContact O-N 2.88Å; D228-A231 VanDerWaalsContact OD1-CB 3.25Å; D228-A231 WeakPolarHBondContact OD1-CB 3.4Å; D228-A231 PolarHBondContact OD1-N 3.4Å; D228-A231 WeakPolarHBondContact OD2-CB 3.37Å; A231-M233 VanDerWaalsContact C-N 3.34Å; A231-M233 PolarHBondContact O-N 2.85Å; A231-K234 WeakPolarHBondContact O-CB 3.24Å; A231-K234 PolarHBondContact O-N 3.09Å; A231-K234 VanDerWaalsContact O-N 3.15Å; A231-L235 PolarHBondContact O-N 2.87Å
232A97.8Very high96.8Very high0 Ų044.8 Ų44.80%025%0.245CC..Hα-helixtrans-57.3-45.1174.900000112.3G220 L223 Q224 D228 K234 L235 F236G220-A232 WeakPolarHBondContact O-CB 3.47Å; L223-A232 HydrophobicContact CB-CB 3.94Å; Q224-A232 HydrophobicContact CB-CB 3.93Å; D228-A232 WeakPolarHBondContact O-CB 3.36Å; D228-A232 PolarHBondContact O-N 3.15Å; A232-K234 VanDerWaalsContact C-N 3.31Å; A232-K234 PolarHBondContact O-N 3.08Å; A232-L235 PolarHBondContact O-N 3.28Å; A232-F236 HydrophobicContact CB-CD2 4.36Å; A232-F236 HydrophobicContact CB-CE2 3.84Å; A232-F236 HydrophobicContact CB-CZ 4.42Å; A232-F236 WeakPolarHBondContact O-CD2 3.31Å; A232-F236 VanDerWaalsContact O-CG 3.3Å; A232-F236 WeakPolarHBondContact O-CG 3.47Å; A232-F236 PolarHBondContact O-N 3.34Å
233M97.6Very high96.8Very high28 Ų2844.9 Ų44.914%0.13825%0.246CC..Hα-helixtrans-61.9-35.6177.5-78-171.3-65.700113.1H229 Q230 A231 F236 N237 I259 L263 E266H229-M233 WeakPolarHBondContact O-CB 3.28Å; H229-M233 VanDerWaalsContact O-CG 3.28Å; H229-M233 WeakPolarHBondContact O-CG 3.05Å; H229-M233 PolarHBondContact O-N 2.95Å; Q230-M233 HydrophobicContact CG-CE 4.5Å; Q230-M233 PolarHBondContact O-N 2.95Å; A231-M233 VanDerWaalsContact C-N 3.34Å; A231-M233 PolarHBondContact O-N 2.85Å; M233-F236 PolarHBondContact O-N 3.44Å; M233-N237 WeakPolarHBondContact O-CB 3.41Å; M233-N237 PolarHBondContact O-N 3.03Å; M233-N237 PolarHBondContact O-ND2 2.74Å; M233-I259 HydrophobicContact CG-CG2 4.36Å; M233-I259 HydrophobicContact SD-CG2 4.42Å; M233-L263 HydrophobicContact SD-CD2 3.75Å; M233-L263 HydrophobicContact SD-CG 3.9Å; M233-E266 WeakPolarHBondContact CE-OE1 3.38Å; M233-E266 WeakPolarHBondContact CE-OE2 3.4Å
234K98Very high96.8Very high149 Ų14945.8 Ų45.865%0.64826%0.259SS*.Hα-helixtrans-61.1-47.5175.1-69172.6-175170.90110.7Q230 A231 A232 N237 T238Q230-K234 PolarHBondContact O-N 3.29Å; A231-K234 WeakPolarHBondContact O-CB 3.24Å; A231-K234 PolarHBondContact O-N 3.09Å; A231-K234 VanDerWaalsContact O-N 3.15Å; A232-K234 VanDerWaalsContact C-N 3.31Å; A232-K234 PolarHBondContact O-N 3.08Å; K234-N237 PolarHBondContact O-N 2.74Å; K234-T238 PolarHBondContact O-N 3.49Å; K234-T238 VanDerWaalsContact O-N 3.09Å; K234-T238 PolarHBondContact O-OG1 2.88Å
235L98Very high96.8Very high23 Ų2353.2 Ų53.212%0.1229%0.288CS..Hα-helixtrans-63.8-43.4177.5-67.8178.4000112.4F216 E219 L223 A231 A232 N237 T238 C239F216-L235 HydrophobicContact CD1-CD2 3.92Å; E219-L235 HydrophobicContact CB-CD1 3.85Å; E219-L235 HydrophobicContact CG-CD1 3.53Å; E219-L235 WeakPolarHBondContact OE1-CD1 3.04Å; L223-L235 HydrophobicContact CD1-CD1 3.59Å; A231-L235 PolarHBondContact O-N 2.87Å; A232-L235 PolarHBondContact O-N 3.28Å; L235-N237 VanDerWaalsContact C-N 3.3Å; L235-N237 PolarHBondContact O-N 3.37Å; L235-T238 WeakPolarHBondContact O-CB 3.49Å; L235-T238 PolarHBondContact O-N 2.79Å; L235-T238 VanDerWaalsContact O-N 3.15Å; L235-C239 PolarHBondContact O-N 3.49Å; L235-C239 PolarHBondContact O-SG 2.99Å
236F98.4Very high96.9Very high0 Ų054.2 Ų54.20%029%0.29CS..Hα-helixtrans-65.9-32.6177.7-61.2-42000112.8F217 G220 M221 Q224 A232 M233 C239 V240 A258 I259F217-F236 AromaticContact CD2-CD1 3.97Å; F217-F236 HydrophobicContact CD2-CD1 3.97Å; F217-F236 HydrophobicContact CD2-CE1 4Å; F217-F236 HydrophobicContact CE2-CD1 4.26Å; F217-F236 HydrophobicContact CE2-CE1 4.1Å; G220-F236 WeakPolarHBondContact O-CZ 3.35Å; M221-F236 HydrophobicContact CG-CE1 4.42Å; M221-F236 HydrophobicContact CG-CZ 4.46Å; Q224-F236 HydrophobicContact CB-CE2 4.42Å; Q224-F236 HydrophobicContact CB-CZ 4.46Å; A232-F236 HydrophobicContact CB-CD2 4.36Å; A232-F236 HydrophobicContact CB-CE2 3.84Å; A232-F236 HydrophobicContact CB-CZ 4.42Å; A232-F236 WeakPolarHBondContact O-CD2 3.31Å; A232-F236 VanDerWaalsContact O-CG 3.3Å; A232-F236 WeakPolarHBondContact O-CG 3.47Å; A232-F236 PolarHBondContact O-N 3.34Å; M233-F236 PolarHBondContact O-N 3.44Å; F236-C239 WeakPolarHBondContact O-CB 3.2Å; F236-C239 PolarHBondContact O-N 2.7Å; F236-V240 WeakPolarHBondContact O-CG2 3.41Å; F236-V240 PolarHBondContact O-N 3.2Å; F236-A258 HydrophobicContact CD1-CB 3.94Å; F236-A258 HydrophobicContact CD2-CB 3.8Å; F236-A258 HydrophobicContact CE1-CB 3.75Å; F236-A258 HydrophobicContact CE2-CB 3.62Å; F236-A258 HydrophobicContact CG-CB 3.97Å; F236-A258 HydrophobicContact CZ-CB 3.6Å; F236-I259 HydrophobicContact CB-CD1 3.93Å; F236-I259 HydrophobicContact CB-CG1 3.4Å; F236-I259 VanDerWaalsContact CB-CG1 3.4Å; F236-I259 HydrophobicContact CD2-CG1 4.21Å; F236-I259 HydrophobicContact CG-CG1 4.23Å
237N98Very high97Very high73 Ų7359.8 Ų59.839%0.3931%0.31SS..Hα-helixtrans-66-40.6171.7-78-57.6000111.5M233 K234 L235 C239 V240 E241M233-N237 WeakPolarHBondContact O-CB 3.41Å; M233-N237 PolarHBondContact O-N 3.03Å; M233-N237 PolarHBondContact O-ND2 2.74Å; K234-N237 PolarHBondContact O-N 2.74Å; L235-N237 VanDerWaalsContact C-N 3.3Å; L235-N237 PolarHBondContact O-N 3.37Å; N237-C239 VanDerWaalsContact C-N 3.28Å; N237-C239 PolarHBondContact O-N 2.93Å; N237-V240 WeakPolarHBondContact O-CB 3.34Å; N237-V240 PolarHBondContact O-N 3.47Å; N237-V240 VanDerWaalsContact O-N 3.13Å; N237-E241 PolarHBondContact O-N 2.81Å
238T97.3Very high97.1Very high51 Ų5160.2 Ų60.231%0.31330%0.302SS..Hα-helixtrans-59.5-39.6170.3-55.50000111.6F216 K234 L235 V240 E241 L242F216-T238 HydrophobicContact CD2-CG2 4.21Å; F216-T238 HydrophobicContact CE2-CG2 4.27Å; K234-T238 PolarHBondContact O-N 3.49Å; K234-T238 VanDerWaalsContact O-N 3.09Å; K234-T238 PolarHBondContact O-OG1 2.88Å; L235-T238 WeakPolarHBondContact O-CB 3.49Å; L235-T238 PolarHBondContact O-N 2.79Å; L235-T238 VanDerWaalsContact O-N 3.15Å; T238-V240 PolarHBondContact O-N 3.5Å; T238-E241 PolarHBondContact O-N 2.74Å; T238-L242 HydrophobicContact CG2-CD1 4.13Å; T238-L242 WeakPolarHBondContact O-CG 3.3Å; T238-L242 PolarHBondContact O-N 3.41Å
239C97.6Very high97.1Very high0 Ų058.5 Ų58.50%029%0.294CS..Hα-helixtrans-61.6-42.2173.5-60.50000111.8F217 L235 F236 N237 E241 L242 F243 S255F217-C239 PolarHBondContact N-SG 3.28Å; L235-C239 PolarHBondContact O-N 3.49Å; L235-C239 PolarHBondContact O-SG 2.99Å; F236-C239 WeakPolarHBondContact O-CB 3.2Å; F236-C239 PolarHBondContact O-N 2.7Å; N237-C239 VanDerWaalsContact C-N 3.28Å; N237-C239 PolarHBondContact O-N 2.93Å; C239-E241 VanDerWaalsContact C-N 3.32Å; C239-E241 PolarHBondContact O-N 3.46Å; C239-L242 PolarHBondContact O-N 3Å; C239-F243 HydrophobicContact CB-CD2 4Å; C239-F243 HydrophobicContact CB-CE2 3.94Å; C239-F243 WeakPolarHBondContact O-CB 3.3Å; C239-F243 WeakPolarHBondContact O-CD2 3.43Å; C239-F243 WeakPolarHBondContact O-CG 3.45Å; C239-F243 PolarHBondContact O-N 3.48Å; C239-S255 WeakPolarHBondContact CB-OG 3.29Å
240V97.9Very high97.1Very high22 Ų2262.2 Ų62.213%0.13331%0.31CS..Hα-helixtrans-58.8-43.9175.8169.50000111.1F236 N237 T238 G244 L252 Y256 I259F236-V240 WeakPolarHBondContact O-CG2 3.41Å; F236-V240 PolarHBondContact O-N 3.2Å; N237-V240 WeakPolarHBondContact O-CB 3.34Å; N237-V240 PolarHBondContact O-N 3.47Å; N237-V240 VanDerWaalsContact O-N 3.13Å; T238-V240 PolarHBondContact O-N 3.5Å; V240-G244 PolarHBondContact O-N 2.92Å; V240-L252 HydrophobicContact CB-CD2 4.41Å; V240-L252 HydrophobicContact CG1-CD2 3.97Å; V240-L252 VanDerWaalsContact O-CD2 3.22Å; V240-L252 WeakPolarHBondContact O-CD2 3.29Å; V240-Y256 HydrophobicContact CG1-CE1 4.06Å; V240-Y256 HydrophobicContact CG2-CD1 4.17Å; V240-Y256 HydrophobicContact CG2-CE1 3.95Å; V240-I259 HydrophobicContact CG2-CD1 4Å
241E97.3Very high97.1Very high143 Ų14356.2 Ų56.267%0.66828%0.282SS*.Hα-helixtrans-63.3-46.6177.2-67.7175.2-17700112N237 T238 C239 G244 Y245N237-E241 PolarHBondContact O-N 2.81Å; T238-E241 PolarHBondContact O-N 2.74Å; C239-E241 VanDerWaalsContact C-N 3.32Å; C239-E241 PolarHBondContact O-N 3.46Å; E241-G244 PolarHBondContact O-N 3.13Å; E241-Y245 PolarHBondContact O-N 3.48Å
242L96.4Very high97.1Very high29 Ų2956 Ų5615%0.15228%0.277CS..Hα-helixtrans-67.5-49.6-179-70.3171.9000112.4A213 F216 T238 C239 G244 Y245 L246A213-L242 HydrophobicContact CB-CB 3.79Å; A213-L242 HydrophobicContact CB-CD1 3.98Å; F216-L242 HydrophobicContact CD2-CD1 3.72Å; F216-L242 HydrophobicContact CE2-CD1 3.96Å; T238-L242 HydrophobicContact CG2-CD1 4.13Å; T238-L242 WeakPolarHBondContact O-CG 3.3Å; T238-L242 PolarHBondContact O-N 3.41Å; C239-L242 PolarHBondContact O-N 3Å; L242-G244 PolarHBondContact O-N 3.24Å; L242-Y245 WeakPolarHBondContact O-CB 3.43Å; L242-Y245 PolarHBondContact O-N 2.94Å; L242-Y245 VanDerWaalsContact O-N 3.16Å; L242-L246 VanDerWaalsContact O-CG 3.32Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 3.36Å
243F97.4Very high97.1Very high2 Ų256.2 Ų56.21%0.00928%0.278CS..Hα-helixtrans-64.6-31.4176.6-69.6-53.6000111.8A213 C239 L246 Q247 D248 G251 L252 S255A213-F243 HydrophobicContact CB-CD1 3.96Å; A213-F243 HydrophobicContact CB-CD2 4.44Å; A213-F243 HydrophobicContact CB-CE1 3.57Å; A213-F243 HydrophobicContact CB-CE2 4.09Å; A213-F243 HydrophobicContact CB-CG 4.38Å; A213-F243 HydrophobicContact CB-CZ 3.64Å; C239-F243 HydrophobicContact CB-CD2 4Å; C239-F243 HydrophobicContact CB-CE2 3.94Å; C239-F243 WeakPolarHBondContact O-CB 3.3Å; C239-F243 WeakPolarHBondContact O-CD2 3.43Å; C239-F243 WeakPolarHBondContact O-CG 3.45Å; C239-F243 PolarHBondContact O-N 3.48Å; F243-L246 HydrophobicContact CD1-CD1 4.45Å; F243-L246 CarbonylContact O-C 3.44Å; F243-L246 PolarHBondContact O-N 3.4Å; F243-Q247 PolarHBondContact O-N 3.28Å; F243-D248 HydrophobicContact CB-CB 4.36Å; F243-D248 HydrophobicContact CD1-CB 3.89Å; F243-D248 PolarHBondContact O-N 3.05Å; F243-G251 WeakPolarHBondContact CD2-O 3.13Å; F243-L252 HydrophobicContact CB-CD2 4.06Å; F243-L252 HydrophobicContact CB-CG 3.94Å; F243-S255 WeakPolarHBondContact CD2-OG 3.48Å
244G96.8Very high97.1Very high36 Ų3658 Ų5837%0.37129%0.285SS..Hα-helixtrans-62.6-46.6170.800000112.5V240 E241 L242 L246 Q247V240-G244 PolarHBondContact O-N 2.92Å; E241-G244 PolarHBondContact O-N 3.13Å; L242-G244 PolarHBondContact O-N 3.24Å; G244-L246 VanDerWaalsContact C-N 3.3Å; G244-L246 PolarHBondContact O-N 2.99Å; G244-Q247 PolarHBondContact O-N 3.06Å; G244-Q247 VanDerWaalsContact O-N 3.16Å
245Y96.3Very high97.1Very high163 Ų16350.9 Ų50.964%0.63926%0.255SS*.Hα-helixtrans-61-39.1174.5175.3-94.6000112.4K209 E241 L242 Q247K209-Y245 HydrophobicContact CD-CD1 3.72Å; K209-Y245 HydrophobicContact CD-CE1 3.57Å; K209-Y245 VanDerWaalsContact NZ-CZ 3.34Å; E241-Y245 PolarHBondContact O-N 3.48Å; L242-Y245 WeakPolarHBondContact O-CB 3.43Å; L242-Y245 PolarHBondContact O-N 2.94Å; L242-Y245 VanDerWaalsContact O-N 3.16Å; Y245-Q247 VanDerWaalsContact C-N 3.25Å; Y245-Q247 PolarHBondContact O-N 3.16Å
246L96.2Very high97.1Very high63 Ų6352 Ų5233%0.3326%0.257SS..THydrogen-bonded Turntrans-77.1-8.5178.1-66.8170.3000113.8K209 L242 F243 G244 D248K209-L246 HydrophobicContact CB-CD1 4.29Å; K209-L246 HydrophobicContact CB-CD2 4.08Å; K209-L246 HydrophobicContact CB-CG 4.46Å; L242-L246 VanDerWaalsContact O-CG 3.32Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 3.36Å; F243-L246 HydrophobicContact CD1-CD1 4.45Å; F243-L246 CarbonylContact O-C 3.44Å; F243-L246 PolarHBondContact O-N 3.4Å; G244-L246 VanDerWaalsContact C-N 3.3Å; G244-L246 PolarHBondContact O-N 2.99Å; L246-D248 HydrophobicContact CB-CB 4.44Å; L246-D248 PolarHBondContact O-N 3.42Å
