A0A087XET1_POEFO Loading...

Aquaporin-3

Aquaglyceroporins form homotetrameric transmembrane channels, with each monomer independently mediating glycerol and water transport across the plasma membrane along their osmotic gradient. Could also be permeable to urea. Also participates in cell permeability to H2O2 and H2O2-mediated signaling. In skin, transports glycerol to the epidermis and stratum corneum, where it maintains hydration, elasticity, and supports lipid biosynthesis for barrier repair. In kidney, contributes to the reabsorption of water, helping the body maintain proper fluid balance.

AlphaFold DB , UniProt , Accession A0A087XET1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 304 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
1M58.8Low82.5Confident217 Ų217128.5 Ų128.5100%1.06961%0.612SS**  0-30.70-82.2179.917100115.3K5M1-K5 PolarHBondContact O-N 2.99Å
2G75.4Confident82.7Confident59 Ų59122.3 Ų122.361%0.60860%0.598SS**Hα-helixtrans-69-39.7-174.800000117.4K5 F6G2-K5 PolarHBondContact O-N 2.69Å; G2-F6 PolarHBondContact O-N 2.71Å; G2-F6 VanDerWaalsContact O-N 3.11Å
3R79.4Confident82.9Confident207 Ų207125.9 Ų125.978%0.78160%0.601SS**Hα-helixtrans-65.8-39.7179.8-84.5-178.2170.4176.6-2.6113F6 Y7R3-F6 PolarHBondContact O-N 3.26Å; R3-Y7 HydrophobicContact CB-CE2 4.39Å; R3-Y7 WeakPolarHBondContact O-CD2 3.39Å; R3-Y7 PolarHBondContact O-N 2.94Å
4Q84Confident83.1Confident133 Ų133128.9 Ų128.962%0.62161%0.611SS**Hα-helixtrans-62.3-47.6177.1-175.6-177.71.600111.3F6 Y7 L8Q4-F6 VanDerWaalsContact C-N 3.31Å; Q4-F6 PolarHBondContact O-N 3.23Å; Q4-Y7 PolarHBondContact O-N 2.93Å; Q4-L8 HydrophobicContact CG-CD1 3.98Å; Q4-L8 HydrophobicContact CG-CG 4.43Å; Q4-L8 WeakPolarHBondContact O-CB 3.49Å; Q4-L8 VanDerWaalsContact O-CG 3.31Å; Q4-L8 WeakPolarHBondContact O-CG 3.29Å; Q4-L8 PolarHBondContact O-N 3.44Å
5K84.4Confident83.3Confident141 Ų141130 Ų13061%0.61361%0.613SS**Hα-helixtrans-60-41.4177.3-163.2177.3-1781800111.7M1 G2 L8 D9M1-K5 PolarHBondContact O-N 2.99Å; G2-K5 PolarHBondContact O-N 2.69Å; K5-L8 PolarHBondContact O-N 3.47Å; K5-D9 WeakPolarHBondContact O-CB 3.26Å; K5-D9 VanDerWaalsContact O-CG 3.25Å; K5-D9 PolarHBondContact O-N 2.91Å
6F87.6Confident83.6Confident119 Ų119129.3 Ų129.352%0.52261%0.609SS.*Hα-helixtrans-60.6-46.3175.5178-96.4000113.2G2 R3 Q4 D9 K10G2-F6 PolarHBondContact O-N 2.71Å; G2-F6 VanDerWaalsContact O-N 3.11Å; R3-F6 PolarHBondContact O-N 3.26Å; Q4-F6 VanDerWaalsContact C-N 3.31Å; Q4-F6 PolarHBondContact O-N 3.23Å; F6-D9 PolarHBondContact O-N 3.48Å; F6-K10 WeakPolarHBondContact O-CB 3.32Å; F6-K10 PolarHBondContact O-N 3Å
7Y87.1Confident84Confident142 Ų142125 Ų12556%0.55759%0.59SS**Hα-helixtrans-66.9-41177.1-72.1-63.7000112R3 Q4 K10 L11R3-Y7 HydrophobicContact CB-CE2 4.39Å; R3-Y7 WeakPolarHBondContact O-CD2 3.39Å; R3-Y7 PolarHBondContact O-N 2.94Å; Q4-Y7 PolarHBondContact O-N 2.93Å; Y7-K10 PolarHBondContact O-N 3.33Å; Y7-L11 WeakPolarHBondContact O-CB 3.33Å; Y7-L11 VanDerWaalsContact O-CG 3.29Å; Y7-L11 WeakPolarHBondContact O-CG 3.35Å; Y7-L11 PolarHBondContact O-N 3.46Å
8L88.1Confident84.3Confident97 Ų97131.3 Ų131.351%0.50861%0.607SS.*Hα-helixtrans-62.2-42.8175.1-71.5174.6000111.8Q4 K5 K10 L11 A12Q4-L8 HydrophobicContact CG-CD1 3.98Å; Q4-L8 HydrophobicContact CG-CG 4.43Å; Q4-L8 WeakPolarHBondContact O-CB 3.49Å; Q4-L8 VanDerWaalsContact O-CG 3.31Å; Q4-L8 WeakPolarHBondContact O-CG 3.29Å; Q4-L8 PolarHBondContact O-N 3.44Å; K5-L8 PolarHBondContact O-N 3.47Å; L8-K10 VanDerWaalsContact C-N 3.31Å; L8-K10 PolarHBondContact O-N 2.92Å; L8-L11 PolarHBondContact O-N 2.98Å; L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.26Å
9D88.1Confident84.7Confident74 Ų74129.4 Ų129.440%0.39660%0.602SS.*Hα-helixtrans-67.6-32.5177.2-74.2-15.1000112.3K5 F6 R13K5-D9 WeakPolarHBondContact O-CB 3.26Å; K5-D9 VanDerWaalsContact O-CG 3.25Å; K5-D9 PolarHBondContact O-N 2.91Å; F6-D9 PolarHBondContact O-N 3.48Å; D9-R13 WeakPolarHBondContact O-CB 3.45Å; D9-R13 WeakPolarHBondContact O-CG 3.4Å; D9-R13 PolarHBondContact O-N 3.47Å; D9-R13 VanDerWaalsContact O-N 3.09Å; D9-R13 PolarHBondContact O-NE 3.39Å
10K87.7Confident85.1Confident134 Ų134127.5 Ų127.558%0.58360%0.596SS**Hα-helixtrans-70.7-45.3174.9-168.2176.5-177.8-178.80110.9F6 Y7 L8 R13 F14F6-K10 WeakPolarHBondContact O-CB 3.32Å; F6-K10 PolarHBondContact O-N 3Å; Y7-K10 PolarHBondContact O-N 3.33Å; L8-K10 VanDerWaalsContact C-N 3.31Å; L8-K10 PolarHBondContact O-N 2.92Å; K10-R13 PolarHBondContact O-N 3.47Å; K10-F14 WeakPolarHBondContact O-CB 3.37Å; K10-F14 PolarHBondContact O-N 3.36Å
11L86.8Confident85.5Confident90 Ų90122.9 Ų122.947%0.47158%0.575SS.*Hα-helixtrans-63.8-44.2175.2-71.1168.3000111.2Y7 L8 R13 F14 F15Y7-L11 WeakPolarHBondContact O-CB 3.33Å; Y7-L11 VanDerWaalsContact O-CG 3.29Å; Y7-L11 WeakPolarHBondContact O-CG 3.35Å; Y7-L11 PolarHBondContact O-N 3.46Å; L8-L11 PolarHBondContact O-N 2.98Å; L11-R13 PolarHBondContact O-N 2.92Å; L11-F14 WeakPolarHBondContact O-CB 3.43Å; L11-F14 PolarHBondContact O-N 2.95Å; L11-F14 VanDerWaalsContact O-N 3.09Å; L11-F15 HydrophobicContact CB-CD2 4.38Å; L11-F15 HydrophobicContact CD2-CD2 4.44Å; L11-F15 HydrophobicContact CD2-CE2 3.91Å; L11-F15 VanDerWaalsContact O-CD2 3.29Å; L11-F15 WeakPolarHBondContact O-CD2 3.43Å; L11-F15 PolarHBondContact O-N 3.31Å
12A85.5Confident87.3Confident54 Ų54115.5 Ų115.545%0.44654%0.54SS..Hα-helixtrans-58.1-49.4177.200000110.5L8 F14 F15 Q16L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.26Å; A12-F14 PolarHBondContact O-N 2.9Å; A12-F15 PolarHBondContact O-N 3.09Å; A12-Q16 WeakPolarHBondContact O-CA 3.44Å; A12-Q16 WeakPolarHBondContact O-CB 3.32Å; A12-Q16 PolarHBondContact O-N 3.05Å
13R84.6Confident88.2Confident170 Ų170117.5 Ų117.564%0.64253%0.529SS*.Hα-helixtrans-62.9-30176.6-77.2-176.7-78.6-169.3-5.2113.6D9 K10 L11D9-R13 WeakPolarHBondContact O-CB 3.45Å; D9-R13 WeakPolarHBondContact O-CG 3.4Å; D9-R13 PolarHBondContact O-N 3.47Å; D9-R13 VanDerWaalsContact O-N 3.09Å; D9-R13 PolarHBondContact O-NE 3.39Å; K10-R13 PolarHBondContact O-N 3.47Å; L11-R13 PolarHBondContact O-N 2.92Å
14F85.9Confident89.1Confident168 Ų168108.5 Ų108.574%0.73750%0.496SS*.Hα-helixtrans-75.1-43.8177.6-173.7-97.6000112.3K10 L11 A12K10-F14 WeakPolarHBondContact O-CB 3.37Å; K10-F14 PolarHBondContact O-N 3.36Å; L11-F14 WeakPolarHBondContact O-CB 3.43Å; L11-F14 PolarHBondContact O-N 2.95Å; L11-F14 VanDerWaalsContact O-N 3.09Å; A12-F14 PolarHBondContact O-N 2.9Å
15F86.8Confident89.7Confident145 Ų145102.2 Ų102.264%0.63647%0.466SS*.Hα-helixtrans-89.9-10.8-178.4-71.6-68.8000114.2L11 A12 I17L11-F15 HydrophobicContact CB-CD2 4.38Å; L11-F15 HydrophobicContact CD2-CD2 4.44Å; L11-F15 HydrophobicContact CD2-CE2 3.91Å; L11-F15 VanDerWaalsContact O-CD2 3.29Å; L11-F15 WeakPolarHBondContact O-CD2 3.43Å; L11-F15 PolarHBondContact O-N 3.31Å; A12-F15 PolarHBondContact O-N 3.09Å; F15-I17 PolarHBondContact O-N 3.28Å
16Q87.5Confident90.3Very high119 Ų11999 Ų9956%0.55646%0.456SS*.  trans-67110.6179.8-178.517818.100110.5A12 R18A12-Q16 WeakPolarHBondContact O-CA 3.44Å; A12-Q16 WeakPolarHBondContact O-CB 3.32Å; A12-Q16 PolarHBondContact O-N 3.05Å; Q16-R18 PolarHBondContact O-N 3.19Å
17I89.8Confident90.8Very high56 Ų5693.8 Ų93.829%0.28744%0.435SS..  trans-71.2120.3174.7-63.6169.6000108.9F15 N19 L22 R23 L26F15-I17 PolarHBondContact O-N 3.28Å; I17-N19 HydrophobicContact CG2-CB 4.33Å; I17-L22 HydrophobicContact CD1-CD2 4.35Å; I17-L22 HydrophobicContact CD1-CG 4.4Å; I17-L22 HydrophobicContact CG2-CB 4.02Å; I17-L22 HydrophobicContact CG2-CD2 3.84Å; I17-L22 HydrophobicContact CG2-CG 4.01Å; I17-R23 HydrophobicContact CG2-CB 4.5Å; I17-L26 HydrophobicContact CD1-CD1 3.12Å
18R89.3Confident91.4Very high238 Ų23887 Ų8790%0.89841%0.408SS*.  trans-79.5-27.5179.7-63.1-174.4-180-172.80113Q16 L20Q16-R18 PolarHBondContact O-N 3.19Å; R18-L20 PolarHBondContact O-N 3.43Å
19N92.7Very high91.9Very high96 Ų9683.3 Ų83.351%0.51339%0.39SS..  trans-73.3112.5177.9-172.8-44.5000109.8I17 L21 L22 R23I17-N19 HydrophobicContact CG2-CB 4.33Å; N19-L21 VanDerWaalsContact C-N 3.32Å; N19-L21 PolarHBondContact O-N 3.32Å; N19-L21 WeakPolarHBondContact OD1-CB 3.43Å; N19-L21 PolarHBondContact OD1-N 3.49Å; N19-L22 HydrophobicContact CB-CB 4.1Å; N19-L22 PolarHBondContact O-N 3.01Å; N19-L22 PolarHBondContact OD1-N 3.31Å; N19-R23 PolarHBondContact O-N 3.24Å
20L93Very high92.4Very high90 Ų9083.9 Ų83.947%0.47139%0.393SS..Hα-helixtrans-57.1-44.5-178.6178.861.9000112.2R18 L22 R23 Q24R18-L20 PolarHBondContact O-N 3.43Å; L20-L22 PolarHBondContact O-N 2.96Å; L20-R23 PolarHBondContact O-N 2.95Å; L20-Q24 HydrophobicContact CD1-CG 4.24Å; L20-Q24 HydrophobicContact CG-CG 4.48Å; L20-Q24 WeakPolarHBondContact O-CB 3.47Å; L20-Q24 VanDerWaalsContact O-CG 3.26Å; L20-Q24 WeakPolarHBondContact O-CG 3.36Å; L20-Q24 PolarHBondContact O-N 3.39Å
21L94.1Very high92.9Very high32 Ų3277.5 Ų77.517%0.16837%0.365CS..Hα-helixtrans-64.3-42.2-177.4-179.558.7000111.6N19 Q24 A25 K100 M103 Y104N19-L21 VanDerWaalsContact C-N 3.32Å; N19-L21 PolarHBondContact O-N 3.32Å; N19-L21 WeakPolarHBondContact OD1-CB 3.43Å; N19-L21 PolarHBondContact OD1-N 3.49Å; L21-Q24 PolarHBondContact O-N 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.41Å; L21-A25 PolarHBondContact O-N 3.32Å; L21-K100 HydrophobicContact CD1-CB 4.11Å; L21-K100 HydrophobicContact CD1-CD 4.28Å; L21-K100 HydrophobicContact CD1-CG 3.85Å; L21-M103 HydrophobicContact CD1-CB 4.22Å; L21-M103 HydrophobicContact CD2-CB 4.42Å; L21-M103 HydrophobicContact CD2-CG 3.94Å; L21-M103 HydrophobicContact CG-CB 4.34Å; L21-M103 HydrophobicContact CG-CG 4.22Å; L21-Y104 HydrophobicContact CD1-CE2 4.24Å
22L94.9Very high93.5Very high61 Ų6173.2 Ų73.232%0.31934%0.342SS..Hα-helixtrans-66.9-40177.2-179.159.4000111.5I17 N19 L20 Q24 A25 L26 F107I17-L22 HydrophobicContact CD1-CD2 4.35Å; I17-L22 HydrophobicContact CD1-CG 4.4Å; I17-L22 HydrophobicContact CG2-CB 4.02Å; I17-L22 HydrophobicContact CG2-CD2 3.84Å; I17-L22 HydrophobicContact CG2-CG 4.01Å; N19-L22 HydrophobicContact CB-CB 4.1Å; N19-L22 PolarHBondContact O-N 3.01Å; N19-L22 PolarHBondContact OD1-N 3.31Å; L20-L22 PolarHBondContact O-N 2.96Å; L22-Q24 VanDerWaalsContact C-N 3.3Å; L22-Q24 PolarHBondContact O-N 3.47Å; L22-A25 PolarHBondContact O-N 2.97Å; L22-L26 HydrophobicContact CD1-CD1 4.31Å; L22-L26 HydrophobicContact CD1-CG 4.3Å; L22-L26 HydrophobicContact CG-CD1 4.15Å; L22-L26 WeakPolarHBondContact O-CB 3.26Å; L22-L26 WeakPolarHBondContact O-CG 3.47Å; L22-L26 PolarHBondContact O-N 2.93Å; L22-F107 HydrophobicContact CD1-CE1 4.37Å; L22-F107 HydrophobicContact CD1-CZ 3.9Å
23R95.8Very high94.1Very high102 Ų10272.1 Ų72.139%0.38533%0.329SS..Hα-helixtrans-61.4-41.5175.7-169.8179.767.7-1725111.6I17 N19 L20 A27 I77I17-R23 HydrophobicContact CG2-CB 4.5Å; N19-R23 PolarHBondContact O-N 3.24Å; L20-R23 PolarHBondContact O-N 2.95Å; R23-A27 PolarHBondContact O-N 2.92Å; R23-A27 VanDerWaalsContact O-N 3.15Å; R23-I77 HydrophobicContact CG-CG2 3.81Å
24Q96.9Very high94.8Very high18 Ų1865.1 Ų65.18%0.08430%0.304CS..Hα-helixtrans-64.5-48174.8-73.8-175.4-3300112L20 L21 L22 L26 A27 E28 I77 Y104L20-Q24 HydrophobicContact CD1-CG 4.24Å; L20-Q24 HydrophobicContact CG-CG 4.48Å; L20-Q24 WeakPolarHBondContact O-CB 3.47Å; L20-Q24 VanDerWaalsContact O-CG 3.26Å; L20-Q24 WeakPolarHBondContact O-CG 3.36Å; L20-Q24 PolarHBondContact O-N 3.39Å; L21-Q24 PolarHBondContact O-N 3.31Å; L22-Q24 VanDerWaalsContact C-N 3.3Å; L22-Q24 PolarHBondContact O-N 3.47Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 3.27Å; Q24-A27 WeakPolarHBondContact O-CB 3.03Å; Q24-A27 PolarHBondContact O-N 3.25Å; Q24-A27 VanDerWaalsContact O-N 3.14Å; Q24-E28 WeakPolarHBondContact O-CG 3.29Å; Q24-E28 PolarHBondContact O-N 2.77Å; Q24-I77 HydrophobicContact CG-CG2 4.43Å; Q24-I77 VanDerWaalsContact CG-O 3.3Å; Q24-I77 WeakPolarHBondContact CG-O 3.49Å; Q24-I77 PolarHBondContact NE2-O 3.17Å; Q24-Y104 HydrophobicContact CB-CE2 3.86Å; Q24-Y104 WeakPolarHBondContact CB-OH 3.36Å; Q24-Y104 PolarHBondContact OE1-OH 2.89Å
25A97.2Very high95.4Very high0 Ų057.8 Ų57.80%027%0.272CS..Hα-helixtrans-61.8-40179.400000112.3L21 L22 A27 E28 C29 F107L21-A25 WeakPolarHBondContact O-CB 3.41Å; L21-A25 PolarHBondContact O-N 3.32Å; L22-A25 PolarHBondContact O-N 2.97Å; A25-A27 VanDerWaalsContact C-N 3.35Å; A25-A27 PolarHBondContact O-N 3.38Å; A25-E28 WeakPolarHBondContact O-CB 3.2Å; A25-E28 PolarHBondContact O-N 2.84Å; A25-C29 PolarHBondContact O-N 3.47Å; A25-F107 HydrophobicContact CB-CB 3.99Å; A25-F107 HydrophobicContact CB-CD1 4.04Å; A25-F107 HydrophobicContact CB-CD2 3.69Å; A25-F107 HydrophobicContact CB-CE1 4.46Å; A25-F107 HydrophobicContact CB-CE2 4.13Å; A25-F107 HydrophobicContact CB-CG 3.63Å; A25-F107 HydrophobicContact CB-CZ 4.5Å; A25-F107 WeakPolarHBondContact O-CB 3.47Å; A25-F107 WeakPolarHBondContact O-CD1 3.26Å
26L97.5Very high95.9Very high74 Ų7450.9 Ų50.939%0.38724%0.242SC..Hα-helixtrans-65.8-36.8174.4-74.2167.9000112.9I17 L22 Q24 C29 L30 F107I17-L26 HydrophobicContact CD1-CD1 3.12Å; L22-L26 HydrophobicContact CD1-CD1 4.31Å; L22-L26 HydrophobicContact CD1-CG 4.3Å; L22-L26 HydrophobicContact CG-CD1 4.15Å; L22-L26 WeakPolarHBondContact O-CB 3.26Å; L22-L26 WeakPolarHBondContact O-CG 3.47Å; L22-L26 PolarHBondContact O-N 2.93Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 3.27Å; L26-C29 WeakPolarHBondContact O-CB 3.31Å; L26-C29 PolarHBondContact O-N 2.76Å; L26-L30 PolarHBondContact O-N 3.23Å; L26-F107 HydrophobicContact CD2-CD1 4.23Å; L26-F107 HydrophobicContact CD2-CE1 3.73Å; L26-F107 HydrophobicContact CG-CE1 4.13Å
27A97.9Very high96.5Very high10 Ų1047 Ų478%0.08322%0.224CC..Hα-helixtrans-65.4-44174.800000110.9R23 Q24 A25 C29 L30 G31 C74 I77R23-A27 PolarHBondContact O-N 2.92Å; R23-A27 VanDerWaalsContact O-N 3.15Å; Q24-A27 WeakPolarHBondContact O-CB 3.03Å; Q24-A27 PolarHBondContact O-N 3.25Å; Q24-A27 VanDerWaalsContact O-N 3.14Å; A25-A27 VanDerWaalsContact C-N 3.35Å; A25-A27 PolarHBondContact O-N 3.38Å; A27-C29 VanDerWaalsContact C-N 3.33Å; A27-C29 PolarHBondContact O-N 3.36Å; A27-L30 PolarHBondContact O-N 3.03Å; A27-G31 PolarHBondContact O-N 3.06Å; A27-C74 VanDerWaalsContact C-CB 3.49Å; A27-C74 HydrophobicContact CB-CB 3.79Å; A27-C74 WeakPolarHBondContact O-CB 3.29Å; A27-I77 HydrophobicContact CB-CB 3.93Å; A27-I77 HydrophobicContact CB-CD1 4.4Å; A27-I77 HydrophobicContact CB-CG2 3.88Å
28E98.4Very high96.9Very high0 Ų048.9 Ų48.90%023%0.231CC..Hα-helixtrans-58.9-42.6172.8-73.3-71.8135.900112.2Q24 A25 L30 G31 T32 S78 G80 H81 L82 Y104 Q108Q24-E28 WeakPolarHBondContact O-CG 3.29Å; Q24-E28 PolarHBondContact O-N 2.77Å; A25-E28 WeakPolarHBondContact O-CB 3.2Å; A25-E28 PolarHBondContact O-N 2.84Å; E28-L30 PolarHBondContact O-N 3.35Å; E28-G31 PolarHBondContact O-N 3.45Å; E28-T32 WeakPolarHBondContact O-CB 3.42Å; E28-T32 PolarHBondContact O-N 3.28Å; E28-T32 PolarHBondContact O-OG1 3.46Å; E28-T32 VanDerWaalsContact O-OG1 3.09Å; E28-S78 WeakPolarHBondContact OE1-CB 3.43Å; E28-S78 PolarHBondContact OE1-OG 2.76Å; E28-S78 VanDerWaalsContact OE1-OG 3.08Å; E28-G80 PolarHBondContact OE1-N 2.87Å; E28-H81 PolarHBondContact OE1-N 2.91Å; E28-L82 WeakPolarHBondContact OE2-CA 3.44Å; E28-L82 PolarHBondContact OE2-N 3.09Å; E28-Y104 HydrophobicContact CG-CD1 3.55Å; E28-Y104 HydrophobicContact CG-CE1 3.52Å; E28-Y104 HydrophobicContact CG-CG 4.14Å; E28-Q108 HydrophobicContact CB-CG 4.07Å; E28-Q108 WeakPolarHBondContact OE2-CG 3.37Å; E28-Q108 PolarHBondContact OE2-NE2 3.49Å
29C98.7Very high97.3Very high19 Ų1937.6 Ų37.613%0.12819%0.188CC..Hα-helixtrans-57.3-47.6174.5-179.40000111.8A25 L26 A27 L33 F107 G111A25-C29 PolarHBondContact O-N 3.47Å; L26-C29 WeakPolarHBondContact O-CB 3.31Å; L26-C29 PolarHBondContact O-N 2.76Å; A27-C29 VanDerWaalsContact C-N 3.33Å; A27-C29 PolarHBondContact O-N 3.36Å; C29-L33 VanDerWaalsContact O-CB 3.25Å; C29-L33 WeakPolarHBondContact O-CB 3.01Å; C29-L33 PolarHBondContact O-N 2.83Å; C29-F107 VanDerWaalsContact CA-O 3.31Å; C29-F107 WeakPolarHBondContact CA-O 3.33Å; C29-F107 HydrophobicContact CB-CB 4.12Å; C29-F107 HydrophobicContact CB-CD1 3.98Å; C29-F107 WeakPolarHBondContact CB-O 3.3Å; C29-G111 WeakPolarHBondContact O-CA 3.23Å; C29-G111 VanDerWaalsContact SG-CA 3.53Å
30L98.7Very high97.6Very high86 Ų8633 Ų3345%0.4516%0.163SC..Hα-helixtrans-66.8-42.3179.6-179.859.8000111.9L26 A27 E28 L33 I34 V73L26-L30 PolarHBondContact O-N 3.23Å; A27-L30 PolarHBondContact O-N 3.03Å; E28-L30 PolarHBondContact O-N 3.35Å; L30-L33 WeakPolarHBondContact O-CB 3.33Å; L30-L33 PolarHBondContact O-N 2.9Å; L30-I34 HydrophobicContact CD1-CD1 4.47Å; L30-I34 HydrophobicContact CG-CD1 4.4Å; L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 2.89Å; L30-V73 HydrophobicContact CD2-CG1 3.6Å; L30-V73 HydrophobicContact CG-CG1 3.86Å
31G98.6Very high97.9Very high0 Ų029.1 Ų29.10%015%0.145CC..Hα-helixtrans-65.1-41.7178.500000112.5A27 E28 I34 L35 L82A27-G31 PolarHBondContact O-N 3.06Å; E28-G31 PolarHBondContact O-N 3.45Å; G31-I34 PolarHBondContact O-N 3.44Å; G31-L35 PolarHBondContact O-N 3.25Å; G31-L82 VanDerWaalsContact CA-CD2 3.5Å
32T98.8Very high98.1Very high0 Ų028.4 Ų28.40%014%0.144CC..Hα-helixtrans-72.1-32.7177.9-54.60000111.1E28 L35 V36 L82 Q108 A112E28-T32 WeakPolarHBondContact O-CB 3.42Å; E28-T32 PolarHBondContact O-N 3.28Å; E28-T32 PolarHBondContact O-OG1 3.46Å; E28-T32 VanDerWaalsContact O-OG1 3.09Å; T32-L35 PolarHBondContact O-N 3Å; T32-V36 HydrophobicContact CG2-CG2 4.27Å; T32-V36 WeakPolarHBondContact O-CB 3.35Å; T32-V36 WeakPolarHBondContact O-CG2 3.45Å; T32-V36 PolarHBondContact O-N 3.4Å; T32-L82 WeakPolarHBondContact OG1-CA 3.39Å; T32-L82 PolarHBondContact OG1-O 3.22Å; T32-Q108 HydrophobicContact CG2-CB 4.42Å; T32-Q108 VanDerWaalsContact CG2-O 3.23Å; T32-Q108 WeakPolarHBondContact CG2-O 3.41Å; T32-A112 HydrophobicContact CG2-CB 3.86Å
33L98.8Very high98.2Very high31 Ų3126.5 Ų26.516%0.16214%0.135CC..Hα-helixtrans-57.1-49.1169.4-179.1162.1000110.8C29 L30 L35 V36 M37 G111 F114 I118C29-L33 VanDerWaalsContact O-CB 3.25Å; C29-L33 WeakPolarHBondContact O-CB 3.01Å; C29-L33 PolarHBondContact O-N 2.83Å; L30-L33 WeakPolarHBondContact O-CB 3.33Å; L30-L33 PolarHBondContact O-N 2.9Å; L33-L35 PolarHBondContact O-N 3.06Å; L33-V36 PolarHBondContact O-N 3.37Å; L33-M37 HydrophobicContact CD2-CB 4.36Å; L33-M37 HydrophobicContact CD2-SD 4.22Å; L33-M37 WeakPolarHBondContact O-CB 3.41Å; L33-M37 PolarHBondContact O-N 3.5Å; L33-G111 VanDerWaalsContact CA-O 3.26Å; L33-G111 WeakPolarHBondContact CA-O 3.39Å; L33-G111 WeakPolarHBondContact CB-O 3.46Å; L33-F114 HydrophobicContact CD1-CB 3.96Å; L33-I118 HydrophobicContact CD1-CD1 4.17Å; L33-I118 HydrophobicContact CD2-CD1 4.1Å; L33-I118 HydrophobicContact CG-CD1 4.35Å
34I98.7Very high98.2Very high23 Ų2321.7 Ų21.712%0.11812%0.117CC..Hα-helixtrans-60.2-46.9178.6-73.4173.5000111.3L30 G31 V36 F38 L69 V73L30-I34 HydrophobicContact CD1-CD1 4.47Å; L30-I34 HydrophobicContact CG-CD1 4.4Å; L30-I34 WeakPolarHBondContact O-CG1 3.47Å; L30-I34 PolarHBondContact O-N 2.89Å; G31-I34 PolarHBondContact O-N 3.44Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 3.11Å; I34-F38 HydrophobicContact CG2-CD2 3.8Å; I34-F38 HydrophobicContact CG2-CE2 3.88Å; I34-F38 WeakPolarHBondContact O-CD2 3.46Å; I34-F38 PolarHBondContact O-N 3.37Å; I34-F38 VanDerWaalsContact O-N 3.14Å; I34-L69 HydrophobicContact CG2-CB 4Å; I34-V73 HydrophobicContact CD1-CB 3.91Å; I34-V73 HydrophobicContact CD1-CG1 3.84Å; I34-V73 HydrophobicContact CD1-CG2 3.63Å
35L98.7Very high98.2Very high13 Ų1324.9 Ų24.97%0.06813%0.132CC..Hα-helixtrans-54-51.3176.4170.760.4000111.4G31 T32 L33 G39 F63 A66 A67 L82G31-L35 PolarHBondContact O-N 3.25Å; T32-L35 PolarHBondContact O-N 3Å; L33-L35 PolarHBondContact O-N 3.06Å; L35-G39 PolarHBondContact O-N 3.07Å; L35-G39 VanDerWaalsContact O-N 3.1Å; L35-F63 HydrophobicContact CD1-CD1 4.26Å; L35-A66 HydrophobicContact CD1-CB 4.21Å; L35-A67 HydrophobicContact CD1-CB 3.97Å; L35-L82 HydrophobicContact CD2-CB 4.47Å
36V98.8Very high98.2Very high0 Ų026 Ų260%014%0.139CC..Hα-helixtrans-76.4-37.5-174.3174.90000112.1T32 L33 I34 C40 A112 A116 R217 P221T32-V36 HydrophobicContact CG2-CG2 4.27Å; T32-V36 WeakPolarHBondContact O-CB 3.35Å; T32-V36 WeakPolarHBondContact O-CG2 3.45Å; T32-V36 PolarHBondContact O-N 3.4Å; L33-V36 PolarHBondContact O-N 3.37Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 3.11Å; V36-C40 VanDerWaalsContact CG1-SG 3.55Å; V36-C40 WeakPolarHBondContact O-CB 3.32Å; V36-C40 PolarHBondContact O-N 3.09Å; V36-C40 PolarHBondContact O-SG 3.39Å; V36-A112 WeakPolarHBondContact CG1-O 3.37Å; V36-A112 HydrophobicContact CG2-CB 3.75Å; V36-A116 HydrophobicContact CG1-CB 4.39Å; V36-R217 HydrophobicContact CG2-CB 4.35Å; V36-R217 HydrophobicContact CG2-CG 4.17Å; V36-P221 HydrophobicContact CG1-CG 3.72Å
37M98.6Very high98Very high38 Ų3824.6 Ų24.619%0.18713%0.134CC..Hα-helixtrans-59.7-55.5177.7-179.5-17570.800110.6L33 G41 I118 I119L33-M37 HydrophobicContact CD2-CB 4.36Å; L33-M37 HydrophobicContact CD2-SD 4.22Å; L33-M37 WeakPolarHBondContact O-CB 3.41Å; L33-M37 PolarHBondContact O-N 3.5Å; M37-G41 PolarHBondContact O-N 3.47Å; M37-I118 HydrophobicContact CG-CG2 4.22Å; M37-I118 HydrophobicContact SD-CD1 4.43Å; M37-I118 HydrophobicContact SD-CG2 4.04Å; M37-I119 HydrophobicContact CG-CD1 3.8Å; M37-I119 HydrophobicContact CG-CG1 4.09Å; M37-I119 WeakPolarHBondContact O-CD1 3.42Å; M37-I119 WeakPolarHBondContact O-CG1 3.26Å