247Q96.1Very high97.1Very high171 Ų17155.5 Ų55.580%0.79927%0.273SS*.THydrogen-bonded Turntrans55.828.9-170.1-54.7-178-6.500113.1F243 G244 Y245 V249F243-Q247 PolarHBondContact O-N 3.28Å; G244-Q247 PolarHBondContact O-N 3.06Å; G244-Q247 VanDerWaalsContact O-N 3.16Å; Y245-Q247 VanDerWaalsContact C-N 3.25Å; Y245-Q247 PolarHBondContact O-N 3.16Å; Q247-V249 PolarHBondContact O-N 3.03Å
248D96.4Very high97Very high53 Ų5352.4 Ų52.428%0.28326%0.257SS..  trans-84.693.6175.4-178.86.2000110.6F243 L246 K250 G251 L252F243-D248 HydrophobicContact CB-CB 4.36Å; F243-D248 HydrophobicContact CD1-CB 3.89Å; F243-D248 PolarHBondContact O-N 3.05Å; L246-D248 HydrophobicContact CB-CB 4.44Å; L246-D248 PolarHBondContact O-N 3.42Å; D248-K250 VanDerWaalsContact C-N 3.25Å; D248-K250 PolarHBondContact O-N 3.47Å; D248-K250 WeakPolarHBondContact OD1-CA 3.3Å; D248-K250 WeakPolarHBondContact OD1-CB 3.17Å; D248-K250 PolarHBondContact OD1-N 2.65Å; D248-G251 VanDerWaalsContact CG-N 3.32Å; D248-G251 PolarHBondContact O-N 3.36Å; D248-G251 PolarHBondContact OD1-N 3.43Å; D248-G251 VanDerWaalsContact OD1-N 3.09Å; D248-G251 PolarHBondContact OD2-N 2.93Å; D248-L252 WeakPolarHBondContact O-CG 3.44Å; D248-L252 PolarHBondContact O-N 2.83Å
249V96.6Very high97.1Very high37 Ų3750.2 Ų50.222%0.22424%0.243CC..Hα-helixtrans-58.6-37.2176178.90000112Q247 L252 V253 L282 L288Q247-V249 PolarHBondContact O-N 3.03Å; V249-L252 PolarHBondContact O-N 2.95Å; V249-V253 HydrophobicContact CG1-CG2 4.27Å; V249-V253 WeakPolarHBondContact O-CB 3.35Å; V249-V253 WeakPolarHBondContact O-CG2 3.45Å; V249-V253 PolarHBondContact O-N 3.16Å; V249-L282 HydrophobicContact CG1-CD2 3.84Å; V249-L282 HydrophobicContact CG1-CG 3.85Å; V249-L288 HydrophobicContact CB-CD1 4.39Å; V249-L288 HydrophobicContact CG1-CD1 3.62Å
250K96.1Very high97.1Very high112 Ų11250.2 Ų50.249%0.48724%0.244SC..Hα-helixtrans-68.7-42.7-177.8-66.5178.3-178.5176.50110.4D248 V253 K254 L288D248-K250 VanDerWaalsContact C-N 3.25Å; D248-K250 PolarHBondContact O-N 3.47Å; D248-K250 WeakPolarHBondContact OD1-CA 3.3Å; D248-K250 WeakPolarHBondContact OD1-CB 3.17Å; D248-K250 PolarHBondContact OD1-N 2.65Å; K250-V253 PolarHBondContact O-N 3.44Å; K250-K254 WeakPolarHBondContact O-CG 3.32Å; K250-K254 PolarHBondContact O-N 3.01Å; K250-L288 HydrophobicContact CG-CD1 4.04Å; K250-L288 HydrophobicContact CG-CD2 4.35Å
251G96.5Very high97.1Very high1 Ų153.9 Ų53.91%0.0126%0.258CS..Hα-helixtrans-62.1-41.9174.100000113.1F243 D248 K254 S255F243-G251 WeakPolarHBondContact CD2-O 3.13Å; D248-G251 VanDerWaalsContact CG-N 3.32Å; D248-G251 PolarHBondContact O-N 3.36Å; D248-G251 PolarHBondContact OD1-N 3.43Å; D248-G251 VanDerWaalsContact OD1-N 3.09Å; D248-G251 PolarHBondContact OD2-N 2.93Å; G251-K254 PolarHBondContact O-N 3.43Å; G251-S255 WeakPolarHBondContact O-CB 3.47Å; G251-S255 PolarHBondContact O-N 3.49Å; G251-S255 PolarHBondContact O-OG 3.15Å
252L97.3Very high97.1Very high21 Ų2147.1 Ų47.111%0.1123%0.226CC..Hα-helixtrans-59.1-50.2174.1-75.4173.2000111.9V240 F243 D248 V249 K254 S255 Y256 L282V240-L252 HydrophobicContact CB-CD2 4.41Å; V240-L252 HydrophobicContact CG1-CD2 3.97Å; V240-L252 VanDerWaalsContact O-CD2 3.22Å; V240-L252 WeakPolarHBondContact O-CD2 3.29Å; F243-L252 HydrophobicContact CB-CD2 4.06Å; F243-L252 HydrophobicContact CB-CG 3.94Å; D248-L252 WeakPolarHBondContact O-CG 3.44Å; D248-L252 PolarHBondContact O-N 2.83Å; V249-L252 PolarHBondContact O-N 2.95Å; L252-K254 PolarHBondContact O-N 3.38Å; L252-S255 PolarHBondContact O-N 2.91Å; L252-S255 VanDerWaalsContact O-N 3.17Å; L252-Y256 HydrophobicContact CB-CE2 4.36Å; L252-Y256 WeakPolarHBondContact O-CD2 3.44Å; L252-Y256 PolarHBondContact O-N 3.23Å; L252-L282 HydrophobicContact CB-CD2 3.73Å; L252-L282 HydrophobicContact CD1-CD2 3.87Å; L252-L282 HydrophobicContact CG-CD2 4.47Å
253V97.4Very high97.2Very high3 Ų346.3 Ų46.32%0.01822%0.222CC..Hα-helixtrans-60-46.2179.6170.40000111.2V249 K250 S255 Y256 K257 L282 C283 R291 I295V249-V253 HydrophobicContact CG1-CG2 4.27Å; V249-V253 WeakPolarHBondContact O-CB 3.35Å; V249-V253 WeakPolarHBondContact O-CG2 3.45Å; V249-V253 PolarHBondContact O-N 3.16Å; K250-V253 PolarHBondContact O-N 3.44Å; V253-S255 VanDerWaalsContact C-N 3.31Å; V253-S255 PolarHBondContact O-N 3.05Å; V253-Y256 PolarHBondContact O-N 3.32Å; V253-K257 PolarHBondContact O-N 2.97Å; V253-L282 HydrophobicContact CG2-CB 4.34Å; V253-L282 HydrophobicContact CG2-CD2 4.11Å; V253-C283 VanDerWaalsContact CG1-SG 3.56Å; V253-C283 WeakPolarHBondContact CG2-SG 3.42Å; V253-R291 HydrophobicContact CG1-CB 4.37Å; V253-I295 HydrophobicContact CG1-CD1 3.42Å; V253-I295 VanDerWaalsContact CG1-CD1 3.42Å
254K96.4Very high97.1Very high66 Ų6650 Ų5029%0.28724%0.239SC..Hα-helixtrans-56.6-46.3175.1-76.6178.3177.2-176.90111.1E214 F217 K250 G251 L252 K257 A258E214-K254 IonicContact OE1-NZ 3.06Å; E214-K254 IonicContact OE2-NZ 2.68Å; F217-K254 HydrophobicContact CE2-CB 3.94Å; F217-K254 HydrophobicContact CZ-CB 4.05Å; K250-K254 WeakPolarHBondContact O-CG 3.32Å; K250-K254 PolarHBondContact O-N 3.01Å; G251-K254 PolarHBondContact O-N 3.43Å; L252-K254 PolarHBondContact O-N 3.38Å; K254-K257 PolarHBondContact O-N 3.01Å; K254-A258 WeakPolarHBondContact O-CB 3.41Å; K254-A258 PolarHBondContact O-N 2.99Å
255S98.1Very high97Very high0 Ų051.5 Ų51.50%024%0.244CC..Hα-helixtrans-65.4-44.7-178-55.90000112.1C239 F243 G251 L252 V253 K257 A258 I259C239-S255 WeakPolarHBondContact CB-OG 3.29Å; F243-S255 WeakPolarHBondContact CD2-OG 3.48Å; G251-S255 WeakPolarHBondContact O-CB 3.47Å; G251-S255 PolarHBondContact O-N 3.49Å; G251-S255 PolarHBondContact O-OG 3.15Å; L252-S255 PolarHBondContact O-N 2.91Å; L252-S255 VanDerWaalsContact O-N 3.17Å; V253-S255 VanDerWaalsContact C-N 3.31Å; V253-S255 PolarHBondContact O-N 3.05Å; S255-K257 PolarHBondContact O-N 3.11Å; S255-A258 PolarHBondContact O-N 3.41Å; S255-I259 WeakPolarHBondContact O-CG1 3.3Å; S255-I259 PolarHBondContact O-N 3.42Å
256Y98.3Very high97Very high46 Ų4647.7 Ų47.718%0.1823%0.232CC..Hα-helixtrans-61.1-42.3175.5-73-50000112.7V240 L252 V253 A258 I259 A260 M275 A279V240-Y256 HydrophobicContact CG1-CE1 4.06Å; V240-Y256 HydrophobicContact CG2-CD1 4.17Å; V240-Y256 HydrophobicContact CG2-CE1 3.95Å; L252-Y256 HydrophobicContact CB-CE2 4.36Å; L252-Y256 WeakPolarHBondContact O-CD2 3.44Å; L252-Y256 PolarHBondContact O-N 3.23Å; V253-Y256 PolarHBondContact O-N 3.32Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; Y256-A258 PolarHBondContact O-N 2.82Å; Y256-I259 PolarHBondContact O-N 3.28Å; Y256-A260 WeakPolarHBondContact O-CB 3.48Å; Y256-A260 PolarHBondContact O-N 3.2Å; Y256-M275 HydrophobicContact CD1-CE 3.53Å; Y256-M275 HydrophobicContact CD1-SD 4.1Å; Y256-M275 HydrophobicContact CE1-CE 3.89Å; Y256-M275 HydrophobicContact CE1-SD 4.38Å; Y256-A279 HydrophobicContact CD2-CB 4.42Å
257K97.6Very high96.9Very high74 Ų7447.1 Ų47.132%0.32224%0.241SC..Hα-helixtrans-63-40.8176-170.4-177.6179.2-174.80111.6V253 K254 S255 A260 K261 L276 D294V253-K257 PolarHBondContact O-N 2.97Å; K254-K257 PolarHBondContact O-N 3.01Å; S255-K257 PolarHBondContact O-N 3.11Å; K257-A260 PolarHBondContact O-N 2.88Å; K257-K261 PolarHBondContact O-N 3.31Å; K257-L276 HydrophobicContact CG-CD2 4.23Å; K257-D294 VanDerWaalsContact NZ-CG 3.3Å; K257-D294 IonicContact NZ-OD1 2.75Å; K257-D294 PolarHBondContact NZ-OD1 2.89Å; K257-D294 IonicContact NZ-OD2 3.69Å; K257-D294 PolarHBondContact NZ-OD2 3.44Å
258A97.9Very high96.9Very high8 Ų842.2 Ų42.27%0.06622%0.221CC..Hα-helixtrans-65.7-42.4177.600000111.9F217 Q224 F236 K254 S255 Y256 K261 S262F217-A258 HydrophobicContact CE2-CB 3.87Å; F217-A258 HydrophobicContact CZ-CB 4.34Å; Q224-A258 PolarHBondContact NE2-O 3.28Å; F236-A258 HydrophobicContact CD1-CB 3.94Å; F236-A258 HydrophobicContact CD2-CB 3.8Å; F236-A258 HydrophobicContact CE1-CB 3.75Å; F236-A258 HydrophobicContact CE2-CB 3.62Å; F236-A258 HydrophobicContact CG-CB 3.97Å; F236-A258 HydrophobicContact CZ-CB 3.6Å; K254-A258 WeakPolarHBondContact O-CB 3.41Å; K254-A258 PolarHBondContact O-N 2.99Å; S255-A258 PolarHBondContact O-N 3.41Å; Y256-A258 VanDerWaalsContact C-N 3.33Å; Y256-A258 PolarHBondContact O-N 2.82Å; A258-K261 PolarHBondContact O-N 2.89Å; A258-S262 PolarHBondContact O-N 3.16Å
259I98.4Very high96.9Very high4 Ų441.7 Ų41.72%0.02122%0.218CC..Hα-helixtrans-60.3-47173-65.4163.7000110.7M233 F236 V240 S255 Y256 K261 S262 L263 M275M233-I259 HydrophobicContact CG-CG2 4.36Å; M233-I259 HydrophobicContact SD-CG2 4.42Å; F236-I259 HydrophobicContact CB-CD1 3.93Å; F236-I259 HydrophobicContact CB-CG1 3.4Å; F236-I259 VanDerWaalsContact CB-CG1 3.4Å; F236-I259 HydrophobicContact CD2-CG1 4.21Å; F236-I259 HydrophobicContact CG-CG1 4.23Å; V240-I259 HydrophobicContact CG2-CD1 4Å; S255-I259 WeakPolarHBondContact O-CG1 3.3Å; S255-I259 PolarHBondContact O-N 3.42Å; Y256-I259 PolarHBondContact O-N 3.28Å; I259-K261 VanDerWaalsContact C-N 3.29Å; I259-K261 PolarHBondContact O-N 3.35Å; I259-S262 WeakPolarHBondContact O-CB 3.49Å; I259-S262 PolarHBondContact O-N 2.99Å; I259-S262 VanDerWaalsContact O-N 3.1Å; I259-L263 HydrophobicContact CG2-CD1 3.77Å; I259-L263 HydrophobicContact CG2-CG 4.21Å; I259-L263 WeakPolarHBondContact O-CG 3.26Å; I259-L263 PolarHBondContact O-N 3.44Å; I259-M275 HydrophobicContact CB-CE 4.01Å; I259-M275 HydrophobicContact CD1-CE 3.63Å; I259-M275 HydrophobicContact CG1-CE 4.4Å; I259-M275 HydrophobicContact CG2-CE 3.6Å; I259-M275 HydrophobicContact CG2-CG 4.28Å
260A97.9Very high96.9Very high1 Ų145.6 Ų45.61%0.00823%0.233CC..Hα-helixtrans-57.3-41.2179.100000112.6Y256 K257 L263 E264 C272 M275 L276Y256-A260 WeakPolarHBondContact O-CB 3.48Å; Y256-A260 PolarHBondContact O-N 3.2Å; K257-A260 PolarHBondContact O-N 2.88Å; A260-L263 PolarHBondContact O-N 3.44Å; A260-E264 WeakPolarHBondContact O-CB 3.23Å; A260-E264 PolarHBondContact O-N 3.38Å; A260-C272 PolarHBondContact O-SG 2.75Å; A260-M275 HydrophobicContact CB-CB 4.13Å; A260-L276 HydrophobicContact CB-CD1 4.21Å; A260-L276 HydrophobicContact CB-CD2 3.7Å; A260-L276 HydrophobicContact CB-CG 3.56Å
261K97Very high96.9Very high99 Ų9943 Ų4343%0.4322%0.223SC..Hα-helixtrans-64.2-38.5175.9179.7174.7167.1-1440112.8Q224 K257 A258 I259 S265Q224-K261 VanDerWaalsContact OE1-CD 3.28Å; K257-K261 PolarHBondContact O-N 3.31Å; A258-K261 PolarHBondContact O-N 2.89Å; I259-K261 VanDerWaalsContact C-N 3.29Å; I259-K261 PolarHBondContact O-N 3.35Å; K261-S265 PolarHBondContact O-N 2.74Å; K261-S265 VanDerWaalsContact O-N 3.12Å; K261-S265 PolarHBondContact O-OG 2.98Å
262S97.9Very high97Very high0 Ų043 Ų430%022%0.223CC..Hα-helixtrans-65.6-43.7172.7-73.20000111.7Q224 H229 A258 I259 E264 S265 E266Q224-S262 PolarHBondContact NE2-OG 3.14Å; H229-S262 PolarHBondContact ND1-OG 2.95Å; A258-S262 PolarHBondContact O-N 3.16Å; I259-S262 WeakPolarHBondContact O-CB 3.49Å; I259-S262 PolarHBondContact O-N 2.99Å; I259-S262 VanDerWaalsContact O-N 3.1Å; S262-E264 PolarHBondContact O-N 3.44Å; S262-S265 PolarHBondContact O-N 2.75Å; S262-E266 PolarHBondContact O-N 3.24Å
263L97.8Very high97Very high13 Ų1342.6 Ų42.67%0.06822%0.22CC..Hα-helixtrans-62.3-41.1176.9-71.4167.5000112.5M233 I259 A260 S265 E266 G267 N268 E271 C272 M275M233-L263 HydrophobicContact SD-CD2 3.75Å; M233-L263 HydrophobicContact SD-CG 3.9Å; I259-L263 HydrophobicContact CG2-CD1 3.77Å; I259-L263 HydrophobicContact CG2-CG 4.21Å; I259-L263 WeakPolarHBondContact O-CG 3.26Å; I259-L263 PolarHBondContact O-N 3.44Å; A260-L263 PolarHBondContact O-N 3.44Å; L263-S265 VanDerWaalsContact C-N 3.33Å; L263-E266 PolarHBondContact O-N 2.93Å; L263-G267 PolarHBondContact O-N 2.84Å; L263-G267 VanDerWaalsContact O-N 3.16Å; L263-N268 HydrophobicContact CB-CB 4.4Å; L263-N268 HydrophobicContact CD2-CB 4.07Å; L263-N268 PolarHBondContact O-N 2.86Å; L263-E271 HydrophobicContact CD1-CB 4Å; L263-E271 HydrophobicContact CD1-CG 3.82Å; L263-E271 HydrophobicContact CD2-CB 4.33Å; L263-E271 HydrophobicContact CD2-CG 4.39Å; L263-C272 HydrophobicContact CB-CB 3.92Å; L263-M275 HydrophobicContact CD1-CG 3.91Å
264E95.8Very high97Very high79 Ų7947.4 Ų47.437%0.36924%0.241SC..Hα-helixtrans-60.4-44.1174.7-174.8178.8-160.600111.3A260 S262 E266 G267 I269A260-E264 WeakPolarHBondContact O-CB 3.23Å; A260-E264 PolarHBondContact O-N 3.38Å; S262-E264 PolarHBondContact O-N 3.44Å; E264-E266 VanDerWaalsContact C-N 3.29Å; E264-E266 PolarHBondContact O-N 2.91Å; E264-G267 PolarHBondContact O-N 3.41Å; E264-I269 HydrophobicContact CG-CD1 4.25Å
265S95.3Very high97.1Very high67 Ų6745 Ų4547%0.46923%0.231SC..Hα-helixtrans-65.7-31.2178.9-54.50000112.6H229 K261 S262 L263 G267H229-S265 VanDerWaalsContact CE1-CB 3.45Å; H229-S265 WeakPolarHBondContact CE1-CB 3.46Å; H229-S265 PolarHBondContact CE1-OG 3.24Å; H229-S265 VanDerWaalsContact NE2-CB 3.27Å; H229-S265 WeakPolarHBondContact NE2-CB 3.33Å; K261-S265 PolarHBondContact O-N 2.74Å; K261-S265 VanDerWaalsContact O-N 3.12Å; K261-S265 PolarHBondContact O-OG 2.98Å; S262-S265 PolarHBondContact O-N 2.75Å; L263-S265 VanDerWaalsContact C-N 3.33Å; S265-G267 VanDerWaalsContact C-N 3.28Å
266E95.8Very high97.1Very high83 Ų8345.1 Ų45.139%0.38823%0.232SC..THydrogen-bonded Turntrans-81.6-2.9172.5-68.1-175.5173.200113.5H229 Q230 M233 S262 L263 E264 N268H229-E266 HydrophobicContact CB-CG 3.94Å; H229-E266 WeakPolarHBondContact CB-OE1 3.42Å; Q230-E266 WeakPolarHBondContact CG-OE1 3.44Å; M233-E266 WeakPolarHBondContact CE-OE1 3.38Å; M233-E266 WeakPolarHBondContact CE-OE2 3.4Å; S262-E266 PolarHBondContact O-N 3.24Å; L263-E266 PolarHBondContact O-N 2.93Å; E264-E266 VanDerWaalsContact C-N 3.29Å; E264-E266 PolarHBondContact O-N 2.91Å; E266-N268 VanDerWaalsContact C-N 3.32Å
267G94.4Very high97Very high51 Ų5145.2 Ų45.253%0.52623%0.234SC..THydrogen-bonded Turntrans77.910.8-178.200000114.8L263 E264 S265 I269L263-G267 PolarHBondContact O-N 2.84Å; L263-G267 VanDerWaalsContact O-N 3.16Å; E264-G267 PolarHBondContact O-N 3.41Å; S265-G267 VanDerWaalsContact C-N 3.28Å; G267-I269 VanDerWaalsContact C-N 3.28Å; G267-I269 PolarHBondContact O-N 3.09Å; G267-I269 VanDerWaalsContact O-N 3.08Å
268N96.6Very high97Very high69 Ų6946.7 Ų46.737%0.36924%0.24SC..  trans-85.569.5176.1-169.2-8000110.9L263 E266 E270 E271 C272L263-N268 HydrophobicContact CB-CB 4.4Å; L263-N268 HydrophobicContact CD2-CB 4.07Å; L263-N268 PolarHBondContact O-N 2.86Å; E266-N268 VanDerWaalsContact C-N 3.32Å; N268-E270 PolarHBondContact O-N 3.12Å; N268-E271 PolarHBondContact O-N 3.23Å; N268-E271 WeakPolarHBondContact OD1-CB 3.5Å; N268-E271 PolarHBondContact OD1-N 3.42Å; N268-C272 WeakPolarHBondContact O-CB 3.25Å; N268-C272 PolarHBondContact O-N 2.98Å
269I96.6Very high96.9Very high42 Ų4246.3 Ų46.322%0.21524%0.237CC..Hα-helixtrans-66.8-39.7-170.4-54.4-56.9000112.2E264 G267 E271 C272 I273 I302 V306E264-I269 HydrophobicContact CG-CD1 4.25Å; G267-I269 VanDerWaalsContact C-N 3.28Å; G267-I269 PolarHBondContact O-N 3.09Å; G267-I269 VanDerWaalsContact O-N 3.08Å; I269-E271 PolarHBondContact O-N 2.99Å; I269-C272 WeakPolarHBondContact O-CB 3.44Å; I269-C272 PolarHBondContact O-N 2.57Å; I269-I273 HydrophobicContact CG2-CD1 4.04Å; I269-I273 HydrophobicContact CG2-CG1 4.44Å; I269-I273 WeakPolarHBondContact O-CG1 3.3Å; I269-I273 PolarHBondContact O-N 2.88Å; I269-I302 HydrophobicContact CG2-CG2 3.8Å; I269-V306 HydrophobicContact CG2-CG1 3.64Å
270E96Very high96.9Very high118 Ų11846.3 Ų46.355%0.55124%0.238SC*.Hα-helixtrans-62.5-42179.6-72.774.8-165.400112.4N268 K274N268-E270 PolarHBondContact O-N 3.12Å; E270-K274 WeakPolarHBondContact O-CG 3.08Å; E270-K274 PolarHBondContact O-N 2.96Å
271E96.9Very high96.8Very high58 Ų5851.7 Ų51.727%0.27127%0.266SS..Hα-helixtrans-74.5-34.9178.4-161.160.5-147.100111.5L263 N268 I269 I273 K274 M275L263-E271 HydrophobicContact CD1-CB 4Å; L263-E271 HydrophobicContact CD1-CG 3.82Å; L263-E271 HydrophobicContact CD2-CB 4.33Å; L263-E271 HydrophobicContact CD2-CG 4.39Å; N268-E271 PolarHBondContact O-N 3.23Å; N268-E271 WeakPolarHBondContact OD1-CB 3.5Å; N268-E271 PolarHBondContact OD1-N 3.42Å; I269-E271 PolarHBondContact O-N 2.99Å; E271-I273 VanDerWaalsContact C-N 3.34Å; E271-I273 PolarHBondContact O-N 3.32Å; E271-K274 PolarHBondContact O-N 3.41Å; E271-K274 WeakPolarHBondContact OE2-CD 3.23Å; E271-K274 IonicContact OE2-NZ 3.75Å; E271-K274 PolarHBondContact OE2-NZ 2.82Å; E271-M275 WeakPolarHBondContact O-CG 3.43Å; E271-M275 PolarHBondContact O-N 3.47Å
272C97.6Very high96.8Very high1 Ų149.2 Ų49.21%0.00726%0.257CS..Hα-helixtrans-54.1-50.4171.1173.60000111.3A260 L263 N268 I269 K274 M275 L276A260-C272 PolarHBondContact O-SG 2.75Å; L263-C272 HydrophobicContact CB-CB 3.92Å; N268-C272 WeakPolarHBondContact O-CB 3.25Å; N268-C272 PolarHBondContact O-N 2.98Å; I269-C272 WeakPolarHBondContact O-CB 3.44Å; I269-C272 PolarHBondContact O-N 2.57Å; C272-K274 PolarHBondContact O-N 2.74Å; C272-M275 PolarHBondContact O-N 3.02Å; C272-L276 PolarHBondContact O-N 2.78Å
273I97.3Very high96.7Very high12 Ų1249.2 Ų49.26%0.06226%0.257CS..Hα-helixtrans-57.2-48.8176.9-70.3169.7000110.5I269 E271 M275 L276 E277 L299 I302 Y303I269-I273 HydrophobicContact CG2-CD1 4.04Å; I269-I273 HydrophobicContact CG2-CG1 4.44Å; I269-I273 WeakPolarHBondContact O-CG1 3.3Å; I269-I273 PolarHBondContact O-N 2.88Å; E271-I273 VanDerWaalsContact C-N 3.34Å; E271-I273 PolarHBondContact O-N 3.32Å; I273-M275 VanDerWaalsContact C-N 3.27Å; I273-M275 PolarHBondContact O-N 3.09Å; I273-L276 PolarHBondContact O-N 2.96Å; I273-E277 HydrophobicContact CG2-CG 4.09Å; I273-E277 WeakPolarHBondContact O-CB 3.46Å; I273-E277 WeakPolarHBondContact O-CG 3.39Å; I273-E277 PolarHBondContact O-N 3.25Å; I273-L299 HydrophobicContact CG2-CD2 4.27Å; I273-I302 HydrophobicContact CD1-CG2 3.94Å; I273-I302 HydrophobicContact CG1-CG2 3.73Å; I273-Y303 HydrophobicContact CD1-CD1 4.43Å; I273-Y303 HydrophobicContact CD1-CE1 4.02Å; I273-Y303 HydrophobicContact CG2-CE1 4.49Å; I273-Y303 HydrophobicContact CG2-CE2 3.95Å; I273-Y303 VanDerWaalsContact CG2-OH 3.29Å; I273-Y303 WeakPolarHBondContact CG2-OH 3.28Å
274K97.4Very high96.5Very high104 Ų10454.4 Ų54.445%0.45228%0.281SS..Hα-helixtrans-58.1-39.7179.6-70.2179.4-152.4156.80112.6E270 E271 C272 K278E270-K274 WeakPolarHBondContact O-CG 3.08Å; E270-K274 PolarHBondContact O-N 2.96Å; E271-K274 PolarHBondContact O-N 3.41Å; E271-K274 WeakPolarHBondContact OE2-CD 3.23Å; E271-K274 IonicContact OE2-NZ 3.75Å; E271-K274 PolarHBondContact OE2-NZ 2.82Å; C272-K274 PolarHBondContact O-N 2.74Å; K274-K278 WeakPolarHBondContact O-CG 3.48Å; K274-K278 PolarHBondContact O-N 3.29Å; K274-K278 VanDerWaalsContact O-N 3.07Å
275M98Very high96.5Very high16 Ų1654.9 Ų54.98%0.07929%0.293CS..Hα-helixtrans-68.8-39.4179.5-67.3-60-95.600111.8Y256 I259 A260 L263 E271 C272 I273 K278 A279Y256-M275 HydrophobicContact CD1-CE 3.53Å; Y256-M275 HydrophobicContact CD1-SD 4.1Å; Y256-M275 HydrophobicContact CE1-CE 3.89Å; Y256-M275 HydrophobicContact CE1-SD 4.38Å; I259-M275 HydrophobicContact CB-CE 4.01Å; I259-M275 HydrophobicContact CD1-CE 3.63Å; I259-M275 HydrophobicContact CG1-CE 4.4Å; I259-M275 HydrophobicContact CG2-CE 3.6Å; I259-M275 HydrophobicContact CG2-CG 4.28Å; A260-M275 HydrophobicContact CB-CB 4.13Å; L263-M275 HydrophobicContact CD1-CG 3.91Å; E271-M275 WeakPolarHBondContact O-CG 3.43Å; E271-M275 PolarHBondContact O-N 3.47Å; C272-M275 PolarHBondContact O-N 3.02Å; I273-M275 VanDerWaalsContact C-N 3.27Å; I273-M275 PolarHBondContact O-N 3.09Å; M275-K278 HydrophobicContact SD-CD 4.33Å; M275-A279 PolarHBondContact O-N 3.15Å; M275-A279 VanDerWaalsContact O-N 3.12Å
276L97.9Very high96.4Very high2 Ų254 Ų541%0.0129%0.287CS..Hα-helixtrans-69.8-38.1174.6-69172.8000112.8K257 A260 C272 I273 A279 A280 I295 T298 L299 I302K257-L276 HydrophobicContact CG-CD2 4.23Å; A260-L276 HydrophobicContact CB-CD1 4.21Å; A260-L276 HydrophobicContact CB-CD2 3.7Å; A260-L276 HydrophobicContact CB-CG 3.56Å; C272-L276 PolarHBondContact O-N 2.78Å; I273-L276 PolarHBondContact O-N 2.96Å; L276-A279 WeakPolarHBondContact O-CB 3.31Å; L276-A279 PolarHBondContact O-N 2.91Å; L276-A280 WeakPolarHBondContact O-CB 3.2Å; L276-A280 PolarHBondContact O-N 3.26Å; L276-I295 HydrophobicContact CB-CG2 4.36Å; L276-I295 HydrophobicContact CD2-CG2 4.37Å; L276-I295 WeakPolarHBondContact O-CG2 3.45Å; L276-T298 HydrophobicContact CD1-CG2 3.88Å; L276-L299 HydrophobicContact CB-CD1 4.07Å; L276-L299 HydrophobicContact CB-CD2 3.5Å; L276-L299 VanDerWaalsContact CB-CD2 3.5Å; L276-L299 HydrophobicContact CB-CG 3.68Å; L276-L299 HydrophobicContact CD1-CD2 4.02Å; L276-L299 HydrophobicContact CD1-CG 4.21Å; L276-L299 HydrophobicContact CG-CD2 4.43Å; L276-I302 HydrophobicContact CD1-CD1 3.36Å
277E97.1Very high96.4Very high48 Ų4855.7 Ų55.722%0.22430%0.299CS..Hα-helixtrans-62.1-45.4175.7-72.5-17816000110.8I273 A279 A280 D281 L299 Y303 Y315I273-E277 HydrophobicContact CG2-CG 4.09Å; I273-E277 WeakPolarHBondContact O-CB 3.46Å; I273-E277 WeakPolarHBondContact O-CG 3.39Å; I273-E277 PolarHBondContact O-N 3.25Å; E277-A279 VanDerWaalsContact C-N 3.3Å; E277-A279 PolarHBondContact O-N 3.22Å; E277-A280 WeakPolarHBondContact O-CB 3.49Å; E277-A280 PolarHBondContact O-N 3.32Å; E277-A280 VanDerWaalsContact O-N 3.15Å; E277-D281 PolarHBondContact O-N 3.5Å; E277-L299 HydrophobicContact CG-CD1 4.22Å; E277-L299 HydrophobicContact CG-CD2 4.07Å; E277-Y303 PolarHBondContact OE1-OH 3.12Å; E277-Y315 WeakPolarHBondContact CG-OH 3.49Å; E277-Y315 PolarHBondContact OE1-OH 3.01Å
278K96.7Very high96.4Very high106 Ų10654.9 Ų54.946%0.46128%0.282SS..Hα-helixtrans-56.5-43.2171.6-74.3173.8-178.5173.30112.5K274 M275 L282K274-K278 WeakPolarHBondContact O-CG 3.48Å; K274-K278 PolarHBondContact O-N 3.29Å; K274-K278 VanDerWaalsContact O-N 3.07Å; M275-K278 HydrophobicContact SD-CD 4.33Å; K278-L282 WeakPolarHBondContact O-CB 3.38Å; K278-L282 PolarHBondContact O-N 2.93Å; K278-L282 VanDerWaalsContact O-N 3.11Å
279A97.3Very high96.3Very high0 Ų053.3 Ų53.30%027%0.273CS..Hα-helixtrans-66.5-37.4178.700000112Y256 M275 L276 E277 L282 C283 I295Y256-A279 HydrophobicContact CD2-CB 4.42Å; M275-A279 PolarHBondContact O-N 3.15Å; M275-A279 VanDerWaalsContact O-N 3.12Å; L276-A279 WeakPolarHBondContact O-CB 3.31Å; L276-A279 PolarHBondContact O-N 2.91Å; E277-A279 VanDerWaalsContact C-N 3.3Å; E277-A279 PolarHBondContact O-N 3.22Å; A279-L282 PolarHBondContact O-N 3.5Å; A279-C283 PolarHBondContact O-N 2.95Å; A279-C283 PolarHBondContact O-SG 2.93Å; A279-I295 HydrophobicContact CB-CD1 3.85Å
280A97.3Very high96.2Very high4 Ų456.8 Ų56.83%0.03329%0.288CS..Hα-helixtrans-65.3-45.617600000111.7L276 E277 L282 C283 H284 L292 I295 L299L276-A280 WeakPolarHBondContact O-CB 3.2Å; L276-A280 PolarHBondContact O-N 3.26Å; E277-A280 WeakPolarHBondContact O-CB 3.49Å; E277-A280 PolarHBondContact O-N 3.32Å; E277-A280 VanDerWaalsContact O-N 3.15Å; A280-L282 VanDerWaalsContact C-N 3.3Å; A280-L282 PolarHBondContact O-N 3.42Å; A280-C283 PolarHBondContact O-N 2.96Å; A280-H284 WeakPolarHBondContact O-CB 3.35Å; A280-H284 PolarHBondContact O-N 3.34Å; A280-L292 HydrophobicContact CB-CD1 4.04Å; A280-L292 WeakPolarHBondContact O-CD1 3.41Å; A280-I295 HydrophobicContact CB-CG2 3.9Å; A280-L299 HydrophobicContact CB-CD1 4.29Å