38F98.6Very high97.9Very high96 Ų9625 Ų2542%0.42113%0.134SC..Hα-helixtrans-69.1-38.5-179.4-71.9-57.8000112.6I34 G41 A42 A66 L69I34-F38 HydrophobicContact CG2-CD2 3.8Å; I34-F38 HydrophobicContact CG2-CE2 3.88Å; I34-F38 WeakPolarHBondContact O-CD2 3.46Å; I34-F38 PolarHBondContact O-N 3.37Å; I34-F38 VanDerWaalsContact O-N 3.14Å; F38-G41 PolarHBondContact O-N 3.23Å; F38-A42 PolarHBondContact O-N 3.12Å; F38-A66 HydrophobicContact CB-CB 3.64Å; F38-A66 HydrophobicContact CD2-CB 4.46Å; F38-L69 HydrophobicContact CD2-CD1 4.48Å; F38-L69 HydrophobicContact CE2-CD1 4.22Å
39G98.4Very high97.7Very high0 Ų026.1 Ų26.10%014%0.142CC..Hα-helixtrans-61.2-55.8176.400000112.9L35 G41 A42 V43 F63L35-G39 PolarHBondContact O-N 3.07Å; L35-G39 VanDerWaalsContact O-N 3.1Å; G39-G41 VanDerWaalsContact C-N 3.29Å; G39-G41 PolarHBondContact O-N 3.41Å; G39-A42 PolarHBondContact O-N 3.4Å; G39-V43 WeakPolarHBondContact O-CG2 3.42Å; G39-V43 PolarHBondContact O-N 2.96Å; G39-F63 VanDerWaalsContact C-CE2 3.49Å; G39-F63 VanDerWaalsContact CA-CE2 3.46Å; G39-F63 WeakPolarHBondContact O-CE2 3.26Å
40C98.5Very high97.4Very high0 Ų032.1 Ų32.10%016%0.163CC..Hα-helixtrans-64.4-35.2177.9-61.50000111.6V36 A42 V43 A44 I119V36-C40 VanDerWaalsContact CG1-SG 3.55Å; V36-C40 WeakPolarHBondContact O-CB 3.32Å; V36-C40 PolarHBondContact O-N 3.09Å; V36-C40 PolarHBondContact O-SG 3.39Å; C40-A42 VanDerWaalsContact C-N 3.33Å; C40-A42 PolarHBondContact O-N 2.97Å; C40-V43 PolarHBondContact O-N 3.42Å; C40-A44 WeakPolarHBondContact O-CB 3.29Å; C40-A44 PolarHBondContact O-N 3.03Å; C40-I119 HydrophobicContact CB-CB 4.41Å; C40-I119 HydrophobicContact CB-CG1 4.28Å; C40-I119 HydrophobicContact CB-CG2 4.18Å
41G98.3Very high97.2Very high8 Ų829.2 Ų29.28%0.08215%0.154CC..Hα-helixtrans-59-43.1174.800000112.4M37 F38 G39 V43 A44 Q45M37-G41 PolarHBondContact O-N 3.47Å; F38-G41 PolarHBondContact O-N 3.23Å; G39-G41 VanDerWaalsContact C-N 3.29Å; G39-G41 PolarHBondContact O-N 3.41Å; G41-V43 PolarHBondContact O-N 3.49Å; G41-A44 PolarHBondContact O-N 3.17Å; G41-Q45 WeakPolarHBondContact O-CB 3.36Å; G41-Q45 PolarHBondContact O-N 2.87Å
42A98.3Very high97Very high17 Ų1733.3 Ų33.314%0.1418%0.183CC..Hα-helixtrans-66.5-36.5176.300000112.9F38 G39 C40 S46 A62F38-A42 PolarHBondContact O-N 3.12Å; G39-A42 PolarHBondContact O-N 3.4Å; C40-A42 VanDerWaalsContact C-N 3.33Å; C40-A42 PolarHBondContact O-N 2.97Å; A42-S46 WeakPolarHBondContact O-CB 3.49Å; A42-S46 PolarHBondContact O-N 3.02Å; A42-A62 HydrophobicContact CB-CB 3.29Å
43V97.5Very high96.7Very high22 Ų2239.6 Ų39.613%0.13321%0.212CC..Hα-helixtrans-68.9-44.5174.4-172.50000110.7G39 C40 G41 Q45 S46 V47 V59 F63 I145G39-V43 WeakPolarHBondContact O-CG2 3.42Å; G39-V43 PolarHBondContact O-N 2.96Å; C40-V43 PolarHBondContact O-N 3.42Å; G41-V43 PolarHBondContact O-N 3.49Å; V43-Q45 VanDerWaalsContact C-N 3.31Å; V43-Q45 PolarHBondContact O-N 3.34Å; V43-S46 PolarHBondContact O-N 3.14Å; V43-S46 VanDerWaalsContact O-N 3.15Å; V43-V47 HydrophobicContact CG1-CG2 4.02Å; V43-V47 WeakPolarHBondContact O-CB 3.39Å; V43-V47 WeakPolarHBondContact O-CG2 3.35Å; V43-V47 PolarHBondContact O-N 3.16Å; V43-V59 HydrophobicContact CG2-CG1 3.67Å; V43-V59 HydrophobicContact CG2-CG2 4.35Å; V43-F63 HydrophobicContact CG2-CE2 3.92Å; V43-I145 HydrophobicContact CG1-CB 4.41Å; V43-I145 HydrophobicContact CG1-CG1 4.29Å
44A97.3Very high96.4Very high1 Ų138.5 Ų38.51%0.00821%0.208CC..Hα-helixtrans-56.9-47.5175.700000110.6C40 G41 S46 V47 L48 I119 Y123 I145C40-A44 WeakPolarHBondContact O-CB 3.29Å; C40-A44 PolarHBondContact O-N 3.03Å; G41-A44 PolarHBondContact O-N 3.17Å; A44-S46 VanDerWaalsContact C-N 3.34Å; A44-S46 PolarHBondContact O-N 2.82Å; A44-V47 PolarHBondContact O-N 3.4Å; A44-L48 HydrophobicContact CB-CD1 4.16Å; A44-L48 VanDerWaalsContact O-CB 3.23Å; A44-L48 WeakPolarHBondContact O-CB 3.39Å; A44-L48 VanDerWaalsContact O-CG 3.25Å; A44-L48 WeakPolarHBondContact O-CG 3.04Å; A44-L48 PolarHBondContact O-N 3.29Å; A44-I119 HydrophobicContact CB-CG2 4.04Å; A44-Y123 HydrophobicContact CB-CD1 4.38Å; A44-Y123 HydrophobicContact CB-CD2 3.73Å; A44-Y123 HydrophobicContact CB-CE2 3.86Å; A44-Y123 HydrophobicContact CB-CG 3.99Å; A44-I145 HydrophobicContact CB-CG2 3.65Å
45Q96.6Very high96.2Very high85 Ų8546.4 Ų46.440%0.39724%0.236SC..Hα-helixtrans-59.6-43.4176.3-171.1166.8-57.900111.9G41 V43 S49 H53 Y123G41-Q45 WeakPolarHBondContact O-CB 3.36Å; G41-Q45 PolarHBondContact O-N 2.87Å; V43-Q45 VanDerWaalsContact C-N 3.31Å; V43-Q45 PolarHBondContact O-N 3.34Å; Q45-S49 WeakPolarHBondContact O-CB 3.32Å; Q45-S49 PolarHBondContact O-N 2.89Å; Q45-S49 PolarHBondContact O-OG 3.23Å; Q45-H53 HydrophobicContact CG-CB 3.73Å; Q45-H53 PolarHBondContact NE2-O 2.92Å; Q45-Y123 PolarHBondContact OE1-OH 3.04Å
46S96.1Very high95.9Very high23 Ų2350.8 Ų50.816%0.16126%0.255CS..Hα-helixtrans-66.8-46.5178.4-173.10000112.3A42 V43 A44 G51 G54A42-S46 WeakPolarHBondContact O-CB 3.49Å; A42-S46 PolarHBondContact O-N 3.02Å; V43-S46 PolarHBondContact O-N 3.14Å; V43-S46 VanDerWaalsContact O-N 3.15Å; A44-S46 VanDerWaalsContact C-N 3.34Å; A44-S46 PolarHBondContact O-N 2.82Å; S46-G51 WeakPolarHBondContact O-CA 3.34Å; S46-G51 PolarHBondContact O-N 3.04Å; S46-G54 PolarHBondContact OG-O 3.41Å
47V94.6Very high95.8Very high44 Ų4455 Ų5527%0.26728%0.277SS..Hα-helixtrans-71.2-54.6-176173.30000111.3V43 A44 S49 Y50 F130 I145V43-V47 HydrophobicContact CG1-CG2 4.02Å; V43-V47 WeakPolarHBondContact O-CB 3.39Å; V43-V47 WeakPolarHBondContact O-CG2 3.35Å; V43-V47 PolarHBondContact O-N 3.16Å; A44-V47 PolarHBondContact O-N 3.4Å; V47-S49 VanDerWaalsContact C-N 3.26Å; V47-S49 PolarHBondContact O-N 3.08Å; V47-Y50 PolarHBondContact O-N 3.03Å; V47-Y50 VanDerWaalsContact O-N 3.11Å; V47-F130 HydrophobicContact CG1-CE1 4.22Å; V47-F130 HydrophobicContact CG1-CZ 4.04Å; V47-F130 VanDerWaalsContact O-CE2 3.29Å; V47-F130 WeakPolarHBondContact O-CE2 3.37Å; V47-I145 HydrophobicContact CB-CD1 4.19Å; V47-I145 HydrophobicContact CB-CG1 4.09Å; V47-I145 HydrophobicContact CG1-CD1 4.08Å; V47-I145 HydrophobicContact CG1-CG1 4.26Å; V47-I145 HydrophobicContact CG2-CG1 4.12Å
48L94.8Very high95.7Very high19 Ų1956.4 Ų56.410%0.09929%0.288CS..Hα-helixtrans-72.3-21.1-171.6-56.9173.8000112.8A44 Y123 A126 L127 F130 I145A44-L48 HydrophobicContact CB-CD1 4.16Å; A44-L48 VanDerWaalsContact O-CB 3.23Å; A44-L48 WeakPolarHBondContact O-CB 3.39Å; A44-L48 VanDerWaalsContact O-CG 3.25Å; A44-L48 WeakPolarHBondContact O-CG 3.04Å; A44-L48 PolarHBondContact O-N 3.29Å; L48-Y123 HydrophobicContact CD1-CD1 3.79Å; L48-Y123 HydrophobicContact CD1-CG 4.01Å; L48-A126 HydrophobicContact CB-CB 4.4Å; L48-A126 HydrophobicContact CD1-CB 4.02Å; L48-L127 HydrophobicContact CD1-CD2 4.23Å; L48-L127 HydrophobicContact CD1-CG 3.91Å; L48-L127 HydrophobicContact CD2-CD2 3.85Å; L48-L127 HydrophobicContact CD2-CG 4.24Å; L48-F130 HydrophobicContact CD2-CB 3.87Å; L48-F130 HydrophobicContact CD2-CD1 4.26Å; L48-F130 HydrophobicContact CD2-CD2 4.02Å; L48-F130 HydrophobicContact CD2-CG 3.81Å; L48-I145 HydrophobicContact CD1-CD1 4.41Å; L48-I145 HydrophobicContact CD2-CD1 4.03Å; L48-I145 HydrophobicContact CG-CD1 4.1Å
49S94.8Very high95.6Very high24 Ų2452.7 Ų52.717%0.16827%0.273CS..THydrogen-bonded Turntrans-92.59.6174.378.20000113.8Q45 V47 G51 S52 H53Q45-S49 WeakPolarHBondContact O-CB 3.32Å; Q45-S49 PolarHBondContact O-N 2.89Å; Q45-S49 PolarHBondContact O-OG 3.23Å; V47-S49 VanDerWaalsContact C-N 3.26Å; V47-S49 PolarHBondContact O-N 3.08Å; S49-G51 PolarHBondContact O-N 3.49Å; S49-S52 VanDerWaalsContact CB-OG 3.32Å; S49-S52 WeakPolarHBondContact CB-OG 3.49Å; S49-S52 WeakPolarHBondContact O-CB 3.19Å; S49-S52 PolarHBondContact O-N 2.82Å; S49-S52 VanDerWaalsContact O-N 3.09Å; S49-S52 PolarHBondContact O-OG 2.69Å; S49-S52 PolarHBondContact OG-N 3.44Å; S49-S52 PolarHBondContact OG-OG 2.86Å; S49-H53 PolarHBondContact OG-N 2.91Å
50Y92.3Very high95.6Very high145 Ų14552.7 Ų52.757%0.56927%0.273SS*.THydrogen-bonded Turntrans53.236.1-174.8-54.1-87.9000113V47 S52 F130 P131 Y140V47-Y50 PolarHBondContact O-N 3.03Å; V47-Y50 VanDerWaalsContact O-N 3.11Å; Y50-S52 VanDerWaalsContact C-N 3.3Å; Y50-S52 PolarHBondContact O-N 3.08Å; Y50-F130 AromaticContact CD1-CE2 3.88Å; Y50-F130 HydrophobicContact CD1-CE2 3.88Å; Y50-F130 HydrophobicContact CD1-CZ 4.4Å; Y50-F130 HydrophobicContact CD2-CE2 4.45Å; Y50-F130 HydrophobicContact CE1-CD2 4.12Å; Y50-F130 AromaticContact CE1-CE2 3.38Å; Y50-F130 HydrophobicContact CE1-CE2 3.38Å; Y50-F130 AromaticContact CE1-CZ 3.97Å; Y50-F130 HydrophobicContact CE1-CZ 3.97Å; Y50-F130 HydrophobicContact CE2-CD2 4.18Å; Y50-F130 HydrophobicContact CE2-CE2 4.02Å; Y50-F130 HydrophobicContact CG-CE2 4.4Å; Y50-F130 AromaticContact CZ-CD2 3.73Å; Y50-F130 AromaticContact CZ-CE2 3.47Å; Y50-F130 VanDerWaalsContact CZ-CE2 3.47Å; Y50-P131 WeakPolarHBondContact OH-CD 3.3Å; Y50-P131 WeakPolarHBondContact OH-CG 3.1Å; Y50-Y140 HydrophobicContact CE1-CE1 4.49Å
51G93.1Very high95.6Very high25 Ų2556.7 Ų56.726%0.25829%0.29SS..THydrogen-bonded Turntrans78.23.8179.100000115.8S46 S49 G54S46-G51 WeakPolarHBondContact O-CA 3.34Å; S46-G51 PolarHBondContact O-N 3.04Å; S49-G51 PolarHBondContact O-N 3.49Å; G51-G54 CarbonylContact C-O 3.6Å; G51-G54 VanDerWaalsContact CA-O 3.32Å; G51-G54 WeakPolarHBondContact CA-O 3.38Å
52S95.3Very high95.6Very high85 Ų8557.5 Ų57.559%0.59430%0.297SS*.SBendtrans-70.3-35.3178.6600000112.9S49 Y50S49-S52 VanDerWaalsContact CB-OG 3.32Å; S49-S52 WeakPolarHBondContact CB-OG 3.49Å; S49-S52 WeakPolarHBondContact O-CB 3.19Å; S49-S52 PolarHBondContact O-N 2.82Å; S49-S52 VanDerWaalsContact O-N 3.09Å; S49-S52 PolarHBondContact O-OG 2.69Å; S49-S52 PolarHBondContact OG-N 3.44Å; S49-S52 PolarHBondContact OG-OG 2.86Å; Y50-S52 VanDerWaalsContact C-N 3.3Å; Y50-S52 PolarHBondContact O-N 3.08Å
53H92.1Very high95.6Very high132 Ų13257 Ų5761%0.61129%0.291SS*.SBendtrans-110.312-177.7-65.872.4000113.2Q45 S49Q45-H53 HydrophobicContact CG-CB 3.73Å; Q45-H53 PolarHBondContact NE2-O 2.92Å; S49-H53 PolarHBondContact OG-N 2.91Å
54G92.6Very high95.6Very high8 Ų856 Ų568%0.08229%0.286CS..  trans-178.2145.9176.400000113.3S46 G51 T58S46-G54 PolarHBondContact OG-O 3.41Å; G51-G54 CarbonylContact C-O 3.6Å; G51-G54 VanDerWaalsContact CA-O 3.32Å; G51-G54 WeakPolarHBondContact CA-O 3.38Å; G54-T58 WeakPolarHBondContact CA-OG1 3.44Å
55R94.2Very high95.7Very high190 Ų19060.8 Ų60.872%0.71731%0.307SS*.  trans-130176.8175.8-65.3-167.2174.7-156.5-0.6110.5L57 T58 V59R55-L57 PolarHBondContact O-N 2.88Å; R55-L57 VanDerWaalsContact O-N 3.15Å; R55-T58 PolarHBondContact N-OG1 3.34Å; R55-T58 PolarHBondContact O-N 3.37Å; R55-T58 PolarHBondContact O-OG1 3.45Å; R55-V59 PolarHBondContact O-N 3.38Å; R55-V59 VanDerWaalsContact O-N 3.11Å
56F93.6Very high95.7Very high105 Ų10556.8 Ų56.846%0.46129%0.288SS..Hα-helixtrans-48.8-44.7179-174.4-106.2000113.1T58 V59 N60 G202F56-T58 PolarHBondContact O-N 3.18Å; F56-V59 PolarHBondContact O-N 3.39Å; F56-N60 VanDerWaalsContact CD1-ND2 3.33Å; F56-N60 WeakPolarHBondContact CD1-ND2 3.26Å; F56-N60 WeakPolarHBondContact CE1-ND2 3.4Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.49Å; F56-N60 PolarHBondContact O-N 3.09Å; F56-N60 VanDerWaalsContact O-N 3.14Å; F56-N60 PolarHBondContact O-ND2 3.18Å; F56-G202 WeakPolarHBondContact CZ-O 3.42Å
57L95.9Very high95.9Very high89 Ų8956 Ų5647%0.46628%0.282SS..Hα-helixtrans-60.4-43.7177.3-179.457.8000112.9R55 V59 N60 F61 L203R55-L57 PolarHBondContact O-N 2.88Å; R55-L57 VanDerWaalsContact O-N 3.15Å; L57-V59 VanDerWaalsContact C-N 3.33Å; L57-V59 PolarHBondContact O-N 2.93Å; L57-N60 PolarHBondContact O-N 3.11Å; L57-F61 HydrophobicContact CD1-CD2 3.85Å; L57-F61 HydrophobicContact CD1-CE2 3.51Å; L57-F61 HydrophobicContact CD1-CZ 4.34Å; L57-F61 HydrophobicContact CD2-CE2 4.16Å; L57-F61 HydrophobicContact CG-CD2 3.87Å; L57-F61 HydrophobicContact CG-CE2 3.69Å; L57-F61 WeakPolarHBondContact O-CD2 3.32Å; L57-F61 PolarHBondContact O-N 3.4Å; L57-L203 HydrophobicContact CD1-CD2 3.49Å; L57-L203 VanDerWaalsContact CD1-CD2 3.49Å
58T95.9Very high96Very high67 Ų6754.4 Ų54.441%0.41127%0.273SS..Hα-helixtrans-69.1-34.1-178.661.60000111.6G54 R55 F56 F61 A62G54-T58 WeakPolarHBondContact CA-OG1 3.44Å; R55-T58 PolarHBondContact N-OG1 3.34Å; R55-T58 PolarHBondContact O-N 3.37Å; R55-T58 PolarHBondContact O-OG1 3.45Å; F56-T58 PolarHBondContact O-N 3.18Å; T58-F61 PolarHBondContact O-N 3.15Å; T58-A62 WeakPolarHBondContact O-CB 3.3Å; T58-A62 PolarHBondContact O-N 3.06Å
59V97.3Very high96.2Very high17 Ų1757.4 Ų57.410%0.10329%0.289CS..Hα-helixtrans-61.5-46.1173.11730000110.6V43 R55 F56 L57 A62 F63V43-V59 HydrophobicContact CG2-CG1 3.67Å; V43-V59 HydrophobicContact CG2-CG2 4.35Å; R55-V59 PolarHBondContact O-N 3.38Å; R55-V59 VanDerWaalsContact O-N 3.11Å; F56-V59 PolarHBondContact O-N 3.39Å; L57-V59 VanDerWaalsContact C-N 3.33Å; L57-V59 PolarHBondContact O-N 2.93Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3.38Å; V59-F63 HydrophobicContact CG1-CD2 3.87Å; V59-F63 HydrophobicContact CG1-CE2 3.99Å; V59-F63 WeakPolarHBondContact O-CD2 3.31Å; V59-F63 PolarHBondContact O-N 3.24Å
60N98Very high96.4Very high0 Ų056.2 Ų56.20%028%0.281CS..Hα-helixtrans-66-41179.7-66.9-47.4000112.4F56 L57 A62 F63 G64 L199 G202 L203 Y211F56-N60 VanDerWaalsContact CD1-ND2 3.33Å; F56-N60 WeakPolarHBondContact CD1-ND2 3.26Å; F56-N60 WeakPolarHBondContact CE1-ND2 3.4Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.49Å; F56-N60 PolarHBondContact O-N 3.09Å; F56-N60 VanDerWaalsContact O-N 3.14Å; F56-N60 PolarHBondContact O-ND2 3.18Å; L57-N60 PolarHBondContact O-N 3.11Å; N60-A62 VanDerWaalsContact C-N 3.32Å; N60-A62 PolarHBondContact O-N 2.99Å; N60-F63 PolarHBondContact O-N 3.34Å; N60-G64 PolarHBondContact O-N 3Å; N60-L199 VanDerWaalsContact C-CD1 3.4Å; N60-L199 HydrophobicContact CB-CD1 3.91Å; N60-L199 WeakPolarHBondContact O-CD1 3.39Å; N60-G202 VanDerWaalsContact OD1-C 3.29Å; N60-G202 WeakPolarHBondContact OD1-CA 3.39Å; N60-G202 PolarHBondContact OD1-O 3.02Å; N60-L203 HydrophobicContact CB-CD2 3.75Å; N60-L203 HydrophobicContact CB-CG 4.06Å; N60-Y211 WeakPolarHBondContact OD1-CE1 3.48Å; N60-Y211 PolarHBondContact OD1-OH 3.38Å
61F98.3Very high96.6Very high84 Ų8450.6 Ų50.637%0.36826%0.26SS..Hα-helixtrans-58-45.1171.3-85-59.7000112.1L57 T58 G64 F65 L199L57-F61 HydrophobicContact CD1-CD2 3.85Å; L57-F61 HydrophobicContact CD1-CE2 3.51Å; L57-F61 HydrophobicContact CD1-CZ 4.34Å; L57-F61 HydrophobicContact CD2-CE2 4.16Å; L57-F61 HydrophobicContact CG-CD2 3.87Å; L57-F61 HydrophobicContact CG-CE2 3.69Å; L57-F61 WeakPolarHBondContact O-CD2 3.32Å; L57-F61 PolarHBondContact O-N 3.4Å; T58-F61 PolarHBondContact O-N 3.15Å; F61-G64 PolarHBondContact O-N 3.24Å; F61-F65 HydrophobicContact CB-CD2 4.36Å; F61-F65 HydrophobicContact CB-CE2 4.23Å; F61-F65 HydrophobicContact CD1-CD2 4.48Å; F61-F65 AromaticContact CD1-CE2 3.68Å; F61-F65 HydrophobicContact CD1-CE2 3.68Å; F61-F65 HydrophobicContact CD1-CZ 4.12Å; F61-F65 HydrophobicContact CE1-CE2 4.5Å; F61-F65 HydrophobicContact CG-CE2 4.33Å; F61-F65 WeakPolarHBondContact O-CD2 3.43Å; F61-F65 WeakPolarHBondContact O-CG 3.24Å; F61-F65 PolarHBondContact O-N 3.11Å; F61-L199 HydrophobicContact CD1-CD1 3.99Å; F61-L199 HydrophobicContact CD1-CD2 3.81Å; F61-L199 HydrophobicContact CE1-CD1 4.4Å; F61-L199 HydrophobicContact CE1-CD2 3.77Å; F61-L199 HydrophobicContact CG-CD1 4.31Å
62A98.2Very high96.8Very high26 Ų2654.4 Ų54.422%0.21527%0.274CS..Hα-helixtrans-61.2-47.4178.800000111.9A42 T58 V59 N60 G64 F65 A66A42-A62 HydrophobicContact CB-CB 3.29Å; T58-A62 WeakPolarHBondContact O-CB 3.3Å; T58-A62 PolarHBondContact O-N 3.06Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3.38Å; N60-A62 VanDerWaalsContact C-N 3.32Å; N60-A62 PolarHBondContact O-N 2.99Å; A62-G64 PolarHBondContact O-N 3.38Å; A62-F65 PolarHBondContact O-N 2.9Å; A62-A66 WeakPolarHBondContact O-CB 3.44Å; A62-A66 PolarHBondContact O-N 2.87Å
63F98.3Very high96.8Very high5 Ų553.9 Ų53.92%0.02227%0.267CS..Hα-helixtrans-62.9-42.8177.9-90.4-78000113.1L35 G39 V43 V59 N60 A66 A67 V198 Y211L35-F63 HydrophobicContact CD1-CD1 4.26Å; G39-F63 VanDerWaalsContact C-CE2 3.49Å; G39-F63 VanDerWaalsContact CA-CE2 3.46Å; G39-F63 WeakPolarHBondContact O-CE2 3.26Å; V43-F63 HydrophobicContact CG2-CE2 3.92Å; V59-F63 HydrophobicContact CG1-CD2 3.87Å; V59-F63 HydrophobicContact CG1-CE2 3.99Å; V59-F63 WeakPolarHBondContact O-CD2 3.31Å; V59-F63 PolarHBondContact O-N 3.24Å; N60-F63 PolarHBondContact O-N 3.34Å; F63-A66 PolarHBondContact O-N 3.24Å; F63-A67 WeakPolarHBondContact O-CB 3.29Å; F63-A67 PolarHBondContact O-N 3.27Å; F63-V198 HydrophobicContact CB-CG1 4.46Å; F63-Y211 HydrophobicContact CB-CE2 4.2Å; F63-Y211 VanDerWaalsContact CD2-OH 3.28Å; F63-Y211 WeakPolarHBondContact CD2-OH 3.42Å; F63-Y211 HydrophobicContact CG-CE2 4.27Å
64G98.4Very high96.9Very high2 Ų247.6 Ų47.62%0.02124%0.238CC..Hα-helixtrans-61.3-50177.400000112.4N60 F61 A62 A67 T68 G195N60-G64 PolarHBondContact O-N 3Å; F61-G64 PolarHBondContact O-N 3.24Å; A62-G64 PolarHBondContact O-N 3.38Å; G64-A67 WeakPolarHBondContact O-CB 3.46Å; G64-A67 PolarHBondContact O-N 3.31Å; G64-T68 PolarHBondContact O-N 3.17Å; G64-T68 VanDerWaalsContact O-N 3.11Å; G64-T68 PolarHBondContact O-OG1 3.32Å; G64-G195 VanDerWaalsContact CA-O 3.23Å; G64-G195 WeakPolarHBondContact CA-O 3.45Å; G64-G195 VanDerWaalsContact O-CA 3.22Å; G64-G195 WeakPolarHBondContact O-CA 3.35Å
65F98.6Very high96.9Very high102 Ų10248.3 Ų48.345%0.44725%0.245SC..Hα-helixtrans-69.7-32.9177.7-65.9-48.2000113F61 A62 A67 T68 L69 F192F61-F65 HydrophobicContact CB-CD2 4.36Å; F61-F65 HydrophobicContact CB-CE2 4.23Å; F61-F65 HydrophobicContact CD1-CD2 4.48Å; F61-F65 AromaticContact CD1-CE2 3.68Å; F61-F65 HydrophobicContact CD1-CE2 3.68Å; F61-F65 HydrophobicContact CD1-CZ 4.12Å; F61-F65 HydrophobicContact CE1-CE2 4.5Å; F61-F65 HydrophobicContact CG-CE2 4.33Å; F61-F65 WeakPolarHBondContact O-CD2 3.43Å; F61-F65 WeakPolarHBondContact O-CG 3.24Å; F61-F65 PolarHBondContact O-N 3.11Å; A62-F65 PolarHBondContact O-N 2.9Å; F65-A67 VanDerWaalsContact C-N 3.32Å; F65-A67 PolarHBondContact O-N 2.84Å; F65-T68 WeakPolarHBondContact O-CB 3.32Å; F65-T68 PolarHBondContact O-N 3.45Å; F65-L69 WeakPolarHBondContact O-CG 3.09Å; F65-L69 PolarHBondContact O-N 3.04Å; F65-F192 HydrophobicContact CE1-CE2 4.07Å
66A98.5Very high96.8Very high1 Ų148.4 Ų48.41%0.00825%0.254CS..Hα-helixtrans-64.1-38.5174.200000111.7L35 F38 A62 F63 L69 G70L35-A66 HydrophobicContact CD1-CB 4.21Å; F38-A66 HydrophobicContact CB-CB 3.64Å; F38-A66 HydrophobicContact CD2-CB 4.46Å; A62-A66 WeakPolarHBondContact O-CB 3.44Å; A62-A66 PolarHBondContact O-N 2.87Å; F63-A66 PolarHBondContact O-N 3.24Å; A66-L69 PolarHBondContact O-N 2.81Å; A66-G70 PolarHBondContact O-N 3.42Å
67A98.4Very high96.8Very high5 Ų546.8 Ų46.84%0.04125%0.249CC..Hα-helixtrans-62.4-47.5171.800000111L35 F63 G64 F65 L69 G70 I71 V198L35-A67 HydrophobicContact CD1-CB 3.97Å; F63-A67 WeakPolarHBondContact O-CB 3.29Å; F63-A67 PolarHBondContact O-N 3.27Å; G64-A67 WeakPolarHBondContact O-CB 3.46Å; G64-A67 PolarHBondContact O-N 3.31Å; F65-A67 VanDerWaalsContact C-N 3.32Å; F65-A67 PolarHBondContact O-N 2.84Å; A67-L69 PolarHBondContact O-N 3.01Å; A67-G70 PolarHBondContact O-N 3.05Å; A67-I71 VanDerWaalsContact O-CG1 3.28Å; A67-I71 WeakPolarHBondContact O-CG1 3.47Å; A67-I71 PolarHBondContact O-N 3.26Å; A67-V198 HydrophobicContact CB-CB 4.35Å; A67-V198 HydrophobicContact CB-CG1 4.49Å; A67-V198 HydrophobicContact CB-CG2 4.04Å
68T98.4Very high96.7Very high12 Ų1242.7 Ų42.77%0.07423%0.228CC..Hα-helixtrans-53.4-51.8174.1-59.60000111.7G64 F65 G70 I71 L72 A191 F192 G195G64-T68 PolarHBondContact O-N 3.17Å; G64-T68 VanDerWaalsContact O-N 3.11Å; G64-T68 PolarHBondContact O-OG1 3.32Å; F65-T68 WeakPolarHBondContact O-CB 3.32Å; F65-T68 PolarHBondContact O-N 3.45Å; T68-G70 PolarHBondContact O-N 3.27Å; T68-I71 PolarHBondContact O-N 2.92Å; T68-L72 HydrophobicContact CG2-CD1 4Å; T68-L72 HydrophobicContact CG2-CG 4.44Å; T68-L72 WeakPolarHBondContact O-CG 3.34Å; T68-L72 PolarHBondContact O-N 2.96Å; T68-A191 HydrophobicContact CG2-CB 4.45Å; T68-A191 PolarHBondContact OG1-O 3.07Å; T68-F192 HydrophobicContact CG2-CB 4.17Å; T68-F192 HydrophobicContact CG2-CD2 4.44Å; T68-G195 WeakPolarHBondContact OG1-CA 3.37Å
69L98.2Very high96.6Very high81 Ų8141.8 Ų41.842%0.42423%0.232SC..Hα-helixtrans-64.6-40.8-178.8-69.3174.8000112I34 F38 F65 A66 A67 I71 L72 V73I34-L69 HydrophobicContact CG2-CB 4Å; F38-L69 HydrophobicContact CD2-CD1 4.48Å; F38-L69 HydrophobicContact CE2-CD1 4.22Å; F65-L69 WeakPolarHBondContact O-CG 3.09Å; F65-L69 PolarHBondContact O-N 3.04Å; A66-L69 PolarHBondContact O-N 2.81Å; A67-L69 PolarHBondContact O-N 3.01Å; L69-I71 VanDerWaalsContact C-N 3.32Å; L69-I71 PolarHBondContact O-N 3.38Å; L69-L72 PolarHBondContact O-N 3.4Å; L69-V73 WeakPolarHBondContact O-CG2 3.26Å; L69-V73 PolarHBondContact O-N 2.71Å
70G98Very high96.5Very high0 Ų041.4 Ų41.40%023%0.232CC..Hα-helixtrans-57-47.3174.700000111.4A66 A67 T68 V73 C74A66-G70 PolarHBondContact O-N 3.42Å; A67-G70 PolarHBondContact O-N 3.05Å; T68-G70 PolarHBondContact O-N 3.27Å; G70-V73 PolarHBondContact O-N 2.77Å; G70-C74 PolarHBondContact O-N 2.91Å; G70-C74 PolarHBondContact O-SG 3.35Å
71I97.9Very high96.5Very high26 Ų2642.2 Ų42.213%0.13324%0.235CC..Hα-helixtrans-66.5-43.1179.7-62.9167.6000110.3A67 T68 L69 V73 C74 G75 L82 A191 V194A67-I71 VanDerWaalsContact O-CG1 3.28Å; A67-I71 WeakPolarHBondContact O-CG1 3.47Å; A67-I71 PolarHBondContact O-N 3.26Å; T68-I71 PolarHBondContact O-N 2.92Å; L69-I71 VanDerWaalsContact C-N 3.32Å; L69-I71 PolarHBondContact O-N 3.38Å; I71-V73 VanDerWaalsContact C-N 3.26Å; I71-V73 PolarHBondContact O-N 2.85Å; I71-C74 PolarHBondContact O-N 3.44Å; I71-G75 WeakPolarHBondContact O-CA 3.41Å; I71-G75 PolarHBondContact O-N 2.94Å; I71-L82 HydrophobicContact CG1-CD1 3.67Å; I71-L82 HydrophobicContact CG1-CG 4.39Å; I71-A191 HydrophobicContact CB-CB 3.88Å; I71-A191 HydrophobicContact CG2-CB 3.59Å; I71-V194 HydrophobicContact CD1-CB 3.64Å; I71-V194 HydrophobicContact CD1-CG1 3.4Å; I71-V194 VanDerWaalsContact CD1-CG1 3.4Å; I71-V194 HydrophobicContact CD1-CG2 4.39Å