281D96.3Very high96.2Very high113 Ų11354.5 Ų54.560%0.60427%0.274SS*.Hα-helixtrans-60.3-41176.8-71-21.4000111.7E277 H284 S285E277-D281 PolarHBondContact O-N 3.5Å; D281-H284 PolarHBondContact O-N 3.46Å; D281-S285 WeakPolarHBondContact O-CB 3.34Å; D281-S285 PolarHBondContact O-N 2.9Å; D281-S285 PolarHBondContact O-OG 3.29Å
282L96.5Very high96.2Very high47 Ų4752 Ų5225%0.24626%0.262CS..Hα-helixtrans-66.4-41.3176.9-152.773.7000111.9V249 L252 V253 K278 A279 A280 H284 S285 S286V249-L282 HydrophobicContact CG1-CD2 3.84Å; V249-L282 HydrophobicContact CG1-CG 3.85Å; L252-L282 HydrophobicContact CB-CD2 3.73Å; L252-L282 HydrophobicContact CD1-CD2 3.87Å; L252-L282 HydrophobicContact CG-CD2 4.47Å; V253-L282 HydrophobicContact CG2-CB 4.34Å; V253-L282 HydrophobicContact CG2-CD2 4.11Å; K278-L282 WeakPolarHBondContact O-CB 3.38Å; K278-L282 PolarHBondContact O-N 2.93Å; K278-L282 VanDerWaalsContact O-N 3.11Å; A279-L282 PolarHBondContact O-N 3.5Å; A280-L282 VanDerWaalsContact C-N 3.3Å; A280-L282 PolarHBondContact O-N 3.42Å; L282-H284 VanDerWaalsContact C-N 3.34Å; L282-S285 WeakPolarHBondContact CA-OG 3.35Å; L282-S285 PolarHBondContact O-OG 3.14Å; L282-S285 VanDerWaalsContact O-OG 3.06Å; L282-S286 VanDerWaalsContact O-CB 3.32Å; L282-S286 WeakPolarHBondContact O-CB 3.46Å; L282-S286 PolarHBondContact O-N 3.35Å; L282-S286 VanDerWaalsContact O-N 3.15Å; L282-S286 PolarHBondContact O-OG 2.96Å
283C96.4Very high96.1Very high0 Ų051.9 Ų51.90%026%0.262CS..Hα-helixtrans-63.6-41.3174.4-68.70000111.8V253 A279 A280 S286 D287 L288 L292V253-C283 VanDerWaalsContact CG1-SG 3.56Å; V253-C283 WeakPolarHBondContact CG2-SG 3.42Å; A279-C283 PolarHBondContact O-N 2.95Å; A279-C283 PolarHBondContact O-SG 2.93Å; A280-C283 PolarHBondContact O-N 2.96Å; C283-S286 PolarHBondContact O-N 2.68Å; C283-D287 PolarHBondContact O-N 3.13Å; C283-D287 VanDerWaalsContact O-N 3.15Å; C283-L288 HydrophobicContact CB-CB 4.16Å; C283-L288 PolarHBondContact O-N 2.68Å; C283-L292 HydrophobicContact CB-CB 3.84Å; C283-L292 HydrophobicContact CB-CD1 4.19Å
284H93.3Very high96.1Very high123 Ų12353.7 Ų53.757%0.56927%0.272SS*.Hα-helixtrans-64.9-48.4-179.7-173.969.8000111.6A280 D281 L282 S286 D287 L292A280-H284 WeakPolarHBondContact O-CB 3.35Å; A280-H284 PolarHBondContact O-N 3.34Å; D281-H284 PolarHBondContact O-N 3.46Å; L282-H284 VanDerWaalsContact C-N 3.34Å; H284-S286 PolarHBondContact O-N 3.07Å; H284-D287 PolarHBondContact O-N 3.28Å; H284-L292 HydrophobicContact CB-CD2 4.3Å
285S95.1Very high96.1Very high89 Ų8948.8 Ų48.862%0.62225%0.251SS*.Hα-helixtrans-66.3-23.3179.153.20000114D281 L282D281-S285 WeakPolarHBondContact O-CB 3.34Å; D281-S285 PolarHBondContact O-N 2.9Å; D281-S285 PolarHBondContact O-OG 3.29Å; L282-S285 WeakPolarHBondContact CA-OG 3.35Å; L282-S285 PolarHBondContact O-OG 3.14Å; L282-S285 VanDerWaalsContact O-OG 3.06Å
286S94.9Very high96.1Very high49 Ų4948 Ų4834%0.34325%0.247SC..THydrogen-bonded Turntrans-108.113.1-177.6-51.60000114.1L282 C283 H284 L288L282-S286 VanDerWaalsContact O-CB 3.32Å; L282-S286 WeakPolarHBondContact O-CB 3.46Å; L282-S286 PolarHBondContact O-N 3.35Å; L282-S286 VanDerWaalsContact O-N 3.15Å; L282-S286 PolarHBondContact O-OG 2.96Å; C283-S286 PolarHBondContact O-N 2.68Å; H284-S286 PolarHBondContact O-N 3.07Å; S286-L288 VanDerWaalsContact C-N 3.28Å; S286-L288 PolarHBondContact O-N 3.1Å
287D94.1Very high96Very high118 Ų11849 Ų4963%0.63125%0.252SS*.THydrogen-bonded Turntrans53.835.1179.7-16029.9000115.3C283 H284 Q289C283-D287 PolarHBondContact O-N 3.13Å; C283-D287 VanDerWaalsContact O-N 3.15Å; H284-D287 PolarHBondContact O-N 3.28Å; D287-Q289 VanDerWaalsContact C-N 3.31Å; D287-Q289 PolarHBondContact O-N 3Å; D287-Q289 VanDerWaalsContact O-N 3.13Å; D287-Q289 WeakPolarHBondContact OD1-CG 3.41Å; D287-Q289 PolarHBondContact OD1-NE2 3Å
288L95.1Very high96Very high34 Ų3448.5 Ų48.518%0.17825%0.252CS..  trans-88.865.1177.6-61.5177.9000111V249 K250 C283 S286 E290 R291 L292V249-L288 HydrophobicContact CB-CD1 4.39Å; V249-L288 HydrophobicContact CG1-CD1 3.62Å; K250-L288 HydrophobicContact CG-CD1 4.04Å; K250-L288 HydrophobicContact CG-CD2 4.35Å; C283-L288 HydrophobicContact CB-CB 4.16Å; C283-L288 PolarHBondContact O-N 2.68Å; S286-L288 VanDerWaalsContact C-N 3.28Å; S286-L288 PolarHBondContact O-N 3.1Å; L288-E290 VanDerWaalsContact C-N 3.33Å; L288-E290 PolarHBondContact O-N 3.11Å; L288-R291 HydrophobicContact CB-CB 4.31Å; L288-R291 PolarHBondContact O-N 3.07Å; L288-R291 VanDerWaalsContact O-N 3.13Å; L288-L292 PolarHBondContact O-N 2.95Å
289Q95.1Very high96Very high36 Ų3643.5 Ų43.517%0.16823%0.23CC..Hα-helixtrans-57.6-39.2-171-61.3-60.2-34.300114.1D287 L292 A293 T325 A326D287-Q289 VanDerWaalsContact C-N 3.31Å; D287-Q289 PolarHBondContact O-N 3Å; D287-Q289 VanDerWaalsContact O-N 3.13Å; D287-Q289 WeakPolarHBondContact OD1-CG 3.41Å; D287-Q289 PolarHBondContact OD1-NE2 3Å; Q289-L292 PolarHBondContact O-N 3.33Å; Q289-A293 WeakPolarHBondContact O-CB 3.38Å; Q289-A293 PolarHBondContact O-N 3.39Å; Q289-T325 HydrophobicContact CB-CG2 4.5Å; Q289-T325 HydrophobicContact CG-CG2 3.84Å; Q289-A326 HydrophobicContact CB-CB 4.01Å
290E94.3Very high96Very high114 Ų11443.5 Ų43.553%0.53323%0.23SC..Hα-helixtrans-59.9-47.9176.5-175.2-163.7158.500111.6L288 A293 D294 A326 E328L288-E290 VanDerWaalsContact C-N 3.33Å; L288-E290 PolarHBondContact O-N 3.11Å; E290-A293 WeakPolarHBondContact O-CB 3.25Å; E290-A293 PolarHBondContact O-N 2.96Å; E290-D294 PolarHBondContact O-N 3.24Å; E290-A326 HydrophobicContact CB-CB 4.25Å; E290-E328 HydrophobicContact CG-CG 4.04Å
291R95.1Very high95.9Very high71 Ų7145 Ų4527%0.26824%0.24SC..Hα-helixtrans-71.3-37.8-179.9-66.1-177.4-179.2-80.8-9.5111.8V253 L288 A293 D294 I295V253-R291 HydrophobicContact CG1-CB 4.37Å; L288-R291 HydrophobicContact CB-CB 4.31Å; L288-R291 PolarHBondContact O-N 3.07Å; L288-R291 VanDerWaalsContact O-N 3.13Å; R291-A293 VanDerWaalsContact C-N 3.28Å; R291-A293 PolarHBondContact O-N 3.45Å; R291-D294 PolarHBondContact O-N 3.28Å; R291-I295 WeakPolarHBondContact O-CB 3.33Å; R291-I295 WeakPolarHBondContact O-CD1 3.43Å; R291-I295 WeakPolarHBondContact O-CG1 3.49Å; R291-I295 PolarHBondContact O-N 2.94Å
292L97.3Very high95.8Very high4 Ų439.8 Ų39.82%0.02121%0.212CC..Hα-helixtrans-58-44.8173.4-177.559.8000110.4A280 C283 H284 L288 Q289 D294 I295 S296 A322A280-L292 HydrophobicContact CB-CD1 4.04Å; A280-L292 WeakPolarHBondContact O-CD1 3.41Å; C283-L292 HydrophobicContact CB-CB 3.84Å; C283-L292 HydrophobicContact CB-CD1 4.19Å; H284-L292 HydrophobicContact CB-CD2 4.3Å; L288-L292 PolarHBondContact O-N 2.95Å; Q289-L292 PolarHBondContact O-N 3.33Å; L292-D294 PolarHBondContact O-N 3.43Å; L292-I295 PolarHBondContact O-N 3.43Å; L292-S296 VanDerWaalsContact O-CB 3.29Å; L292-S296 WeakPolarHBondContact O-CB 3.31Å; L292-S296 PolarHBondContact O-N 3.28Å; L292-S296 PolarHBondContact O-OG 3.26Å; L292-S296 VanDerWaalsContact O-OG 3.05Å; L292-A322 HydrophobicContact CB-CB 4.21Å; L292-A322 HydrophobicContact CD2-CB 4.12Å; L292-A322 HydrophobicContact CG-CB 4.09Å
293A96.6Very high95.7Very high0 Ų037.8 Ų37.80%020%0.202CC..Hα-helixtrans-58.8-4717900000112.6Q289 E290 R291 L297 S319 A322 A323 L331Q289-A293 WeakPolarHBondContact O-CB 3.38Å; Q289-A293 PolarHBondContact O-N 3.39Å; E290-A293 WeakPolarHBondContact O-CB 3.25Å; E290-A293 PolarHBondContact O-N 2.96Å; R291-A293 VanDerWaalsContact C-N 3.28Å; R291-A293 PolarHBondContact O-N 3.45Å; A293-L297 WeakPolarHBondContact O-CB 3.24Å; A293-L297 PolarHBondContact O-N 3.32Å; A293-S319 WeakPolarHBondContact O-CB 3.38Å; A293-S319 PolarHBondContact O-OG 2.88Å; A293-A322 HydrophobicContact CB-CB 3.83Å; A293-A323 HydrophobicContact CB-CB 3.92Å; A293-L331 HydrophobicContact CB-CD1 4.21Å
294D96.3Very high95.5Very high50 Ų5040 Ų4027%0.26722%0.217SC..Hα-helixtrans-66.8-41.8179.3170.857.8000112.9K257 E290 R291 L292 L297 T298K257-D294 VanDerWaalsContact NZ-CG 3.3Å; K257-D294 IonicContact NZ-OD1 2.75Å; K257-D294 PolarHBondContact NZ-OD1 2.89Å; K257-D294 IonicContact NZ-OD2 3.69Å; K257-D294 PolarHBondContact NZ-OD2 3.44Å; E290-D294 PolarHBondContact O-N 3.24Å; R291-D294 PolarHBondContact O-N 3.28Å; L292-D294 PolarHBondContact O-N 3.43Å; D294-L297 WeakPolarHBondContact O-CB 3.26Å; D294-L297 PolarHBondContact O-N 3.44Å; D294-T298 PolarHBondContact O-N 3.03Å; D294-T298 PolarHBondContact O-OG1 2.85Å
295I97.3Very high95.4Very high1 Ų140.1 Ų40.11%0.00522%0.222CC..Hα-helixtrans-68.3-46.1177.6-69.1162.7000111.2V253 L276 A279 A280 R291 L292 L297 T298 L299V253-I295 HydrophobicContact CG1-CD1 3.42Å; V253-I295 VanDerWaalsContact CG1-CD1 3.42Å; L276-I295 HydrophobicContact CB-CG2 4.36Å; L276-I295 HydrophobicContact CD2-CG2 4.37Å; L276-I295 WeakPolarHBondContact O-CG2 3.45Å; A279-I295 HydrophobicContact CB-CD1 3.85Å; A280-I295 HydrophobicContact CB-CG2 3.9Å; R291-I295 WeakPolarHBondContact O-CB 3.33Å; R291-I295 WeakPolarHBondContact O-CD1 3.43Å; R291-I295 WeakPolarHBondContact O-CG1 3.49Å; R291-I295 PolarHBondContact O-N 2.94Å; L292-I295 PolarHBondContact O-N 3.43Å; I295-L297 VanDerWaalsContact C-N 3.26Å; I295-L297 PolarHBondContact O-N 3.4Å; I295-T298 WeakPolarHBondContact O-CB 3.45Å; I295-T298 PolarHBondContact O-N 3.22Å; I295-T298 VanDerWaalsContact O-N 3.08Å; I295-L299 HydrophobicContact CG2-CD1 4.08Å; I295-L299 PolarHBondContact O-N 3.13Å
296S97.7Very high95.3Very high0 Ų038.5 Ų38.50%021%0.208CC..Hα-helixtrans-62.5-34.3176.1-62.80000111.4L292 T298 G300 Y315 Q318L292-S296 VanDerWaalsContact O-CB 3.29Å; L292-S296 WeakPolarHBondContact O-CB 3.31Å; L292-S296 PolarHBondContact O-N 3.28Å; L292-S296 PolarHBondContact O-OG 3.26Å; L292-S296 VanDerWaalsContact O-OG 3.05Å; S296-T298 VanDerWaalsContact C-N 3.34Å; S296-G300 PolarHBondContact O-N 3.07Å; S296-Y315 WeakPolarHBondContact CB-O 3.47Å; S296-Y315 WeakPolarHBondContact O-CB 3.24Å; S296-Q318 PolarHBondContact OG-OE1 3.39Å
297L96.7Very high95Very high22 Ų2240.8 Ų40.812%0.11522%0.216CC..Hα-helixtrans-62.8-42.9172.9-17267.8000111.4A293 D294 I295 G300 C301 F316 S319 L331 K334 A335 K338A293-L297 WeakPolarHBondContact O-CB 3.24Å; A293-L297 PolarHBondContact O-N 3.32Å; D294-L297 WeakPolarHBondContact O-CB 3.26Å; D294-L297 PolarHBondContact O-N 3.44Å; I295-L297 VanDerWaalsContact C-N 3.26Å; I295-L297 PolarHBondContact O-N 3.4Å; L297-G300 PolarHBondContact O-N 3.3Å; L297-C301 PolarHBondContact O-N 3.47Å; L297-C301 VanDerWaalsContact O-N 3.09Å; L297-C301 PolarHBondContact O-SG 3.29Å; L297-F316 HydrophobicContact CD1-CD1 3.88Å; L297-F316 HydrophobicContact CD1-CE1 3.91Å; L297-F316 WeakPolarHBondContact O-CE1 3.26Å; L297-S319 WeakPolarHBondContact CB-OG 3.42Å; L297-L331 HydrophobicContact CD2-CD2 4.16Å; L297-K334 HydrophobicContact CD2-CB 4.27Å; L297-K334 HydrophobicContact CD2-CD 4.49Å; L297-A335 HydrophobicContact CD1-CB 4.28Å; L297-K338 HydrophobicContact CD1-CG 4.33Å
298T96.7Very high94.7Very high38 Ų3841 Ų4123%0.23321%0.209CC..Hα-helixtrans-64.7-48.8178.7-540000110.9L276 D294 I295 S296 G300 C301 I302L276-T298 HydrophobicContact CD1-CG2 3.88Å; D294-T298 PolarHBondContact O-N 3.03Å; D294-T298 PolarHBondContact O-OG1 2.85Å; I295-T298 WeakPolarHBondContact O-CB 3.45Å; I295-T298 PolarHBondContact O-N 3.22Å; I295-T298 VanDerWaalsContact O-N 3.08Å; S296-T298 VanDerWaalsContact C-N 3.34Å; T298-G300 VanDerWaalsContact C-N 3.32Å; T298-G300 PolarHBondContact O-N 3.02Å; T298-C301 PolarHBondContact O-N 3.48Å; T298-C301 VanDerWaalsContact O-N 3.14Å; T298-I302 HydrophobicContact CG2-CD1 4.08Å; T298-I302 WeakPolarHBondContact O-CG1 3.34Å; T298-I302 PolarHBondContact O-N 3.47Å
299L97.4Very high94.2Very high0 Ų040.5 Ų40.50%021%0.207CC..Hα-helixtrans-56.2-45.2174-80.3167.4000111.8I273 L276 E277 A280 I295 C301 I302 Y303 Y315I273-L299 HydrophobicContact CG2-CD2 4.27Å; L276-L299 HydrophobicContact CB-CD1 4.07Å; L276-L299 HydrophobicContact CB-CD2 3.5Å; L276-L299 VanDerWaalsContact CB-CD2 3.5Å; L276-L299 HydrophobicContact CB-CG 3.68Å; L276-L299 HydrophobicContact CD1-CD2 4.02Å; L276-L299 HydrophobicContact CD1-CG 4.21Å; L276-L299 HydrophobicContact CG-CD2 4.43Å; E277-L299 HydrophobicContact CG-CD1 4.22Å; E277-L299 HydrophobicContact CG-CD2 4.07Å; A280-L299 HydrophobicContact CB-CD1 4.29Å; I295-L299 HydrophobicContact CG2-CD1 4.08Å; I295-L299 PolarHBondContact O-N 3.13Å; L299-C301 VanDerWaalsContact C-N 3.29Å; L299-C301 PolarHBondContact O-N 2.94Å; L299-I302 PolarHBondContact O-N 3.32Å; L299-Y303 HydrophobicContact CB-CD2 4.47Å; L299-Y303 HydrophobicContact CD2-CE2 4.15Å; L299-Y303 WeakPolarHBondContact O-CB 3.49Å; L299-Y303 VanDerWaalsContact O-CD2 3.24Å; L299-Y303 WeakPolarHBondContact O-CD2 3.21Å; L299-Y303 PolarHBondContact O-N 3.06Å; L299-Y315 HydrophobicContact CB-CD1 3.82Å; L299-Y315 HydrophobicContact CB-CD2 4.03Å; L299-Y315 HydrophobicContact CB-CE1 4.2Å; L299-Y315 HydrophobicContact CB-CE2 4.39Å; L299-Y315 HydrophobicContact CB-CG 3.74Å; L299-Y315 HydrophobicContact CD1-CD1 3.79Å; L299-Y315 HydrophobicContact CD1-CE1 3.43Å; L299-Y315 VanDerWaalsContact CD1-CE1 3.43Å; L299-Y315 HydrophobicContact CD1-CG 4.49Å; L299-Y315 HydrophobicContact CG-CD1 4.44Å; L299-Y315 HydrophobicContact CG-CE1 4.37Å
300G96.1Very high93.8Very high0 Ų044.6 Ų44.60%023%0.23CC..Hα-helixtrans-58.2-40.9177.300000112.6S296 L297 T298 S304 S312 F316S296-G300 PolarHBondContact O-N 3.07Å; L297-G300 PolarHBondContact O-N 3.3Å; T298-G300 VanDerWaalsContact C-N 3.32Å; T298-G300 PolarHBondContact O-N 3.02Å; G300-S304 PolarHBondContact O-N 2.66Å; G300-S312 WeakPolarHBondContact O-CB 3.45Å; G300-S312 PolarHBondContact O-OG 3.15Å; G300-F316 VanDerWaalsContact C-CE1 3.47Å; G300-F316 WeakPolarHBondContact O-CZ 3.44Å
301C94.9Very high93.7Very high35 Ų3543 Ų4324%0.23622%0.221CC..Hα-helixtrans-65.4-50.4175.9-64.30000111.4L297 T298 L299 Y303 S304 D305L297-C301 PolarHBondContact O-N 3.47Å; L297-C301 VanDerWaalsContact O-N 3.09Å; L297-C301 PolarHBondContact O-SG 3.29Å; T298-C301 PolarHBondContact O-N 3.48Å; T298-C301 VanDerWaalsContact O-N 3.14Å; L299-C301 VanDerWaalsContact C-N 3.29Å; L299-C301 PolarHBondContact O-N 2.94Å; C301-Y303 VanDerWaalsContact C-N 3.32Å; C301-Y303 PolarHBondContact O-N 2.96Å; C301-S304 WeakPolarHBondContact O-CA 3.28Å; C301-S304 VanDerWaalsContact O-CB 3.24Å; C301-S304 WeakPolarHBondContact O-CB 3.19Å; C301-S304 PolarHBondContact O-N 3.49Å; C301-D305 PolarHBondContact O-N 3.11Å
302I95.3Very high93.6Very high5 Ų539.7 Ų39.73%0.02621%0.208CC..Hα-helixtrans-58.6-44.8179.4-65.6165.2000110.9I269 I273 L276 T298 L299 S304 D305 V306I269-I302 HydrophobicContact CG2-CG2 3.8Å; I273-I302 HydrophobicContact CD1-CG2 3.94Å; I273-I302 HydrophobicContact CG1-CG2 3.73Å; L276-I302 HydrophobicContact CD1-CD1 3.36Å; T298-I302 HydrophobicContact CG2-CD1 4.08Å; T298-I302 WeakPolarHBondContact O-CG1 3.34Å; T298-I302 PolarHBondContact O-N 3.47Å; L299-I302 PolarHBondContact O-N 3.32Å; I302-S304 VanDerWaalsContact C-N 3.28Å; I302-S304 PolarHBondContact O-N 3.1Å; I302-D305 PolarHBondContact O-N 3.47Å; I302-D305 VanDerWaalsContact O-N 3.13Å; I302-V306 WeakPolarHBondContact O-CG2 3.47Å; I302-V306 PolarHBondContact O-N 3.5Å
303Y94.4Very high93.3Very high4 Ų440.4 Ų40.42%0.01621%0.214CC..Hα-helixtrans-63.9-31.7176.8-84.3-64.4000113.2I273 E277 L299 C301 V306 R308 K311 Y315I273-Y303 HydrophobicContact CD1-CD1 4.43Å; I273-Y303 HydrophobicContact CD1-CE1 4.02Å; I273-Y303 HydrophobicContact CG2-CE1 4.49Å; I273-Y303 HydrophobicContact CG2-CE2 3.95Å; I273-Y303 VanDerWaalsContact CG2-OH 3.29Å; I273-Y303 WeakPolarHBondContact CG2-OH 3.28Å; E277-Y303 PolarHBondContact OE1-OH 3.12Å; L299-Y303 HydrophobicContact CB-CD2 4.47Å; L299-Y303 HydrophobicContact CD2-CE2 4.15Å; L299-Y303 WeakPolarHBondContact O-CB 3.49Å; L299-Y303 VanDerWaalsContact O-CD2 3.24Å; L299-Y303 WeakPolarHBondContact O-CD2 3.21Å; L299-Y303 PolarHBondContact O-N 3.06Å; C301-Y303 VanDerWaalsContact C-N 3.32Å; C301-Y303 PolarHBondContact O-N 2.96Å; Y303-V306 HydrophobicContact CD1-CG2 4.21Å; Y303-R308 HydrophobicContact CD1-CB 3.99Å; Y303-R308 CarbonylContact O-C 3.49Å; Y303-R308 WeakPolarHBondContact O-CA 3.05Å; Y303-R308 PolarHBondContact O-N 3.02Å; Y303-K311 HydrophobicContact CD1-CB 3.84Å; Y303-K311 HydrophobicContact CD1-CD 3.92Å; Y303-K311 HydrophobicContact CD2-CB 4.29Å; Y303-K311 HydrophobicContact CE1-CB 4.13Å; Y303-K311 HydrophobicContact CE1-CD 3.37Å; Y303-K311 HydrophobicContact CE1-CG 4.4Å; Y303-K311 HydrophobicContact CE2-CD 4.42Å; Y303-K311 HydrophobicContact CG-CB 3.9Å; Y303-K311 PolarHBondContact OH-NZ 2.94Å; Y303-Y315 AromaticContact CD2-CD2 3.51Å; Y303-Y315 HydrophobicContact CD2-CD2 3.51Å; Y303-Y315 AromaticContact CD2-CE2 3.61Å; Y303-Y315 HydrophobicContact CD2-CE2 3.61Å; Y303-Y315 AromaticContact CE2-CD2 3.65Å; Y303-Y315 HydrophobicContact CE2-CD2 3.65Å; Y303-Y315 AromaticContact CE2-CE2 3.2Å; Y303-Y315 HydrophobicContact CE2-CE2 3.2Å
304S91.3Very high93.2Very high47 Ų4746 Ų4633%0.32924%0.24SC..Hα-helixtrans-65.6-44.8171.5-174.90000110.8G300 C301 I302 V306 N307G300-S304 PolarHBondContact O-N 2.66Å; C301-S304 WeakPolarHBondContact O-CA 3.28Å; C301-S304 VanDerWaalsContact O-CB 3.24Å; C301-S304 WeakPolarHBondContact O-CB 3.19Å; C301-S304 PolarHBondContact O-N 3.49Å; I302-S304 VanDerWaalsContact C-N 3.28Å; I302-S304 PolarHBondContact O-N 3.1Å; S304-V306 PolarHBondContact O-N 3.16Å; S304-N307 WeakPolarHBondContact O-CA 2.96Å; S304-N307 PolarHBondContact O-N 3.36Å
305D91.4Very high93.2Very high126 Ų12645.4 Ų45.467%0.67423%0.234SC*.Hα-helixtrans-68-34.6-176.5-63.9-21.5000112C301 I302 N307C301-D305 PolarHBondContact O-N 3.11Å; I302-D305 PolarHBondContact O-N 3.47Å; I302-D305 VanDerWaalsContact O-N 3.13Å; D305-N307 PolarHBondContact O-N 3.36Å
306V92.7Very high93.2Very high54 Ų5445.4 Ų45.433%0.32723%0.234SC..THydrogen-bonded Turntrans-81.313.2171-57.10000114.1I269 I302 Y303 S304 R308I269-V306 HydrophobicContact CG2-CG1 3.64Å; I302-V306 WeakPolarHBondContact O-CG2 3.47Å; I302-V306 PolarHBondContact O-N 3.5Å; Y303-V306 HydrophobicContact CD1-CG2 4.21Å; S304-V306 PolarHBondContact O-N 3.16Å; V306-R308 VanDerWaalsContact C-N 3.34Å; V306-R308 HydrophobicContact CG2-CB 4.28Å; V306-R308 HydrophobicContact CG2-CG 3.99Å; V306-R308 PolarHBondContact O-N 3.42Å
307N88.3Confident93Very high97 Ų9748.2 Ų48.252%0.51925%0.249SC..THydrogen-bonded Turntrans56.940.1177.3-162.516.8000113.9S304 D305 P309 K349S304-N307 WeakPolarHBondContact O-CA 2.96Å; S304-N307 PolarHBondContact O-N 3.36Å; D305-N307 PolarHBondContact O-N 3.36Å; N307-P309 WeakPolarHBondContact O-CD 3.47Å; N307-K349 PolarHBondContact OD1-NZ 3.45Å
308R89.3Confident93Very high123 Ų12350 Ų5046%0.46426%0.257SS..  trans-110.972.3172.6-66.3-177.3-176.5-1764110.1Y303 V306 L310 K311 S312Y303-R308 HydrophobicContact CD1-CB 3.99Å; Y303-R308 CarbonylContact O-C 3.49Å; Y303-R308 WeakPolarHBondContact O-CA 3.05Å; Y303-R308 PolarHBondContact O-N 3.02Å; V306-R308 VanDerWaalsContact C-N 3.34Å; V306-R308 HydrophobicContact CG2-CB 4.28Å; V306-R308 HydrophobicContact CG2-CG 3.99Å; V306-R308 PolarHBondContact O-N 3.42Å; R308-L310 VanDerWaalsContact C-N 3.35Å; R308-L310 PolarHBondContact O-N 2.72Å; R308-K311 PolarHBondContact O-N 3.43Å; R308-S312 PolarHBondContact O-N 3.35Å; R308-S312 VanDerWaalsContact O-N 3.1Å
309P84.2Confident93Very high24 Ų2448.2 Ų48.216%0.15625%0.246CC..Hα-helixtrans-64.4-33-167.725.4-35.7000114.1N307 S312 C313N307-P309 WeakPolarHBondContact O-CD 3.47Å; P309-S312 WeakPolarHBondContact O-CB 3.19Å; P309-S312 PolarHBondContact O-N 2.97Å; P309-C313 PolarHBondContact O-N 2.9Å; P309-C313 PolarHBondContact O-SG 3.37Å; P309-C313 VanDerWaalsContact O-SG 3.36Å
310L86.9Confident93Very high121 Ų12152.1 Ų52.163%0.63426%0.261SS*.Hα-helixtrans-63.1-52.7179.1-64.5175.4000111.5R308 S312 C313 E314R308-L310 VanDerWaalsContact C-N 3.35Å; R308-L310 PolarHBondContact O-N 2.72Å; L310-S312 VanDerWaalsContact C-N 3.27Å; L310-S312 PolarHBondContact O-N 3.46Å; L310-C313 WeakPolarHBondContact O-CB 3.39Å; L310-C313 PolarHBondContact O-N 3.28Å; L310-E314 PolarHBondContact O-N 3.07Å
311K90.9Very high93Very high82 Ų8258 Ų5836%0.35729%0.286SS..Hα-helixtrans-60.6-38.1175-75.5-164.9167.1-1590112.2Y303 R308 C313 E314 Y315Y303-K311 HydrophobicContact CD1-CB 3.84Å; Y303-K311 HydrophobicContact CD1-CD 3.92Å; Y303-K311 HydrophobicContact CD2-CB 4.29Å; Y303-K311 HydrophobicContact CE1-CB 4.13Å; Y303-K311 HydrophobicContact CE1-CD 3.37Å; Y303-K311 HydrophobicContact CE1-CG 4.4Å; Y303-K311 HydrophobicContact CE2-CD 4.42Å; Y303-K311 HydrophobicContact CG-CB 3.9Å; Y303-K311 PolarHBondContact OH-NZ 2.94Å; R308-K311 PolarHBondContact O-N 3.43Å; K311-C313 PolarHBondContact O-N 3.46Å; K311-E314 PolarHBondContact O-N 3.1Å; K311-Y315 VanDerWaalsContact O-CD2 3.26Å; K311-Y315 WeakPolarHBondContact O-CD2 3.37Å; K311-Y315 PolarHBondContact O-N 2.83Å; K311-Y315 VanDerWaalsContact O-N 3.1Å
312S93.4Very high93.1Very high0 Ų056.4 Ų56.40%028%0.276CS..Hα-helixtrans-58.8-46.8175.6-1780000111.8G300 R308 P309 L310 E314 Y315 F316G300-S312 WeakPolarHBondContact O-CB 3.45Å; G300-S312 PolarHBondContact O-OG 3.15Å; R308-S312 PolarHBondContact O-N 3.35Å; R308-S312 VanDerWaalsContact O-N 3.1Å; P309-S312 WeakPolarHBondContact O-CB 3.19Å; P309-S312 PolarHBondContact O-N 2.97Å; L310-S312 VanDerWaalsContact C-N 3.27Å; L310-S312 PolarHBondContact O-N 3.46Å; S312-E314 PolarHBondContact O-N 3.35Å; S312-Y315 PolarHBondContact O-N 3.46Å; S312-F316 VanDerWaalsContact O-CD2 3.22Å; S312-F316 WeakPolarHBondContact O-CD2 3.43Å; S312-F316 WeakPolarHBondContact O-CG 3.37Å; S312-F316 PolarHBondContact O-N 2.94Å; S312-F316 WeakPolarHBondContact OG-CE2 3.27Å
313C91.8Very high93.1Very high19 Ų1956.2 Ų56.213%0.12828%0.275CS..Hα-helixtrans-61-43175.1-71.90000112.7P309 L310 K311 Y315 F316 L317 L339 T342P309-C313 PolarHBondContact O-N 2.9Å; P309-C313 PolarHBondContact O-SG 3.37Å; P309-C313 VanDerWaalsContact O-SG 3.36Å; L310-C313 WeakPolarHBondContact O-CB 3.39Å; L310-C313 PolarHBondContact O-N 3.28Å; K311-C313 PolarHBondContact O-N 3.46Å; C313-Y315 PolarHBondContact O-N 3.35Å; C313-F316 PolarHBondContact O-N 3.08Å; C313-L317 WeakPolarHBondContact O-CB 3.42Å; C313-L317 PolarHBondContact O-N 2.77Å; C313-L339 HydrophobicContact CB-CD1 4.23Å; C313-L339 WeakPolarHBondContact O-CD1 3.3Å; C313-T342 PolarHBondContact SG-OG1 3.29Å; C313-T342 VanDerWaalsContact SG-OG1 3.33Å
314E93.8Very high93.2Very high119 Ų11958.3 Ų58.356%0.55629%0.29SS*.Hα-helixtrans-56.1-49.6176.8-70.5171177.300111.4L310 K311 S312 L317 Q318L310-E314 PolarHBondContact O-N 3.07Å; K311-E314 PolarHBondContact O-N 3.1Å; S312-E314 PolarHBondContact O-N 3.35Å; E314-L317 PolarHBondContact O-N 2.6Å; E314-Q318 PolarHBondContact O-N 2.94Å