72L96.8Very high96.5Very high106 Ų10638.5 Ų38.556%0.55522%0.219SC*.Hα-helixtrans-59.6-36.9177.2-73.6173.9000112.5T68 L69 A191T68-L72 HydrophobicContact CG2-CD1 4Å; T68-L72 HydrophobicContact CG2-CG 4.44Å; T68-L72 WeakPolarHBondContact O-CG 3.34Å; T68-L72 PolarHBondContact O-N 2.96Å; L69-L72 PolarHBondContact O-N 3.4Å; L72-A191 HydrophobicContact CD2-CB 3.71Å; L72-A191 HydrophobicContact CG-CB 3.77Å
73V95.5Very high96.5Very high73 Ų7337.6 Ų37.644%0.44221%0.211SC..Hα-helixtrans-72.7-36.7-178.2166.40000112.8L30 I34 L69 G70 I71L30-V73 HydrophobicContact CD2-CG1 3.6Å; L30-V73 HydrophobicContact CG-CG1 3.86Å; I34-V73 HydrophobicContact CD1-CB 3.91Å; I34-V73 HydrophobicContact CD1-CG1 3.84Å; I34-V73 HydrophobicContact CD1-CG2 3.63Å; L69-V73 WeakPolarHBondContact O-CG2 3.26Å; L69-V73 PolarHBondContact O-N 2.71Å; G70-V73 PolarHBondContact O-N 2.77Å; I71-V73 VanDerWaalsContact C-N 3.26Å; I71-V73 PolarHBondContact O-N 2.85Å
74C94.9Very high96.6Very high1 Ų137.4 Ų37.41%0.00721%0.21CC..Hα-helixtrans-114.9-11.6-171.869.40000115.3A27 G70 I71 Q76 I77 S78 G80 L82A27-C74 VanDerWaalsContact C-CB 3.49Å; A27-C74 HydrophobicContact CB-CB 3.79Å; A27-C74 WeakPolarHBondContact O-CB 3.29Å; G70-C74 PolarHBondContact O-N 2.91Å; G70-C74 PolarHBondContact O-SG 3.35Å; I71-C74 PolarHBondContact O-N 3.44Å; C74-Q76 PolarHBondContact O-N 3.38Å; C74-I77 PolarHBondContact O-N 3.14Å; C74-I77 VanDerWaalsContact O-N 3.1Å; C74-S78 PolarHBondContact O-N 3.44Å; C74-S78 PolarHBondContact O-OG 2.96Å; C74-G80 VanDerWaalsContact SG-CA 3.56Å; C74-L82 WeakPolarHBondContact SG-CD2 3.31Å
75G92.3Very high96.6Very high22 Ų2237.3 Ų37.323%0.22721%0.209CC..Hα-helixtrans-56.9-47.6-168.900000113.4I71 I77 S78 G79I71-G75 WeakPolarHBondContact O-CA 3.41Å; I71-G75 PolarHBondContact O-N 2.94Å; G75-I77 PolarHBondContact O-N 3.5Å; G75-I77 VanDerWaalsContact O-N 3.13Å; G75-S78 PolarHBondContact O-N 3.08Å; G75-G79 WeakPolarHBondContact O-CA 3.5Å; G75-G79 PolarHBondContact O-N 3.48Å
76Q91.2Very high96.6Very high193 Ų19332.9 Ų32.990%0.90219%0.19SC*.Hα-helixtrans-62.1-26-178.6-167.965.33.800113.6C74C74-Q76 PolarHBondContact O-N 3.38Å
77I93.4Very high96.6Very high71 Ų7132.8 Ų32.836%0.36419%0.19SC..Hα-helixtrans-93.4-48.4-177.5-60.6177.6000110.3R23 Q24 A27 C74 G75R23-I77 HydrophobicContact CG-CG2 3.81Å; Q24-I77 HydrophobicContact CG-CG2 4.43Å; Q24-I77 VanDerWaalsContact CG-O 3.3Å; Q24-I77 WeakPolarHBondContact CG-O 3.49Å; Q24-I77 PolarHBondContact NE2-O 3.17Å; A27-I77 HydrophobicContact CB-CB 3.93Å; A27-I77 HydrophobicContact CB-CD1 4.4Å; A27-I77 HydrophobicContact CB-CG2 3.88Å; C74-I77 PolarHBondContact O-N 3.14Å; C74-I77 VanDerWaalsContact O-N 3.1Å; G75-I77 PolarHBondContact O-N 3.5Å; G75-I77 VanDerWaalsContact O-N 3.13Å
78S94.3Very high96.6Very high2 Ų234.4 Ų34.41%0.01420%0.196CC..Hα-helixtrans-109.4-17.3-164.659.30000115.5E28 C74 G75 G80 Y104E28-S78 WeakPolarHBondContact OE1-CB 3.43Å; E28-S78 PolarHBondContact OE1-OG 2.76Å; E28-S78 VanDerWaalsContact OE1-OG 3.08Å; C74-S78 PolarHBondContact O-N 3.44Å; C74-S78 PolarHBondContact O-OG 2.96Å; G75-S78 PolarHBondContact O-N 3.08Å; S78-G80 VanDerWaalsContact C-N 3.32Å; S78-G80 PolarHBondContact OG-N 3.13Å; S78-G80 VanDerWaalsContact OG-N 3.17Å; S78-Y104 PolarHBondContact O-OH 3.38Å
79G93.6Very high96.6Very high49 Ų4933.9 Ų33.951%0.50519%0.193SC..  trans92.5-15.4-16500000113.3G75G75-G79 WeakPolarHBondContact O-CA 3.5Å; G75-G79 PolarHBondContact O-N 3.48Å
80G96.1Very high96.5Very high9 Ų931 Ų319%0.09318%0.178CC..  trans6750.2175.400000113.3E28 C74 S78E28-G80 PolarHBondContact OE1-N 2.87Å; C74-G80 VanDerWaalsContact SG-CA 3.56Å; S78-G80 VanDerWaalsContact C-N 3.32Å; S78-G80 PolarHBondContact OG-N 3.13Å; S78-G80 VanDerWaalsContact OG-N 3.17Å
81H98Very high96.5Very high17 Ų1731 Ų318%0.07918%0.178CC..  trans-73.8-44.8-178.4-60.1178.4000111.4E28 N83 V86 T87 L90 Y104E28-H81 PolarHBondContact OE1-N 2.91Å; H81-N83 WeakPolarHBondContact O-CB 3.21Å; H81-N83 PolarHBondContact O-N 3.1Å; H81-V86 HydrophobicContact CB-CG1 4.25Å; H81-T87 WeakPolarHBondContact CB-OG1 3.46Å; H81-T87 PolarHBondContact ND1-OG1 3.49Å; H81-L90 VanDerWaalsContact NE2-CD1 3.32Å; H81-L90 WeakPolarHBondContact NE2-CD1 3.2Å; H81-Y104 HydrophobicContact CB-CD1 4.47Å; H81-Y104 AromaticContact CE1-CE1 3.7Å; H81-Y104 AromaticContact ND1-CD1 3.54Å; H81-Y104 AromaticContact ND1-CE1 3.49Å; H81-Y104 WeakPolarHBondContact ND1-CE1 3.46Å
82L98.2Very high96.5Very high6 Ų633.4 Ų33.43%0.03119%0.191CC..  trans56.60.5178.8-50.8-177.1000116E28 G31 T32 L35 I71 C74 N214E28-L82 WeakPolarHBondContact OE2-CA 3.44Å; E28-L82 PolarHBondContact OE2-N 3.09Å; G31-L82 VanDerWaalsContact CA-CD2 3.5Å; T32-L82 WeakPolarHBondContact OG1-CA 3.39Å; T32-L82 PolarHBondContact OG1-O 3.22Å; L35-L82 HydrophobicContact CD2-CB 4.47Å; I71-L82 HydrophobicContact CG1-CD1 3.67Å; I71-L82 HydrophobicContact CG1-CG 4.39Å; C74-L82 WeakPolarHBondContact SG-CD2 3.31Å; L82-N214 PolarHBondContact O-ND2 3.05Å
83N98.6Very high96.3Very high7 Ų730.6 Ų30.64%0.03718%0.176CC..SBendtrans-148123.6-164.9-176.3-15000109.3H81 A85 V86 T87 V213 N214 P215H81-N83 WeakPolarHBondContact O-CB 3.21Å; H81-N83 PolarHBondContact O-N 3.1Å; N83-A85 VanDerWaalsContact C-N 3.27Å; N83-A85 PolarHBondContact O-N 3.42Å; N83-A85 WeakPolarHBondContact OD1-CB 3.49Å; N83-A85 PolarHBondContact OD1-N 2.98Å; N83-V86 HydrophobicContact CB-CB 4.02Å; N83-V86 HydrophobicContact CB-CG2 3.72Å; N83-V86 PolarHBondContact O-N 3.35Å; N83-T87 PolarHBondContact O-N 3.05Å; N83-T87 PolarHBondContact O-OG1 2.94Å; N83-T87 VanDerWaalsContact O-OG1 3.05Å; N83-V213 PolarHBondContact ND2-O 3Å; N83-N214 HydrophobicContact CB-CB 4.31Å; N83-N214 WeakPolarHBondContact CB-ND2 3.43Å; N83-N214 VanDerWaalsContact CG-CG 3.44Å; N83-N214 WeakPolarHBondContact ND2-CB 3.46Å; N83-N214 WeakPolarHBondContact OD1-CA 3Å; N83-P215 WeakPolarHBondContact OD1-CD 3.48Å
84P98.8Very high96.2Very high0 Ų030.1 Ų30.10%019%0.186CC..Hα-helixtrans-57.7-37.6174.9-27.835.8000113.1V86 T87 F88 F101 F105 Q108 N214 P215 A216 F250P84-V86 PolarHBondContact O-N 3.29Å; P84-T87 PolarHBondContact O-N 3.26Å; P84-F88 VanDerWaalsContact O-CB 3.24Å; P84-F88 WeakPolarHBondContact O-CB 3.45Å; P84-F88 PolarHBondContact O-N 3.43Å; P84-F101 WeakPolarHBondContact O-CE2 3.37Å; P84-F105 HydrophobicContact CB-CB 4.35Å; P84-F105 HydrophobicContact CB-CD1 4.02Å; P84-F105 HydrophobicContact CB-CD2 3.87Å; P84-F105 HydrophobicContact CB-CE1 4.29Å; P84-F105 HydrophobicContact CB-CE2 4.19Å; P84-F105 HydrophobicContact CB-CG 3.82Å; P84-F105 HydrophobicContact CB-CZ 4.39Å; P84-F105 HydrophobicContact CG-CB 4.33Å; P84-F105 HydrophobicContact CG-CD1 4.38Å; P84-F105 HydrophobicContact CG-CD2 3.31Å; P84-F105 HydrophobicContact CG-CE2 3.67Å; P84-F105 HydrophobicContact CG-CG 3.76Å; P84-F105 HydrophobicContact CG-CZ 4.32Å; P84-Q108 VanDerWaalsContact CG-OE1 3.28Å; P84-Q108 VanDerWaalsContact N-OE1 3.09Å; P84-N214 VanDerWaalsContact CD-OD1 3.3Å; P84-N214 WeakPolarHBondContact CD-OD1 3.49Å; P84-P215 HydrophobicContact CB-CB 4.24Å; P84-P215 HydrophobicContact CB-CG 4.24Å; P84-P215 HydrophobicContact CG-CB 4.1Å; P84-A216 HydrophobicContact CG-CB 3.71Å; P84-F250 HydrophobicContact CB-CE1 4.04Å; P84-F250 HydrophobicContact CB-CZ 3.84Å
85A98.7Very high96Very high0 Ų034.3 Ų34.30%020%0.202CC..Hα-helixtrans-66.4-37.6179.400000112.3N83 F88 S89 T167 P249 A253N83-A85 VanDerWaalsContact C-N 3.27Å; N83-A85 PolarHBondContact O-N 3.42Å; N83-A85 WeakPolarHBondContact OD1-CB 3.49Å; N83-A85 PolarHBondContact OD1-N 2.98Å; A85-F88 PolarHBondContact O-N 3.41Å; A85-S89 PolarHBondContact O-N 3.38Å; A85-T167 HydrophobicContact CB-CG2 3.93Å; A85-P249 HydrophobicContact CB-CB 3.99Å; A85-A253 HydrophobicContact CB-CB 4.26Å
86V98.5Very high96.1Very high9 Ų935 Ų356%0.05520%0.199CC..Hα-helixtrans-66.5-47.7173.6176.10000110.4H81 N83 P84 F88 S89 L90 I171 I174H81-V86 HydrophobicContact CB-CG1 4.25Å; N83-V86 HydrophobicContact CB-CB 4.02Å; N83-V86 HydrophobicContact CB-CG2 3.72Å; N83-V86 PolarHBondContact O-N 3.35Å; P84-V86 PolarHBondContact O-N 3.29Å; V86-F88 PolarHBondContact O-N 2.89Å; V86-S89 PolarHBondContact O-N 3.23Å; V86-L90 HydrophobicContact CG1-CD1 4.24Å; V86-L90 WeakPolarHBondContact O-CG 3.07Å; V86-L90 PolarHBondContact O-N 3.05Å; V86-I171 HydrophobicContact CB-CD1 4.29Å; V86-I171 HydrophobicContact CG2-CD1 3.82Å; V86-I174 HydrophobicContact CG1-CD1 4.42Å; V86-I174 HydrophobicContact CG1-CG2 4.49Å; V86-I174 HydrophobicContact CG2-CD1 3.6Å
87T98.4Very high96.3Very high0 Ų034.6 Ų34.60%019%0.189CC..Hα-helixtrans-58.6-40.6177.2-52.20000111.2H81 N83 P84 L90 C91 F101 Y104 Q108H81-T87 WeakPolarHBondContact CB-OG1 3.46Å; H81-T87 PolarHBondContact ND1-OG1 3.49Å; N83-T87 PolarHBondContact O-N 3.05Å; N83-T87 PolarHBondContact O-OG1 2.94Å; N83-T87 VanDerWaalsContact O-OG1 3.05Å; P84-T87 PolarHBondContact O-N 3.26Å; T87-L90 PolarHBondContact O-N 3.01Å; T87-C91 PolarHBondContact O-N 3.09Å; T87-C91 PolarHBondContact O-SG 3.46Å; T87-F101 HydrophobicContact CG2-CD2 3.95Å; T87-Y104 HydrophobicContact CG2-CD1 4Å; T87-Y104 HydrophobicContact CG2-CG 4.17Å; T87-Q108 PolarHBondContact OG1-NE2 3.25Å
88F98.6Very high96.5Very high38 Ų3837.5 Ų37.517%0.16720%0.196CC..Hα-helixtrans-63.8-47.7177.4-174.6-102.5000112P84 A85 V86 L90 C91 L92 W98 F101 F250 A253 I254P84-F88 VanDerWaalsContact O-CB 3.24Å; P84-F88 WeakPolarHBondContact O-CB 3.45Å; P84-F88 PolarHBondContact O-N 3.43Å; A85-F88 PolarHBondContact O-N 3.41Å; V86-F88 PolarHBondContact O-N 2.89Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.34Å; F88-C91 WeakPolarHBondContact O-CB 3.33Å; F88-C91 PolarHBondContact O-N 3.47Å; F88-C91 VanDerWaalsContact O-N 3.09Å; F88-L92 HydrophobicContact CD1-CD1 3.91Å; F88-L92 HydrophobicContact CD1-CG 4.24Å; F88-L92 HydrophobicContact CE1-CD1 3.64Å; F88-L92 HydrophobicContact CE1-CD2 4.22Å; F88-L92 HydrophobicContact CE1-CG 4.01Å; F88-L92 HydrophobicContact CZ-CD1 4.44Å; F88-L92 HydrophobicContact CZ-CD2 4.21Å; F88-L92 HydrophobicContact CZ-CG 4.41Å; F88-L92 WeakPolarHBondContact O-CG 3.34Å; F88-L92 PolarHBondContact O-N 3.44Å; F88-W98 HydrophobicContact CD2-CH2 4.12Å; F88-W98 AromaticContact CD2-CZ3 3.82Å; F88-W98 HydrophobicContact CD2-CZ3 3.82Å; F88-W98 AromaticContact CE2-CH2 3.76Å; F88-W98 HydrophobicContact CE2-CH2 3.76Å; F88-W98 AromaticContact CE2-CZ3 3.65Å; F88-W98 HydrophobicContact CE2-CZ3 3.65Å; F88-W98 HydrophobicContact CZ-CH2 4.29Å; F88-F101 HydrophobicContact CB-CD2 4.3Å; F88-F101 HydrophobicContact CB-CE2 3.78Å; F88-F101 HydrophobicContact CB-CZ 4.45Å; F88-F101 HydrophobicContact CD2-CE2 4.07Å; F88-F101 HydrophobicContact CD2-CZ 4.06Å; F88-F101 HydrophobicContact CG-CE2 4.41Å; F88-F250 HydrophobicContact CB-CD1 3.9Å; F88-F250 HydrophobicContact CB-CE1 3.98Å; F88-F250 HydrophobicContact CD1-CD1 4.02Å; F88-F250 HydrophobicContact CD2-CD1 4.25Å; F88-F250 AromaticContact CG-CD1 3.81Å; F88-F250 HydrophobicContact CG-CD1 3.81Å; F88-F250 HydrophobicContact CG-CE1 4.23Å; F88-A253 HydrophobicContact CD1-CB 4.37Å; F88-I254 HydrophobicContact CE1-CD1 4.15Å; F88-I254 HydrophobicContact CE1-CG1 3.76Å
89S98.1Very high96.5Very high2 Ų246.4 Ų46.41%0.01423%0.229CC..Hα-helixtrans-55.9-44.8174.9170.70000112.4A85 V86 C91 L92 L93 I171 T257A85-S89 PolarHBondContact O-N 3.38Å; V86-S89 PolarHBondContact O-N 3.23Å; S89-C91 VanDerWaalsContact C-N 3.3Å; S89-C91 PolarHBondContact O-N 2.98Å; S89-L92 WeakPolarHBondContact O-CB 3.26Å; S89-L92 PolarHBondContact O-N 2.85Å; S89-L93 PolarHBondContact O-N 2.91Å; S89-L93 VanDerWaalsContact O-N 3.11Å; S89-I171 WeakPolarHBondContact OG-CG2 3.35Å; S89-T257 WeakPolarHBondContact CB-OG1 3.49Å; S89-T257 PolarHBondContact OG-OG1 3.23Å
90L97.6Very high96.5Very high20 Ų2045.9 Ų45.911%0.10521%0.213CC..Hα-helixtrans-67-30.5177.4-64.7174.8000112.8H81 V86 T87 F88 G94 R95 E96 L175H81-L90 VanDerWaalsContact NE2-CD1 3.32Å; H81-L90 WeakPolarHBondContact NE2-CD1 3.2Å; V86-L90 HydrophobicContact CG1-CD1 4.24Å; V86-L90 WeakPolarHBondContact O-CG 3.07Å; V86-L90 PolarHBondContact O-N 3.05Å; T87-L90 PolarHBondContact O-N 3.01Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.34Å; L90-G94 PolarHBondContact O-N 3.27Å; L90-R95 HydrophobicContact CD2-CB 4.4Å; L90-R95 PolarHBondContact O-N 2.94Å; L90-E96 HydrophobicContact CB-CB 4.22Å; L90-E96 HydrophobicContact CB-CG 4.19Å; L90-E96 PolarHBondContact O-N 2.73Å; L90-E96 VanDerWaalsContact O-N 3.08Å; L90-L175 HydrophobicContact CD2-CD2 4.31Å
91C97.6Very high96.6Very high1 Ų147.2 Ų47.21%0.00722%0.216CC..Hα-helixtrans-70.4-39171.6-660000112.1T87 F88 S89 L93 G94 W98T87-C91 PolarHBondContact O-N 3.09Å; T87-C91 PolarHBondContact O-SG 3.46Å; F88-C91 WeakPolarHBondContact O-CB 3.33Å; F88-C91 PolarHBondContact O-N 3.47Å; F88-C91 VanDerWaalsContact O-N 3.09Å; S89-C91 VanDerWaalsContact C-N 3.3Å; S89-C91 PolarHBondContact O-N 2.98Å; C91-L93 VanDerWaalsContact C-N 3.27Å; C91-L93 PolarHBondContact O-N 3.23Å; C91-G94 PolarHBondContact O-N 3.08Å; C91-W98 HydrophobicContact CB-CD2 3.77Å; C91-W98 HydrophobicContact CB-CE3 3.78Å; C91-W98 HydrophobicContact CB-CG 4.44Å; C91-W98 HydrophobicContact CB-CH2 3.88Å; C91-W98 HydrophobicContact CB-CZ2 3.86Å; C91-W98 HydrophobicContact CB-CZ3 3.83Å
92L97.1Very high96.6Very high76 Ų7650.1 Ų50.140%0.39824%0.236SC..Hα-helixtrans-60.1-38.7175-69.8174.7000111.8F88 S89 G94 W98 I254F88-L92 HydrophobicContact CD1-CD1 3.91Å; F88-L92 HydrophobicContact CD1-CG 4.24Å; F88-L92 HydrophobicContact CE1-CD1 3.64Å; F88-L92 HydrophobicContact CE1-CD2 4.22Å; F88-L92 HydrophobicContact CE1-CG 4.01Å; F88-L92 HydrophobicContact CZ-CD1 4.44Å; F88-L92 HydrophobicContact CZ-CD2 4.21Å; F88-L92 HydrophobicContact CZ-CG 4.41Å; F88-L92 WeakPolarHBondContact O-CG 3.34Å; F88-L92 PolarHBondContact O-N 3.44Å; S89-L92 WeakPolarHBondContact O-CB 3.26Å; S89-L92 PolarHBondContact O-N 2.85Å; L92-G94 PolarHBondContact O-N 2.75Å; L92-W98 HydrophobicContact CD2-CH2 3.82Å; L92-W98 HydrophobicContact CD2-CZ2 3.96Å; L92-W98 HydrophobicContact CG-CH2 4.24Å; L92-W98 HydrophobicContact CG-CZ2 4.47Å; L92-I254 HydrophobicContact CD1-CG1 3.91Å
93L93.8Very high96.5Very high46 Ų4653.3 Ų53.324%0.24125%0.252CS..THydrogen-bonded Turntrans-77.9-1.8176.9-67.6176.7000114S89 C91 R95 L175 T257 Q261S89-L93 PolarHBondContact O-N 2.91Å; S89-L93 VanDerWaalsContact O-N 3.11Å; C91-L93 VanDerWaalsContact C-N 3.27Å; C91-L93 PolarHBondContact O-N 3.23Å; L93-R95 HydrophobicContact CB-CG 4.01Å; L93-R95 PolarHBondContact O-N 2.88Å; L93-R95 VanDerWaalsContact O-N 3.09Å; L93-L175 HydrophobicContact CD1-CD1 3.98Å; L93-L175 HydrophobicContact CD1-CD2 3.42Å; L93-L175 VanDerWaalsContact CD1-CD2 3.42Å; L93-L175 HydrophobicContact CD1-CG 4.36Å; L93-T257 HydrophobicContact CD1-CG2 4.1Å; L93-T257 HydrophobicContact CD2-CG2 3.48Å; L93-T257 VanDerWaalsContact CD2-CG2 3.48Å; L93-T257 HydrophobicContact CG-CG2 3.63Å; L93-Q261 HydrophobicContact CD2-CG 3.66Å
94G92.6Very high96.5Very high64 Ų6453 Ų5366%0.6625%0.25SS*.THydrogen-bonded Turntrans67.25.6-174.600000114.6L90 C91 L92 E96L90-G94 PolarHBondContact O-N 3.27Å; C91-G94 PolarHBondContact O-N 3.08Å; L92-G94 PolarHBondContact O-N 2.75Å; G94-E96 PolarHBondContact O-N 3.34Å
95R91.4Very high96.5Very high89 Ų8955.1 Ų55.134%0.33626%0.26SS..SBendtrans-68.1-24.6173.9-65.1-176.8-179.4-1760.3111.1L90 L93 D179 E269L90-R95 HydrophobicContact CD2-CB 4.4Å; L90-R95 PolarHBondContact O-N 2.94Å; L93-R95 HydrophobicContact CB-CG 4.01Å; L93-R95 PolarHBondContact O-N 2.88Å; L93-R95 VanDerWaalsContact O-N 3.09Å; R95-D179 IonicContact NH2-OD2 2.86Å; R95-E269 IonicContact NH2-OE1 3.02Å
96E94.4Very high96.5Very high37 Ų3759.7 Ų59.717%0.17328%0.283CS..SBendtrans-130.2150.3174.8-80.2-68-170.800114.2L90 G94 K100L90-E96 HydrophobicContact CB-CB 4.22Å; L90-E96 HydrophobicContact CB-CG 4.19Å; L90-E96 PolarHBondContact O-N 2.73Å; L90-E96 VanDerWaalsContact O-N 3.08Å; G94-E96 PolarHBondContact O-N 3.34Å; E96-K100 IonicContact OE1-NZ 2.69Å; E96-K100 PolarHBondContact OE1-NZ 3.24Å; E96-K100 WeakPolarHBondContact OE2-CD 3.28Å; E96-K100 WeakPolarHBondContact OE2-CE 3.43Å; E96-K100 IonicContact OE2-NZ 3.67Å; E96-K100 PolarHBondContact OE2-NZ 3.35Å
97R95.5Very high96.5Very high184 Ų18460.9 Ų60.969%0.69429%0.288SS*.  trans-78.4130.7179.1-63.6-177.7-176.2174.61.4110.2R99 K100R97-R99 PolarHBondContact O-N 2.86Å; R97-K100 HydrophobicContact CB-CG 4.42Å; R97-K100 WeakPolarHBondContact O-CB 3.41Å; R97-K100 PolarHBondContact O-N 3.35Å
98W96.5Very high96.5Very high132 Ų13260.9 Ų60.950%0.529%0.288SS..THydrogen-bonded Turntrans-51.1-31.1176.6-73.3100.3000115.2F88 C91 L92 K100 F101 P102F88-W98 HydrophobicContact CD2-CH2 4.12Å; F88-W98 AromaticContact CD2-CZ3 3.82Å; F88-W98 HydrophobicContact CD2-CZ3 3.82Å; F88-W98 AromaticContact CE2-CH2 3.76Å; F88-W98 HydrophobicContact CE2-CH2 3.76Å; F88-W98 AromaticContact CE2-CZ3 3.65Å; F88-W98 HydrophobicContact CE2-CZ3 3.65Å; F88-W98 HydrophobicContact CZ-CH2 4.29Å; C91-W98 HydrophobicContact CB-CD2 3.77Å; C91-W98 HydrophobicContact CB-CE3 3.78Å; C91-W98 HydrophobicContact CB-CG 4.44Å; C91-W98 HydrophobicContact CB-CH2 3.88Å; C91-W98 HydrophobicContact CB-CZ2 3.86Å; C91-W98 HydrophobicContact CB-CZ3 3.83Å; L92-W98 HydrophobicContact CD2-CH2 3.82Å; L92-W98 HydrophobicContact CD2-CZ2 3.96Å; L92-W98 HydrophobicContact CG-CH2 4.24Å; L92-W98 HydrophobicContact CG-CZ2 4.47Å; W98-K100 PolarHBondContact O-N 3.49Å; W98-F101 WeakPolarHBondContact O-CB 3.37Å; W98-F101 PolarHBondContact O-N 3.36Å; W98-F101 VanDerWaalsContact O-N 3.17Å; W98-P102 VanDerWaalsContact O-CD 3.29Å; W98-P102 WeakPolarHBondContact O-CD 3.1Å
99R94Very high96.5Very high189 Ų18959.7 Ų59.771%0.71328%0.284SS*.THydrogen-bonded Turntrans-62.8-24.2175.4-167.717669.2-177.51.4113.3R97R97-R99 PolarHBondContact O-N 2.86Å
100K94.4Very high96.6Very high37 Ų3762.4 Ų62.416%0.16130%0.298CS..Hα-helixtrans-73.3-34.1176.2-61.5-157.3-170.3166.60112.2L21 E96 R97 W98 M103 Y104L21-K100 HydrophobicContact CD1-CB 4.11Å; L21-K100 HydrophobicContact CD1-CD 4.28Å; L21-K100 HydrophobicContact CD1-CG 3.85Å; E96-K100 IonicContact OE1-NZ 2.69Å; E96-K100 PolarHBondContact OE1-NZ 3.24Å; E96-K100 WeakPolarHBondContact OE2-CD 3.28Å; E96-K100 WeakPolarHBondContact OE2-CE 3.43Å; E96-K100 IonicContact OE2-NZ 3.67Å; E96-K100 PolarHBondContact OE2-NZ 3.35Å; R97-K100 HydrophobicContact CB-CG 4.42Å; R97-K100 WeakPolarHBondContact O-CB 3.41Å; R97-K100 PolarHBondContact O-N 3.35Å; W98-K100 PolarHBondContact O-N 3.49Å; K100-M103 PolarHBondContact O-N 3.5Å; K100-M103 VanDerWaalsContact O-N 3.14Å; K100-Y104 HydrophobicContact CB-CD2 4.14Å; K100-Y104 HydrophobicContact CB-CE2 4.18Å; K100-Y104 HydrophobicContact CD-CE2 4.08Å; K100-Y104 WeakPolarHBondContact O-CD2 3.49Å; K100-Y104 PolarHBondContact O-N 3.01Å
101F97.7Very high96.6Very high37 Ų3761.5 Ų61.516%0.16229%0.293CS..Hα-helixtrans-50.5-54.1-174.4176.7-107.1000114.4P84 T87 F88 W98 M103 Y104 F105 F250P84-F101 WeakPolarHBondContact O-CE2 3.37Å; T87-F101 HydrophobicContact CG2-CD2 3.95Å; F88-F101 HydrophobicContact CB-CD2 4.3Å; F88-F101 HydrophobicContact CB-CE2 3.78Å; F88-F101 HydrophobicContact CB-CZ 4.45Å; F88-F101 HydrophobicContact CD2-CE2 4.07Å; F88-F101 HydrophobicContact CD2-CZ 4.06Å; F88-F101 HydrophobicContact CG-CE2 4.41Å; W98-F101 WeakPolarHBondContact O-CB 3.37Å; W98-F101 PolarHBondContact O-N 3.36Å; W98-F101 VanDerWaalsContact O-N 3.17Å; F101-M103 VanDerWaalsContact C-N 3.31Å; F101-M103 PolarHBondContact O-N 2.87Å; F101-Y104 PolarHBondContact O-N 2.97Å; F101-F105 HydrophobicContact CE1-CD1 4.33Å; F101-F105 AromaticContact CZ-CD1 3.92Å; F101-F105 HydrophobicContact CZ-CD1 3.92Å; F101-F105 WeakPolarHBondContact O-CB 3.4Å; F101-F105 PolarHBondContact O-N 3.49Å; F101-F250 HydrophobicContact CE2-CE1 4Å; F101-F250 AromaticContact CZ-CE1 3.76Å; F101-F250 HydrophobicContact CZ-CE1 3.76Å; F101-F250 HydrophobicContact CZ-CZ 4.03Å
102P97.7Very high96.7Very high78 Ų7861.4 Ų61.451%0.50629%0.292SS..Hα-helixtrans-65-34.2-178.724.7-34.6000112.9W98 L106W98-P102 VanDerWaalsContact O-CD 3.29Å; W98-P102 WeakPolarHBondContact O-CD 3.1Å; P102-L106 VanDerWaalsContact O-CB 3.32Å; P102-L106 WeakPolarHBondContact O-CB 3.17Å; P102-L106 PolarHBondContact O-N 3.03Å
103M97.1Very high96.8Very high73 Ų7360.2 Ų60.236%0.3628%0.284SS..Hα-helixtrans-68-44.4175.7-86-66.3-153.300111.7L21 K100 F101 L106 F107L21-M103 HydrophobicContact CD1-CB 4.22Å; L21-M103 HydrophobicContact CD2-CB 4.42Å; L21-M103 HydrophobicContact CD2-CG 3.94Å; L21-M103 HydrophobicContact CG-CB 4.34Å; L21-M103 HydrophobicContact CG-CG 4.22Å; K100-M103 PolarHBondContact O-N 3.5Å; K100-M103 VanDerWaalsContact O-N 3.14Å; F101-M103 VanDerWaalsContact C-N 3.31Å; F101-M103 PolarHBondContact O-N 2.87Å; M103-L106 PolarHBondContact O-N 3.39Å; M103-F107 WeakPolarHBondContact O-CD2 3.25Å; M103-F107 PolarHBondContact O-N 3.23Å; M103-F107 HydrophobicContact SD-CD2 4.39Å; M103-F107 HydrophobicContact SD-CE2 4.02Å