315Y96.8Very high93.4Very high36 Ų3660.7 Ų60.714%0.14130%0.302CS..Hα-helixtrans-69.8-36.8179.9-80.5-64.2000113.1E277 S296 L299 Y303 K311 S312 C313 L317 Q318 S319E277-Y315 WeakPolarHBondContact CG-OH 3.49Å; E277-Y315 PolarHBondContact OE1-OH 3.01Å; S296-Y315 WeakPolarHBondContact CB-O 3.47Å; S296-Y315 WeakPolarHBondContact O-CB 3.24Å; L299-Y315 HydrophobicContact CB-CD1 3.82Å; L299-Y315 HydrophobicContact CB-CD2 4.03Å; L299-Y315 HydrophobicContact CB-CE1 4.2Å; L299-Y315 HydrophobicContact CB-CE2 4.39Å; L299-Y315 HydrophobicContact CB-CG 3.74Å; L299-Y315 HydrophobicContact CD1-CD1 3.79Å; L299-Y315 HydrophobicContact CD1-CE1 3.43Å; L299-Y315 VanDerWaalsContact CD1-CE1 3.43Å; L299-Y315 HydrophobicContact CD1-CG 4.49Å; L299-Y315 HydrophobicContact CG-CD1 4.44Å; L299-Y315 HydrophobicContact CG-CE1 4.37Å; Y303-Y315 AromaticContact CD2-CD2 3.51Å; Y303-Y315 HydrophobicContact CD2-CD2 3.51Å; Y303-Y315 AromaticContact CD2-CE2 3.61Å; Y303-Y315 HydrophobicContact CD2-CE2 3.61Å; Y303-Y315 AromaticContact CE2-CD2 3.65Å; Y303-Y315 HydrophobicContact CE2-CD2 3.65Å; Y303-Y315 AromaticContact CE2-CE2 3.2Å; Y303-Y315 HydrophobicContact CE2-CE2 3.2Å; K311-Y315 VanDerWaalsContact O-CD2 3.26Å; K311-Y315 WeakPolarHBondContact O-CD2 3.37Å; K311-Y315 PolarHBondContact O-N 2.83Å; K311-Y315 VanDerWaalsContact O-N 3.1Å; S312-Y315 PolarHBondContact O-N 3.46Å; C313-Y315 PolarHBondContact O-N 3.35Å; Y315-L317 VanDerWaalsContact C-N 3.35Å; Y315-Q318 VanDerWaalsContact CD1-OE1 3.31Å; Y315-Q318 PolarHBondContact O-N 3.02Å; Y315-S319 WeakPolarHBondContact O-CB 3.45Å; Y315-S319 PolarHBondContact O-N 2.85Å
316F96.4Very high93.5Very high2 Ų256.1 Ų56.11%0.00928%0.282CS..Hα-helixtrans-65.7-37.5172.9-69.9-40.3000112.7L297 G300 S312 C313 S319 Y320 K338 L339 T342L297-F316 HydrophobicContact CD1-CD1 3.88Å; L297-F316 HydrophobicContact CD1-CE1 3.91Å; L297-F316 WeakPolarHBondContact O-CE1 3.26Å; G300-F316 VanDerWaalsContact C-CE1 3.47Å; G300-F316 WeakPolarHBondContact O-CZ 3.44Å; S312-F316 VanDerWaalsContact O-CD2 3.22Å; S312-F316 WeakPolarHBondContact O-CD2 3.43Å; S312-F316 WeakPolarHBondContact O-CG 3.37Å; S312-F316 PolarHBondContact O-N 2.94Å; S312-F316 WeakPolarHBondContact OG-CE2 3.27Å; C313-F316 PolarHBondContact O-N 3.08Å; F316-S319 WeakPolarHBondContact O-CB 3.21Å; F316-S319 PolarHBondContact O-N 3.07Å; F316-Y320 PolarHBondContact O-N 3.5Å; F316-K338 HydrophobicContact CD1-CB 3.78Å; F316-K338 HydrophobicContact CD2-CB 4Å; F316-K338 HydrophobicContact CE1-CB 3.67Å; F316-K338 HydrophobicContact CE1-CD 4.49Å; F316-K338 HydrophobicContact CE1-CG 4.08Å; F316-K338 HydrophobicContact CE2-CB 3.89Å; F316-K338 HydrophobicContact CG-CB 3.95Å; F316-K338 HydrophobicContact CZ-CB 3.73Å; F316-K338 HydrophobicContact CZ-CD 4.14Å; F316-K338 HydrophobicContact CZ-CG 4.17Å; F316-L339 HydrophobicContact CB-CB 3.95Å; F316-L339 HydrophobicContact CB-CD1 4.1Å; F316-T342 HydrophobicContact CD2-CG2 4Å; F316-T342 WeakPolarHBondContact CD2-OG1 3.44Å; F316-T342 HydrophobicContact CE2-CG2 3.54Å
317L95.3Very high93.7Very high59 Ų5963.7 Ų63.731%0.30931%0.305SS..Hα-helixtrans-66.2-41.7173.7-179.762.2000111.6C313 E314 Y315 S319 Y320 K321 L339C313-L317 WeakPolarHBondContact O-CB 3.42Å; C313-L317 PolarHBondContact O-N 2.77Å; E314-L317 PolarHBondContact O-N 2.6Å; Y315-L317 VanDerWaalsContact C-N 3.35Å; L317-S319 VanDerWaalsContact C-N 3.33Å; L317-Y320 PolarHBondContact O-N 3.18Å; L317-K321 HydrophobicContact CG-CD 4.38Å; L317-K321 WeakPolarHBondContact O-CG 3.5Å; L317-K321 PolarHBondContact O-N 3.42Å; L317-L339 HydrophobicContact CB-CD1 4.29Å; L317-L339 HydrophobicContact CB-CD2 4.3Å; L317-L339 HydrophobicContact CD1-CD2 4.01Å
318Q96Very high93.9Very high60 Ų6062.4 Ų62.428%0.2830%0.296SS..Hα-helixtrans-60.3-45.3174.1-171.5-176.124.800111S296 E314 Y315 Y320 K321 A322S296-Q318 PolarHBondContact OG-OE1 3.39Å; E314-Q318 PolarHBondContact O-N 2.94Å; Y315-Q318 VanDerWaalsContact CD1-OE1 3.31Å; Y315-Q318 PolarHBondContact O-N 3.02Å; Q318-Y320 PolarHBondContact O-N 3.48Å; Q318-K321 PolarHBondContact O-N 3.11Å; Q318-A322 WeakPolarHBondContact O-CB 3.39Å; Q318-A322 PolarHBondContact O-N 3.4Å
319S97.1Very high94.1Very high0 Ų060.6 Ų60.60%030%0.298CS..Hα-helixtrans-57.4-48176.1179.60000112A293 L297 Y315 F316 L317 K321 A322 A323A293-S319 WeakPolarHBondContact O-CB 3.38Å; A293-S319 PolarHBondContact O-OG 2.88Å; L297-S319 WeakPolarHBondContact CB-OG 3.42Å; Y315-S319 WeakPolarHBondContact O-CB 3.45Å; Y315-S319 PolarHBondContact O-N 2.85Å; F316-S319 WeakPolarHBondContact O-CB 3.21Å; F316-S319 PolarHBondContact O-N 3.07Å; L317-S319 VanDerWaalsContact C-N 3.33Å; S319-K321 PolarHBondContact O-N 3.21Å; S319-A322 PolarHBondContact O-N 3.4Å; S319-A323 VanDerWaalsContact O-CB 3.3Å; S319-A323 WeakPolarHBondContact O-CB 3.35Å; S319-A323 PolarHBondContact O-N 3.18Å
320Y96.8Very high94.6Very high82 Ų8263.9 Ų63.932%0.32232%0.318SS..Hα-helixtrans-59.8-47.1178174.5-99.1000112.2F316 L317 Q318 A323 C324 Q336F316-Y320 PolarHBondContact O-N 3.5Å; L317-Y320 PolarHBondContact O-N 3.18Å; Q318-Y320 PolarHBondContact O-N 3.48Å; Y320-A323 PolarHBondContact O-N 3Å; Y320-C324 PolarHBondContact O-N 3.23Å; Y320-C324 PolarHBondContact O-SG 3.1Å; Y320-Q336 HydrophobicContact CD2-CB 4.09Å; Y320-Q336 HydrophobicContact CE2-CB 4.2Å
321K96.4Very high94.9Very high122 Ų12259.3 Ų59.353%0.5329%0.294SS..Hα-helixtrans-61.9-47.6178.7-72.7173.8-179.7174.10111.6L317 Q318 S319 A323 C324 T325L317-K321 HydrophobicContact CG-CD 4.38Å; L317-K321 WeakPolarHBondContact O-CG 3.5Å; L317-K321 PolarHBondContact O-N 3.42Å; Q318-K321 PolarHBondContact O-N 3.11Å; S319-K321 PolarHBondContact O-N 3.21Å; K321-A323 VanDerWaalsContact C-N 3.34Å; K321-A323 PolarHBondContact O-N 2.88Å; K321-C324 WeakPolarHBondContact O-CB 3.12Å; K321-C324 PolarHBondContact O-N 3.1Å; K321-T325 PolarHBondContact O-N 3.37Å; K321-T325 VanDerWaalsContact O-N 3.09Å; K321-T325 PolarHBondContact O-OG1 2.96Å
322A96.4Very high95Very high3 Ų357.3 Ų57.33%0.02529%0.286CS..Hα-helixtrans-62.5-41.6178.600000111.6L292 A293 Q318 S319 C324 T325 A326L292-A322 HydrophobicContact CB-CB 4.21Å; L292-A322 HydrophobicContact CD2-CB 4.12Å; L292-A322 HydrophobicContact CG-CB 4.09Å; A293-A322 HydrophobicContact CB-CB 3.83Å; Q318-A322 WeakPolarHBondContact O-CB 3.39Å; Q318-A322 PolarHBondContact O-N 3.4Å; S319-A322 PolarHBondContact O-N 3.4Å; A322-C324 VanDerWaalsContact C-N 3.34Å; A322-C324 PolarHBondContact O-N 3.35Å; A322-T325 PolarHBondContact O-N 3.14Å; A322-A326 WeakPolarHBondContact O-CB 3.34Å; A322-A326 PolarHBondContact O-N 3.2Å
323A96.4Very high95Very high0 Ų062.5 Ų62.50%031%0.31CS..Hα-helixtrans-65.5-35176.200000112.6A293 S319 Y320 K321 R327 E328 L331 Q332A293-A323 HydrophobicContact CB-CB 3.92Å; S319-A323 VanDerWaalsContact O-CB 3.3Å; S319-A323 WeakPolarHBondContact O-CB 3.35Å; S319-A323 PolarHBondContact O-N 3.18Å; Y320-A323 PolarHBondContact O-N 3Å; K321-A323 VanDerWaalsContact C-N 3.34Å; K321-A323 PolarHBondContact O-N 2.88Å; A323-R327 PolarHBondContact O-N 3.21Å; A323-E328 PolarHBondContact O-N 3.23Å; A323-L331 HydrophobicContact CB-CB 3.88Å; A323-Q332 HydrophobicContact CB-CB 4.37Å; A323-Q332 HydrophobicContact CB-CG 3.6Å; A323-Q332 PolarHBondContact O-NE2 3.48Å
324C95.3Very high95.2Very high48 Ų4867.1 Ų67.132%0.32433%0.328SS..Hα-helixtrans-60.7-48.4171.7-70.60000111.3Y320 K321 A322 A326 R327Y320-C324 PolarHBondContact O-N 3.23Å; Y320-C324 PolarHBondContact O-SG 3.1Å; K321-C324 WeakPolarHBondContact O-CB 3.12Å; K321-C324 PolarHBondContact O-N 3.1Å; A322-C324 VanDerWaalsContact C-N 3.34Å; A322-C324 PolarHBondContact O-N 3.35Å; C324-A326 PolarHBondContact O-N 3.36Å; C324-R327 PolarHBondContact O-N 2.92Å
325T95.9Very high95.2Very high97 Ų9761.4 Ų61.460%0.59530%0.301SS*.Hα-helixtrans-62.4-43.4178.1-52.10000111.7Q289 K321 A322 R327Q289-T325 HydrophobicContact CB-CG2 4.5Å; Q289-T325 HydrophobicContact CG-CG2 3.84Å; K321-T325 PolarHBondContact O-N 3.37Å; K321-T325 VanDerWaalsContact O-N 3.09Å; K321-T325 PolarHBondContact O-OG1 2.96Å; A322-T325 PolarHBondContact O-N 3.14Å; T325-R327 PolarHBondContact O-N 3.31Å
326A94.1Very high95Very high31 Ų3164.8 Ų64.826%0.25632%0.318SS..Hα-helixtrans-72.7-10.317800000114.1Q289 E290 A322 C324 E328Q289-A326 HydrophobicContact CB-CB 4.01Å; E290-A326 HydrophobicContact CB-CB 4.25Å; A322-A326 WeakPolarHBondContact O-CB 3.34Å; A322-A326 PolarHBondContact O-N 3.2Å; C324-A326 PolarHBondContact O-N 3.36Å; A326-E328 HydrophobicContact CB-CB 4.46Å; A326-E328 HydrophobicContact CB-CG 3.99Å; A326-E328 PolarHBondContact O-N 3.22Å
327R95.4Very high94.9Very high213 Ų21369.7 Ų69.780%0.80435%0.348SS*.THydrogen-bonded Turntrans59.628.3-172.8-53.8-178.1178.7-172.7-0.6114A323 C324 T325 V329A323-R327 PolarHBondContact O-N 3.21Å; C324-R327 PolarHBondContact O-N 2.92Å; T325-R327 PolarHBondContact O-N 3.31Å; R327-V329 PolarHBondContact O-N 2.95Å
328E93.2Very high94.9Very high70 Ų7071.6 Ų71.633%0.32735%0.354SS..  trans-84.786.8178.9-77.3-58.6144.200112.1E290 A323 A326 V330 L331 Q332E290-E328 HydrophobicContact CG-CG 4.04Å; A323-E328 PolarHBondContact O-N 3.23Å; A326-E328 HydrophobicContact CB-CB 4.46Å; A326-E328 HydrophobicContact CB-CG 3.99Å; A326-E328 PolarHBondContact O-N 3.22Å; E328-V330 VanDerWaalsContact C-N 3.28Å; E328-V330 PolarHBondContact O-N 3.25Å; E328-L331 HydrophobicContact CB-CB 4.09Å; E328-L331 HydrophobicContact CB-CD1 4.13Å; E328-L331 HydrophobicContact CB-CG 4.45Å; E328-L331 HydrophobicContact CG-CD1 4.34Å; E328-L331 PolarHBondContact O-N 3.47Å; E328-Q332 VanDerWaalsContact O-CG 3.24Å; E328-Q332 WeakPolarHBondContact O-CG 3.49Å; E328-Q332 PolarHBondContact O-N 2.97Å
329V94Very high94.7Very high84 Ų8470.3 Ų70.351%0.50935%0.348SS..Hα-helixtrans-58-37.4-173.1179.80000112.8R327 H333R327-V329 PolarHBondContact O-N 2.95Å; V329-H333 WeakPolarHBondContact CG1-CE1 3.34Å; V329-H333 PolarHBondContact O-N 3.17Å; V329-H333 PolarHBondContact O-ND1 3.43Å
330V94.6Very high94.2Very high93 Ų9372.3 Ų72.356%0.56437%0.369SS*.Hα-helixtrans-69-43.6-179.6179.10000111.1E328 K334E328-V330 VanDerWaalsContact C-N 3.28Å; E328-V330 PolarHBondContact O-N 3.25Å; V330-K334 HydrophobicContact CG1-CD 4.42Å; V330-K334 WeakPolarHBondContact O-CG 3.49Å; V330-K334 PolarHBondContact O-N 2.72Å; V330-K334 VanDerWaalsContact O-N 3.16Å
331L92.9Very high93.8Very high25 Ų2574.3 Ų74.313%0.13138%0.381CS..Hα-helixtrans-69-38.1177.7-73.1173.2000111.6A293 L297 A323 E328 H333 K334 A335A293-L331 HydrophobicContact CB-CD1 4.21Å; L297-L331 HydrophobicContact CD2-CD2 4.16Å; A323-L331 HydrophobicContact CB-CB 3.88Å; E328-L331 HydrophobicContact CB-CB 4.09Å; E328-L331 HydrophobicContact CB-CD1 4.13Å; E328-L331 HydrophobicContact CB-CG 4.45Å; E328-L331 HydrophobicContact CG-CD1 4.34Å; E328-L331 PolarHBondContact O-N 3.47Å; L331-H333 PolarHBondContact O-N 3.1Å; L331-K334 PolarHBondContact O-N 3.5Å; L331-A335 WeakPolarHBondContact O-CB 3.31Å; L331-A335 PolarHBondContact O-N 3.28Å
332Q93.4Very high93.3Very high41 Ų4168.8 Ų68.819%0.19236%0.357CS..Hα-helixtrans-54.2-53.1174.7-73.2167.716.500111.4A323 E328 K334 A335 Q336A323-Q332 HydrophobicContact CB-CB 4.37Å; A323-Q332 HydrophobicContact CB-CG 3.6Å; A323-Q332 PolarHBondContact O-NE2 3.48Å; E328-Q332 VanDerWaalsContact O-CG 3.24Å; E328-Q332 WeakPolarHBondContact O-CG 3.49Å; E328-Q332 PolarHBondContact O-N 2.97Å; Q332-K334 PolarHBondContact O-N 2.99Å; Q332-A335 PolarHBondContact O-N 2.94Å; Q332-Q336 VanDerWaalsContact O-CB 3.3Å; Q332-Q336 WeakPolarHBondContact O-CB 3.32Å; Q332-Q336 PolarHBondContact O-N 3.04Å
333H93.7Very high92.6Very high108 Ų10869.2 Ų69.250%0.536%0.36SS..Hα-helixtrans-63-42.7179.7-68.7123.5000112.2V329 L331 Q336 V337V329-H333 WeakPolarHBondContact CG1-CE1 3.34Å; V329-H333 PolarHBondContact O-N 3.17Å; V329-H333 PolarHBondContact O-ND1 3.43Å; L331-H333 PolarHBondContact O-N 3.1Å; H333-Q336 PolarHBondContact O-N 2.88Å; H333-V337 WeakPolarHBondContact O-CG2 3.47Å; H333-V337 PolarHBondContact O-N 2.77Å
334K95.3Very high91.9Very high116 Ų11671.3 Ų71.350%0.50438%0.378SS..Hα-helixtrans-60-49.1177.2-75.9179.3179.2-179.20111.6L297 V330 L331 Q332 V337 K338L297-K334 HydrophobicContact CD2-CB 4.27Å; L297-K334 HydrophobicContact CD2-CD 4.49Å; V330-K334 HydrophobicContact CG1-CD 4.42Å; V330-K334 WeakPolarHBondContact O-CG 3.49Å; V330-K334 PolarHBondContact O-N 2.72Å; V330-K334 VanDerWaalsContact O-N 3.16Å; L331-K334 PolarHBondContact O-N 3.5Å; Q332-K334 PolarHBondContact O-N 2.99Å; K334-V337 PolarHBondContact O-N 3.46Å; K334-K338 WeakPolarHBondContact O-CB 3.29Å; K334-K338 WeakPolarHBondContact O-CG 3.37Å; K334-K338 PolarHBondContact O-N 2.66Å
335A93.7Very high91.2Very high0 Ų073.6 Ų73.60%038%0.384CS..Hα-helixtrans-63.3-41.6179.400000111.6L297 L331 Q332 K338 L339L297-A335 HydrophobicContact CD1-CB 4.28Å; L331-A335 WeakPolarHBondContact O-CB 3.31Å; L331-A335 PolarHBondContact O-N 3.28Å; Q332-A335 PolarHBondContact O-N 2.94Å; A335-K338 PolarHBondContact O-N 3.42Å; A335-L339 VanDerWaalsContact O-CB 3.24Å; A335-L339 WeakPolarHBondContact O-CB 3.33Å; A335-L339 PolarHBondContact O-N 3.21Å
336Q93.3Very high90.2Very high107 Ų10770.5 Ų70.550%0.537%0.366SS..Hα-helixtrans-61.7-45.9177.6-173.9-177.213.200112.4Y320 Q332 H333 G340Y320-Q336 HydrophobicContact CD2-CB 4.09Å; Y320-Q336 HydrophobicContact CE2-CB 4.2Å; Q332-Q336 VanDerWaalsContact O-CB 3.3Å; Q332-Q336 WeakPolarHBondContact O-CB 3.32Å; Q332-Q336 PolarHBondContact O-N 3.04Å; H333-Q336 PolarHBondContact O-N 2.88Å; Q336-G340 PolarHBondContact O-N 3.43Å
337V94.3Very high89.2Confident104 Ų10470.4 Ų70.463%0.6336%0.361SS*.Hα-helixtrans-63.3-45.9177.91700000110.7H333 K334 G340 H341H333-V337 WeakPolarHBondContact O-CG2 3.47Å; H333-V337 PolarHBondContact O-N 2.77Å; K334-V337 PolarHBondContact O-N 3.46Å; V337-G340 PolarHBondContact O-N 3.47Å; V337-H341 WeakPolarHBondContact O-CB 3.49Å; V337-H341 PolarHBondContact O-N 3.14Å
338K94.3Very high88.2Confident99 Ų9964.3 Ų64.343%0.4334%0.343SS..Hα-helixtrans-63.1-45.4179.3-73.1-70-174.6172.60111.8L297 F316 K334 A335 H341 T342L297-K338 HydrophobicContact CD1-CG 4.33Å; F316-K338 HydrophobicContact CD1-CB 3.78Å; F316-K338 HydrophobicContact CD2-CB 4Å; F316-K338 HydrophobicContact CE1-CB 3.67Å; F316-K338 HydrophobicContact CE1-CD 4.49Å; F316-K338 HydrophobicContact CE1-CG 4.08Å; F316-K338 HydrophobicContact CE2-CB 3.89Å; F316-K338 HydrophobicContact CG-CB 3.95Å; F316-K338 HydrophobicContact CZ-CB 3.73Å; F316-K338 HydrophobicContact CZ-CD 4.14Å; F316-K338 HydrophobicContact CZ-CG 4.17Å; K334-K338 WeakPolarHBondContact O-CB 3.29Å; K334-K338 WeakPolarHBondContact O-CG 3.37Å; K334-K338 PolarHBondContact O-N 2.66Å; A335-K338 PolarHBondContact O-N 3.42Å; K338-H341 PolarHBondContact O-N 2.83Å; K338-T342 PolarHBondContact O-N 3.24Å; K338-T342 PolarHBondContact O-OG1 3.31Å; K338-T342 VanDerWaalsContact O-OG1 3.05Å
339L92.1Very high87.3Confident33 Ų3365.5 Ų65.517%0.17335%0.347CS..Hα-helixtrans-58.1-49.8175.2-178.661.6000111.4C313 F316 L317 A335 H341 T342 S343C313-L339 HydrophobicContact CB-CD1 4.23Å; C313-L339 WeakPolarHBondContact O-CD1 3.3Å; F316-L339 HydrophobicContact CB-CB 3.95Å; F316-L339 HydrophobicContact CB-CD1 4.1Å; L317-L339 HydrophobicContact CB-CD1 4.29Å; L317-L339 HydrophobicContact CB-CD2 4.3Å; L317-L339 HydrophobicContact CD1-CD2 4.01Å; A335-L339 VanDerWaalsContact O-CB 3.24Å; A335-L339 WeakPolarHBondContact O-CB 3.33Å; A335-L339 PolarHBondContact O-N 3.21Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 PolarHBondContact O-N 2.78Å; L339-T342 PolarHBondContact O-N 3.32Å; L339-T342 PolarHBondContact O-OG1 2.97Å; L339-S343 WeakPolarHBondContact O-CB 3.46Å; L339-S343 PolarHBondContact O-N 3.34Å; L339-S343 PolarHBondContact O-OG 2.82Å
340G87.5Confident86.2Confident42 Ų4265 Ų6543%0.43335%0.348SS..Hα-helixtrans-59.4-41.9178.700000112.7Q336 V337 A344Q336-G340 PolarHBondContact O-N 3.43Å; V337-G340 PolarHBondContact O-N 3.47Å; G340-A344 VanDerWaalsContact O-CB 3.3Å; G340-A344 WeakPolarHBondContact O-CB 3.16Å; G340-A344 PolarHBondContact O-N 2.99Å
341H87.3Confident85.2Confident125 Ų12563.6 Ų63.658%0.57933%0.333SS*.Hα-helixtrans-63.5-48.7176.8179.7-91.2000112.2V337 K338 L339 A344 H345V337-H341 WeakPolarHBondContact O-CB 3.49Å; V337-H341 PolarHBondContact O-N 3.14Å; K338-H341 PolarHBondContact O-N 2.83Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 PolarHBondContact O-N 2.78Å; H341-A344 PolarHBondContact O-N 3.37Å; H341-H345 WeakPolarHBondContact O-CB 3.21Å; H341-H345 PolarHBondContact O-N 3.01Å
342T86.3Confident84.3Confident5 Ų565.4 Ų65.43%0.03134%0.343CS..Hα-helixtrans-70.6-37.2-179.148.60000113.1C313 F316 K338 L339 H345 S346C313-T342 PolarHBondContact SG-OG1 3.29Å; C313-T342 VanDerWaalsContact SG-OG1 3.33Å; F316-T342 HydrophobicContact CD2-CG2 4Å; F316-T342 WeakPolarHBondContact CD2-OG1 3.44Å; F316-T342 HydrophobicContact CE2-CG2 3.54Å; K338-T342 PolarHBondContact O-N 3.24Å; K338-T342 PolarHBondContact O-OG1 3.31Å; K338-T342 VanDerWaalsContact O-OG1 3.05Å; L339-T342 PolarHBondContact O-N 3.32Å; L339-T342 PolarHBondContact O-OG1 2.97Å; T342-H345 PolarHBondContact O-N 2.73Å; T342-S346 WeakPolarHBondContact O-CB 3.44Å; T342-S346 PolarHBondContact O-N 3.15Å
343S82.9Confident83.1Confident12 Ų1267 Ų678%0.08436%0.359CS..Hα-helixtrans-60.8-46.8172.9-63.50000110.7L339 H345 S346 L347L339-S343 WeakPolarHBondContact O-CB 3.46Å; L339-S343 PolarHBondContact O-N 3.34Å; L339-S343 PolarHBondContact O-OG 2.82Å; S343-H345 PolarHBondContact O-N 3.28Å; S343-S346 PolarHBondContact O-N 2.91Å; S343-L347 WeakPolarHBondContact O-CB 3.5Å; S343-L347 WeakPolarHBondContact O-CD1 3.48Å; S343-L347 VanDerWaalsContact O-CG 3.26Å; S343-L347 WeakPolarHBondContact O-CG 3.39Å; S343-L347 PolarHBondContact O-N 3.08Å
344A81.2Confident82.1Confident44 Ų4463.2 Ų63.236%0.36434%0.341SS..Hα-helixtrans-61.7-43.9176.500000112.2G340 H341 L347 I348G340-A344 VanDerWaalsContact O-CB 3.3Å; G340-A344 WeakPolarHBondContact O-CB 3.16Å; G340-A344 PolarHBondContact O-N 2.99Å; H341-A344 PolarHBondContact O-N 3.37Å; A344-L347 PolarHBondContact O-N 2.86Å; A344-I348 VanDerWaalsContact O-CG1 3.25Å; A344-I348 WeakPolarHBondContact O-CG1 3.42Å; A344-I348 PolarHBondContact O-N 2.79Å
345H79.4Confident80.9Confident97 Ų9763.8 Ų63.845%0.44935%0.347SS..Hα-helixtrans-63.6-43.6178.1-173.378.8000112.4H341 T342 S343 L347 I348 K349H341-H345 WeakPolarHBondContact O-CB 3.21Å; H341-H345 PolarHBondContact O-N 3.01Å; T342-H345 PolarHBondContact O-N 2.73Å; S343-H345 PolarHBondContact O-N 3.28Å; H345-L347 VanDerWaalsContact C-N 3.35Å; H345-I348 PolarHBondContact O-N 2.67Å; H345-K349 WeakPolarHBondContact O-CB 3.14Å; H345-K349 PolarHBondContact O-N 2.66Å
346S75.4Confident80Confident31 Ų3171 Ų7122%0.21738%0.381CS..Hα-helixtrans-61.5-44.1176.9-167.40000111.5T342 S343 K349 S350T342-S346 WeakPolarHBondContact O-CB 3.44Å; T342-S346 PolarHBondContact O-N 3.15Å; S343-S346 PolarHBondContact O-N 2.91Å; S346-K349 PolarHBondContact O-N 3.47Å; S346-S350 PolarHBondContact O-N 2.93Å
347L73.7Confident78.9Confident29 Ų2969.6 Ų69.615%0.15238%0.379CS..Hα-helixtrans-63.8-46.8176.3-75.1165.9000112S343 A344 H345 K349 S350 Y351 D377 F378S343-L347 WeakPolarHBondContact O-CB 3.5Å; S343-L347 WeakPolarHBondContact O-CD1 3.48Å; S343-L347 VanDerWaalsContact O-CG 3.26Å; S343-L347 WeakPolarHBondContact O-CG 3.39Å; S343-L347 PolarHBondContact O-N 3.08Å; A344-L347 PolarHBondContact O-N 2.86Å; H345-L347 VanDerWaalsContact C-N 3.35Å; L347-K349 VanDerWaalsContact C-N 3.27Å; L347-K349 PolarHBondContact O-N 3.36Å; L347-S350 PolarHBondContact O-N 3.42Å; L347-S350 PolarHBondContact O-OG 2.85Å; L347-Y351 VanDerWaalsContact O-CD2 3.31Å; L347-Y351 WeakPolarHBondContact O-CD2 3.24Å; L347-D377 HydrophobicContact CD2-CB 4.2Å; L347-F378 HydrophobicContact CD1-CD1 4.12Å; L347-F378 HydrophobicContact CD1-CE1 3.91Å; L347-F378 HydrophobicContact CD1-CZ 4.49Å
348I75Confident77.6Confident86 Ų8670.9 Ų70.944%0.44139%0.39SS..Hα-helixtrans-61.7-40.8179.2-69.6164.6000110.4A344 H345 S350 Y351 N352A344-I348 VanDerWaalsContact O-CG1 3.25Å; A344-I348 WeakPolarHBondContact O-CG1 3.42Å; A344-I348 PolarHBondContact O-N 2.79Å; H345-I348 PolarHBondContact O-N 2.67Å; I348-S350 VanDerWaalsContact C-N 3.3Å; I348-S350 PolarHBondContact O-N 3.49Å; I348-Y351 CarbonylContact O-C 3.57Å; I348-Y351 PolarHBondContact O-N 2.88Å; I348-N352 WeakPolarHBondContact CG2-OD1 3.38Å; I348-N352 PolarHBondContact O-N 3.23Å; I348-N352 PolarHBondContact O-OD1 3.39Å
349K73.1Confident77.1Confident94 Ų9468.5 Ų68.541%0.40939%0.385SS..Hα-helixtrans-60.2-36.1179.8-168.7176.7-177.2178.40113.1N307 H345 S346 L347 Y351 N352N307-K349 PolarHBondContact OD1-NZ 3.45Å; H345-K349 WeakPolarHBondContact O-CB 3.14Å; H345-K349 PolarHBondContact O-N 2.66Å; S346-K349 PolarHBondContact O-N 3.47Å; L347-K349 VanDerWaalsContact C-N 3.27Å; L347-K349 PolarHBondContact O-N 3.36Å; K349-Y351 PolarHBondContact O-N 3.31Å; K349-N352 PolarHBondContact O-N 3.46Å
350S71.8Confident76.5Confident75 Ų7573.5 Ų73.552%0.52441%0.412SS..Hα-helixtrans-68.9-19.7177.657.90000113.7S346 L347 I348S346-S350 PolarHBondContact O-N 2.93Å; L347-S350 PolarHBondContact O-N 3.42Å; L347-S350 PolarHBondContact O-OG 2.85Å; I348-S350 VanDerWaalsContact C-N 3.3Å; I348-S350 PolarHBondContact O-N 3.49Å
351Y72.9Confident76.2Confident62 Ų6275.8 Ų75.824%0.24342%0.418CS..Hα-helixtrans-109-0.8179.7-68.5-83.4000113.8L347 I348 K349 S353 E354 M355 L366 W369L347-Y351 VanDerWaalsContact O-CD2 3.31Å; L347-Y351 WeakPolarHBondContact O-CD2 3.24Å; I348-Y351 CarbonylContact O-C 3.57Å; I348-Y351 PolarHBondContact O-N 2.88Å; K349-Y351 PolarHBondContact O-N 3.31Å; Y351-S353 VanDerWaalsContact C-N 3.34Å; Y351-S353 PolarHBondContact O-N 3.23Å; Y351-E354 VanDerWaalsContact CD1-OE2 3.31Å; Y351-E354 WeakPolarHBondContact CD1-OE2 3.43Å; Y351-E354 WeakPolarHBondContact O-CB 3.42Å; Y351-E354 PolarHBondContact O-N 3.37Å; Y351-M355 WeakPolarHBondContact O-CG 3.43Å; Y351-M355 PolarHBondContact O-N 3.48Å; Y351-L366 HydrophobicContact CD1-CD2 4.08Å; Y351-L366 HydrophobicContact CG-CD2 4.3Å; Y351-W369 HydrophobicContact CD1-CG 4.45Å; Y351-W369 HydrophobicContact CD2-CD2 4.29Å; Y351-W369 HydrophobicContact CD2-CG 4.31Å; Y351-W369 AromaticContact CD2-NE1 3.99Å; Y351-W369 HydrophobicContact CE1-CB 3.85Å; Y351-W369 AromaticContact CE1-CG 3.89Å; Y351-W369 HydrophobicContact CE1-CG 3.89Å; Y351-W369 AromaticContact CE2-CD1 3.3Å; Y351-W369 HydrophobicContact CE2-CD2 4.15Å; Y351-W369 AromaticContact CE2-CE2 3.92Å; Y351-W369 AromaticContact CE2-CG 3.77Å; Y351-W369 HydrophobicContact CE2-CG 3.77Å; Y351-W369 AromaticContact CE2-NE1 3.36Å; Y351-W369 AromaticContact CZ-CD1 3.23Å; Y351-W369 AromaticContact CZ-CG 3.53Å; Y351-W369 AromaticContact CZ-NE1 3.83Å
352N73.4Confident75.9Confident64 Ų6470.4 Ų70.434%0.34239%0.394SS..Hα-helixtrans-55.7-43.1-178.7-88.8-7000113.3I348 K349 E354 M355 E356I348-N352 WeakPolarHBondContact CG2-OD1 3.38Å; I348-N352 PolarHBondContact O-N 3.23Å; I348-N352 PolarHBondContact O-OD1 3.39Å; K349-N352 PolarHBondContact O-N 3.46Å; N352-E354 PolarHBondContact O-N 3.08Å; N352-M355 PolarHBondContact O-N 2.92Å; N352-M355 VanDerWaalsContact O-N 3.1Å; N352-E356 WeakPolarHBondContact O-CG 3.17Å; N352-E356 PolarHBondContact O-N 3.19Å