104Y98.4Very high97Very high1 Ų163 Ų630%0.00429%0.294CS..Hα-helixtrans-63.3-49.1177.5-88.8-129.8000110.6L21 Q24 E28 S78 H81 T87 K100 F101 L106 F107 Q108L21-Y104 HydrophobicContact CD1-CE2 4.24Å; Q24-Y104 HydrophobicContact CB-CE2 3.86Å; Q24-Y104 WeakPolarHBondContact CB-OH 3.36Å; Q24-Y104 PolarHBondContact OE1-OH 2.89Å; E28-Y104 HydrophobicContact CG-CD1 3.55Å; E28-Y104 HydrophobicContact CG-CE1 3.52Å; E28-Y104 HydrophobicContact CG-CG 4.14Å; S78-Y104 PolarHBondContact O-OH 3.38Å; H81-Y104 HydrophobicContact CB-CD1 4.47Å; H81-Y104 AromaticContact CE1-CE1 3.7Å; H81-Y104 AromaticContact ND1-CD1 3.54Å; H81-Y104 AromaticContact ND1-CE1 3.49Å; H81-Y104 WeakPolarHBondContact ND1-CE1 3.46Å; T87-Y104 HydrophobicContact CG2-CD1 4Å; T87-Y104 HydrophobicContact CG2-CG 4.17Å; K100-Y104 HydrophobicContact CB-CD2 4.14Å; K100-Y104 HydrophobicContact CB-CE2 4.18Å; K100-Y104 HydrophobicContact CD-CE2 4.08Å; K100-Y104 WeakPolarHBondContact O-CD2 3.49Å; K100-Y104 PolarHBondContact O-N 3.01Å; F101-Y104 PolarHBondContact O-N 2.97Å; Y104-L106 VanDerWaalsContact C-N 3.34Å; Y104-L106 PolarHBondContact O-N 3.31Å; Y104-F107 PolarHBondContact O-N 3.26Å; Y104-Q108 VanDerWaalsContact O-CB 3.26Å; Y104-Q108 WeakPolarHBondContact O-CB 3.37Å; Y104-Q108 VanDerWaalsContact O-CD 3.24Å; Y104-Q108 WeakPolarHBondContact O-CG 3.38Å; Y104-Q108 PolarHBondContact O-N 3.29Å; Y104-Q108 PolarHBondContact O-OE1 3.4Å
105F98.6Very high97.3Very high45 Ų4559.9 Ų59.920%0.19726%0.263CS..Hα-helixtrans-58.2-47.4178.5-168.4170.3000110.9P84 F101 F107 T109 P215 F250P84-F105 HydrophobicContact CB-CB 4.35Å; P84-F105 HydrophobicContact CB-CD1 4.02Å; P84-F105 HydrophobicContact CB-CD2 3.87Å; P84-F105 HydrophobicContact CB-CE1 4.29Å; P84-F105 HydrophobicContact CB-CE2 4.19Å; P84-F105 HydrophobicContact CB-CG 3.82Å; P84-F105 HydrophobicContact CB-CZ 4.39Å; P84-F105 HydrophobicContact CG-CB 4.33Å; P84-F105 HydrophobicContact CG-CD1 4.38Å; P84-F105 HydrophobicContact CG-CD2 3.31Å; P84-F105 HydrophobicContact CG-CE2 3.67Å; P84-F105 HydrophobicContact CG-CG 3.76Å; P84-F105 HydrophobicContact CG-CZ 4.32Å; F101-F105 HydrophobicContact CE1-CD1 4.33Å; F101-F105 AromaticContact CZ-CD1 3.92Å; F101-F105 HydrophobicContact CZ-CD1 3.92Å; F101-F105 WeakPolarHBondContact O-CB 3.4Å; F101-F105 PolarHBondContact O-N 3.49Å; F105-F107 PolarHBondContact O-N 2.79Å; F105-T109 WeakPolarHBondContact CD2-OG1 3.18Å; F105-T109 WeakPolarHBondContact CE2-OG1 3.47Å; F105-T109 WeakPolarHBondContact O-CB 3.46Å; F105-T109 PolarHBondContact O-N 2.88Å; F105-T109 PolarHBondContact O-OG1 3.09Å; F105-P215 HydrophobicContact CE2-CB 4.35Å; F105-P215 HydrophobicContact CZ-CB 4.17Å; F105-F250 HydrophobicContact CD1-CZ 4.3Å; F105-F250 HydrophobicContact CE1-CE2 4.21Å; F105-F250 AromaticContact CE1-CZ 3.76Å; F105-F250 HydrophobicContact CE1-CZ 3.76Å; F105-F250 HydrophobicContact CZ-CZ 4.36Å
106L98.5Very high97.6Very high95 Ų9555.7 Ų55.750%0.49725%0.247SC..Hα-helixtrans-57.4-50.8177.9178.261.8000111.9P102 M103 Y104 T109 I110P102-L106 VanDerWaalsContact O-CB 3.32Å; P102-L106 WeakPolarHBondContact O-CB 3.17Å; P102-L106 PolarHBondContact O-N 3.03Å; M103-L106 PolarHBondContact O-N 3.39Å; Y104-L106 VanDerWaalsContact C-N 3.34Å; Y104-L106 PolarHBondContact O-N 3.31Å; L106-T109 WeakPolarHBondContact O-CB 3.41Å; L106-T109 PolarHBondContact O-N 2.78Å; L106-I110 HydrophobicContact CD1-CD1 4Å; L106-I110 HydrophobicContact CD1-CG1 4.38Å; L106-I110 HydrophobicContact CG-CD1 3.89Å; L106-I110 VanDerWaalsContact O-CG1 3.29Å; L106-I110 WeakPolarHBondContact O-CG1 3.39Å; L106-I110 PolarHBondContact O-N 2.89Å
107F98.6Very high97.9Very high34 Ų3455.4 Ų55.415%0.14925%0.249CC..Hα-helixtrans-74-33.2-175.8-85.4-103000113.6L22 A25 L26 C29 M103 Y104 F105 T109 I110 G111L22-F107 HydrophobicContact CD1-CE1 4.37Å; L22-F107 HydrophobicContact CD1-CZ 3.9Å; A25-F107 HydrophobicContact CB-CB 3.99Å; A25-F107 HydrophobicContact CB-CD1 4.04Å; A25-F107 HydrophobicContact CB-CD2 3.69Å; A25-F107 HydrophobicContact CB-CE1 4.46Å; A25-F107 HydrophobicContact CB-CE2 4.13Å; A25-F107 HydrophobicContact CB-CG 3.63Å; A25-F107 HydrophobicContact CB-CZ 4.5Å; A25-F107 WeakPolarHBondContact O-CB 3.47Å; A25-F107 WeakPolarHBondContact O-CD1 3.26Å; L26-F107 HydrophobicContact CD2-CD1 4.23Å; L26-F107 HydrophobicContact CD2-CE1 3.73Å; L26-F107 HydrophobicContact CG-CE1 4.13Å; C29-F107 VanDerWaalsContact CA-O 3.31Å; C29-F107 WeakPolarHBondContact CA-O 3.33Å; C29-F107 HydrophobicContact CB-CB 4.12Å; C29-F107 HydrophobicContact CB-CD1 3.98Å; C29-F107 WeakPolarHBondContact CB-O 3.3Å; M103-F107 WeakPolarHBondContact O-CD2 3.25Å; M103-F107 PolarHBondContact O-N 3.23Å; M103-F107 HydrophobicContact SD-CD2 4.39Å; M103-F107 HydrophobicContact SD-CE2 4.02Å; Y104-F107 PolarHBondContact O-N 3.26Å; F105-F107 PolarHBondContact O-N 2.79Å; F107-T109 VanDerWaalsContact C-N 3.29Å; F107-T109 PolarHBondContact O-N 2.86Å; F107-I110 PolarHBondContact O-N 2.88Å; F107-G111 PolarHBondContact O-N 2.97Å
108Q98.8Very high98Very high0 Ų050.1 Ų50.10%023%0.234CC..Hα-helixtrans-59.8-43.8169.1-70.4159.2-5.900110E28 T32 P84 T87 Y104 G111 A112 A216E28-Q108 HydrophobicContact CB-CG 4.07Å; E28-Q108 WeakPolarHBondContact OE2-CG 3.37Å; E28-Q108 PolarHBondContact OE2-NE2 3.49Å; T32-Q108 HydrophobicContact CG2-CB 4.42Å; T32-Q108 VanDerWaalsContact CG2-O 3.23Å; T32-Q108 WeakPolarHBondContact CG2-O 3.41Å; P84-Q108 VanDerWaalsContact CG-OE1 3.28Å; P84-Q108 VanDerWaalsContact N-OE1 3.09Å; T87-Q108 PolarHBondContact OG1-NE2 3.25Å; Y104-Q108 VanDerWaalsContact O-CB 3.26Å; Y104-Q108 WeakPolarHBondContact O-CB 3.37Å; Y104-Q108 VanDerWaalsContact O-CD 3.24Å; Y104-Q108 WeakPolarHBondContact O-CG 3.38Å; Y104-Q108 PolarHBondContact O-N 3.29Å; Y104-Q108 PolarHBondContact O-OE1 3.4Å; Q108-G111 PolarHBondContact O-N 3.31Å; Q108-A112 WeakPolarHBondContact O-CB 3.15Å; Q108-A112 PolarHBondContact O-N 3.47Å; Q108-A216 HydrophobicContact CB-CB 3.7Å
109T98.8Very high98.1Very high14 Ų1444 Ų449%0.08621%0.211CC..Hα-helixtrans-65.5-42.3178.4-55.30000111.9F105 L106 F107 A112 F113 F219 L223F105-T109 WeakPolarHBondContact CD2-OG1 3.18Å; F105-T109 WeakPolarHBondContact CE2-OG1 3.47Å; F105-T109 WeakPolarHBondContact O-CB 3.46Å; F105-T109 PolarHBondContact O-N 2.88Å; F105-T109 PolarHBondContact O-OG1 3.09Å; L106-T109 WeakPolarHBondContact O-CB 3.41Å; L106-T109 PolarHBondContact O-N 2.78Å; F107-T109 VanDerWaalsContact C-N 3.29Å; F107-T109 PolarHBondContact O-N 2.86Å; T109-A112 PolarHBondContact O-N 2.94Å; T109-F113 WeakPolarHBondContact O-CB 3.48Å; T109-F113 PolarHBondContact O-N 3.39Å; T109-F219 HydrophobicContact CG2-CD1 3.82Å; T109-F219 HydrophobicContact CG2-CE1 4.43Å; T109-L223 HydrophobicContact CG2-CD1 4.32Å
110I98.8Very high98.3Very high59 Ų5936.5 Ų36.530%0.30318%0.183SC..Hα-helixtrans-61.9-44.2174-70167.7000110.5L106 F107 A112 F113 F114L106-I110 HydrophobicContact CD1-CD1 4Å; L106-I110 HydrophobicContact CD1-CG1 4.38Å; L106-I110 HydrophobicContact CG-CD1 3.89Å; L106-I110 VanDerWaalsContact O-CG1 3.29Å; L106-I110 WeakPolarHBondContact O-CG1 3.39Å; L106-I110 PolarHBondContact O-N 2.89Å; F107-I110 PolarHBondContact O-N 2.88Å; I110-A112 PolarHBondContact O-N 3.36Å; I110-F113 WeakPolarHBondContact O-CB 3.43Å; I110-F113 PolarHBondContact O-N 3.09Å; I110-F114 HydrophobicContact CG2-CD2 3.6Å; I110-F114 HydrophobicContact CG2-CE2 3.43Å; I110-F114 VanDerWaalsContact CG2-CE2 3.43Å; I110-F114 VanDerWaalsContact O-CD2 3.25Å; I110-F114 WeakPolarHBondContact O-CD2 3.25Å; I110-F114 PolarHBondContact O-N 3.02Å
111G98.8Very high98.5Very high0 Ų037 Ų370%020%0.199CC..Hα-helixtrans-58.6-48.2175.600000112.1C29 L33 F107 Q108 F113 F114 G115C29-G111 WeakPolarHBondContact O-CA 3.23Å; C29-G111 VanDerWaalsContact SG-CA 3.53Å; L33-G111 VanDerWaalsContact CA-O 3.26Å; L33-G111 WeakPolarHBondContact CA-O 3.39Å; L33-G111 WeakPolarHBondContact CB-O 3.46Å; F107-G111 PolarHBondContact O-N 2.97Å; Q108-G111 PolarHBondContact O-N 3.31Å; G111-F113 PolarHBondContact O-N 3.5Å; G111-F114 PolarHBondContact O-N 2.74Å; G111-G115 PolarHBondContact O-N 3.44Å
112A98.9Very high98.5Very high0 Ų041.1 Ų41.10%022%0.22CC..Hα-helixtrans-60.5-43.6176.500000112.5T32 V36 Q108 T109 I110 G115 A116 A216 P221T32-A112 HydrophobicContact CG2-CB 3.86Å; V36-A112 WeakPolarHBondContact CG1-O 3.37Å; V36-A112 HydrophobicContact CG2-CB 3.75Å; Q108-A112 WeakPolarHBondContact O-CB 3.15Å; Q108-A112 PolarHBondContact O-N 3.47Å; T109-A112 PolarHBondContact O-N 2.94Å; I110-A112 PolarHBondContact O-N 3.36Å; A112-G115 PolarHBondContact O-N 3.36Å; A112-A116 PolarHBondContact O-N 3.3Å; A112-A216 WeakPolarHBondContact CB-O 3.48Å; A112-P221 HydrophobicContact CB-CG 4.39Å
113F98.8Very high98.5Very high51 Ų5139.7 Ų39.722%0.22421%0.205CC..Hα-helixtrans-57.6-49174.6176.4-80.3000111.6T109 I110 G111 A116 S117 L223 F224 I227T109-F113 WeakPolarHBondContact O-CB 3.48Å; T109-F113 PolarHBondContact O-N 3.39Å; I110-F113 WeakPolarHBondContact O-CB 3.43Å; I110-F113 PolarHBondContact O-N 3.09Å; G111-F113 PolarHBondContact O-N 3.5Å; F113-A116 PolarHBondContact O-N 3.33Å; F113-S117 PolarHBondContact O-N 3.28Å; F113-L223 HydrophobicContact CD2-CB 4.12Å; F113-L223 HydrophobicContact CE2-CB 4.46Å; F113-F224 HydrophobicContact CD2-CB 3.63Å; F113-F224 HydrophobicContact CE1-CD2 4.29Å; F113-F224 VanDerWaalsContact CE2-CA 3.42Å; F113-F224 HydrophobicContact CE2-CB 3.66Å; F113-F224 HydrophobicContact CE2-CD2 4.18Å; F113-F224 HydrophobicContact CE2-CG 4.45Å; F113-F224 HydrophobicContact CG-CB 4.24Å; F113-F224 HydrophobicContact CZ-CB 4.28Å; F113-F224 AromaticContact CZ-CD2 3.95Å; F113-F224 HydrophobicContact CZ-CD2 3.95Å; F113-I227 HydrophobicContact CE2-CD1 4.11Å; F113-I227 HydrophobicContact CZ-CD1 3.89Å
114F98.8Very high98.5Very high103 Ų10340.8 Ų40.845%0.45221%0.206SC..Hα-helixtrans-68.3-38.6179.4-76.1-57.7000112.4L33 I110 G111 A116 S117 I118L33-F114 HydrophobicContact CD1-CB 3.96Å; I110-F114 HydrophobicContact CG2-CD2 3.6Å; I110-F114 HydrophobicContact CG2-CE2 3.43Å; I110-F114 VanDerWaalsContact CG2-CE2 3.43Å; I110-F114 VanDerWaalsContact O-CD2 3.25Å; I110-F114 WeakPolarHBondContact O-CD2 3.25Å; I110-F114 PolarHBondContact O-N 3.02Å; G111-F114 PolarHBondContact O-N 2.74Å; F114-A116 VanDerWaalsContact C-N 3.29Å; F114-A116 PolarHBondContact O-N 3Å; F114-S117 WeakPolarHBondContact CA-OG 3.43Å; F114-S117 PolarHBondContact O-N 3.13Å; F114-S117 VanDerWaalsContact O-N 3.12Å; F114-S117 PolarHBondContact O-OG 3.35Å; F114-I118 WeakPolarHBondContact O-CG1 3.46Å; F114-I118 PolarHBondContact O-N 3.37Å
115G98.8Very high98.4Very high0 Ų047.1 Ų47.10%024%0.24CC..Hα-helixtrans-56.7-43.8174.100000112.1G111 A112 I119G111-G115 PolarHBondContact O-N 3.44Å; A112-G115 PolarHBondContact O-N 3.36Å; G115-I119 PolarHBondContact O-N 3.25Å
116A98.8Very high98.2Very high0 Ų047 Ų470%025%0.247CC..Hα-helixtrans-64.2-43.5173.600000112.6V36 A112 F113 F114 I118 I119 F120 F146 P221 F224V36-A116 HydrophobicContact CG1-CB 4.39Å; A112-A116 PolarHBondContact O-N 3.3Å; F113-A116 PolarHBondContact O-N 3.33Å; F114-A116 VanDerWaalsContact C-N 3.29Å; F114-A116 PolarHBondContact O-N 3Å; A116-I118 VanDerWaalsContact C-N 3.31Å; A116-I118 PolarHBondContact O-N 3.32Å; A116-I119 PolarHBondContact O-N 2.93Å; A116-F120 PolarHBondContact O-N 2.79Å; A116-F146 HydrophobicContact CB-CD1 3.86Å; A116-F146 WeakPolarHBondContact O-CE1 3.35Å; A116-P221 HydrophobicContact CB-CB 3.71Å; A116-P221 HydrophobicContact CB-CG 4Å; A116-F224 HydrophobicContact CB-CB 4.4Å; A116-F224 HydrophobicContact CB-CD1 4.03Å; A116-F224 HydrophobicContact CB-CG 4.35Å
117S98.7Very high98.1Very high31 Ų3142.5 Ų42.522%0.21722%0.224CC..Hα-helixtrans-61.9-36179.474.50000113.6F113 F114 F120 G121 F224F113-S117 PolarHBondContact O-N 3.28Å; F114-S117 WeakPolarHBondContact CA-OG 3.43Å; F114-S117 PolarHBondContact O-N 3.13Å; F114-S117 VanDerWaalsContact O-N 3.12Å; F114-S117 PolarHBondContact O-OG 3.35Å; S117-F120 PolarHBondContact O-N 2.97Å; S117-G121 PolarHBondContact O-N 2.92Å; S117-F224 VanDerWaalsContact CB-CE2 3.45Å
118I98.8Very high97.8Very high74 Ų7448.5 Ų48.538%0.37925%0.245SC..Hα-helixtrans-64.8-46.6176.8-70.5165.2000109.8L33 M37 F114 A116 G121 M122L33-I118 HydrophobicContact CD1-CD1 4.17Å; L33-I118 HydrophobicContact CD2-CD1 4.1Å; L33-I118 HydrophobicContact CG-CD1 4.35Å; M37-I118 HydrophobicContact CG-CG2 4.22Å; M37-I118 HydrophobicContact SD-CD1 4.43Å; M37-I118 HydrophobicContact SD-CG2 4.04Å; F114-I118 WeakPolarHBondContact O-CG1 3.46Å; F114-I118 PolarHBondContact O-N 3.37Å; A116-I118 VanDerWaalsContact C-N 3.31Å; A116-I118 PolarHBondContact O-N 3.32Å; I118-G121 PolarHBondContact O-N 2.81Å; I118-M122 WeakPolarHBondContact O-CB 3.37Å; I118-M122 PolarHBondContact O-N 3.19Å
119I98.6Very high97.5Very high4 Ų455.2 Ų55.22%0.02128%0.282CS..Hα-helixtrans-66.7-38.9179.1-65.4-54.6000111.9M37 C40 A44 G115 A116 M122 Y123 F146M37-I119 HydrophobicContact CG-CD1 3.8Å; M37-I119 HydrophobicContact CG-CG1 4.09Å; M37-I119 WeakPolarHBondContact O-CD1 3.42Å; M37-I119 WeakPolarHBondContact O-CG1 3.26Å; C40-I119 HydrophobicContact CB-CB 4.41Å; C40-I119 HydrophobicContact CB-CG1 4.28Å; C40-I119 HydrophobicContact CB-CG2 4.18Å; A44-I119 HydrophobicContact CB-CG2 4.04Å; G115-I119 PolarHBondContact O-N 3.25Å; A116-I119 PolarHBondContact O-N 2.93Å; I119-M122 HydrophobicContact CD1-CE 3.57Å; I119-M122 PolarHBondContact O-N 3.47Å; I119-Y123 HydrophobicContact CG2-CD2 3.93Å; I119-Y123 HydrophobicContact CG2-CE2 4.43Å; I119-Y123 PolarHBondContact O-N 3.31Å; I119-F146 HydrophobicContact CB-CE1 4.45Å; I119-F146 HydrophobicContact CG2-CE1 4.25Å
120F98.3Very high97.2Very high30 Ų3055.1 Ų55.113%0.13228%0.28CS..Hα-helixtrans-57.8-48.6172.3172.6-90000111.9A116 S117 M122 Y123 Y124 L127 F134 F146 F224 A228 W230A116-F120 PolarHBondContact O-N 2.79Å; S117-F120 PolarHBondContact O-N 2.97Å; F120-M122 PolarHBondContact O-N 2.93Å; F120-Y123 CarbonylContact O-C 3.6Å; F120-Y123 PolarHBondContact O-N 2.9Å; F120-Y124 HydrophobicContact CD1-CD2 4.3Å; F120-Y124 AromaticContact CE1-CD2 3.58Å; F120-Y124 HydrophobicContact CE1-CD2 3.58Å; F120-Y124 AromaticContact CE1-CE2 3.88Å; F120-Y124 HydrophobicContact CE1-CE2 3.88Å; F120-Y124 HydrophobicContact CE2-CD2 4.38Å; F120-Y124 AromaticContact CZ-CD2 3.63Å; F120-Y124 HydrophobicContact CZ-CD2 3.63Å; F120-Y124 AromaticContact CZ-CE2 3.66Å; F120-Y124 HydrophobicContact CZ-CE2 3.66Å; F120-Y124 VanDerWaalsContact O-CA 3.31Å; F120-Y124 WeakPolarHBondContact O-CA 3.22Å; F120-Y124 WeakPolarHBondContact O-CB 3.25Å; F120-Y124 PolarHBondContact O-N 3.14Å; F120-L127 HydrophobicContact CD2-CD1 3.96Å; F120-L127 HydrophobicContact CE2-CD1 4.46Å; F120-F134 AromaticContact CE2-CE1 3.69Å; F120-F134 HydrophobicContact CE2-CE1 3.69Å; F120-F134 HydrophobicContact CE2-CZ 4.24Å; F120-F134 HydrophobicContact CZ-CE1 4.29Å; F120-F134 HydrophobicContact CZ-CZ 4.4Å; F120-F146 HydrophobicContact CB-CE1 4Å; F120-F146 HydrophobicContact CB-CZ 3.91Å; F120-F146 HydrophobicContact CD2-CZ 4.21Å; F120-F224 HydrophobicContact CB-CE1 3.44Å; F120-F224 VanDerWaalsContact CB-CE1 3.44Å; F120-F224 HydrophobicContact CB-CZ 3.51Å; F120-F224 HydrophobicContact CD1-CE1 4.34Å; F120-F224 AromaticContact CD1-CZ 3.69Å; F120-F224 HydrophobicContact CD1-CZ 3.69Å; F120-F224 AromaticContact CD2-CE1 3.9Å; F120-F224 HydrophobicContact CD2-CE1 3.9Å; F120-F224 HydrophobicContact CD2-CZ 4.02Å; F120-F224 HydrophobicContact CE1-CZ 4.38Å; F120-F224 AromaticContact CG-CE1 3.65Å; F120-F224 HydrophobicContact CG-CE1 3.65Å; F120-F224 AromaticContact CG-CZ 3.48Å; F120-F224 HydrophobicContact CG-CZ 3.48Å; F120-F224 VanDerWaalsContact CG-CZ 3.48Å; F120-A228 HydrophobicContact CE2-CB 4.2Å; F120-A228 HydrophobicContact CZ-CB 4.35Å; F120-W230 AromaticContact CD2-CH2 3.95Å; F120-W230 HydrophobicContact CD2-CH2 3.95Å; F120-W230 AromaticContact CD2-CZ3 3.82Å; F120-W230 HydrophobicContact CD2-CZ3 3.82Å; F120-W230 AromaticContact CE2-CH2 3.95Å; F120-W230 HydrophobicContact CE2-CH2 3.95Å; F120-W230 AromaticContact CE2-CZ3 3.62Å; F120-W230 HydrophobicContact CE2-CZ3 3.62Å
121G98.1Very high96.5Very high48 Ų4855 Ų5550%0.49528%0.283SS..Hα-helixtrans-63.9-40.1177.500000112.6S117 I118 Y124S117-G121 PolarHBondContact O-N 2.92Å; I118-G121 PolarHBondContact O-N 2.81Å; G121-Y124 WeakPolarHBondContact O-CB 3.5Å; G121-Y124 PolarHBondContact O-N 3.41Å
122M97.9Very high95.4Very high123 Ų12356.3 Ų56.361%0.60630%0.296SS*.Hα-helixtrans-68.1-34.4-179.5-169.6173.175.800113.3I118 I119 F120I118-M122 WeakPolarHBondContact O-CB 3.37Å; I118-M122 PolarHBondContact O-N 3.19Å; I119-M122 HydrophobicContact CD1-CE 3.57Å; I119-M122 PolarHBondContact O-N 3.47Å; F120-M122 PolarHBondContact O-N 2.93Å
123Y97.4Very high94.7Very high48 Ų4858.3 Ų58.319%0.18831%0.31CS..THydrogen-bonded Turntrans-104.317178.4-76.5-83.8000113.1A44 Q45 L48 I119 F120 D125 A126 L127A44-Y123 HydrophobicContact CB-CD1 4.38Å; A44-Y123 HydrophobicContact CB-CD2 3.73Å; A44-Y123 HydrophobicContact CB-CE2 3.86Å; A44-Y123 HydrophobicContact CB-CG 3.99Å; Q45-Y123 PolarHBondContact OE1-OH 3.04Å; L48-Y123 HydrophobicContact CD1-CD1 3.79Å; L48-Y123 HydrophobicContact CD1-CG 4.01Å; I119-Y123 HydrophobicContact CG2-CD2 3.93Å; I119-Y123 HydrophobicContact CG2-CE2 4.43Å; I119-Y123 PolarHBondContact O-N 3.31Å; F120-Y123 CarbonylContact O-C 3.6Å; F120-Y123 PolarHBondContact O-N 2.9Å; Y123-D125 PolarHBondContact O-N 3.42Å; Y123-A126 HydrophobicContact CD1-CB 4.27Å; Y123-A126 PolarHBondContact O-N 3.39Å; Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 WeakPolarHBondContact O-CG 3.39Å; Y123-L127 PolarHBondContact O-N 3.39Å
124Y96.7Very high94.1Very high96 Ų9658.1 Ų58.138%0.37631%0.309SS..Hα-helixtrans-57.4-48.2-172-174.7-98.1000112.6F120 G121 A126 L127 W128F120-Y124 HydrophobicContact CD1-CD2 4.3Å; F120-Y124 AromaticContact CE1-CD2 3.58Å; F120-Y124 HydrophobicContact CE1-CD2 3.58Å; F120-Y124 AromaticContact CE1-CE2 3.88Å; F120-Y124 HydrophobicContact CE1-CE2 3.88Å; F120-Y124 HydrophobicContact CE2-CD2 4.38Å; F120-Y124 AromaticContact CZ-CD2 3.63Å; F120-Y124 HydrophobicContact CZ-CD2 3.63Å; F120-Y124 AromaticContact CZ-CE2 3.66Å; F120-Y124 HydrophobicContact CZ-CE2 3.66Å; F120-Y124 VanDerWaalsContact O-CA 3.31Å; F120-Y124 WeakPolarHBondContact O-CA 3.22Å; F120-Y124 WeakPolarHBondContact O-CB 3.25Å; F120-Y124 PolarHBondContact O-N 3.14Å; G121-Y124 WeakPolarHBondContact O-CB 3.5Å; G121-Y124 PolarHBondContact O-N 3.41Å; Y124-A126 PolarHBondContact O-N 3.43Å; Y124-L127 WeakPolarHBondContact O-CB 3.45Å; Y124-L127 PolarHBondContact O-N 2.86Å; Y124-W128 PolarHBondContact O-N 3.45Å
125D96.6Very high93.4Very high134 Ų13455.5 Ų55.572%0.71730%0.3SS*.Hα-helixtrans-64.9-41.4180-61.8-20.1000111.7Y123 L127 W128 D129Y123-D125 PolarHBondContact O-N 3.42Å; D125-L127 VanDerWaalsContact C-N 3.35Å; D125-L127 PolarHBondContact O-N 2.96Å; D125-W128 PolarHBondContact O-N 3.03Å; D125-D129 PolarHBondContact O-N 3.49Å
126A95.4Very high92.6Very high42 Ų4256.9 Ų56.935%0.34731%0.307SS..Hα-helixtrans-66.6-35.6176.900000112.2L48 Y123 Y124 W128 F130L48-A126 HydrophobicContact CB-CB 4.4Å; L48-A126 HydrophobicContact CD1-CB 4.02Å; Y123-A126 HydrophobicContact CD1-CB 4.27Å; Y123-A126 PolarHBondContact O-N 3.39Å; Y124-A126 PolarHBondContact O-N 3.43Å; A126-W128 VanDerWaalsContact C-N 3.34Å; A126-F130 WeakPolarHBondContact O-CB 3.17Å; A126-F130 PolarHBondContact O-N 2.87Å; A126-F130 VanDerWaalsContact O-N 3.12Å
127L95Very high91.2Very high1 Ų162.5 Ų62.51%0.00534%0.341CS..Hα-helixtrans-66.3-37.2173.3-83.9162.7000112L48 F120 Y123 Y124 D125 C133 T142 I145 F146 W230L48-L127 HydrophobicContact CD1-CD2 4.23Å; L48-L127 HydrophobicContact CD1-CG 3.91Å; L48-L127 HydrophobicContact CD2-CD2 3.85Å; L48-L127 HydrophobicContact CD2-CG 4.24Å; F120-L127 HydrophobicContact CD2-CD1 3.96Å; F120-L127 HydrophobicContact CE2-CD1 4.46Å; Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 WeakPolarHBondContact O-CG 3.39Å; Y123-L127 PolarHBondContact O-N 3.39Å; Y124-L127 WeakPolarHBondContact O-CB 3.45Å; Y124-L127 PolarHBondContact O-N 2.86Å; D125-L127 VanDerWaalsContact C-N 3.35Å; D125-L127 PolarHBondContact O-N 2.96Å; L127-C133 WeakPolarHBondContact O-CB 3.39Å; L127-C133 PolarHBondContact O-SG 2.8Å; L127-T142 HydrophobicContact CD2-CG2 4.28Å; L127-I145 HydrophobicContact CD2-CD1 4.02Å; L127-F146 HydrophobicContact CD1-CZ 4.28Å; L127-W230 HydrophobicContact CD1-CH2 4.47Å; L127-W230 HydrophobicContact CD2-CH2 4.37Å; L127-W230 HydrophobicContact CD2-CZ2 4.31Å
128W92.8Very high89.8Confident160 Ų16063 Ų6361%0.60635%0.345SS*.Hα-helixtrans-72.6-37.2179.9-161.4-89.6000112.3Y124 D125 A126 F130 F134Y124-W128 PolarHBondContact O-N 3.45Å; D125-W128 PolarHBondContact O-N 3.03Å; A126-W128 VanDerWaalsContact C-N 3.34Å; W128-F130 VanDerWaalsContact C-N 3.32Å; W128-F134 AromaticContact CE3-CE2 3.95Å; W128-F134 HydrophobicContact CE3-CE2 3.95Å; W128-F134 HydrophobicContact CE3-CZ 4.13Å; W128-F134 AromaticContact CZ3-CE2 3.62Å; W128-F134 HydrophobicContact CZ3-CE2 3.62Å; W128-F134 HydrophobicContact CZ3-CZ 4.15Å
129D93.8Very high88.5Confident142 Ų14267.4 Ų67.476%0.75936%0.364SS*.Hα-helixtrans-73.8-23.1175.5-168.858.6000112.9D125D125-D129 PolarHBondContact O-N 3.49Å