353S68.6Low75.5Confident75 Ų7574.1 Ų74.152%0.52442%0.416SS..Hα-helixtrans-64.9-30.1178.957.40000112.8Y351 T357Y351-S353 VanDerWaalsContact C-N 3.34Å; Y351-S353 PolarHBondContact O-N 3.23Å; S353-T357 PolarHBondContact O-N 3.46Å; S353-T357 PolarHBondContact O-OG1 2.9Å
354E73.4Confident75.5Confident27 Ų2779.9 Ų79.913%0.12644%0.44CS..Hα-helixtrans-77.9-27.2175.6-54.8-168.4155.400111.5Y351 N352 S362 R365 L366Y351-E354 VanDerWaalsContact CD1-OE2 3.31Å; Y351-E354 WeakPolarHBondContact CD1-OE2 3.43Å; Y351-E354 WeakPolarHBondContact O-CB 3.42Å; Y351-E354 PolarHBondContact O-N 3.37Å; N352-E354 PolarHBondContact O-N 3.08Å; E354-S362 VanDerWaalsContact O-CB 3.29Å; E354-S362 WeakPolarHBondContact O-CB 3.3Å; E354-R365 WeakPolarHBondContact OE1-CD 3.27Å; E354-R365 IonicContact OE1-CZ 2.93Å; E354-R365 IonicContact OE1-NE 2.84Å; E354-R365 IonicContact OE1-NH1 3.89Å; E354-R365 PolarHBondContact OE1-NH1 3.18Å; E354-R365 VanDerWaalsContact OE2-CB 3.29Å; E354-R365 WeakPolarHBondContact OE2-CB 3.29Å; E354-L366 HydrophobicContact CB-CD2 4.42Å; E354-L366 HydrophobicContact CB-CG 4.32Å
355M68.8Low75.4Confident128 Ų12884.6 Ų84.663%0.63145%0.448SS*.Hα-helixtrans-75.5-32172.1-63-165.786.600113Y351 N352 L366Y351-M355 WeakPolarHBondContact O-CG 3.43Å; Y351-M355 PolarHBondContact O-N 3.48Å; N352-M355 PolarHBondContact O-N 2.92Å; N352-M355 VanDerWaalsContact O-N 3.1Å; M355-L366 HydrophobicContact CG-CD1 4.08Å; M355-L366 HydrophobicContact CG-CD2 4.03Å
356E74.7Confident75.3Confident153 Ų15381.8 Ų81.872%0.71544%0.436SS*.Hα-helixtrans-80.8-19.5-179.1-72.2175.3-179.900113.6N352 P358N352-E356 WeakPolarHBondContact O-CG 3.17Å; N352-E356 PolarHBondContact O-N 3.19Å; E356-P358 WeakPolarHBondContact O-CD 3.4Å
357T71.8Confident75.6Confident76 Ų7683.4 Ų83.447%0.46645%0.445SS..SBendtrans-110100-177.853.40000111.4S353 S359 S362S353-T357 PolarHBondContact O-N 3.46Å; S353-T357 PolarHBondContact O-OG1 2.9Å; T357-S359 PolarHBondContact O-N 3.16Å; T357-S362 VanDerWaalsContact O-CB 3.3Å; T357-S362 WeakPolarHBondContact O-CB 3.33Å; T357-S362 PolarHBondContact O-OG 2.83Å; T357-S362 PolarHBondContact OG1-OG 3.26Å
358P66.3Low75.9Confident132 Ų13286.2 Ų86.286%0.85746%0.46SS*.  trans-72.789.9-179.728-32.6000110.5E356E356-P358 WeakPolarHBondContact O-CD 3.4Å
359S82.5Confident75.9Confident48 Ų4884.4 Ų84.434%0.33645%0.448SS..  trans-128.3151.417287.40000110.8T357 T361 S362 V363T357-S359 PolarHBondContact O-N 3.16Å; S359-T361 PolarHBondContact O-N 3.24Å; S359-T361 PolarHBondContact OG-N 3.33Å; S359-S362 PolarHBondContact O-N 2.94Å; S359-S362 VanDerWaalsContact O-N 3.1Å; S359-S362 PolarHBondContact OG-N 2.67Å; S359-S362 PolarHBondContact OG-OG 2.87Å; S359-V363 WeakPolarHBondContact O-CG2 3.36Å; S359-V363 PolarHBondContact O-N 3.07Å
360L80.6Confident75.9Confident139 Ų13986.9 Ų86.973%0.72846%0.458SS*.Hα-helixtrans-57-32.5176.4-168.874.9000111.7K364L360-K364 PolarHBondContact O-N 3.08Å
361T81.5Confident76.1Confident90 Ų9090.5 Ų90.555%0.55247%0.467SS*.Hα-helixtrans-70.5-43177.5-40.30000111.5S359 K364 R365S359-T361 PolarHBondContact O-N 3.24Å; S359-T361 PolarHBondContact OG-N 3.33Å; T361-K364 PolarHBondContact O-N 3.11Å; T361-R365 PolarHBondContact O-N 2.68Å
362S79.6Confident76Confident12 Ų1292.4 Ų92.48%0.08449%0.485CS..Hα-helixtrans-63.9-42.7176-47.50000111.1E354 T357 S359 R365 L366E354-S362 VanDerWaalsContact O-CB 3.29Å; E354-S362 WeakPolarHBondContact O-CB 3.3Å; T357-S362 VanDerWaalsContact O-CB 3.3Å; T357-S362 WeakPolarHBondContact O-CB 3.33Å; T357-S362 PolarHBondContact O-OG 2.83Å; T357-S362 PolarHBondContact OG1-OG 3.26Å; S359-S362 PolarHBondContact O-N 2.94Å; S359-S362 VanDerWaalsContact O-N 3.1Å; S359-S362 PolarHBondContact OG-N 2.67Å; S359-S362 PolarHBondContact OG-OG 2.87Å; S362-R365 PolarHBondContact O-N 2.8Å; S362-L366 WeakPolarHBondContact O-CG 2.83Å; S362-L366 PolarHBondContact O-N 2.97Å
363V79.3Confident75.6Confident82 Ų8296.5 Ų96.550%0.49750%0.496SS..Hα-helixtrans-63-43.5176.3174.70000111.5S359 L366 V367S359-V363 WeakPolarHBondContact O-CG2 3.36Å; S359-V363 PolarHBondContact O-N 3.07Å; V363-L366 PolarHBondContact O-N 3.35Å; V363-V367 HydrophobicContact CG1-CG2 4.41Å; V363-V367 VanDerWaalsContact O-CG2 3.28Å; V363-V367 WeakPolarHBondContact O-CG2 3.38Å; V363-V367 PolarHBondContact O-N 2.85Å
364K82.8Confident75.2Confident133 Ų13394.3 Ų94.358%0.57849%0.486SS*.Hα-helixtrans-59.9-47.5175.9-85.5-175.3174.1-1760112L360 T361 L366 V367 D368L360-K364 PolarHBondContact O-N 3.08Å; T361-K364 PolarHBondContact O-N 3.11Å; K364-L366 VanDerWaalsContact C-N 3.35Å; K364-L366 PolarHBondContact O-N 3.16Å; K364-V367 PolarHBondContact O-N 3.45Å; K364-D368 WeakPolarHBondContact O-CB 3.34Å; K364-D368 PolarHBondContact O-N 3.36Å
365R78.4Confident73.9Confident143 Ų143101 Ų10154%0.5452%0.517SS..Hα-helixtrans-62.1-39.7178.6-74.4-175177.9173.6-1.5113.2E354 T361 S362 W369E354-R365 WeakPolarHBondContact OE1-CD 3.27Å; E354-R365 IonicContact OE1-CZ 2.93Å; E354-R365 IonicContact OE1-NE 2.84Å; E354-R365 IonicContact OE1-NH1 3.89Å; E354-R365 PolarHBondContact OE1-NH1 3.18Å; E354-R365 VanDerWaalsContact OE2-CB 3.29Å; E354-R365 WeakPolarHBondContact OE2-CB 3.29Å; T361-R365 PolarHBondContact O-N 2.68Å; S362-R365 PolarHBondContact O-N 2.8Å; R365-W369 VanDerWaalsContact O-CB 3.25Å; R365-W369 WeakPolarHBondContact O-CB 3.47Å; R365-W369 PolarHBondContact O-N 2.97Å
366L78.2Confident72.8Confident38 Ų38103.8 Ų103.820%0.19953%0.528CS..Hα-helixtrans-66.3-36.8175.2-71.6170.1000112.4Y351 E354 M355 S362 V363 K364 K370Y351-L366 HydrophobicContact CD1-CD2 4.08Å; Y351-L366 HydrophobicContact CG-CD2 4.3Å; E354-L366 HydrophobicContact CB-CD2 4.42Å; E354-L366 HydrophobicContact CB-CG 4.32Å; M355-L366 HydrophobicContact CG-CD1 4.08Å; M355-L366 HydrophobicContact CG-CD2 4.03Å; S362-L366 WeakPolarHBondContact O-CG 2.83Å; S362-L366 PolarHBondContact O-N 2.97Å; V363-L366 PolarHBondContact O-N 3.35Å; K364-L366 VanDerWaalsContact C-N 3.35Å; K364-L366 PolarHBondContact O-N 3.16Å; L366-K370 WeakPolarHBondContact O-CB 3.17Å; L366-K370 PolarHBondContact O-N 3.44Å
367V80.7Confident71.6Confident66 Ų66100.3 Ų100.340%0.451%0.514SS..Hα-helixtrans-69.6-48.4175.4170.90000110.7V363 K364 W369 K370 E371V363-V367 HydrophobicContact CG1-CG2 4.41Å; V363-V367 VanDerWaalsContact O-CG2 3.28Å; V363-V367 WeakPolarHBondContact O-CG2 3.38Å; V363-V367 PolarHBondContact O-N 2.85Å; K364-V367 PolarHBondContact O-N 3.45Å; V367-W369 VanDerWaalsContact C-N 3.29Å; V367-W369 PolarHBondContact O-N 3.34Å; V367-K370 PolarHBondContact O-N 3.03Å; V367-K370 VanDerWaalsContact O-N 3.08Å; V367-E371 HydrophobicContact CG1-CG 4.49Å; V367-E371 WeakPolarHBondContact O-CG 3.31Å; V367-E371 PolarHBondContact O-N 3.43Å
368D79.8Confident70.5Confident88 Ų88101.3 Ų101.347%0.47151%0.512SS..Hα-helixtrans-58.1-43.7177-67.2-18.4000110.5K364 E371 T372K364-D368 WeakPolarHBondContact O-CB 3.34Å; K364-D368 PolarHBondContact O-N 3.36Å; D368-E371 PolarHBondContact O-N 3.25Å; D368-T372 WeakPolarHBondContact O-CB 3.36Å; D368-T372 WeakPolarHBondContact O-CG2 3.14Å; D368-T372 PolarHBondContact O-N 2.9Å; D368-T372 PolarHBondContact O-OG1 3.28Å
369W74.7Confident69.2Low48 Ų48102.6 Ų102.618%0.18252%0.523CS..Hα-helixtrans-60-46.9173.6169.472.1000112.3Y351 R365 V367 E371 T372 R373Y351-W369 HydrophobicContact CD1-CG 4.45Å; Y351-W369 HydrophobicContact CD2-CD2 4.29Å; Y351-W369 HydrophobicContact CD2-CG 4.31Å; Y351-W369 AromaticContact CD2-NE1 3.99Å; Y351-W369 HydrophobicContact CE1-CB 3.85Å; Y351-W369 AromaticContact CE1-CG 3.89Å; Y351-W369 HydrophobicContact CE1-CG 3.89Å; Y351-W369 AromaticContact CE2-CD1 3.3Å; Y351-W369 HydrophobicContact CE2-CD2 4.15Å; Y351-W369 AromaticContact CE2-CE2 3.92Å; Y351-W369 AromaticContact CE2-CG 3.77Å; Y351-W369 HydrophobicContact CE2-CG 3.77Å; Y351-W369 AromaticContact CE2-NE1 3.36Å; Y351-W369 AromaticContact CZ-CD1 3.23Å; Y351-W369 AromaticContact CZ-CG 3.53Å; Y351-W369 AromaticContact CZ-NE1 3.83Å; R365-W369 VanDerWaalsContact O-CB 3.25Å; R365-W369 WeakPolarHBondContact O-CB 3.47Å; R365-W369 PolarHBondContact O-N 2.97Å; V367-W369 VanDerWaalsContact C-N 3.29Å; V367-W369 PolarHBondContact O-N 3.34Å; W369-E371 VanDerWaalsContact C-N 3.25Å; W369-E371 PolarHBondContact O-N 3.3Å; W369-T372 PolarHBondContact O-N 3.22Å; W369-R373 WeakPolarHBondContact O-CB 3.48Å; W369-R373 PolarHBondContact O-N 2.88Å
370K73.5Confident68.5Low145 Ų145105.4 Ų105.463%0.6353%0.532SS*.Hα-helixtrans-62.6-34.6179.4-174.5-176.7176.2-173.20112.1L366 V367L366-K370 WeakPolarHBondContact O-CB 3.17Å; L366-K370 PolarHBondContact O-N 3.44Å; V367-K370 PolarHBondContact O-N 3.03Å; V367-K370 VanDerWaalsContact O-N 3.08Å
371E76.8Confident67.9Low152 Ų152103.6 Ų103.671%0.7152%0.522SS*.Hα-helixtrans-78.4-29.3178.8-72-176175.100113V367 D368 W369V367-E371 HydrophobicContact CG1-CG 4.49Å; V367-E371 WeakPolarHBondContact O-CG 3.31Å; V367-E371 PolarHBondContact O-N 3.43Å; D368-E371 PolarHBondContact O-N 3.25Å; W369-E371 VanDerWaalsContact C-N 3.25Å; W369-E371 PolarHBondContact O-N 3.3Å
372T70.6Confident67.1Low101 Ų101104.3 Ų104.362%0.6252%0.52SS*.Hα-helixtrans-100.9-14.1-175.555.60000114.8D368 W369 G374D368-T372 WeakPolarHBondContact O-CB 3.36Å; D368-T372 WeakPolarHBondContact O-CG2 3.14Å; D368-T372 PolarHBondContact O-N 2.9Å; D368-T372 PolarHBondContact O-OG1 3.28Å; W369-T372 PolarHBondContact O-N 3.22Å; T372-G374 PolarHBondContact O-N 2.83Å
373R64.1Low66.4Low150 Ų150109.8 Ų109.857%0.56655%0.546SS*.  trans-53.6113.7-177.169.4-176.1-170.6165.85.9111.4W369W369-R373 WeakPolarHBondContact O-CB 3.48Å; W369-R373 PolarHBondContact O-N 2.88Å
374G60.4Low65.6Low30 Ų30111.5 Ų111.531%0.30955%0.549SS..  trans-141.2173.9-175.500000111.1T372 Q376 D377 F378T372-G374 PolarHBondContact O-N 2.83Å; G374-Q376 PolarHBondContact O-N 3.29Å; G374-D377 PolarHBondContact N-OD2 3.4Å; G374-D377 PolarHBondContact O-N 3.19Å; G374-F378 WeakPolarHBondContact O-CD2 3.43Å; G374-F378 VanDerWaalsContact O-CE2 3.26Å; G374-F378 WeakPolarHBondContact O-CE2 3.39Å
375H46Very low64.4Low168 Ų168110.1 Ų110.178%0.77855%0.547SS*.G310 helixtrans-52.6-21.4-171.4-125.6-49.9000115.2F378H375-F378 PolarHBondContact O-N 3.06Å
376Q46.5Very low63.4Low186 Ų186107.7 Ų107.787%0.86955%0.547SS*.G310 helixtrans-75.6-20.9179.6-69.7-178.9-17.300114.2G374 F378G374-Q376 PolarHBondContact O-N 3.29Å; Q376-F378 VanDerWaalsContact C-N 3.26Å; Q376-F378 PolarHBondContact O-N 3.2Å
377D48.9Very low62.3Low80 Ų80113.1 Ų113.143%0.42857%0.574SS.*G310 helixtrans-83.9-1.8175.1-57.9-46.5000112.6L347 G374L347-D377 HydrophobicContact CD2-CB 4.2Å; G374-D377 PolarHBondContact N-OD2 3.4Å; G374-D377 PolarHBondContact O-N 3.19Å
378F48.8Very low60.8Low97 Ų97117 Ų11743%0.42559%0.589SS.*G310 helixtrans-103.24.7-175.8-62.7-90.7000114L347 G374 H375 Q376L347-F378 HydrophobicContact CD1-CD1 4.12Å; L347-F378 HydrophobicContact CD1-CE1 3.91Å; L347-F378 HydrophobicContact CD1-CZ 4.49Å; G374-F378 WeakPolarHBondContact O-CD2 3.43Å; G374-F378 VanDerWaalsContact O-CE2 3.26Å; G374-F378 WeakPolarHBondContact O-CE2 3.39Å; H375-F378 PolarHBondContact O-N 3.06Å; Q376-F378 VanDerWaalsContact C-N 3.26Å; Q376-F378 PolarHBondContact O-N 3.2Å
379C39.1Very low59Low159 Ų159119.6 Ų119.6100%1.07460%0.599SS**  trans-115.70-179-73.90000112.5

Retrieved 379 of 379 residues in 488.5 ms (Link to these results)

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