130F92.3Very high87.4Confident12 Ų1272 Ų725%0.05338%0.382CS..SBendtrans-70.6131.4-177.8-161.5-104.1000112.3V47 L48 Y50 A126 W128 G132 C133 Y140 T142V47-F130 HydrophobicContact CG1-CE1 4.22Å; V47-F130 HydrophobicContact CG1-CZ 4.04Å; V47-F130 VanDerWaalsContact O-CE2 3.29Å; V47-F130 WeakPolarHBondContact O-CE2 3.37Å; L48-F130 HydrophobicContact CD2-CB 3.87Å; L48-F130 HydrophobicContact CD2-CD1 4.26Å; L48-F130 HydrophobicContact CD2-CD2 4.02Å; L48-F130 HydrophobicContact CD2-CG 3.81Å; Y50-F130 AromaticContact CD1-CE2 3.88Å; Y50-F130 HydrophobicContact CD1-CE2 3.88Å; Y50-F130 HydrophobicContact CD1-CZ 4.4Å; Y50-F130 HydrophobicContact CD2-CE2 4.45Å; Y50-F130 HydrophobicContact CE1-CD2 4.12Å; Y50-F130 AromaticContact CE1-CE2 3.38Å; Y50-F130 HydrophobicContact CE1-CE2 3.38Å; Y50-F130 AromaticContact CE1-CZ 3.97Å; Y50-F130 HydrophobicContact CE1-CZ 3.97Å; Y50-F130 HydrophobicContact CE2-CD2 4.18Å; Y50-F130 HydrophobicContact CE2-CE2 4.02Å; Y50-F130 HydrophobicContact CG-CE2 4.4Å; Y50-F130 AromaticContact CZ-CD2 3.73Å; Y50-F130 AromaticContact CZ-CE2 3.47Å; Y50-F130 VanDerWaalsContact CZ-CE2 3.47Å; A126-F130 WeakPolarHBondContact O-CB 3.17Å; A126-F130 PolarHBondContact O-N 2.87Å; A126-F130 VanDerWaalsContact O-N 3.12Å; W128-F130 VanDerWaalsContact C-N 3.32Å; F130-G132 PolarHBondContact O-N 3.12Å; F130-C133 PolarHBondContact O-N 3.16Å; F130-C133 VanDerWaalsContact O-N 3.12Å; F130-Y140 AromaticContact CE1-CD1 3.94Å; F130-Y140 HydrophobicContact CE1-CD1 3.94Å; F130-Y140 HydrophobicContact CE1-CG 4.37Å; F130-Y140 AromaticContact CZ-CD1 3.98Å; F130-Y140 HydrophobicContact CZ-CD1 3.98Å; F130-T142 HydrophobicContact CD1-CG2 3.67Å; F130-T142 HydrophobicContact CE1-CG2 4.07Å
131P84.3Confident86.8Confident57 Ų5772.7 Ų72.737%0.3739%0.387SS..THydrogen-bonded Turntrans-55.7130171.2-22.332.4000110.2Y50 Y140Y50-P131 WeakPolarHBondContact OH-CD 3.3Å; Y50-P131 WeakPolarHBondContact OH-CG 3.1Å; P131-Y140 HydrophobicContact CB-CD2 4.34Å; P131-Y140 HydrophobicContact CB-CE2 4.5Å; P131-Y140 HydrophobicContact CB-CG 4.37Å; P131-Y140 WeakPolarHBondContact O-CB 3.24Å
132G75.1Confident86.6Confident27 Ų2770.4 Ų70.428%0.27836%0.363SS..THydrogen-bonded Turntrans78.531.8-175.300000114F130 F134 N135 T142F130-G132 PolarHBondContact O-N 3.12Å; G132-F134 PolarHBondContact O-N 3.31Å; G132-N135 WeakPolarHBondContact O-CB 3.25Å; G132-N135 PolarHBondContact O-N 2.92Å; G132-T142 PolarHBondContact O-OG1 3.23Å
133C83Confident86.5Confident42 Ų4264.5 Ų64.528%0.28433%0.334SS..THydrogen-bonded Turntrans-42.8129.5162.7-1690000110.7L127 F130 N135L127-C133 WeakPolarHBondContact O-CB 3.39Å; L127-C133 PolarHBondContact O-SG 2.8Å; F130-C133 PolarHBondContact O-N 3.16Å; F130-C133 VanDerWaalsContact O-N 3.12Å; C133-N135 PolarHBondContact O-N 2.91Å
134F86.3Confident86.3Confident47 Ų4763.7 Ų63.721%0.20634%0.34CS..THydrogen-bonded Turntrans55.729.5-178.3-46.9-44.1000116.3F120 W128 G132 T142 W230F120-F134 AromaticContact CE2-CE1 3.69Å; F120-F134 HydrophobicContact CE2-CE1 3.69Å; F120-F134 HydrophobicContact CE2-CZ 4.24Å; F120-F134 HydrophobicContact CZ-CE1 4.29Å; F120-F134 HydrophobicContact CZ-CZ 4.4Å; W128-F134 AromaticContact CE3-CE2 3.95Å; W128-F134 HydrophobicContact CE3-CE2 3.95Å; W128-F134 HydrophobicContact CE3-CZ 4.13Å; W128-F134 AromaticContact CZ3-CE2 3.62Å; W128-F134 HydrophobicContact CZ3-CE2 3.62Å; W128-F134 HydrophobicContact CZ3-CZ 4.15Å; G132-F134 PolarHBondContact O-N 3.31Å; F134-T142 PolarHBondContact N-OG1 3.09Å; F134-W230 HydrophobicContact CB-CD2 4.22Å; F134-W230 HydrophobicContact CB-CG 4.36Å; F134-W230 AromaticContact CD1-CD2 3.89Å; F134-W230 HydrophobicContact CD1-CD2 3.89Å; F134-W230 AromaticContact CD1-CE2 3.84Å; F134-W230 AromaticContact CD1-CE3 3.67Å; F134-W230 HydrophobicContact CD1-CE3 3.67Å; F134-W230 AromaticContact CD1-CH2 3.38Å; F134-W230 HydrophobicContact CD1-CH2 3.38Å; F134-W230 AromaticContact CD1-CZ2 3.61Å; F134-W230 HydrophobicContact CD1-CZ2 3.61Å; F134-W230 AromaticContact CD1-CZ3 3.42Å; F134-W230 HydrophobicContact CD1-CZ3 3.42Å; F134-W230 VanDerWaalsContact CD1-CZ3 3.42Å; F134-W230 HydrophobicContact CE1-CE3 4.35Å; F134-W230 AromaticContact CE1-CH2 3.62Å; F134-W230 HydrophobicContact CE1-CH2 3.62Å; F134-W230 HydrophobicContact CE1-CZ2 4.24Å; F134-W230 AromaticContact CE1-CZ3 3.69Å; F134-W230 HydrophobicContact CE1-CZ3 3.69Å; F134-W230 HydrophobicContact CG-CE3 4.5Å
135N84.9Confident86.3Confident48 Ų4859.2 Ų59.226%0.25732%0.323SS..  trans-94.5146.2179.5-156.4-42.7000113G132 C133 T137 S138 N141 T142 A143 W230G132-N135 WeakPolarHBondContact O-CB 3.25Å; G132-N135 PolarHBondContact O-N 2.92Å; C133-N135 PolarHBondContact O-N 2.91Å; N135-T137 PolarHBondContact OD1-N 3.25Å; N135-S138 WeakPolarHBondContact ND2-CB 3.39Å; N135-S138 PolarHBondContact ND2-OG 3.47Å; N135-S138 PolarHBondContact OD1-N 2.9Å; N135-S138 VanDerWaalsContact OD1-N 3.11Å; N135-S138 PolarHBondContact OD1-OG 3.04Å; N135-N141 PolarHBondContact O-OD1 3.36Å; N135-N141 VanDerWaalsContact O-OD1 3.14Å; N135-T142 PolarHBondContact N-OG1 2.66Å; N135-T142 PolarHBondContact O-N 3.42Å; N135-T142 VanDerWaalsContact O-N 3.08Å; N135-T142 PolarHBondContact O-OG1 2.9Å; N135-A143 PolarHBondContact O-N 3.26Å; N135-W230 PolarHBondContact O-NE1 2.81Å
136L81.4Confident86.4Confident29 Ų2952.9 Ų52.915%0.15229%0.289CS..SBendtrans-110.1-28-179.6-69.384.7000114.1N141 A143 W230 V234L136-N141 VanDerWaalsContact O-CG 3.29Å; L136-N141 PolarHBondContact O-ND2 3.47Å; L136-N141 VanDerWaalsContact O-ND2 3.16Å; L136-A143 HydrophobicContact CG-CB 4.21Å; L136-W230 HydrophobicContact CD1-CB 3.91Å; L136-W230 HydrophobicContact CD1-CG 4.25Å; L136-W230 WeakPolarHBondContact CD1-O 3.22Å; L136-V234 HydrophobicContact CD2-CB 4.21Å; L136-V234 HydrophobicContact CD2-CG1 3.62Å; L136-V234 HydrophobicContact CG-CG1 4.29Å
137T69.8Low86.5Confident117 Ų11750.9 Ų50.972%0.71827%0.273SS*.SBendtrans-127.2-12.4-161.743.90000114.5N135N135-T137 PolarHBondContact OD1-N 3.25Å
138S70.6Confident86.5Confident43 Ų4351.2 Ų51.230%0.30128%0.275SS..SBendtrans-76.8175176.973.40000112.4N135 Y140 N141N135-S138 WeakPolarHBondContact ND2-CB 3.39Å; N135-S138 PolarHBondContact ND2-OG 3.47Å; N135-S138 PolarHBondContact OD1-N 2.9Å; N135-S138 VanDerWaalsContact OD1-N 3.11Å; N135-S138 PolarHBondContact OD1-OG 3.04Å; S138-Y140 PolarHBondContact O-N 3.04Å; S138-Y140 PolarHBondContact OG-N 3.31Å; S138-N141 PolarHBondContact O-N 3.45Å
139E69.9Low86.7Confident166 Ų16645 Ų4578%0.77625%0.252SS*.THydrogen-bonded Turntrans-56-27.9169.7-173.4170.4178.600112.5N141E139-N141 PolarHBondContact O-N 3.08Å
140Y75.7Confident86.7Confident101 Ų10138.8 Ų38.840%0.39622%0.219SC..THydrogen-bonded Turntrans-101.653177.9-56.6-74.8000111.7Y50 F130 P131 S138 T142Y50-Y140 HydrophobicContact CE1-CE1 4.49Å; F130-Y140 AromaticContact CE1-CD1 3.94Å; F130-Y140 HydrophobicContact CE1-CD1 3.94Å; F130-Y140 HydrophobicContact CE1-CG 4.37Å; F130-Y140 AromaticContact CZ-CD1 3.98Å; F130-Y140 HydrophobicContact CZ-CD1 3.98Å; P131-Y140 HydrophobicContact CB-CD2 4.34Å; P131-Y140 HydrophobicContact CB-CE2 4.5Å; P131-Y140 HydrophobicContact CB-CG 4.37Å; P131-Y140 WeakPolarHBondContact O-CB 3.24Å; S138-Y140 PolarHBondContact O-N 3.04Å; S138-Y140 PolarHBondContact OG-N 3.31Å; Y140-T142 PolarHBondContact O-N 2.89Å
141N86.6Confident86.8Confident43 Ų4339.4 Ų39.423%0.2323%0.226CC..  trans-68.1115176.61774.1000110.8N135 L136 S138 E139 A143 G144N135-N141 PolarHBondContact O-OD1 3.36Å; N135-N141 VanDerWaalsContact O-OD1 3.14Å; L136-N141 VanDerWaalsContact O-CG 3.29Å; L136-N141 PolarHBondContact O-ND2 3.47Å; L136-N141 VanDerWaalsContact O-ND2 3.16Å; S138-N141 PolarHBondContact O-N 3.45Å; E139-N141 PolarHBondContact O-N 3.08Å; N141-A143 WeakPolarHBondContact OD1-CA 3.39Å; N141-A143 WeakPolarHBondContact OD1-CB 2.92Å; N141-A143 PolarHBondContact OD1-N 3.27Å; N141-G144 PolarHBondContact OD1-N 3.29Å
142T93.9Very high87.1Confident0 Ų044.9 Ų44.90%024%0.244CC..  trans-97.1-16.1177.649.60000112.9L127 F130 G132 F134 N135 Y140 G144 I145 W230L127-T142 HydrophobicContact CD2-CG2 4.28Å; F130-T142 HydrophobicContact CD1-CG2 3.67Å; F130-T142 HydrophobicContact CE1-CG2 4.07Å; G132-T142 PolarHBondContact O-OG1 3.23Å; F134-T142 PolarHBondContact N-OG1 3.09Å; N135-T142 PolarHBondContact N-OG1 2.66Å; N135-T142 PolarHBondContact O-N 3.42Å; N135-T142 VanDerWaalsContact O-N 3.08Å; N135-T142 PolarHBondContact O-OG1 2.9Å; Y140-T142 PolarHBondContact O-N 2.89Å; T142-G144 PolarHBondContact O-N 3.44Å; T142-I145 WeakPolarHBondContact O-CB 3.34Å; T142-I145 WeakPolarHBondContact O-CG1 3.28Å; T142-I145 PolarHBondContact O-N 2.99Å; T142-W230 PolarHBondContact OG1-NE1 3.24Å; T142-W230 VanDerWaalsContact OG1-NE1 3.1Å
143A94.4Very high88Confident0 Ų048.7 Ų48.70%025%0.254CS..G310 helixtrans-64.2-3017500000112.1N135 L136 N141 I145 F146 A147 Y149 W230N135-A143 PolarHBondContact O-N 3.26Å; L136-A143 HydrophobicContact CG-CB 4.21Å; N141-A143 WeakPolarHBondContact OD1-CA 3.39Å; N141-A143 WeakPolarHBondContact OD1-CB 2.92Å; N141-A143 PolarHBondContact OD1-N 3.27Å; A143-I145 PolarHBondContact O-N 2.89Å; A143-I145 VanDerWaalsContact O-N 3.17Å; A143-F146 PolarHBondContact O-N 3.36Å; A143-F146 VanDerWaalsContact O-N 3.11Å; A143-A147 PolarHBondContact O-N 2.9Å; A143-Y149 HydrophobicContact CB-CE2 3.65Å; A143-W230 HydrophobicContact CB-CG 4.3Å; A143-W230 VanDerWaalsContact N-NE1 3.17Å
144G94.5Very high88.5Confident31 Ų3147.5 Ų47.532%0.3225%0.245SC..G310 helixtrans-62.8-13.1176.200000115.1N141 T142 F146 A147N141-G144 PolarHBondContact OD1-N 3.29Å; T142-G144 PolarHBondContact O-N 3.44Å; G144-F146 VanDerWaalsContact C-N 3.29Å; G144-A147 WeakPolarHBondContact CA-O 3.25Å
145I96.8Very high89Confident1 Ų149.4 Ų49.41%0.00526%0.261CS..G310 helixtrans-64.8-37.3171.7-67.5168.5000111V43 A44 V47 L48 L127 T142 A143V43-I145 HydrophobicContact CG1-CB 4.41Å; V43-I145 HydrophobicContact CG1-CG1 4.29Å; A44-I145 HydrophobicContact CB-CG2 3.65Å; V47-I145 HydrophobicContact CB-CD1 4.19Å; V47-I145 HydrophobicContact CB-CG1 4.09Å; V47-I145 HydrophobicContact CG1-CD1 4.08Å; V47-I145 HydrophobicContact CG1-CG1 4.26Å; V47-I145 HydrophobicContact CG2-CG1 4.12Å; L48-I145 HydrophobicContact CD1-CD1 4.41Å; L48-I145 HydrophobicContact CD2-CD1 4.03Å; L48-I145 HydrophobicContact CG-CD1 4.1Å; L127-I145 HydrophobicContact CD2-CD1 4.02Å; T142-I145 WeakPolarHBondContact O-CB 3.34Å; T142-I145 WeakPolarHBondContact O-CG1 3.28Å; T142-I145 PolarHBondContact O-N 2.99Å; A143-I145 PolarHBondContact O-N 2.89Å; A143-I145 VanDerWaalsContact O-N 3.17Å
146F97.9Very high89.4Confident1 Ų150.4 Ų50.40%0.00427%0.266CS..THydrogen-bonded Turntrans-102.2-49.8-167.5-60.6-76.4000112.1A116 I119 F120 L127 A143 G144 R217 P221 T225 W230A116-F146 HydrophobicContact CB-CD1 3.86Å; A116-F146 WeakPolarHBondContact O-CE1 3.35Å; I119-F146 HydrophobicContact CB-CE1 4.45Å; I119-F146 HydrophobicContact CG2-CE1 4.25Å; F120-F146 HydrophobicContact CB-CE1 4Å; F120-F146 HydrophobicContact CB-CZ 3.91Å; F120-F146 HydrophobicContact CD2-CZ 4.21Å; L127-F146 HydrophobicContact CD1-CZ 4.28Å; A143-F146 PolarHBondContact O-N 3.36Å; A143-F146 VanDerWaalsContact O-N 3.11Å; G144-F146 VanDerWaalsContact C-N 3.29Å; F146-R217 PolarHBondContact O-NH1 3.4Å; F146-P221 HydrophobicContact CB-CB 3.9Å; F146-P221 VanDerWaalsContact O-CB 3.26Å; F146-P221 WeakPolarHBondContact O-CB 3.36Å; F146-T225 HydrophobicContact CB-CG2 3.66Å; F146-T225 HydrophobicContact CD2-CG2 3.45Å; F146-T225 VanDerWaalsContact CD2-CG2 3.45Å; F146-T225 HydrophobicContact CE2-CG2 4.26Å; F146-T225 HydrophobicContact CG-CG2 3.65Å; F146-W230 HydrophobicContact CD2-CH2 4.29Å; F146-W230 HydrophobicContact CD2-CZ2 4.41Å; F146-W230 AromaticContact CE2-CH2 3.56Å; F146-W230 HydrophobicContact CE2-CH2 3.56Å; F146-W230 AromaticContact CE2-CZ2 3.92Å; F146-W230 HydrophobicContact CE2-CZ2 3.92Å; F146-W230 HydrophobicContact CE2-CZ3 4.26Å; F146-W230 HydrophobicContact CZ-CH2 4.36Å
147A97.1Very high90.1Very high1 Ų154.8 Ų54.81%0.00829%0.293CS..SBendtrans-121.7160.8-178.300000111A143 G144 Y149 R222A143-A147 PolarHBondContact O-N 2.9Å; G144-A147 WeakPolarHBondContact CA-O 3.25Å; A147-Y149 HydrophobicContact CB-CE2 4.31Å; A147-Y149 VanDerWaalsContact O-CD2 3.32Å; A147-Y149 WeakPolarHBondContact O-CD2 3.41Å; A147-Y149 WeakPolarHBondContact O-CE2 3.46Å; A147-R222 HydrophobicContact CB-CB 3.99Å
148T96.6Very high91.4Very high8 Ų852.9 Ų52.95%0.04928%0.279CS..  trans-82146.4-177.665.50000112S209 A212 D218 R222 W241T148-S209 VanDerWaalsContact CB-O 3.3Å; T148-S209 WeakPolarHBondContact CB-O 3.3Å; T148-A212 HydrophobicContact CG2-CB 3.76Å; T148-D218 WeakPolarHBondContact CB-OD2 3.3Å; T148-D218 PolarHBondContact N-OD2 3.37Å; T148-D218 PolarHBondContact OG1-OD2 3.19Å; T148-R222 PolarHBondContact O-NH2 3.42Å; T148-W241 VanDerWaalsContact O-CD1 3.23Å; T148-W241 PolarHBondContact O-NE1 2.97Å
149Y95.4Very high92.7Very high30 Ų3050.9 Ų50.912%0.11826%0.264CS..  trans-138148173.7-65.7-89000108.7A143 A147 R222 V234 A237A143-Y149 HydrophobicContact CB-CE2 3.65Å; A147-Y149 HydrophobicContact CB-CE2 4.31Å; A147-Y149 VanDerWaalsContact O-CD2 3.32Å; A147-Y149 WeakPolarHBondContact O-CD2 3.41Å; A147-Y149 WeakPolarHBondContact O-CE2 3.46Å; Y149-R222 VanDerWaalsContact CE1-NH1 3.3Å; Y149-R222 PolarHBondContact OH-NH1 3.29Å; Y149-V234 WeakPolarHBondContact OH-CB 3.45Å; Y149-A237 HydrophobicContact CD1-CB 4.21Å; Y149-A237 HydrophobicContact CE1-CB 3.89Å
150P95.1Very high94Very high11 Ų1146.4 Ų46.47%0.07124%0.242CC..  trans-73.4144-177.431.4-32000109.7L154 R238 W241P150-L154 HydrophobicContact CB-CB 4.22Å; P150-L154 HydrophobicContact CB-CD2 3.9Å; P150-L154 HydrophobicContact CB-CG 4.48Å; P150-R238 HydrophobicContact CG-CB 3.68Å; P150-R238 HydrophobicContact CG-CG 3.7Å; P150-W241 HydrophobicContact CB-CD2 4.05Å; P150-W241 HydrophobicContact CB-CE3 3.81Å; P150-W241 HydrophobicContact CB-CH2 4.13Å; P150-W241 HydrophobicContact CB-CZ2 4.36Å; P150-W241 HydrophobicContact CB-CZ3 3.84Å; P150-W241 VanDerWaalsContact CD-CD2 3.48Å; P150-W241 VanDerWaalsContact CD-CG 3.46Å; P150-W241 HydrophobicContact CG-CB 4.43Å; P150-W241 HydrophobicContact CG-CD2 3.72Å; P150-W241 HydrophobicContact CG-CE3 3.68Å; P150-W241 HydrophobicContact CG-CG 4.04Å; P150-W241 HydrophobicContact CG-CZ3 4.24Å
151A92.8Very high95Very high25 Ų2547.4 Ų47.421%0.20725%0.249CC..  trans-60.5157.6170.800000111.2H153 L154 N208A151-H153 WeakPolarHBondContact CB-CE1 3.46Å; A151-H153 WeakPolarHBondContact CB-ND1 3.42Å; A151-H153 PolarHBondContact O-N 3.42Å; A151-H153 VanDerWaalsContact O-N 3.1Å; A151-L154 WeakPolarHBondContact O-CB 3.38Å; A151-L154 PolarHBondContact O-N 3.43Å; A151-N208 VanDerWaalsContact CB-O 3.26Å; A151-N208 WeakPolarHBondContact CB-O 3.12Å; A151-N208 PolarHBondContact N-O 2.94Å
152K91.4Very high95.6Very high171 Ų17145.9 Ų45.974%0.74324%0.241SC*.THydrogen-bonded Turntrans-58.4-29.8-173.8-65.5-175.8-178176.90113.4
153H93.1Very high95.8Very high107 Ų10746 Ų4650%0.49524%0.241SC..THydrogen-bonded Turntrans-84.9-10.6179.863.5-83.4000114A151 F207 N208A151-H153 WeakPolarHBondContact CB-CE1 3.46Å; A151-H153 WeakPolarHBondContact CB-ND1 3.42Å; A151-H153 PolarHBondContact O-N 3.42Å; A151-H153 VanDerWaalsContact O-N 3.1Å; H153-F207 AromaticContact CE1-CE1 3.32Å; H153-F207 WeakPolarHBondContact CE1-CE1 3.28Å; H153-F207 AromaticContact CE1-CZ 3.41Å; H153-F207 VanDerWaalsContact CE1-CZ 3.41Å; H153-F207 WeakPolarHBondContact CE1-CZ 3.37Å; H153-F207 AromaticContact NE2-CE1 3.68Å; H153-N208 PolarHBondContact NE2-OD1 2.8Å
154L94.8Very high96Very high17 Ų1746.8 Ų46.89%0.08925%0.245CC..  trans-90.4123.5-170.3-169.870.9000111.2P150 A151 N158 N208 W241P150-L154 HydrophobicContact CB-CB 4.22Å; P150-L154 HydrophobicContact CB-CD2 3.9Å; P150-L154 HydrophobicContact CB-CG 4.48Å; A151-L154 WeakPolarHBondContact O-CB 3.38Å; A151-L154 PolarHBondContact O-N 3.43Å; L154-N158 HydrophobicContact CD1-CB 3.95Å; L154-N208 HydrophobicContact CD1-CB 4.09Å; L154-N208 HydrophobicContact CD2-CB 3.93Å; L154-N208 WeakPolarHBondContact CD2-O 3.46Å; L154-W241 HydrophobicContact CD2-CH2 4.2Å; L154-W241 HydrophobicContact CD2-CZ3 4.49Å
155T95.6Very high96.2Very high88 Ų8848.7 Ų48.754%0.5425%0.248SC..  trans-79.7155.2170.465.30000110.7V157 N158 G159T155-V157 VanDerWaalsContact C-N 3.26Å; T155-V157 PolarHBondContact O-N 3.44Å; T155-N158 PolarHBondContact O-N 3Å; T155-N158 WeakPolarHBondContact OG1-CB 3.39Å; T155-N158 PolarHBondContact OG1-N 3.05Å; T155-G159 PolarHBondContact O-N 2.93Å
156I94.9Very high96.2Very high69 Ų6948.7 Ų48.735%0.35425%0.248SC..Hα-helixtrans-56-43.4176.7-65.6167.6000111.4N158 G159 F160 D239 V244I156-N158 PolarHBondContact O-N 2.98Å; I156-G159 PolarHBondContact O-N 3.32Å; I156-F160 WeakPolarHBondContact O-CB 3.45Å; I156-F160 PolarHBondContact O-N 2.96Å; I156-D239 HydrophobicContact CD1-CB 3.39Å; I156-D239 HydrophobicContact CG1-CB 4.49Å; I156-V244 HydrophobicContact CG2-CG2 3.99Å
157V96Very high96.3Very high120 Ų12048.7 Ų48.773%0.72725%0.248SC*.Hα-helixtrans-60.1-48-178.9178.50000110.8T155 G159 F160 F161T155-V157 VanDerWaalsContact C-N 3.26Å; T155-V157 PolarHBondContact O-N 3.44Å; V157-G159 VanDerWaalsContact C-N 3.34Å; V157-F160 PolarHBondContact O-N 3.12Å; V157-F161 PolarHBondContact O-N 3Å; V157-F161 VanDerWaalsContact O-N 3.1Å
158N96.8Very high96.4Very high78 Ų7849.2 Ų49.242%0.41725%0.252SS..Hα-helixtrans-71.3-32.4179.7-15944.9000111.8L154 T155 I156 F161 D162L154-N158 HydrophobicContact CD1-CB 3.95Å; T155-N158 PolarHBondContact O-N 3Å; T155-N158 WeakPolarHBondContact OG1-CB 3.39Å; T155-N158 PolarHBondContact OG1-N 3.05Å; I156-N158 PolarHBondContact O-N 2.98Å; N158-F161 PolarHBondContact O-N 3.29Å; N158-D162 VanDerWaalsContact O-CB 3.28Å; N158-D162 WeakPolarHBondContact O-CB 3.49Å; N158-D162 PolarHBondContact O-N 3.09Å
159G96.8Very high96.4Very high0 Ų050.7 Ų50.70%027%0.265CS..Hα-helixtrans-67.3-33.5172.700000113.7T155 I156 V157 D162 Q163T155-G159 PolarHBondContact O-N 2.93Å; I156-G159 PolarHBondContact O-N 3.32Å; V157-G159 VanDerWaalsContact C-N 3.34Å; G159-D162 PolarHBondContact O-N 3.27Å; G159-Q163 WeakPolarHBondContact O-CG 3.24Å; G159-Q163 PolarHBondContact O-N 3.48Å
160F97.4Very high96.6Very high72 Ų7249.5 Ų49.532%0.31626%0.261SS..Hα-helixtrans-66-44.9172.3-163.7-97000111I156 V157 Q163 I164 V244 A248 L251I156-F160 WeakPolarHBondContact O-CB 3.45Å; I156-F160 PolarHBondContact O-N 2.96Å; V157-F160 PolarHBondContact O-N 3.12Å; F160-Q163 PolarHBondContact O-N 2.9Å; F160-I164 HydrophobicContact CD1-CD1 3.57Å; F160-I164 HydrophobicContact CD1-CG1 4.34Å; F160-I164 HydrophobicContact CE1-CD1 3.58Å; F160-I164 HydrophobicContact CE1-CG1 4.32Å; F160-I164 VanDerWaalsContact O-CG1 3.3Å; F160-I164 WeakPolarHBondContact O-CG1 3.33Å; F160-I164 PolarHBondContact O-N 3.05Å; F160-V244 HydrophobicContact CB-CG1 4.33Å; F160-V244 HydrophobicContact CD2-CG1 4.13Å; F160-V244 HydrophobicContact CD2-CG2 4.33Å; F160-A248 HydrophobicContact CD2-CB 3.63Å; F160-A248 HydrophobicContact CE2-CB 3.61Å; F160-A248 HydrophobicContact CG-CB 4.08Å; F160-A248 HydrophobicContact CZ-CB 4.08Å; F160-L251 HydrophobicContact CE1-CD2 4.1Å
161F97.9Very high96.8Very high123 Ų12349 Ų4954%0.53926%0.258SS..Hα-helixtrans-60.6-46.4173.1179-105.7000112.4V157 N158 Q163 I164 I165V157-F161 PolarHBondContact O-N 3Å; V157-F161 VanDerWaalsContact O-N 3.1Å; N158-F161 PolarHBondContact O-N 3.29Å; F161-Q163 VanDerWaalsContact C-N 3.34Å; F161-Q163 PolarHBondContact O-N 3.36Å; F161-I164 WeakPolarHBondContact O-CB 3.31Å; F161-I164 PolarHBondContact O-N 3.31Å; F161-I165 HydrophobicContact CD1-CG1 4.33Å; F161-I165 HydrophobicContact CD2-CG1 4.17Å; F161-I165 HydrophobicContact CE1-CG1 3.92Å; F161-I165 HydrophobicContact CE2-CD1 3.82Å; F161-I165 HydrophobicContact CE2-CG1 3.74Å; F161-I165 HydrophobicContact CG-CG1 4.46Å; F161-I165 HydrophobicContact CZ-CD1 3.91Å; F161-I165 HydrophobicContact CZ-CG1 3.6Å; F161-I165 WeakPolarHBondContact O-CG1 3.26Å; F161-I165 PolarHBondContact O-N 3.36Å
162D97.8Very high97Very high11 Ų1149.8 Ų49.86%0.05926%0.26CS..Hα-helixtrans-53.4-48.1176179.582.6000112N158 G159 I165 G166 N208 S209N158-D162 VanDerWaalsContact O-CB 3.28Å; N158-D162 WeakPolarHBondContact O-CB 3.49Å; N158-D162 PolarHBondContact O-N 3.09Å; G159-D162 PolarHBondContact O-N 3.27Å; D162-I165 PolarHBondContact O-N 3.03Å; D162-G166 PolarHBondContact O-N 3.38Å; D162-N208 WeakPolarHBondContact OD1-CB 3.35Å; D162-N208 PolarHBondContact OD1-ND2 3.26Å; D162-S209 PolarHBondContact OD2-OG 3.33Å
163Q98.3Very high97.3Very high1 Ų144 Ų441%0.00524%0.241CC..Hα-helixtrans-70.5-32.9178.5-71.8-58.6-55.100113.7G159 F160 F161 T167 S209 V244 A248G159-Q163 WeakPolarHBondContact O-CG 3.24Å; G159-Q163 PolarHBondContact O-N 3.48Å; F160-Q163 PolarHBondContact O-N 2.9Å; F161-Q163 VanDerWaalsContact C-N 3.34Å; F161-Q163 PolarHBondContact O-N 3.36Å; Q163-T167 WeakPolarHBondContact O-CB 3.48Å; Q163-T167 PolarHBondContact O-N 3.07Å; Q163-T167 VanDerWaalsContact O-N 3.09Å; Q163-T167 PolarHBondContact O-OG1 2.97Å; Q163-S209 PolarHBondContact NE2-OG 3.36Å; Q163-V244 HydrophobicContact CB-CG1 4.28Å; Q163-V244 HydrophobicContact CG-CG1 3.95Å; Q163-A248 HydrophobicContact CB-CB 3.58Å
164I98.6Very high97.5Very high17 Ų1739.7 Ų39.79%0.08722%0.221CC..Hα-helixtrans-61.8-52.8171.9-72.9166.1000110F160 F161 T167 A168 A248 L251 G252 I255F160-I164 HydrophobicContact CD1-CD1 3.57Å; F160-I164 HydrophobicContact CD1-CG1 4.34Å; F160-I164 HydrophobicContact CE1-CD1 3.58Å; F160-I164 HydrophobicContact CE1-CG1 4.32Å; F160-I164 VanDerWaalsContact O-CG1 3.3Å; F160-I164 WeakPolarHBondContact O-CG1 3.33Å; F160-I164 PolarHBondContact O-N 3.05Å; F161-I164 WeakPolarHBondContact O-CB 3.31Å; F161-I164 PolarHBondContact O-N 3.31Å; I164-T167 PolarHBondContact O-N 3.12Å; I164-A168 VanDerWaalsContact O-CB 3.3Å; I164-A168 WeakPolarHBondContact O-CB 3.43Å; I164-A168 PolarHBondContact O-N 3.01Å; I164-A248 HydrophobicContact CG1-CB 4.21Å; I164-L251 HydrophobicContact CD1-CD2 3.68Å; I164-L251 HydrophobicContact CD1-CG 4.21Å; I164-L251 HydrophobicContact CG1-CB 4.31Å; I164-L251 HydrophobicContact CG1-CD2 4.3Å; I164-L251 HydrophobicContact CG1-CG 4.35Å; I164-G252 WeakPolarHBondContact O-CA 3.05Å; I164-I255 HydrophobicContact CG2-CD1 3.72Å
165I98.4Very high97.6Very high71 Ų7138.9 Ų38.936%0.36422%0.217SC..Hα-helixtrans-65.9-43.8-175.3-62.1-58.8000110.8F161 D162 T167 A168 A169 M205F161-I165 HydrophobicContact CD1-CG1 4.33Å; F161-I165 HydrophobicContact CD2-CG1 4.17Å; F161-I165 HydrophobicContact CE1-CG1 3.92Å; F161-I165 HydrophobicContact CE2-CD1 3.82Å; F161-I165 HydrophobicContact CE2-CG1 3.74Å; F161-I165 HydrophobicContact CG-CG1 4.46Å; F161-I165 HydrophobicContact CZ-CD1 3.91Å; F161-I165 HydrophobicContact CZ-CG1 3.6Å; F161-I165 WeakPolarHBondContact O-CG1 3.26Å; F161-I165 PolarHBondContact O-N 3.36Å; D162-I165 PolarHBondContact O-N 3.03Å; I165-T167 VanDerWaalsContact C-N 3.31Å; I165-T167 PolarHBondContact O-N 3.32Å; I165-A168 PolarHBondContact O-N 3.02Å; I165-A169 WeakPolarHBondContact O-CB 3.44Å; I165-A169 PolarHBondContact O-N 3.38Å; I165-M205 HydrophobicContact CB-CE 4.03Å; I165-M205 HydrophobicContact CG2-CE 3.76Å
166G98.4Very high97.6Very high2 Ų236 Ų362%0.02120%0.202CC..Hα-helixtrans-60.5-41.7177.700000112.1D162 L170D162-G166 PolarHBondContact O-N 3.38Å; G166-L170 WeakPolarHBondContact O-CB 3.5Å; G166-L170 PolarHBondContact O-N 2.96Å
167T98.8Very high97.6Very high0 Ų033.7 Ų33.70%019%0.19CC..Hα-helixtrans-74.6-37.1178.5-47.90000112.3A85 Q163 I164 I165 L170 I171 V213 P249A85-T167 HydrophobicContact CB-CG2 3.93Å; Q163-T167 WeakPolarHBondContact O-CB 3.48Å; Q163-T167 PolarHBondContact O-N 3.07Å; Q163-T167 VanDerWaalsContact O-N 3.09Å; Q163-T167 PolarHBondContact O-OG1 2.97Å; I164-T167 PolarHBondContact O-N 3.12Å; I165-T167 VanDerWaalsContact C-N 3.31Å; I165-T167 PolarHBondContact O-N 3.32Å; T167-L170 WeakPolarHBondContact O-CB 3.24Å; T167-L170 PolarHBondContact O-N 3.42Å; T167-I171 HydrophobicContact CG2-CG1 4.24Å; T167-I171 WeakPolarHBondContact O-CB 3.42Å; T167-I171 VanDerWaalsContact O-CG1 3.26Å; T167-I171 WeakPolarHBondContact O-CG1 3.16Å; T167-I171 PolarHBondContact O-N 3.39Å; T167-V213 WeakPolarHBondContact OG1-CA 3.44Å; T167-P249 HydrophobicContact CG2-CB 3.86Å; T167-P249 VanDerWaalsContact CG2-O 3.24Å; T167-P249 WeakPolarHBondContact CG2-O 3.39Å; T167-P249 WeakPolarHBondContact OG1-CA 3.46Å; T167-P249 WeakPolarHBondContact OG1-CB 3.36Å
168A98.7Very high97.4Very high12 Ų1231.1 Ų31.110%0.09918%0.175CC..Hα-helixtrans-61.4-45.2175.100000111.1I164 I165 I171 V172 G252 I255I164-A168 VanDerWaalsContact O-CB 3.3Å; I164-A168 WeakPolarHBondContact O-CB 3.43Å; I164-A168 PolarHBondContact O-N 3.01Å; I165-A168 PolarHBondContact O-N 3.02Å; A168-I171 PolarHBondContact O-N 3.49Å; A168-V172 VanDerWaalsContact O-CG2 3.31Å; A168-V172 WeakPolarHBondContact O-CG2 3.45Å; A168-V172 PolarHBondContact O-N 3.47Å; A168-G252 VanDerWaalsContact CA-O 3.25Å; A168-G252 WeakPolarHBondContact CA-O 3.34Å; A168-G252 WeakPolarHBondContact CB-O 3.29Å; A168-I255 HydrophobicContact CB-CG2 4.34Å
169A98.4Very high97.1Very high39 Ų3927.7 Ų27.732%0.32216%0.156SC..Hα-helixtrans-60-46174.800000111.7I165 I171 V172 C173I165-A169 WeakPolarHBondContact O-CB 3.44Å; I165-A169 PolarHBondContact O-N 3.38Å; A169-I171 VanDerWaalsContact C-N 3.33Å; A169-I171 PolarHBondContact O-N 3.28Å; A169-V172 PolarHBondContact O-N 2.95Å; A169-C173 PolarHBondContact O-N 3.4Å; A169-C173 PolarHBondContact O-SG 3.29Å; A169-C173 VanDerWaalsContact O-SG 3.38Å
170L98.6Very high96.7Very high5 Ų532.5 Ų32.53%0.02619%0.187CC..Hα-helixtrans-54.8-48.8174.7179.263.4000111.5G166 T167 C173 I174 V197 V198 I201 V213G166-L170 WeakPolarHBondContact O-CB 3.5Å; G166-L170 PolarHBondContact O-N 2.96Å; T167-L170 WeakPolarHBondContact O-CB 3.24Å; T167-L170 PolarHBondContact O-N 3.42Å; L170-C173 PolarHBondContact O-N 2.97Å; L170-I174 HydrophobicContact CD1-CD1 3.72Å; L170-I174 HydrophobicContact CD1-CG1 4.2Å; L170-I174 HydrophobicContact CD2-CD1 4.46Å; L170-I174 HydrophobicContact CG-CD1 3.77Å; L170-I174 WeakPolarHBondContact O-CB 3.35Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.45Å; L170-V197 HydrophobicContact CD1-CG1 3.77Å; L170-V198 HydrophobicContact CD1-CG2 4.17Å; L170-I201 HydrophobicContact CB-CD1 3.66Å; L170-I201 HydrophobicContact CD1-CD1 4.06Å; L170-I201 HydrophobicContact CG-CD1 4.43Å; L170-V213 HydrophobicContact CD2-CB 4.29Å; L170-V213 HydrophobicContact CD2-CG2 3.94Å
171I98.6Very high96.2Very high1 Ų134.4 Ų34.41%0.00519%0.193CC..Hα-helixtrans-68.8-41.9-176.3-67.4-67.8000111.6V86 S89 T167 A168 A169 C173 I174 L175 A253V86-I171 HydrophobicContact CB-CD1 4.29Å; V86-I171 HydrophobicContact CG2-CD1 3.82Å; S89-I171 WeakPolarHBondContact OG-CG2 3.35Å; T167-I171 HydrophobicContact CG2-CG1 4.24Å; T167-I171 WeakPolarHBondContact O-CB 3.42Å; T167-I171 VanDerWaalsContact O-CG1 3.26Å; T167-I171 WeakPolarHBondContact O-CG1 3.16Å; T167-I171 PolarHBondContact O-N 3.39Å; A168-I171 PolarHBondContact O-N 3.49Å; A169-I171 VanDerWaalsContact C-N 3.33Å; A169-I171 PolarHBondContact O-N 3.28Å; I171-C173 VanDerWaalsContact C-N 3.34Å; I171-C173 PolarHBondContact O-N 3.27Å; I171-I174 PolarHBondContact O-N 3.41Å; I171-L175 HydrophobicContact CG2-CD1 3.93Å; I171-L175 HydrophobicContact CG2-CG 4.25Å; I171-L175 WeakPolarHBondContact O-CB 3.2Å; I171-L175 VanDerWaalsContact O-CG 3.26Å; I171-L175 WeakPolarHBondContact O-CG 3.42Å; I171-L175 PolarHBondContact O-N 3.49Å; I171-A253 HydrophobicContact CD1-CB 4.44Å; I171-A253 HydrophobicContact CG1-CB 4.08Å
172V98.4Very high95.8Very high42 Ų4230.5 Ų30.526%0.25518%0.178SC..Hα-helixtrans-57.3-48.4174.5168.80000110.7A168 A169 L175 A176 G256 V259 Y260A168-V172 VanDerWaalsContact O-CG2 3.31Å; A168-V172 WeakPolarHBondContact O-CG2 3.45Å; A168-V172 PolarHBondContact O-N 3.47Å; A169-V172 PolarHBondContact O-N 2.95Å; V172-L175 PolarHBondContact O-N 3.35Å; V172-A176 WeakPolarHBondContact O-CB 3.47Å; V172-A176 PolarHBondContact O-N 3.36Å; V172-G256 WeakPolarHBondContact CG2-O 3.47Å; V172-V259 HydrophobicContact CG2-CB 4.31Å; V172-V259 HydrophobicContact CG2-CG1 4.08Å; V172-Y260 HydrophobicContact CG1-CD2 4.34Å
173C97.8Very high95.3Very high50 Ų5036.2 Ų36.234%0.33821%0.209SC..Hα-helixtrans-67-41.8-179.9-67.70000112.4A169 L170 I171 A176 I177 V197A169-C173 PolarHBondContact O-N 3.4Å; A169-C173 PolarHBondContact O-SG 3.29Å; A169-C173 VanDerWaalsContact O-SG 3.38Å; L170-C173 PolarHBondContact O-N 2.97Å; I171-C173 VanDerWaalsContact C-N 3.34Å; I171-C173 PolarHBondContact O-N 3.27Å; C173-A176 WeakPolarHBondContact O-CB 3.38Å; C173-A176 PolarHBondContact O-N 2.7Å; C173-I177 WeakPolarHBondContact O-CD1 3.29Å; C173-I177 WeakPolarHBondContact O-CG1 3.46Å; C173-I177 PolarHBondContact O-N 3.12Å; C173-V197 HydrophobicContact CB-CB 4.35Å; C173-V197 HydrophobicContact CB-CG1 3.72Å; C173-V197 HydrophobicContact CB-CG2 3.62Å
174I97Very high94.6Very high15 Ų1542 Ų428%0.07725%0.246CC..Hα-helixtrans-61-47.1176.2-73.5172.6000110.3V86 L170 I171 A176 I177 V178 V194V86-I174 HydrophobicContact CG1-CD1 4.42Å; V86-I174 HydrophobicContact CG1-CG2 4.49Å; V86-I174 HydrophobicContact CG2-CD1 3.6Å; L170-I174 HydrophobicContact CD1-CD1 3.72Å; L170-I174 HydrophobicContact CD1-CG1 4.2Å; L170-I174 HydrophobicContact CD2-CD1 4.46Å; L170-I174 HydrophobicContact CG-CD1 3.77Å; L170-I174 WeakPolarHBondContact O-CB 3.35Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.4Å; L170-I174 PolarHBondContact O-N 3.45Å; I171-I174 PolarHBondContact O-N 3.41Å; I174-A176 VanDerWaalsContact C-N 3.31Å; I174-A176 PolarHBondContact O-N 3Å; I174-I177 PolarHBondContact O-N 3.07Å; I174-I177 VanDerWaalsContact O-N 3.12Å; I174-V178 HydrophobicContact CG2-CG1 4.48Å; I174-V178 WeakPolarHBondContact O-CG2 3.33Å; I174-V178 PolarHBondContact O-N 3.36Å; I174-V194 HydrophobicContact CD1-CG1 4.27Å; I174-V194 HydrophobicContact CG1-CG1 4.13Å; I174-V194 HydrophobicContact CG1-CG2 4.38Å
175L96.6Very high94.1Very high1 Ų143.8 Ų43.81%0.00526%0.255CS..Hα-helixtrans-61-42.6178.5-68.4178.6000111.1L90 L93 I171 V172 I177 V178 D179 T257 Y260L90-L175 HydrophobicContact CD2-CD2 4.31Å; L93-L175 HydrophobicContact CD1-CD1 3.98Å; L93-L175 HydrophobicContact CD1-CD2 3.42Å; L93-L175 VanDerWaalsContact CD1-CD2 3.42Å; L93-L175 HydrophobicContact CD1-CG 4.36Å; I171-L175 HydrophobicContact CG2-CD1 3.93Å; I171-L175 HydrophobicContact CG2-CG 4.25Å; I171-L175 WeakPolarHBondContact O-CB 3.2Å; I171-L175 VanDerWaalsContact O-CG 3.26Å; I171-L175 WeakPolarHBondContact O-CG 3.42Å; I171-L175 PolarHBondContact O-N 3.49Å; V172-L175 PolarHBondContact O-N 3.35Å; L175-I177 VanDerWaalsContact C-N 3.29Å; L175-I177 PolarHBondContact O-N 3.27Å; L175-V178 PolarHBondContact O-N 3.03Å; L175-D179 VanDerWaalsContact O-CB 3.25Å; L175-D179 WeakPolarHBondContact O-CB 3.5Å; L175-D179 PolarHBondContact O-N 2.93Å; L175-T257 HydrophobicContact CD1-CG2 4.31Å; L175-Y260 HydrophobicContact CB-CD1 3.48Å; L175-Y260 VanDerWaalsContact CB-CD1 3.48Å; L175-Y260 HydrophobicContact CB-CD2 4.11Å; L175-Y260 HydrophobicContact CB-CE1 3.75Å; L175-Y260 HydrophobicContact CB-CE2 4.37Å; L175-Y260 HydrophobicContact CB-CG 3.67Å; L175-Y260 HydrophobicContact CD1-CD1 3.87Å; L175-Y260 HydrophobicContact CD1-CG 4.05Å; L175-Y260 HydrophobicContact CG-CD1 4.29Å
176A95.8Very high93.8Very high27 Ų2744.4 Ų44.422%0.22326%0.264CS..Hα-helixtrans-58.4-37.2173.700000114V172 C173 I174 N182 Y260V172-A176 WeakPolarHBondContact O-CB 3.47Å; V172-A176 PolarHBondContact O-N 3.36Å; C173-A176 WeakPolarHBondContact O-CB 3.38Å; C173-A176 PolarHBondContact O-N 2.7Å; I174-A176 VanDerWaalsContact C-N 3.31Å; I174-A176 PolarHBondContact O-N 3Å; A176-N182 PolarHBondContact O-ND2 3.49Å; A176-Y260 VanDerWaalsContact CA-CE2 3.48Å; A176-Y260 HydrophobicContact CB-CD2 4.4Å; A176-Y260 HydrophobicContact CB-CE2 3.68Å
177I94.8Very high93.2Very high20 Ų2053.3 Ų53.310%0.10331%0.305CS..Hα-helixtrans-74-39.5-179.2-70.4160.3000111.8C173 I174 L175 I185 E190 T193 V194 V197C173-I177 WeakPolarHBondContact O-CD1 3.29Å; C173-I177 WeakPolarHBondContact O-CG1 3.46Å; C173-I177 PolarHBondContact O-N 3.12Å; I174-I177 PolarHBondContact O-N 3.07Å; I174-I177 VanDerWaalsContact O-N 3.12Å; L175-I177 VanDerWaalsContact C-N 3.29Å; L175-I177 PolarHBondContact O-N 3.27Å; I177-I185 HydrophobicContact CG2-CG1 4.35Å; I177-E190 HydrophobicContact CG2-CB 4.26Å; I177-T193 HydrophobicContact CD1-CG2 3.56Å; I177-T193 HydrophobicContact CG1-CG2 3.8Å; I177-V194 HydrophobicContact CD1-CG2 3.95Å; I177-V194 HydrophobicContact CG2-CG2 4.19Å; I177-V197 HydrophobicContact CD1-CG2 3.97Å
178V91.3Very high92.5Very high67 Ų6755.5 Ų55.541%0.40633%0.328SS..Hα-helixtrans-96.30.5-174.4-52.40000113.4I174 L175 P180I174-V178 HydrophobicContact CG2-CG1 4.48Å; I174-V178 WeakPolarHBondContact O-CG2 3.33Å; I174-V178 PolarHBondContact O-N 3.36Å; L175-V178 PolarHBondContact O-N 3.03Å; V178-P180 WeakPolarHBondContact O-CD 3.23Å
179D91.3Very high92.3Very high6 Ų659 Ų593%0.03235%0.345CS..  trans-75117.1174.7-166.7-43.2000110R95 L175 Y181 N182 Y260R95-D179 IonicContact NH2-OD2 2.86Å; L175-D179 VanDerWaalsContact O-CB 3.25Å; L175-D179 WeakPolarHBondContact O-CB 3.5Å; L175-D179 PolarHBondContact O-N 2.93Å; D179-Y181 PolarHBondContact O-N 3.36Å; D179-Y181 WeakPolarHBondContact OD1-CB 3.2Å; D179-Y181 PolarHBondContact OD1-N 3.47Å; D179-N182 HydrophobicContact CB-CB 3.87Å; D179-N182 PolarHBondContact O-N 3.14Å; D179-N182 PolarHBondContact OD1-N 2.98Å; D179-Y260 HydrophobicContact CB-CE1 4.47Å; D179-Y260 WeakPolarHBondContact CB-OH 3.42Å; D179-Y260 PolarHBondContact OD2-OH 2.8Å
180P87.3Confident92Very high100 Ų10060.5 Ų60.565%0.64935%0.345SS*.THydrogen-bonded Turntrans-68.6-15.8-17729.8-36.3000113.7V178V178-P180 WeakPolarHBondContact O-CD 3.23Å
181Y88.6Confident91.8Very high113 Ų11360.6 Ų60.644%0.44335%0.346SS..THydrogen-bonded Turntrans-99.1-16.2-177.5-51.1-64.3000112.9D179 V268 E269 V272D179-Y181 PolarHBondContact O-N 3.36Å; D179-Y181 WeakPolarHBondContact OD1-CB 3.2Å; D179-Y181 PolarHBondContact OD1-N 3.47Å; Y181-V268 VanDerWaalsContact CB-CG1 3.48Å; Y181-V268 WeakPolarHBondContact O-CG1 3.06Å; Y181-E269 HydrophobicContact CD2-CG 3.78Å; Y181-E269 HydrophobicContact CE2-CG 4.04Å; Y181-V272 HydrophobicContact CD1-CB 4.24Å; Y181-V272 HydrophobicContact CD1-CG1 4.06Å; Y181-V272 HydrophobicContact CD1-CG2 3.61Å; Y181-V272 HydrophobicContact CE1-CB 4.31Å; Y181-V272 HydrophobicContact CE1-CG1 3.73Å; Y181-V272 HydrophobicContact CE1-CG2 4.16Å; Y181-V272 HydrophobicContact CG-CG2 4.05Å
182N89.5Confident91.8Very high40 Ų4065.5 Ų65.521%0.21437%0.368CS..SBendtrans-78.2179.5174.9-164.416.1000111.3A176 D179 P184A176-N182 PolarHBondContact O-ND2 3.49Å; D179-N182 HydrophobicContact CB-CB 3.87Å; D179-N182 PolarHBondContact O-N 3.14Å; D179-N182 PolarHBondContact OD1-N 2.98Å; N182-P184 WeakPolarHBondContact O-CD 3.5Å
183N85.7Confident91.7Very high132 Ų13265.2 Ų65.271%0.70637%0.366SS*.SBendtrans-48.7116.5178.3-79-20.4000111.6I185N183-I185 PolarHBondContact O-N 2.86Å
184P83.8Confident91.7Very high122 Ų12263.7 Ų63.779%0.79236%0.355SS*.PPolyproline II helixtrans-69.5126.9-171.826.4-34000110.4N182N182-P184 WeakPolarHBondContact O-CD 3.5Å
185I89.4Confident91.7Very high54 Ų5463 Ų6328%0.27735%0.352SS..PPolyproline II helixtrans-80.3136.5168.8-56.9-57.4000108I177 N183 Q187 L189 E190I177-I185 HydrophobicContact CG2-CG1 4.35Å; N183-I185 PolarHBondContact O-N 2.86Å; I185-Q187 PolarHBondContact O-N 3.46Å; I185-L189 HydrophobicContact CG2-CB 3.88Å; I185-E190 HydrophobicContact CB-CG 4.47Å; I185-E190 HydrophobicContact CG2-CG 4.33Å
186P90.6Very high91.8Very high84 Ų8468.2 Ų68.255%0.54538%0.375SS..PPolyproline II helixtrans-55.6134.6174-25.134000111.2G188 L189P186-G188 PolarHBondContact O-N 2.88Å; P186-L189 HydrophobicContact CB-CD1 3.9Å; P186-L189 HydrophobicContact CB-CG 4.28Å; P186-L189 HydrophobicContact CG-CD1 4Å; P186-L189 WeakPolarHBondContact O-CB 3.44Å; P186-L189 PolarHBondContact O-N 2.98Å
187Q86.1Confident91.9Very high189 Ų18967.7 Ų67.788%0.88337%0.369SS*.THydrogen-bonded Turntrans-54.9128.4-175.5-171.2-179.79.400111.4I185I185-Q187 PolarHBondContact O-N 3.46Å
188G85.2Confident92.1Very high47 Ų4767.8 Ų67.849%0.48537%0.37SS..THydrogen-bonded Turntrans92.7-10.1-177.900000114.5P186 E190P186-G188 PolarHBondContact O-N 2.88Å; G188-E190 VanDerWaalsContact C-OE2 3.28Å; G188-E190 WeakPolarHBondContact CA-OE2 3.35Å; G188-E190 PolarHBondContact N-OE1 3.45Å; G188-E190 PolarHBondContact N-OE2 3.43Å
189L92.9Very high92.4Very high86 Ų8665.2 Ų65.245%0.4535%0.354SS..  trans-91.8-5.5174.7-63.7-173.7000113.6I185 P186 A191 F192 T193I185-L189 HydrophobicContact CG2-CB 3.88Å; P186-L189 HydrophobicContact CB-CD1 3.9Å; P186-L189 HydrophobicContact CB-CG 4.28Å; P186-L189 HydrophobicContact CG-CD1 4Å; P186-L189 WeakPolarHBondContact O-CB 3.44Å; P186-L189 PolarHBondContact O-N 2.98Å; L189-A191 VanDerWaalsContact C-N 3.31Å; L189-A191 PolarHBondContact O-N 3.45Å; L189-F192 PolarHBondContact O-N 2.87Å; L189-F192 VanDerWaalsContact O-N 3.12Å; L189-T193 PolarHBondContact O-N 3.34Å; L189-T193 PolarHBondContact O-OG1 3.4Å
190E92.6Very high92.8Very high70 Ų7068 Ų6833%0.32737%0.371SS..Hα-helixtrans-58.3-45.8-178.2-53.386.9164.700110.8I177 I185 G188 F192 T193 V194I177-E190 HydrophobicContact CG2-CB 4.26Å; I185-E190 HydrophobicContact CB-CG 4.47Å; I185-E190 HydrophobicContact CG2-CG 4.33Å; G188-E190 VanDerWaalsContact C-OE2 3.28Å; G188-E190 WeakPolarHBondContact CA-OE2 3.35Å; G188-E190 PolarHBondContact N-OE1 3.45Å; G188-E190 PolarHBondContact N-OE2 3.43Å; E190-F192 VanDerWaalsContact C-N 3.33Å; E190-F192 PolarHBondContact O-N 3.49Å; E190-T193 PolarHBondContact O-N 3.39Å; E190-V194 WeakPolarHBondContact O-CG2 3.13Å; E190-V194 PolarHBondContact O-N 3.18Å
191A95.6Very high93.3Very high6 Ų663.6 Ų63.65%0.0534%0.342CS..Hα-helixtrans-60.1-42177.400000112.3T68 I71 L72 L189 V194 G195T68-A191 HydrophobicContact CG2-CB 4.45Å; T68-A191 PolarHBondContact OG1-O 3.07Å; I71-A191 HydrophobicContact CB-CB 3.88Å; I71-A191 HydrophobicContact CG2-CB 3.59Å; L72-A191 HydrophobicContact CD2-CB 3.71Å; L72-A191 HydrophobicContact CG-CB 3.77Å; L189-A191 VanDerWaalsContact C-N 3.31Å; L189-A191 PolarHBondContact O-N 3.45Å; A191-V194 PolarHBondContact O-N 3.42Å; A191-G195 PolarHBondContact O-N 3.01Å; A191-G195 VanDerWaalsContact O-N 3.07Å
192F96.9Very high93.7Very high105 Ų10558.2 Ų58.246%0.46132%0.321SS..Hα-helixtrans-65.4-44.6178178.8-91000111.3F65 T68 L189 E190 V194 G195 F196F65-F192 HydrophobicContact CE1-CE2 4.07Å; T68-F192 HydrophobicContact CG2-CB 4.17Å; T68-F192 HydrophobicContact CG2-CD2 4.44Å; L189-F192 PolarHBondContact O-N 2.87Å; L189-F192 VanDerWaalsContact O-N 3.12Å; E190-F192 VanDerWaalsContact C-N 3.33Å; E190-F192 PolarHBondContact O-N 3.49Å; F192-V194 VanDerWaalsContact C-N 3.35Å; F192-V194 PolarHBondContact O-N 3.06Å; F192-G195 PolarHBondContact O-N 3.38Å; F192-F196 PolarHBondContact O-N 2.96Å
193T96.9Very high94.1Very high36 Ų3660 Ų6022%0.22133%0.33CS..Hα-helixtrans-64.5-39.2179.1-51.50000111.5I177 L189 E190 F196 V197I177-T193 HydrophobicContact CD1-CG2 3.56Å; I177-T193 HydrophobicContact CG1-CG2 3.8Å; L189-T193 PolarHBondContact O-N 3.34Å; L189-T193 PolarHBondContact O-OG1 3.4Å; E190-T193 PolarHBondContact O-N 3.39Å; T193-F196 WeakPolarHBondContact O-CB 3.26Å; T193-F196 PolarHBondContact O-N 3.02Å; T193-V197 WeakPolarHBondContact O-CG2 3.47Å; T193-V197 PolarHBondContact O-N 3.44Å
194V97.4Very high94.6Very high18 Ų1857.7 Ų57.711%0.10932%0.324CS..Hα-helixtrans-64.1-43.2174.3175.60000111.4I71 I174 I177 E190 A191 F192 F196 V197 V198I71-V194 HydrophobicContact CD1-CB 3.64Å; I71-V194 HydrophobicContact CD1-CG1 3.4Å; I71-V194 VanDerWaalsContact CD1-CG1 3.4Å; I71-V194 HydrophobicContact CD1-CG2 4.39Å; I174-V194 HydrophobicContact CD1-CG1 4.27Å; I174-V194 HydrophobicContact CG1-CG1 4.13Å; I174-V194 HydrophobicContact CG1-CG2 4.38Å; I177-V194 HydrophobicContact CD1-CG2 3.95Å; I177-V194 HydrophobicContact CG2-CG2 4.19Å; E190-V194 WeakPolarHBondContact O-CG2 3.13Å; E190-V194 PolarHBondContact O-N 3.18Å; A191-V194 PolarHBondContact O-N 3.42Å; F192-V194 VanDerWaalsContact C-N 3.35Å; F192-V194 PolarHBondContact O-N 3.06Å; V194-F196 VanDerWaalsContact C-N 3.29Å; V194-F196 PolarHBondContact O-N 3.38Å; V194-V197 WeakPolarHBondContact O-CB 3.37Å; V194-V197 PolarHBondContact O-N 2.82Å; V194-V198 PolarHBondContact O-N 3.36Å
195G97.9Very high95.2Very high1 Ų153.9 Ų53.91%0.0130%0.296CS..Hα-helixtrans-64.3-33.3174.600000113.4G64 T68 A191 F192 V197 V198 L199G64-G195 VanDerWaalsContact CA-O 3.23Å; G64-G195 WeakPolarHBondContact CA-O 3.45Å; G64-G195 VanDerWaalsContact O-CA 3.22Å; G64-G195 WeakPolarHBondContact O-CA 3.35Å; T68-G195 WeakPolarHBondContact OG1-CA 3.37Å; A191-G195 PolarHBondContact O-N 3.01Å; A191-G195 VanDerWaalsContact O-N 3.07Å; F192-G195 PolarHBondContact O-N 3.38Å; G195-V197 VanDerWaalsContact C-N 3.34Å; G195-V197 PolarHBondContact O-N 3.34Å; G195-V198 PolarHBondContact O-N 3.07Å; G195-L199 PolarHBondContact O-N 2.85Å
196F98.1Very high95.5Very high110 Ų11051.6 Ų51.648%0.48229%0.286SS..Hα-helixtrans-62.9-38.5172.1-178.3-101.7000112.2F192 T193 V194 L199 V200F192-F196 PolarHBondContact O-N 2.96Å; T193-F196 WeakPolarHBondContact O-CB 3.26Å; T193-F196 PolarHBondContact O-N 3.02Å; V194-F196 VanDerWaalsContact C-N 3.29Å; V194-F196 PolarHBondContact O-N 3.38Å; F196-L199 HydrophobicContact CD2-CD2 4.32Å; F196-L199 WeakPolarHBondContact O-CB 3.39Å; F196-L199 PolarHBondContact O-N 3.13Å; F196-V200 HydrophobicContact CD1-CG2 4.19Å; F196-V200 HydrophobicContact CE1-CG2 3.75Å; F196-V200 HydrophobicContact CE2-CG2 4.23Å; F196-V200 HydrophobicContact CZ-CG2 3.77Å; F196-V200 WeakPolarHBondContact O-CG2 3.35Å; F196-V200 PolarHBondContact O-N 3.04Å
197V98.3Very high95.7Very high16 Ų1654.9 Ų54.910%0.09729%0.292CS..Hα-helixtrans-60.5-46.7172.9174.10000110.9L170 C173 I177 T193 V194 G195 L199 V200 I201L170-V197 HydrophobicContact CD1-CG1 3.77Å; C173-V197 HydrophobicContact CB-CB 4.35Å; C173-V197 HydrophobicContact CB-CG1 3.72Å; C173-V197 HydrophobicContact CB-CG2 3.62Å; I177-V197 HydrophobicContact CD1-CG2 3.97Å; T193-V197 WeakPolarHBondContact O-CG2 3.47Å; T193-V197 PolarHBondContact O-N 3.44Å; V194-V197 WeakPolarHBondContact O-CB 3.37Å; V194-V197 PolarHBondContact O-N 2.82Å; G195-V197 VanDerWaalsContact C-N 3.34Å; G195-V197 PolarHBondContact O-N 3.34Å; V197-L199 VanDerWaalsContact C-N 3.31Å; V197-L199 PolarHBondContact O-N 3.1Å; V197-V200 PolarHBondContact O-N 2.84Å; V197-I201 HydrophobicContact CG1-CD1 3.83Å; V197-I201 HydrophobicContact CG1-CG1 4.47Å; V197-I201 WeakPolarHBondContact O-CG1 3.34Å; V197-I201 PolarHBondContact O-N 3.09Å
198V98.3Very high96.2Very high21 Ų2148 Ų4813%0.12726%0.261CS..Hα-helixtrans-59.2-43.4177175.50000111.1F63 A67 L170 V194 G195 I201 G202F63-V198 HydrophobicContact CB-CG1 4.46Å; A67-V198 HydrophobicContact CB-CB 4.35Å; A67-V198 HydrophobicContact CB-CG1 4.49Å; A67-V198 HydrophobicContact CB-CG2 4.04Å; L170-V198 HydrophobicContact CD1-CG2 4.17Å; V194-V198 PolarHBondContact O-N 3.36Å; G195-V198 PolarHBondContact O-N 3.07Å; V198-I201 PolarHBondContact O-N 3.32Å; V198-G202 PolarHBondContact O-N 3.41Å
199L98.4Very high96.6Very high13 Ų1345.8 Ų45.87%0.06824%0.238CC..Hα-helixtrans-57.4-51.1174.7171.260.7000111.6N60 F61 G195 F196 V197 I201 G202 L203N60-L199 VanDerWaalsContact C-CD1 3.4Å; N60-L199 HydrophobicContact CB-CD1 3.91Å; N60-L199 WeakPolarHBondContact O-CD1 3.39Å; F61-L199 HydrophobicContact CD1-CD1 3.99Å; F61-L199 HydrophobicContact CD1-CD2 3.81Å; F61-L199 HydrophobicContact CE1-CD1 4.4Å; F61-L199 HydrophobicContact CE1-CD2 3.77Å; F61-L199 HydrophobicContact CG-CD1 4.31Å; G195-L199 PolarHBondContact O-N 2.85Å; F196-L199 HydrophobicContact CD2-CD2 4.32Å; F196-L199 WeakPolarHBondContact O-CB 3.39Å; F196-L199 PolarHBondContact O-N 3.13Å; V197-L199 VanDerWaalsContact C-N 3.31Å; V197-L199 PolarHBondContact O-N 3.1Å; L199-I201 VanDerWaalsContact C-N 3.34Å; L199-I201 PolarHBondContact O-N 3.39Å; L199-G202 PolarHBondContact O-N 3.41Å; L199-L203 HydrophobicContact CD1-CD1 3.74Å; L199-L203 HydrophobicContact CD1-CG 3.95Å; L199-L203 HydrophobicContact CG-CD1 3.91Å; L199-L203 HydrophobicContact CG-CG 4.48Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.28Å; L199-L203 PolarHBondContact O-N 3.05Å
200V98.3Very high96.6Very high65 Ų6542.9 Ų42.939%0.39423%0.229SC..Hα-helixtrans-62.4-42.1-178.2171.30000111.2F196 V197 G202 L203 S204F196-V200 HydrophobicContact CD1-CG2 4.19Å; F196-V200 HydrophobicContact CE1-CG2 3.75Å; F196-V200 HydrophobicContact CE2-CG2 4.23Å; F196-V200 HydrophobicContact CZ-CG2 3.77Å; F196-V200 WeakPolarHBondContact O-CG2 3.35Å; F196-V200 PolarHBondContact O-N 3.04Å; V197-V200 PolarHBondContact O-N 2.84Å; V200-G202 VanDerWaalsContact C-N 3.34Å; V200-G202 PolarHBondContact O-N 3.33Å; V200-L203 PolarHBondContact O-N 3.24Å; V200-S204 WeakPolarHBondContact O-CB 3.1Å; V200-S204 PolarHBondContact O-N 2.83Å; V200-S204 PolarHBondContact O-OG 2.74Å
201I98.2Very high96.8Very high8 Ų840.2 Ų40.24%0.04122%0.216CC..Hα-helixtrans-61.1-45.3175.3-68.4169.2000110.3L170 V197 V198 L199 L203 S204 M205 V213L170-I201 HydrophobicContact CB-CD1 3.66Å; L170-I201 HydrophobicContact CD1-CD1 4.06Å; L170-I201 HydrophobicContact CG-CD1 4.43Å; V197-I201 HydrophobicContact CG1-CD1 3.83Å; V197-I201 HydrophobicContact CG1-CG1 4.47Å; V197-I201 WeakPolarHBondContact O-CG1 3.34Å; V197-I201 PolarHBondContact O-N 3.09Å; V198-I201 PolarHBondContact O-N 3.32Å; L199-I201 VanDerWaalsContact C-N 3.34Å; L199-I201 PolarHBondContact O-N 3.39Å; I201-L203 VanDerWaalsContact C-N 3.34Å; I201-L203 PolarHBondContact O-N 3.06Å; I201-S204 PolarHBondContact O-N 2.97Å; I201-S204 PolarHBondContact O-OG 2.93Å; I201-M205 HydrophobicContact CG2-CB 4.48Å; I201-M205 HydrophobicContact CG2-SD 4.43Å; I201-M205 WeakPolarHBondContact O-CA 3.32Å; I201-M205 WeakPolarHBondContact O-CB 3.48Å; I201-M205 PolarHBondContact O-N 3.47Å; I201-V213 HydrophobicContact CG2-CG1 4.38Å
202G97.6Very high96.7Very high0 Ų040 Ų400%022%0.215CC..Hα-helixtrans-61.4-40.9177.700000113.2F56 N60 V198 L199 V200 G206F56-G202 WeakPolarHBondContact CZ-O 3.42Å; N60-G202 VanDerWaalsContact OD1-C 3.29Å; N60-G202 WeakPolarHBondContact OD1-CA 3.39Å; N60-G202 PolarHBondContact OD1-O 3.02Å; V198-G202 PolarHBondContact O-N 3.41Å; L199-G202 PolarHBondContact O-N 3.41Å; V200-G202 VanDerWaalsContact C-N 3.34Å; V200-G202 PolarHBondContact O-N 3.33Å; G202-G206 WeakPolarHBondContact O-CA 3.5Å; G202-G206 PolarHBondContact O-N 2.77Å; G202-G206 VanDerWaalsContact O-N 3.13Å
203L97.6Very high96.7Very high77 Ų7735.5 Ų35.540%0.40320%0.196SC..Hα-helixtrans-69.4-32.2178.4-68.5173.3000113.8L57 N60 L199 V200 I201L57-L203 HydrophobicContact CD1-CD2 3.49Å; L57-L203 VanDerWaalsContact CD1-CD2 3.49Å; N60-L203 HydrophobicContact CB-CD2 3.75Å; N60-L203 HydrophobicContact CB-CG 4.06Å; L199-L203 HydrophobicContact CD1-CD1 3.74Å; L199-L203 HydrophobicContact CD1-CG 3.95Å; L199-L203 HydrophobicContact CG-CD1 3.91Å; L199-L203 HydrophobicContact CG-CG 4.48Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.28Å; L199-L203 PolarHBondContact O-N 3.05Å; V200-L203 PolarHBondContact O-N 3.24Å; I201-L203 VanDerWaalsContact C-N 3.34Å; I201-L203 PolarHBondContact O-N 3.06Å
204S97.1Very high96.8Very high84 Ų8434.2 Ų34.259%0.58719%0.188SC*.Hα-helixtrans-98.2-29.8-17454.80000113.8V200 I201V200-S204 WeakPolarHBondContact O-CB 3.1Å; V200-S204 PolarHBondContact O-N 2.83Å; V200-S204 PolarHBondContact O-OG 2.74Å; I201-S204 PolarHBondContact O-N 2.97Å; I201-S204 PolarHBondContact O-OG 2.93Å
205M95.8Very high96.9Very high42 Ų4233.4 Ų33.421%0.20718%0.182CC..Hα-helixtrans-126.25-170-54-178.770.200113.2I165 I201 F207I165-M205 HydrophobicContact CB-CE 4.03Å; I165-M205 HydrophobicContact CG2-CE 3.76Å; I201-M205 HydrophobicContact CG2-CB 4.48Å; I201-M205 HydrophobicContact CG2-SD 4.43Å; I201-M205 WeakPolarHBondContact O-CA 3.32Å; I201-M205 WeakPolarHBondContact O-CB 3.48Å; I201-M205 PolarHBondContact O-N 3.47Å; M205-F207 PolarHBondContact O-N 2.74Å
206G95.3Very high96.9Very high5 Ų533.3 Ų33.35%0.05218%0.182CC..Hα-helixtrans-79.6-14.8-172.300000116.8G202 G210 Y211G202-G206 WeakPolarHBondContact O-CA 3.5Å; G202-G206 PolarHBondContact O-N 2.77Å; G202-G206 VanDerWaalsContact O-N 3.13Å; G206-G210 WeakPolarHBondContact O-CA 3.3Å; G206-G210 PolarHBondContact O-N 3.21Å; G206-Y211 VanDerWaalsContact CA-CD1 3.48Å
207F95.7Very high96.9Very high154 Ų15428.9 Ų28.968%0.67516%0.162SC*.Hα-helixtrans-67.7-38.6-176174.8-126.5000113.7H153 M205H153-F207 AromaticContact CE1-CE1 3.32Å; H153-F207 WeakPolarHBondContact CE1-CE1 3.28Å; H153-F207 AromaticContact CE1-CZ 3.41Å; H153-F207 VanDerWaalsContact CE1-CZ 3.41Å; H153-F207 WeakPolarHBondContact CE1-CZ 3.37Å; H153-F207 AromaticContact NE2-CE1 3.68Å; M205-F207 PolarHBondContact O-N 2.74Å
208N96.3Very high96.9Very high43 Ų4328.1 Ų28.123%0.2316%0.157CC..Hα-helixtrans-67.9-54.5-173.6-75.2-28.6000111.8A151 H153 L154 D162A151-N208 VanDerWaalsContact CB-O 3.26Å; A151-N208 WeakPolarHBondContact CB-O 3.12Å; A151-N208 PolarHBondContact N-O 2.94Å; H153-N208 PolarHBondContact NE2-OD1 2.8Å; L154-N208 HydrophobicContact CD1-CB 4.09Å; L154-N208 HydrophobicContact CD2-CB 3.93Å; L154-N208 WeakPolarHBondContact CD2-O 3.46Å; D162-N208 WeakPolarHBondContact OD1-CB 3.35Å; D162-N208 PolarHBondContact OD1-ND2 3.26Å
209S94.1Very high97Very high1 Ų129.7 Ų29.71%0.00716%0.163CC..Hα-helixtrans-142.712.2-168.769.80000114.4T148 D162 Q163 Y211T148-S209 VanDerWaalsContact CB-O 3.3Å; T148-S209 WeakPolarHBondContact CB-O 3.3Å; D162-S209 PolarHBondContact OD2-OG 3.33Å; Q163-S209 PolarHBondContact NE2-OG 3.36Å; S209-Y211 VanDerWaalsContact C-N 3.35Å; S209-Y211 PolarHBondContact O-N 2.63Å
210G93.1Very high97Very high26 Ų2629.1 Ų29.127%0.26816%0.159SC..  trans72.824.2177.500000114.8G206 A212G206-G210 WeakPolarHBondContact O-CA 3.3Å; G206-G210 PolarHBondContact O-N 3.21Å; G210-A212 PolarHBondContact O-N 3.24Å
211Y95.6Very high97Very high14 Ų1426 Ų266%0.05514%0.141CC..  trans44.552.717163.3-81.2000114.1N60 F63 G206 S209 V213N60-Y211 WeakPolarHBondContact OD1-CE1 3.48Å; N60-Y211 PolarHBondContact OD1-OH 3.38Å; F63-Y211 HydrophobicContact CB-CE2 4.2Å; F63-Y211 VanDerWaalsContact CD2-OH 3.28Å; F63-Y211 WeakPolarHBondContact CD2-OH 3.42Å; F63-Y211 HydrophobicContact CG-CE2 4.27Å; G206-Y211 VanDerWaalsContact CA-CD1 3.48Å; S209-Y211 VanDerWaalsContact C-N 3.35Å; S209-Y211 PolarHBondContact O-N 2.63Å; Y211-V213 WeakPolarHBondContact O-CG2 3.38Å; Y211-V213 PolarHBondContact O-N 3.25Å
212A94.5Very high97Very high2 Ų225.6 Ų25.62%0.01714%0.139CC..  trans-51.9-53.9-177.700000112.2T148 G210 N214 D218 P245T148-A212 HydrophobicContact CG2-CB 3.76Å; G210-A212 PolarHBondContact O-N 3.24Å; A212-N214 WeakPolarHBondContact O-CB 3.26Å; A212-N214 PolarHBondContact O-N 3.19Å; A212-D218 HydrophobicContact CB-CB 4.42Å; A212-P245 HydrophobicContact CB-CB 3.5Å
213V97.2Very high97Very high10 Ų1028.7 Ų28.76%0.06116%0.155CC..  trans456.5174.6-53.70000116.7N83 T167 L170 I201 Y211N83-V213 PolarHBondContact ND2-O 3Å; T167-V213 WeakPolarHBondContact OG1-CA 3.44Å; L170-V213 HydrophobicContact CD2-CB 4.29Å; L170-V213 HydrophobicContact CD2-CG2 3.94Å; I201-V213 HydrophobicContact CG2-CG1 4.38Å; Y211-V213 WeakPolarHBondContact O-CG2 3.38Å; Y211-V213 PolarHBondContact O-N 3.25Å
214N98.5Very high97.1Very high9 Ų925.9 Ų25.95%0.04814%0.139CC..  trans-151.2106.1-170.6177.3-21000108.1L82 N83 P84 A212 A216 R217 D218L82-N214 PolarHBondContact O-ND2 3.05Å; N83-N214 HydrophobicContact CB-CB 4.31Å; N83-N214 WeakPolarHBondContact CB-ND2 3.43Å; N83-N214 VanDerWaalsContact CG-CG 3.44Å; N83-N214 WeakPolarHBondContact ND2-CB 3.46Å; N83-N214 WeakPolarHBondContact OD1-CA 3Å; P84-N214 VanDerWaalsContact CD-OD1 3.3Å; P84-N214 WeakPolarHBondContact CD-OD1 3.49Å; A212-N214 WeakPolarHBondContact O-CB 3.26Å; A212-N214 PolarHBondContact O-N 3.19Å; N214-A216 VanDerWaalsContact C-N 3.3Å; N214-A216 PolarHBondContact O-N 3.05Å; N214-A216 PolarHBondContact OD1-N 3.5Å; N214-R217 HydrophobicContact CB-CB 3.74Å; N214-R217 VanDerWaalsContact CG-CB 3.49Å; N214-R217 PolarHBondContact O-N 3.27Å; N214-R217 PolarHBondContact OD1-N 3.17Å; N214-R217 VanDerWaalsContact OD1-N 3.09Å; N214-D218 PolarHBondContact O-N 3.41Å
215P98.8Very high97.1Very high0 Ų021.9 Ų21.90%011%0.111CC..Hα-helixtrans-56.9-38.4-179.4-29.737000114.1N83 P84 F105 D218 F219 P245 I246 P249 F250N83-P215 WeakPolarHBondContact OD1-CD 3.48Å; P84-P215 HydrophobicContact CB-CB 4.24Å; P84-P215 HydrophobicContact CB-CG 4.24Å; P84-P215 HydrophobicContact CG-CB 4.1Å; F105-P215 HydrophobicContact CE2-CB 4.35Å; F105-P215 HydrophobicContact CZ-CB 4.17Å; P215-D218 PolarHBondContact O-N 3.26Å; P215-F219 WeakPolarHBondContact O-CB 3.46Å; P215-F219 PolarHBondContact O-N 2.82Å; P215-P245 WeakPolarHBondContact CA-O 3.46Å; P215-I246 WeakPolarHBondContact CG-O 3.5Å; P215-P249 HydrophobicContact CG-CB 3.97Å; P215-P249 HydrophobicContact CG-CG 4.23Å; P215-F250 HydrophobicContact CB-CE2 4.36Å; P215-F250 HydrophobicContact CB-CZ 4.4Å; P215-F250 HydrophobicContact CG-CD2 4.49Å; P215-F250 HydrophobicContact CG-CE2 3.9Å; P215-F250 HydrophobicContact CG-CZ 3.93Å
216A98.8Very high97.2Very high0 Ų020.8 Ų20.80%011%0.109CC..Hα-helixtrans-69.9-39.9-179.800000112.2P84 Q108 A112 N214 D218 G220P84-A216 HydrophobicContact CG-CB 3.71Å; Q108-A216 HydrophobicContact CB-CB 3.7Å; A112-A216 WeakPolarHBondContact CB-O 3.48Å; N214-A216 VanDerWaalsContact C-N 3.3Å; N214-A216 PolarHBondContact O-N 3.05Å; N214-A216 PolarHBondContact OD1-N 3.5Å; A216-D218 PolarHBondContact O-N 2.9Å; A216-G220 PolarHBondContact O-N 2.78Å
217R98.4Very high97.3Very high16 Ų1627 Ų276%0.0614%0.139CC..Hα-helixtrans-63.4-23.9178.6175.6-93.1177.3-85.39.5113.1V36 F146 N214 P221V36-R217 HydrophobicContact CG2-CB 4.35Å; V36-R217 HydrophobicContact CG2-CG 4.17Å; F146-R217 PolarHBondContact O-NH1 3.4Å; N214-R217 HydrophobicContact CB-CB 3.74Å; N214-R217 VanDerWaalsContact CG-CB 3.49Å; N214-R217 PolarHBondContact O-N 3.27Å; N214-R217 PolarHBondContact OD1-N 3.17Å; N214-R217 VanDerWaalsContact OD1-N 3.09Å; R217-P221 WeakPolarHBondContact O-CD 3.49Å; R217-P221 WeakPolarHBondContact O-CG 3.41Å
218D98.4Very high97.2Very high0 Ų020.7 Ų20.70%012%0.116CC..Hα-helixtrans-95.9-50.6174.1-170.4-90.1000112T148 A212 N214 P215 A216 P221 R222 P245T148-D218 WeakPolarHBondContact CB-OD2 3.3Å; T148-D218 PolarHBondContact N-OD2 3.37Å; T148-D218 PolarHBondContact OG1-OD2 3.19Å; A212-D218 HydrophobicContact CB-CB 4.42Å; N214-D218 PolarHBondContact O-N 3.41Å; P215-D218 PolarHBondContact O-N 3.26Å; A216-D218 PolarHBondContact O-N 2.9Å; D218-P221 WeakPolarHBondContact O-CD 3.41Å; D218-R222 VanDerWaalsContact CG-NH2 3.26Å; D218-R222 VanDerWaalsContact O-CB 3.24Å; D218-R222 WeakPolarHBondContact O-CB 3.43Å; D218-R222 PolarHBondContact O-N 3.24Å; D218-R222 VanDerWaalsContact O-N 3.08Å; D218-R222 IonicContact OD1-CZ 3.95Å; D218-R222 VanDerWaalsContact OD1-CZ 3.27Å; D218-R222 IonicContact OD1-NE 2.94Å; D218-R222 PolarHBondContact OD1-NE 3.5Å; D218-R222 IonicContact OD1-NH2 3.92Å; D218-R222 PolarHBondContact OD1-NH2 2.88Å; D218-R222 IonicContact OD2-NH2 3.92Å; D218-R222 PolarHBondContact OD2-NH2 3.25Å; D218-P245 HydrophobicContact CB-CB 3.87Å; D218-P245 HydrophobicContact CB-CG 4.07Å; D218-P245 VanDerWaalsContact CG-CG 3.43Å; D218-P245 VanDerWaalsContact OD1-CG 3.26Å; D218-P245 WeakPolarHBondContact OD1-CG 3.34Å
219F98.6Very high97.1Very high55 Ų5520.9 Ų20.924%0.24113%0.128CC..Hα-helixtrans-69-40.6-171.3-174.8-125000113.3T109 P215 R222 L223 F235 I246T109-F219 HydrophobicContact CG2-CD1 3.82Å; T109-F219 HydrophobicContact CG2-CE1 4.43Å; P215-F219 WeakPolarHBondContact O-CB 3.46Å; P215-F219 PolarHBondContact O-N 2.82Å; F219-R222 PolarHBondContact O-N 3.1Å; F219-L223 HydrophobicContact CD1-CD1 3.93Å; F219-L223 HydrophobicContact CD2-CG 4.32Å; F219-L223 HydrophobicContact CE1-CD1 3.55Å; F219-L223 HydrophobicContact CE1-CG 4.22Å; F219-L223 HydrophobicContact CE2-CD1 4.22Å; F219-L223 HydrophobicContact CE2-CD2 4.11Å; F219-L223 HydrophobicContact CE2-CG 3.98Å; F219-L223 HydrophobicContact CG-CD1 4.42Å; F219-L223 HydrophobicContact CZ-CD1 3.71Å; F219-L223 HydrophobicContact CZ-CD2 3.96Å; F219-L223 HydrophobicContact CZ-CG 3.92Å; F219-L223 WeakPolarHBondContact O-CG 3.41Å; F219-L223 PolarHBondContact O-N 3.29Å; F219-F235 HydrophobicContact CD2-CE1 4.4Å; F219-F235 HydrophobicContact CE2-CE1 4.03Å; F219-I246 HydrophobicContact CB-CD1 4.22Å; F219-I246 HydrophobicContact CB-CG1 4.24Å; F219-I246 HydrophobicContact CD2-CD1 3.6Å; F219-I246 HydrophobicContact CD2-CG1 4.5Å; F219-I246 HydrophobicContact CE2-CD1 4.15Å; F219-I246 HydrophobicContact CG-CD1 4Å
220G98.6Very high97.2Very high0 Ų021.4 Ų21.40%013%0.13CC..Hα-helixtrans-60-54178.400000112.8A216 R222 L223 F224A216-G220 PolarHBondContact O-N 2.78Å; G220-R222 VanDerWaalsContact C-N 3.27Å; G220-R222 PolarHBondContact O-N 3.26Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 2.97Å; G220-F224 PolarHBondContact O-N 3.48Å
221P98.6Very high97.3Very high0 Ų021.6 Ų21.60%013%0.132CC..Hα-helixtrans-63.4-31176-27.238.9000113.4V36 A112 A116 F146 R217 D218 F224 T225V36-P221 HydrophobicContact CG1-CG 3.72Å; A112-P221 HydrophobicContact CB-CG 4.39Å; A116-P221 HydrophobicContact CB-CB 3.71Å; A116-P221 HydrophobicContact CB-CG 4Å; F146-P221 HydrophobicContact CB-CB 3.9Å; F146-P221 VanDerWaalsContact O-CB 3.26Å; F146-P221 WeakPolarHBondContact O-CB 3.36Å; R217-P221 WeakPolarHBondContact O-CD 3.49Å; R217-P221 WeakPolarHBondContact O-CG 3.41Å; D218-P221 WeakPolarHBondContact O-CD 3.41Å; P221-F224 PolarHBondContact O-N 3.49Å; P221-T225 WeakPolarHBondContact O-CG2 3.48Å; P221-T225 PolarHBondContact O-N 2.94Å; P221-T225 PolarHBondContact O-OG1 3.11Å
222R97.9Very high97.2Very high0 Ų026.2 Ų26.20%016%0.162CC..Hα-helixtrans-67-42.4174.6-166.8-179.8-61.5-78.2-4.8112.1A147 T148 Y149 D218 F219 G220 F224 T225 A226 V234 F235A147-R222 HydrophobicContact CB-CB 3.99Å; T148-R222 PolarHBondContact O-NH2 3.42Å; Y149-R222 VanDerWaalsContact CE1-NH1 3.3Å; Y149-R222 PolarHBondContact OH-NH1 3.29Å; D218-R222 VanDerWaalsContact CG-NH2 3.26Å; D218-R222 VanDerWaalsContact O-CB 3.24Å; D218-R222 WeakPolarHBondContact O-CB 3.43Å; D218-R222 PolarHBondContact O-N 3.24Å; D218-R222 VanDerWaalsContact O-N 3.08Å; D218-R222 IonicContact OD1-CZ 3.95Å; D218-R222 VanDerWaalsContact OD1-CZ 3.27Å; D218-R222 IonicContact OD1-NE 2.94Å; D218-R222 PolarHBondContact OD1-NE 3.5Å; D218-R222 IonicContact OD1-NH2 3.92Å; D218-R222 PolarHBondContact OD1-NH2 2.88Å; D218-R222 IonicContact OD2-NH2 3.92Å; D218-R222 PolarHBondContact OD2-NH2 3.25Å; F219-R222 PolarHBondContact O-N 3.1Å; G220-R222 VanDerWaalsContact C-N 3.27Å; G220-R222 PolarHBondContact O-N 3.26Å; R222-F224 VanDerWaalsContact C-N 3.31Å; R222-F224 PolarHBondContact O-N 3.33Å; R222-T225 WeakPolarHBondContact CA-OG1 3.44Å; R222-T225 PolarHBondContact O-N 2.96Å; R222-T225 PolarHBondContact O-OG1 3.49Å; R222-T225 VanDerWaalsContact O-OG1 3.04Å; R222-A226 WeakPolarHBondContact O-CB 3.2Å; R222-A226 PolarHBondContact O-N 2.99Å; R222-V234 HydrophobicContact CG-CB 3.97Å; R222-V234 HydrophobicContact CG-CG2 3.78Å; R222-V234 PolarHBondContact NH1-O 3.27Å; R222-F235 HydrophobicContact CB-CE1 4.43Å; R222-F235 HydrophobicContact CG-CD1 4.13Å; R222-F235 HydrophobicContact CG-CE1 3.7Å; R222-F235 HydrophobicContact CG-CZ 4.14Å
223L98.4Very high97.2Very high65 Ų6527.3 Ų27.334%0.3417%0.173SC..Hα-helixtrans-60.3-42.1171.8-74.9169.2000111.5T109 F113 F219 G220 A226 F235T109-L223 HydrophobicContact CG2-CD1 4.32Å; F113-L223 HydrophobicContact CD2-CB 4.12Å; F113-L223 HydrophobicContact CE2-CB 4.46Å; F219-L223 HydrophobicContact CD1-CD1 3.93Å; F219-L223 HydrophobicContact CD2-CG 4.32Å; F219-L223 HydrophobicContact CE1-CD1 3.55Å; F219-L223 HydrophobicContact CE1-CG 4.22Å; F219-L223 HydrophobicContact CE2-CD1 4.22Å; F219-L223 HydrophobicContact CE2-CD2 4.11Å; F219-L223 HydrophobicContact CE2-CG 3.98Å; F219-L223 HydrophobicContact CG-CD1 4.42Å; F219-L223 HydrophobicContact CZ-CD1 3.71Å; F219-L223 HydrophobicContact CZ-CD2 3.96Å; F219-L223 HydrophobicContact CZ-CG 3.92Å; F219-L223 WeakPolarHBondContact O-CG 3.41Å; F219-L223 PolarHBondContact O-N 3.29Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 2.97Å; L223-A226 WeakPolarHBondContact O-CB 3.05Å; L223-A226 PolarHBondContact O-N 3.33Å; L223-F235 HydrophobicContact CD2-CZ 3.92Å; L223-F235 HydrophobicContact CG-CZ 4.45Å
224F98.5Very high97.1Very high18 Ų1826.9 Ų26.98%0.07917%0.17CC..Hα-helixtrans-61.4-53176.4172-101000111.8F113 A116 S117 F120 G220 P221 R222 A226 I227 A228F113-F224 HydrophobicContact CD2-CB 3.63Å; F113-F224 HydrophobicContact CE1-CD2 4.29Å; F113-F224 VanDerWaalsContact CE2-CA 3.42Å; F113-F224 HydrophobicContact CE2-CB 3.66Å; F113-F224 HydrophobicContact CE2-CD2 4.18Å; F113-F224 HydrophobicContact CE2-CG 4.45Å; F113-F224 HydrophobicContact CG-CB 4.24Å; F113-F224 HydrophobicContact CZ-CB 4.28Å; F113-F224 AromaticContact CZ-CD2 3.95Å; F113-F224 HydrophobicContact CZ-CD2 3.95Å; A116-F224 HydrophobicContact CB-CB 4.4Å; A116-F224 HydrophobicContact CB-CD1 4.03Å; A116-F224 HydrophobicContact CB-CG 4.35Å; S117-F224 VanDerWaalsContact CB-CE2 3.45Å; F120-F224 HydrophobicContact CB-CE1 3.44Å; F120-F224 VanDerWaalsContact CB-CE1 3.44Å; F120-F224 HydrophobicContact CB-CZ 3.51Å; F120-F224 HydrophobicContact CD1-CE1 4.34Å; F120-F224 AromaticContact CD1-CZ 3.69Å; F120-F224 HydrophobicContact CD1-CZ 3.69Å; F120-F224 AromaticContact CD2-CE1 3.9Å; F120-F224 HydrophobicContact CD2-CE1 3.9Å; F120-F224 HydrophobicContact CD2-CZ 4.02Å; F120-F224 HydrophobicContact CE1-CZ 4.38Å; F120-F224 AromaticContact CG-CE1 3.65Å; F120-F224 HydrophobicContact CG-CE1 3.65Å; F120-F224 AromaticContact CG-CZ 3.48Å; F120-F224 HydrophobicContact CG-CZ 3.48Å; F120-F224 VanDerWaalsContact CG-CZ 3.48Å; G220-F224 PolarHBondContact O-N 3.48Å; P221-F224 PolarHBondContact O-N 3.49Å; R222-F224 VanDerWaalsContact C-N 3.31Å; R222-F224 PolarHBondContact O-N 3.33Å; F224-A226 PolarHBondContact O-N 2.89Å; F224-I227 WeakPolarHBondContact O-CG1 3.49Å; F224-I227 PolarHBondContact O-N 2.9Å; F224-I227 VanDerWaalsContact O-N 3.09Å; F224-A228 HydrophobicContact CD1-CB 4.22Å; F224-A228 HydrophobicContact CD2-CB 4.42Å; F224-A228 HydrophobicContact CE1-CB 3.67Å; F224-A228 HydrophobicContact CE2-CB 3.91Å; F224-A228 HydrophobicContact CZ-CB 3.5Å; F224-A228 VanDerWaalsContact CZ-CB 3.5Å; F224-A228 VanDerWaalsContact O-CB 3.23Å; F224-A228 WeakPolarHBondContact O-CB 3.46Å; F224-A228 PolarHBondContact O-N 3.3Å
225T97.8Very high97Very high0 Ų028.4 Ų28.40%018%0.177CC..Hα-helixtrans-61.2-33.4-179.146.20000112.7F146 P221 R222 I227 A228 W230F146-T225 HydrophobicContact CB-CG2 3.66Å; F146-T225 HydrophobicContact CD2-CG2 3.45Å; F146-T225 VanDerWaalsContact CD2-CG2 3.45Å; F146-T225 HydrophobicContact CE2-CG2 4.26Å; F146-T225 HydrophobicContact CG-CG2 3.65Å; P221-T225 WeakPolarHBondContact O-CG2 3.48Å; P221-T225 PolarHBondContact O-N 2.94Å; P221-T225 PolarHBondContact O-OG1 3.11Å; R222-T225 WeakPolarHBondContact CA-OG1 3.44Å; R222-T225 PolarHBondContact O-N 2.96Å; R222-T225 PolarHBondContact O-OG1 3.49Å; R222-T225 VanDerWaalsContact O-OG1 3.04Å; T225-I227 PolarHBondContact O-N 3.46Å; T225-A228 PolarHBondContact O-N 3.25Å; T225-W230 HydrophobicContact CG2-CD2 4.24Å; T225-W230 HydrophobicContact CG2-CE3 3.96Å; T225-W230 HydrophobicContact CG2-CZ3 4.23Å; T225-W230 WeakPolarHBondContact O-CB 3.49Å; T225-W230 PolarHBondContact O-N 3.3Å
226A97.4Very high96.8Very high19 Ų1933.3 Ų33.316%0.15721%0.207CC..Hα-helixtrans-57.2-36.5175.500000113.4R222 L223 F224 G231 V234 F235R222-A226 WeakPolarHBondContact O-CB 3.2Å; R222-A226 PolarHBondContact O-N 2.99Å; L223-A226 WeakPolarHBondContact O-CB 3.05Å; L223-A226 PolarHBondContact O-N 3.33Å; F224-A226 PolarHBondContact O-N 2.89Å; A226-G231 WeakPolarHBondContact CA-O 3.42Å; A226-G231 CarbonylContact O-C 3.57Å; A226-G231 VanDerWaalsContact O-CA 3.3Å; A226-G231 WeakPolarHBondContact O-CA 3.23Å; A226-G231 PolarHBondContact O-N 3.1Å; A226-V234 HydrophobicContact CB-CG2 3.69Å; A226-F235 HydrophobicContact CB-CE2 3.61Å; A226-F235 HydrophobicContact CB-CZ 4.21Å
227I97.3Very high96.4Very high134 Ų13433.9 Ų33.969%0.68721%0.212SC*.Hα-helixtrans-98.1-16.418066.2170000113.3F113 F224 T225F113-I227 HydrophobicContact CE2-CD1 4.11Å; F113-I227 HydrophobicContact CZ-CD1 3.89Å; F224-I227 WeakPolarHBondContact O-CG1 3.49Å; F224-I227 PolarHBondContact O-N 2.9Å; F224-I227 VanDerWaalsContact O-N 3.09Å; T225-I227 PolarHBondContact O-N 3.46Å
228A95.5Very high95.9Very high22 Ų2238.9 Ų38.918%0.18223%0.23CC..Hα-helixtrans-89.23-175.200000114.7F120 F224 T225 W230F120-A228 HydrophobicContact CE2-CB 4.2Å; F120-A228 HydrophobicContact CZ-CB 4.35Å; F224-A228 HydrophobicContact CD1-CB 4.22Å; F224-A228 HydrophobicContact CD2-CB 4.42Å; F224-A228 HydrophobicContact CE1-CB 3.67Å; F224-A228 HydrophobicContact CE2-CB 3.91Å; F224-A228 HydrophobicContact CZ-CB 3.5Å; F224-A228 VanDerWaalsContact CZ-CB 3.5Å; F224-A228 VanDerWaalsContact O-CB 3.23Å; F224-A228 WeakPolarHBondContact O-CB 3.46Å; F224-A228 PolarHBondContact O-N 3.3Å; T225-A228 PolarHBondContact O-N 3.25Å; A228-W230 HydrophobicContact CB-CE3 4.42Å; A228-W230 HydrophobicContact CB-CZ3 4.28Å
229G93.3Very high95.5Very high48 Ų4845.7 Ų45.750%0.49527%0.267SS..THydrogen-bonded Turntrans132.5-22.3172.700000115.3G231G229-G231 VanDerWaalsContact C-N 3.26Å; G229-G231 PolarHBondContact O-N 3.32Å
230W95.2Very high95.3Very high12 Ų1243.8 Ų43.85%0.04526%0.262CS..SBendtrans-73.4-19.4177.5-74.1-96.9000112.7F120 L127 F134 N135 L136 T142 A143 F146 T225 A228 V234F120-W230 AromaticContact CD2-CH2 3.95Å; F120-W230 HydrophobicContact CD2-CH2 3.95Å; F120-W230 AromaticContact CD2-CZ3 3.82Å; F120-W230 HydrophobicContact CD2-CZ3 3.82Å; F120-W230 AromaticContact CE2-CH2 3.95Å; F120-W230 HydrophobicContact CE2-CH2 3.95Å; F120-W230 AromaticContact CE2-CZ3 3.62Å; F120-W230 HydrophobicContact CE2-CZ3 3.62Å; L127-W230 HydrophobicContact CD1-CH2 4.47Å; L127-W230 HydrophobicContact CD2-CH2 4.37Å; L127-W230 HydrophobicContact CD2-CZ2 4.31Å; F134-W230 HydrophobicContact CB-CD2 4.22Å; F134-W230 HydrophobicContact CB-CG 4.36Å; F134-W230 AromaticContact CD1-CD2 3.89Å; F134-W230 HydrophobicContact CD1-CD2 3.89Å; F134-W230 AromaticContact CD1-CE2 3.84Å; F134-W230 AromaticContact CD1-CE3 3.67Å; F134-W230 HydrophobicContact CD1-CE3 3.67Å; F134-W230 AromaticContact CD1-CH2 3.38Å; F134-W230 HydrophobicContact CD1-CH2 3.38Å; F134-W230 AromaticContact CD1-CZ2 3.61Å; F134-W230 HydrophobicContact CD1-CZ2 3.61Å; F134-W230 AromaticContact CD1-CZ3 3.42Å; F134-W230 HydrophobicContact CD1-CZ3 3.42Å; F134-W230 VanDerWaalsContact CD1-CZ3 3.42Å; F134-W230 HydrophobicContact CE1-CE3 4.35Å; F134-W230 AromaticContact CE1-CH2 3.62Å; F134-W230 HydrophobicContact CE1-CH2 3.62Å; F134-W230 HydrophobicContact CE1-CZ2 4.24Å; F134-W230 AromaticContact CE1-CZ3 3.69Å; F134-W230 HydrophobicContact CE1-CZ3 3.69Å; F134-W230 HydrophobicContact CG-CE3 4.5Å; N135-W230 PolarHBondContact O-NE1 2.81Å; L136-W230 HydrophobicContact CD1-CB 3.91Å; L136-W230 HydrophobicContact CD1-CG 4.25Å; L136-W230 WeakPolarHBondContact CD1-O 3.22Å; T142-W230 PolarHBondContact OG1-NE1 3.24Å; T142-W230 VanDerWaalsContact OG1-NE1 3.1Å; A143-W230 HydrophobicContact CB-CG 4.3Å; A143-W230 VanDerWaalsContact N-NE1 3.17Å; F146-W230 HydrophobicContact CD2-CH2 4.29Å; F146-W230 HydrophobicContact CD2-CZ2 4.41Å; F146-W230 AromaticContact CE2-CH2 3.56Å; F146-W230 HydrophobicContact CE2-CH2 3.56Å; F146-W230 AromaticContact CE2-CZ2 3.92Å; F146-W230 HydrophobicContact CE2-CZ2 3.92Å; F146-W230 HydrophobicContact CE2-CZ3 4.26Å; F146-W230 HydrophobicContact CZ-CH2 4.36Å; T225-W230 HydrophobicContact CG2-CD2 4.24Å; T225-W230 HydrophobicContact CG2-CE3 3.96Å; T225-W230 HydrophobicContact CG2-CZ3 4.23Å; T225-W230 WeakPolarHBondContact O-CB 3.49Å; T225-W230 PolarHBondContact O-N 3.3Å; A228-W230 HydrophobicContact CB-CE3 4.42Å; A228-W230 HydrophobicContact CB-CZ3 4.28Å; W230-V234 HydrophobicContact CB-CG1 3.81Å
231G95.3Very high95.1Very high29 Ų2943.8 Ų43.830%0.29926%0.262SS..  trans73.2-177.6177.600000113.9A226 G229 G233 V234A226-G231 WeakPolarHBondContact CA-O 3.42Å; A226-G231 CarbonylContact O-C 3.57Å; A226-G231 VanDerWaalsContact O-CA 3.3Å; A226-G231 WeakPolarHBondContact O-CA 3.23Å; A226-G231 PolarHBondContact O-N 3.1Å; G229-G231 VanDerWaalsContact C-N 3.26Å; G229-G231 PolarHBondContact O-N 3.32Å; G231-G233 PolarHBondContact O-N 3.5Å; G231-G233 VanDerWaalsContact O-N 3.1Å; G231-V234 PolarHBondContact O-N 2.9Å
232T95.3Very high95Very high112 Ų11246 Ų4669%0.68727%0.272SS*.THydrogen-bonded Turntrans-68.8-10.3-174.154.50000114.2V234 F235T232-V234 PolarHBondContact O-N 3.42Å; T232-F235 PolarHBondContact O-N 2.86Å
233G94.2Very high95Very high24 Ų2449.9 Ų49.925%0.24729%0.292CS..Hα-helixtrans-56-22.3175.400000113.7G231 F235 T236 A237G231-G233 PolarHBondContact O-N 3.5Å; G231-G233 VanDerWaalsContact O-N 3.1Å; G233-F235 PolarHBondContact O-N 2.86Å; G233-F235 VanDerWaalsContact O-N 3.13Å; G233-T236 PolarHBondContact O-N 2.89Å; G233-T236 PolarHBondContact O-OG1 3.48Å; G233-A237 WeakPolarHBondContact O-CB 3.48Å; G233-A237 PolarHBondContact O-N 2.62Å
234V95.4Very high95Very high1 Ų147 Ų471%0.00628%0.278CS..Hα-helixtrans-62.1-19.6176.5-59.30000113.2L136 Y149 R222 A226 W230 G231 T232L136-V234 HydrophobicContact CD2-CB 4.21Å; L136-V234 HydrophobicContact CD2-CG1 3.62Å; L136-V234 HydrophobicContact CG-CG1 4.29Å; Y149-V234 WeakPolarHBondContact OH-CB 3.45Å; R222-V234 HydrophobicContact CG-CB 3.97Å; R222-V234 HydrophobicContact CG-CG2 3.78Å; R222-V234 PolarHBondContact NH1-O 3.27Å; A226-V234 HydrophobicContact CB-CG2 3.69Å; W230-V234 HydrophobicContact CB-CG1 3.81Å; G231-V234 PolarHBondContact O-N 2.9Å; T232-V234 PolarHBondContact O-N 3.42Å
235F96.4Very high95Very high42 Ų4246.2 Ų46.218%0.18427%0.274CS..Hα-helixtrans-97.1-18175.9-59.6-69.2000113.3F219 R222 L223 A226 T232 G233 G240 F242F219-F235 HydrophobicContact CD2-CE1 4.4Å; F219-F235 HydrophobicContact CE2-CE1 4.03Å; R222-F235 HydrophobicContact CB-CE1 4.43Å; R222-F235 HydrophobicContact CG-CD1 4.13Å; R222-F235 HydrophobicContact CG-CE1 3.7Å; R222-F235 HydrophobicContact CG-CZ 4.14Å; L223-F235 HydrophobicContact CD2-CZ 3.92Å; L223-F235 HydrophobicContact CG-CZ 4.45Å; A226-F235 HydrophobicContact CB-CE2 3.61Å; A226-F235 HydrophobicContact CB-CZ 4.21Å; T232-F235 PolarHBondContact O-N 2.86Å; G233-F235 PolarHBondContact O-N 2.86Å; G233-F235 VanDerWaalsContact O-N 3.13Å; F235-G240 WeakPolarHBondContact O-CA 3.31Å; F235-F242 HydrophobicContact CB-CD1 4.09Å; F235-F242 HydrophobicContact CB-CE1 4.16Å; F235-F242 HydrophobicContact CB-CG 4.42Å; F235-F242 HydrophobicContact CD1-CB 4.22Å; F235-F242 HydrophobicContact CD1-CD1 4.35Å; F235-F242 AromaticContact CD1-CD2 3.78Å; F235-F242 HydrophobicContact CD1-CD2 3.78Å; F235-F242 HydrophobicContact CD1-CE2 4.2Å; F235-F242 AromaticContact CD1-CG 3.85Å; F235-F242 HydrophobicContact CD1-CG 3.85Å; F235-F242 HydrophobicContact CE1-CD2 4.45Å; F235-F242 WeakPolarHBondContact O-CD1 3.4Å; F235-F242 WeakPolarHBondContact O-CE1 3.38Å
236T93.8Very high94.9Very high103 Ų10347 Ų4763%0.63228%0.278SS*.Hα-helixtrans-104.7-13.8179.659.30000112.7G233 R238 D239 G240G233-T236 PolarHBondContact O-N 2.89Å; G233-T236 PolarHBondContact O-OG1 3.48Å; T236-R238 PolarHBondContact O-N 3.14Å; T236-D239 PolarHBondContact O-N 3.04Å; T236-G240 PolarHBondContact O-N 2.97Å
237A90.1Very high95Very high12 Ų1251.9 Ų51.910%0.09930%0.296CS..Hα-helixtrans-53.1135.8178.200000111.7Y149 G233 D239 G240 W241Y149-A237 HydrophobicContact CD1-CB 4.21Å; Y149-A237 HydrophobicContact CE1-CB 3.89Å; G233-A237 WeakPolarHBondContact O-CB 3.48Å; G233-A237 PolarHBondContact O-N 2.62Å; A237-D239 PolarHBondContact O-N 3.19Å; A237-G240 PolarHBondContact O-N 3.49Å; A237-W241 WeakPolarHBondContact O-CB 3.18Å; A237-W241 PolarHBondContact O-N 3.41Å
238R88.4Confident95Very high121 Ų12145.5 Ų45.546%0.45726%0.263SS..Hα-helixtrans52.452.1177.1-60.8-75.4-170.2-170-3111.9P150 T236 G240 W241P150-R238 HydrophobicContact CG-CB 3.68Å; P150-R238 HydrophobicContact CG-CG 3.7Å; T236-R238 PolarHBondContact O-N 3.14Å; R238-G240 VanDerWaalsContact C-N 3.34Å; R238-G240 PolarHBondContact O-N 2.81Å; R238-W241 HydrophobicContact CB-CB 4.09Å; R238-W241 PolarHBondContact O-N 3.42Å
239D89.5Confident95.2Very high143 Ų14344.4 Ų44.477%0.76526%0.255SS*.Hα-helixtrans59.940.9175.4-55.6-48.2000113.4I156 T236 A237I156-D239 HydrophobicContact CD1-CB 3.39Å; I156-D239 HydrophobicContact CG1-CB 4.49Å; T236-D239 PolarHBondContact O-N 3.04Å; A237-D239 PolarHBondContact O-N 3.19Å
240G93.6Very high95.4Very high14 Ų1443.7 Ų43.714%0.14424%0.238CC..Hα-helixtrans79.237.8178.500000113.6F235 T236 A237 R238 F242 L243F235-G240 WeakPolarHBondContact O-CA 3.31Å; T236-G240 PolarHBondContact O-N 2.97Å; A237-G240 PolarHBondContact O-N 3.49Å; R238-G240 VanDerWaalsContact C-N 3.34Å; R238-G240 PolarHBondContact O-N 2.81Å; G240-F242 WeakPolarHBondContact O-CD1 3.34Å; G240-F242 PolarHBondContact O-N 3.32Å; G240-L243 PolarHBondContact O-N 3.44Å; G240-L243 VanDerWaalsContact O-N 3.13Å
241W96.1Very high95.6Very high1 Ų146.4 Ų46.40%0.00425%0.253CS..THydrogen-bonded Turntrans-50.5-33.8-176173.6-104.5000114.2T148 P150 L154 A237 R238 L243 V244 P245T148-W241 VanDerWaalsContact O-CD1 3.23Å; T148-W241 PolarHBondContact O-NE1 2.97Å; P150-W241 HydrophobicContact CB-CD2 4.05Å; P150-W241 HydrophobicContact CB-CE3 3.81Å; P150-W241 HydrophobicContact CB-CH2 4.13Å; P150-W241 HydrophobicContact CB-CZ2 4.36Å; P150-W241 HydrophobicContact CB-CZ3 3.84Å; P150-W241 VanDerWaalsContact CD-CD2 3.48Å; P150-W241 VanDerWaalsContact CD-CG 3.46Å; P150-W241 HydrophobicContact CG-CB 4.43Å; P150-W241 HydrophobicContact CG-CD2 3.72Å; P150-W241 HydrophobicContact CG-CE3 3.68Å; P150-W241 HydrophobicContact CG-CG 4.04Å; P150-W241 HydrophobicContact CG-CZ3 4.24Å; L154-W241 HydrophobicContact CD2-CH2 4.2Å; L154-W241 HydrophobicContact CD2-CZ3 4.49Å; A237-W241 WeakPolarHBondContact O-CB 3.18Å; A237-W241 PolarHBondContact O-N 3.41Å; R238-W241 HydrophobicContact CB-CB 4.09Å; R238-W241 PolarHBondContact O-N 3.42Å; W241-L243 PolarHBondContact O-N 3.44Å; W241-V244 HydrophobicContact CD2-CB 4.25Å; W241-V244 HydrophobicContact CD2-CG2 4.4Å; W241-V244 HydrophobicContact CE3-CB 4.02Å; W241-V244 HydrophobicContact CE3-CG1 4.45Å; W241-V244 HydrophobicContact CE3-CG2 3.79Å; W241-V244 HydrophobicContact CH2-CB 4.07Å; W241-V244 HydrophobicContact CH2-CG1 3.67Å; W241-V244 HydrophobicContact CH2-CG2 4.47Å; W241-V244 HydrophobicContact CZ2-CB 4.28Å; W241-V244 HydrophobicContact CZ2-CG1 4.11Å; W241-V244 HydrophobicContact CZ3-CB 3.94Å; W241-V244 HydrophobicContact CZ3-CG1 3.87Å; W241-V244 HydrophobicContact CZ3-CG2 3.85Å; W241-V244 WeakPolarHBondContact O-CB 3.28Å; W241-V244 PolarHBondContact O-N 2.99Å; W241-P245 WeakPolarHBondContact O-CD 3.16Å
242F96.6Very high95.7Very high47 Ų4745 Ų4521%0.20624%0.239CC..THydrogen-bonded Turntrans-53.4-24.8-178.782.1-74.4000114.6F235 G240 V244 P245 I246F235-F242 HydrophobicContact CB-CD1 4.09Å; F235-F242 HydrophobicContact CB-CE1 4.16Å; F235-F242 HydrophobicContact CB-CG 4.42Å; F235-F242 HydrophobicContact CD1-CB 4.22Å; F235-F242 HydrophobicContact CD1-CD1 4.35Å; F235-F242 AromaticContact CD1-CD2 3.78Å; F235-F242 HydrophobicContact CD1-CD2 3.78Å; F235-F242 HydrophobicContact CD1-CE2 4.2Å; F235-F242 AromaticContact CD1-CG 3.85Å; F235-F242 HydrophobicContact CD1-CG 3.85Å; F235-F242 HydrophobicContact CE1-CD2 4.45Å; F235-F242 WeakPolarHBondContact O-CD1 3.4Å; F235-F242 WeakPolarHBondContact O-CE1 3.38Å; G240-F242 WeakPolarHBondContact O-CD1 3.34Å; G240-F242 PolarHBondContact O-N 3.32Å; F242-V244 VanDerWaalsContact C-N 3.3Å; F242-V244 PolarHBondContact O-N 3.32Å; F242-P245 WeakPolarHBondContact O-CD 3.33Å; F242-I246 HydrophobicContact CD2-CD1 3.79Å; F242-I246 HydrophobicContact CE2-CD1 4.38Å; F242-I246 WeakPolarHBondContact O-CD1 3.4Å; F242-I246 VanDerWaalsContact O-CG1 3.25Å; F242-I246 WeakPolarHBondContact O-CG1 3.32Å
243L97.5Very high95.9Very high80 Ų8039.7 Ų39.742%0.41921%0.206SC..Hα-helixtrans-66.2-34.2175.9-64.5171.5000111.7G240 W241 I246 F247G240-L243 PolarHBondContact O-N 3.44Å; G240-L243 VanDerWaalsContact O-N 3.13Å; W241-L243 PolarHBondContact O-N 3.44Å; L243-I246 PolarHBondContact O-N 2.67Å; L243-F247 HydrophobicContact CB-CD2 4.28Å; L243-F247 HydrophobicContact CD2-CD2 4.18Å; L243-F247 HydrophobicContact CD2-CE2 3.74Å; L243-F247 VanDerWaalsContact O-CD2 3.3Å; L243-F247 WeakPolarHBondContact O-CD2 3.35Å; L243-F247 PolarHBondContact O-N 3.37Å
244V98Very high96.1Very high6 Ų641.6 Ų41.64%0.03621%0.21CC..Hα-helixtrans-63.2-58.7-177.5-179.80000112.1I156 F160 Q163 W241 F242 I246 F247 A248 P249I156-V244 HydrophobicContact CG2-CG2 3.99Å; F160-V244 HydrophobicContact CB-CG1 4.33Å; F160-V244 HydrophobicContact CD2-CG1 4.13Å; F160-V244 HydrophobicContact CD2-CG2 4.33Å; Q163-V244 HydrophobicContact CB-CG1 4.28Å; Q163-V244 HydrophobicContact CG-CG1 3.95Å; W241-V244 HydrophobicContact CD2-CB 4.25Å; W241-V244 HydrophobicContact CD2-CG2 4.4Å; W241-V244 HydrophobicContact CE3-CB 4.02Å; W241-V244 HydrophobicContact CE3-CG1 4.45Å; W241-V244 HydrophobicContact CE3-CG2 3.79Å; W241-V244 HydrophobicContact CH2-CB 4.07Å; W241-V244 HydrophobicContact CH2-CG1 3.67Å; W241-V244 HydrophobicContact CH2-CG2 4.47Å; W241-V244 HydrophobicContact CZ2-CB 4.28Å; W241-V244 HydrophobicContact CZ2-CG1 4.11Å; W241-V244 HydrophobicContact CZ3-CB 3.94Å; W241-V244 HydrophobicContact CZ3-CG1 3.87Å; W241-V244 HydrophobicContact CZ3-CG2 3.85Å; W241-V244 WeakPolarHBondContact O-CB 3.28Å; W241-V244 PolarHBondContact O-N 2.99Å; F242-V244 VanDerWaalsContact C-N 3.3Å; F242-V244 PolarHBondContact O-N 3.32Å; V244-I246 PolarHBondContact O-N 3.1Å; V244-I246 VanDerWaalsContact O-N 3.16Å; V244-F247 PolarHBondContact O-N 3.42Å; V244-A248 HydrophobicContact CG1-CB 4.17Å; V244-A248 WeakPolarHBondContact O-CB 3.3Å; V244-A248 PolarHBondContact O-N 3.4Å; V244-P249 WeakPolarHBondContact O-CD 3.44Å
245P97.5Very high96.3Very high0 Ų044.8 Ų44.80%023%0.226CC..Hα-helixtrans-69.5-9.5179.231.1-36.3000113.6A212 P215 D218 W241 F242 P249A212-P245 HydrophobicContact CB-CB 3.5Å; P215-P245 WeakPolarHBondContact CA-O 3.46Å; D218-P245 HydrophobicContact CB-CB 3.87Å; D218-P245 HydrophobicContact CB-CG 4.07Å; D218-P245 VanDerWaalsContact CG-CG 3.43Å; D218-P245 VanDerWaalsContact OD1-CG 3.26Å; D218-P245 WeakPolarHBondContact OD1-CG 3.34Å; W241-P245 WeakPolarHBondContact O-CD 3.16Å; F242-P245 WeakPolarHBondContact O-CD 3.33Å; P245-P249 WeakPolarHBondContact O-CD 3.44Å; P245-P249 VanDerWaalsContact O-CG 3.28Å; P245-P249 WeakPolarHBondContact O-CG 3.39Å
246I97.3Very high96.4Very high18 Ų1842.8 Ų42.89%0.09222%0.217CC..Hα-helixtrans-84.7-51.4171.1-68.3173.4000110.9P215 F219 F242 L243 V244 F250P215-I246 WeakPolarHBondContact CG-O 3.5Å; F219-I246 HydrophobicContact CB-CD1 4.22Å; F219-I246 HydrophobicContact CB-CG1 4.24Å; F219-I246 HydrophobicContact CD2-CD1 3.6Å; F219-I246 HydrophobicContact CD2-CG1 4.5Å; F219-I246 HydrophobicContact CE2-CD1 4.15Å; F219-I246 HydrophobicContact CG-CD1 4Å; F242-I246 HydrophobicContact CD2-CD1 3.79Å; F242-I246 HydrophobicContact CE2-CD1 4.38Å; F242-I246 WeakPolarHBondContact O-CD1 3.4Å; F242-I246 VanDerWaalsContact O-CG1 3.25Å; F242-I246 WeakPolarHBondContact O-CG1 3.32Å; L243-I246 PolarHBondContact O-N 2.67Å; V244-I246 PolarHBondContact O-N 3.1Å; V244-I246 VanDerWaalsContact O-N 3.16Å; I246-F250 WeakPolarHBondContact O-CD2 3.33Å; I246-F250 WeakPolarHBondContact O-CE2 3.28Å
247F98.1Very high96.6Very high120 Ų12038.2 Ų38.253%0.52619%0.189SC..Hα-helixtrans-95.9-37.9-168.9-68.3-69.8000114.2L243 V244 P249 F250 L251L243-F247 HydrophobicContact CB-CD2 4.28Å; L243-F247 HydrophobicContact CD2-CD2 4.18Å; L243-F247 HydrophobicContact CD2-CE2 3.74Å; L243-F247 VanDerWaalsContact O-CD2 3.3Å; L243-F247 WeakPolarHBondContact O-CD2 3.35Å; L243-F247 PolarHBondContact O-N 3.37Å; V244-F247 PolarHBondContact O-N 3.42Å; F247-P249 VanDerWaalsContact C-N 3.34Å; F247-F250 PolarHBondContact O-N 3.27Å; F247-F250 VanDerWaalsContact O-N 3.14Å; F247-L251 PolarHBondContact O-N 3.04Å
248A98.3Very high97Very high0 Ų043 Ų430%021%0.211CC..Hα-helixtrans-58.7-39.8-179.300000112.7F160 Q163 I164 V244 F250 L251 G252F160-A248 HydrophobicContact CD2-CB 3.63Å; F160-A248 HydrophobicContact CE2-CB 3.61Å; F160-A248 HydrophobicContact CG-CB 4.08Å; F160-A248 HydrophobicContact CZ-CB 4.08Å; Q163-A248 HydrophobicContact CB-CB 3.58Å; I164-A248 HydrophobicContact CG1-CB 4.21Å; V244-A248 HydrophobicContact CG1-CB 4.17Å; V244-A248 WeakPolarHBondContact O-CB 3.3Å; V244-A248 PolarHBondContact O-N 3.4Å; A248-F250 VanDerWaalsContact C-N 3.3Å; A248-F250 PolarHBondContact O-N 3.32Å; A248-L251 PolarHBondContact O-N 3.2Å; A248-G252 PolarHBondContact O-N 3.08Å
249P98.7Very high97.5Very high0 Ų040 Ų400%021%0.206CC..Hα-helixtrans-60.9-32.8176.4-29.840.2000114.5A85 T167 P215 V244 P245 F247 G252 A253A85-P249 HydrophobicContact CB-CB 3.99Å; T167-P249 HydrophobicContact CG2-CB 3.86Å; T167-P249 VanDerWaalsContact CG2-O 3.24Å; T167-P249 WeakPolarHBondContact CG2-O 3.39Å; T167-P249 WeakPolarHBondContact OG1-CA 3.46Å; T167-P249 WeakPolarHBondContact OG1-CB 3.36Å; P215-P249 HydrophobicContact CG-CB 3.97Å; P215-P249 HydrophobicContact CG-CG 4.23Å; V244-P249 WeakPolarHBondContact O-CD 3.44Å; P245-P249 WeakPolarHBondContact O-CD 3.44Å; P245-P249 VanDerWaalsContact O-CG 3.28Å; P245-P249 WeakPolarHBondContact O-CG 3.39Å; F247-P249 VanDerWaalsContact C-N 3.34Å; P249-G252 PolarHBondContact O-N 3.11Å; P249-A253 WeakPolarHBondContact O-CB 3.37Å; P249-A253 PolarHBondContact O-N 2.77Å
250F98.7Very high97.9Very high32 Ų3233.3 Ų33.314%0.1417%0.17CC..Hα-helixtrans-68-39.3176.7-68.2-63.5000111.9P84 F88 F101 F105 P215 I246 F247 A248 A253 I254P84-F250 HydrophobicContact CB-CE1 4.04Å; P84-F250 HydrophobicContact CB-CZ 3.84Å; F88-F250 HydrophobicContact CB-CD1 3.9Å; F88-F250 HydrophobicContact CB-CE1 3.98Å; F88-F250 HydrophobicContact CD1-CD1 4.02Å; F88-F250 HydrophobicContact CD2-CD1 4.25Å; F88-F250 AromaticContact CG-CD1 3.81Å; F88-F250 HydrophobicContact CG-CD1 3.81Å; F88-F250 HydrophobicContact CG-CE1 4.23Å; F101-F250 HydrophobicContact CE2-CE1 4Å; F101-F250 AromaticContact CZ-CE1 3.76Å; F101-F250 HydrophobicContact CZ-CE1 3.76Å; F101-F250 HydrophobicContact CZ-CZ 4.03Å; F105-F250 HydrophobicContact CD1-CZ 4.3Å; F105-F250 HydrophobicContact CE1-CE2 4.21Å; F105-F250 AromaticContact CE1-CZ 3.76Å; F105-F250 HydrophobicContact CE1-CZ 3.76Å; F105-F250 HydrophobicContact CZ-CZ 4.36Å; P215-F250 HydrophobicContact CB-CE2 4.36Å; P215-F250 HydrophobicContact CB-CZ 4.4Å; P215-F250 HydrophobicContact CG-CD2 4.49Å; P215-F250 HydrophobicContact CG-CE2 3.9Å; P215-F250 HydrophobicContact CG-CZ 3.93Å; I246-F250 WeakPolarHBondContact O-CD2 3.33Å; I246-F250 WeakPolarHBondContact O-CE2 3.28Å; F247-F250 PolarHBondContact O-N 3.27Å; F247-F250 VanDerWaalsContact O-N 3.14Å; A248-F250 VanDerWaalsContact C-N 3.3Å; A248-F250 PolarHBondContact O-N 3.32Å; F250-A253 WeakPolarHBondContact O-CB 3.42Å; F250-A253 PolarHBondContact O-N 3.33Å; F250-I254 WeakPolarHBondContact O-CG1 3.4Å; F250-I254 PolarHBondContact O-N 2.93Å
251L98.6Very high98Very high70 Ų7033.3 Ų33.337%0.36617%0.166SC..Hα-helixtrans-67.1-41.5174.1-176.456.5000111.3F160 I164 F247 A248 A253 I254 I255F160-L251 HydrophobicContact CE1-CD2 4.1Å; I164-L251 HydrophobicContact CD1-CD2 3.68Å; I164-L251 HydrophobicContact CD1-CG 4.21Å; I164-L251 HydrophobicContact CG1-CB 4.31Å; I164-L251 HydrophobicContact CG1-CD2 4.3Å; I164-L251 HydrophobicContact CG1-CG 4.35Å; F247-L251 PolarHBondContact O-N 3.04Å; A248-L251 PolarHBondContact O-N 3.2Å; L251-A253 VanDerWaalsContact C-N 3.27Å; L251-A253 PolarHBondContact O-N 3.3Å; L251-I254 PolarHBondContact O-N 2.95Å; L251-I255 HydrophobicContact CD1-CD1 4.26Å; L251-I255 HydrophobicContact CG-CD1 4.08Å; L251-I255 WeakPolarHBondContact O-CG1 3.36Å; L251-I255 PolarHBondContact O-N 3.31Å
252G98.7Very high98Very high0 Ų038.2 Ų38.20%019%0.192CC..Hα-helixtrans-58.2-38.4170.800000112.6I164 A168 A248 P249 I255 G256I164-G252 WeakPolarHBondContact O-CA 3.05Å; A168-G252 VanDerWaalsContact CA-O 3.25Å; A168-G252 WeakPolarHBondContact CA-O 3.34Å; A168-G252 WeakPolarHBondContact CB-O 3.29Å; A248-G252 PolarHBondContact O-N 3.08Å; P249-G252 PolarHBondContact O-N 3.11Å; G252-I255 PolarHBondContact O-N 3.17Å; G252-G256 PolarHBondContact O-N 3.2Å
253A98.7Very high98Very high0 Ų042.6 Ų42.60%022%0.215CC..Hα-helixtrans-65.2-4517600000112.6A85 F88 I171 P249 F250 L251 I255 G256 T257A85-A253 HydrophobicContact CB-CB 4.26Å; F88-A253 HydrophobicContact CD1-CB 4.37Å; I171-A253 HydrophobicContact CD1-CB 4.44Å; I171-A253 HydrophobicContact CG1-CB 4.08Å; P249-A253 WeakPolarHBondContact O-CB 3.37Å; P249-A253 PolarHBondContact O-N 2.77Å; F250-A253 WeakPolarHBondContact O-CB 3.42Å; F250-A253 PolarHBondContact O-N 3.33Å; L251-A253 VanDerWaalsContact C-N 3.27Å; L251-A253 PolarHBondContact O-N 3.3Å; A253-I255 VanDerWaalsContact C-N 3.34Å; A253-I255 PolarHBondContact O-N 3.23Å; A253-G256 PolarHBondContact O-N 2.79Å; A253-T257 WeakPolarHBondContact O-CB 3.45Å; A253-T257 PolarHBondContact O-N 3.37Å; A253-T257 PolarHBondContact O-OG1 3.2Å
254I98.8Very high97.9Very high63 Ų6341.1 Ų41.132%0.32321%0.209SC..Hα-helixtrans-56.3-51.2174.5-64.8166000110.2F88 L92 F250 L251 T257 M258F88-I254 HydrophobicContact CE1-CD1 4.15Å; F88-I254 HydrophobicContact CE1-CG1 3.76Å; L92-I254 HydrophobicContact CD1-CG1 3.91Å; F250-I254 WeakPolarHBondContact O-CG1 3.4Å; F250-I254 PolarHBondContact O-N 2.93Å; L251-I254 PolarHBondContact O-N 2.95Å; I254-T257 PolarHBondContact O-N 3.41Å; I254-M258 HydrophobicContact CG2-SD 4.01Å; I254-M258 WeakPolarHBondContact O-CG 3.34Å; I254-M258 PolarHBondContact O-N 3.3Å
255I98.6Very high97.6Very high68 Ų6840.9 Ų40.935%0.34921%0.207SC..Hα-helixtrans-62.4-48.5-178.1-67.1166.9000110.5I164 A168 L251 G252 A253 T257 M258 V259I164-I255 HydrophobicContact CG2-CD1 3.72Å; A168-I255 HydrophobicContact CB-CG2 4.34Å; L251-I255 HydrophobicContact CD1-CD1 4.26Å; L251-I255 HydrophobicContact CG-CD1 4.08Å; L251-I255 WeakPolarHBondContact O-CG1 3.36Å; L251-I255 PolarHBondContact O-N 3.31Å; G252-I255 PolarHBondContact O-N 3.17Å; A253-I255 VanDerWaalsContact C-N 3.34Å; A253-I255 PolarHBondContact O-N 3.23Å; I255-T257 VanDerWaalsContact C-N 3.35Å; I255-T257 PolarHBondContact O-N 2.95Å; I255-M258 PolarHBondContact O-N 3.49Å; I255-V259 HydrophobicContact CG2-CG2 4.16Å; I255-V259 WeakPolarHBondContact O-CB 3.48Å; I255-V259 VanDerWaalsContact O-CG2 3.24Å; I255-V259 WeakPolarHBondContact O-CG2 3.36Å; I255-V259 PolarHBondContact O-N 3.25Å
256G98.6Very high97.3Very high0 Ų046.4 Ų46.40%023%0.232CC..Hα-helixtrans-60.7-42.4179.900000112.6V172 G252 A253 V259 Y260V172-G256 WeakPolarHBondContact CG2-O 3.47Å; G252-G256 PolarHBondContact O-N 3.2Å; A253-G256 PolarHBondContact O-N 2.79Å; G256-V259 PolarHBondContact O-N 3.41Å; G256-Y260 WeakPolarHBondContact O-CB 3.45Å; G256-Y260 PolarHBondContact O-N 3.39Å
257T98.4Very high97Very high8 Ų851.4 Ų51.45%0.04925%0.254CS..Hα-helixtrans-61.4-48.4174.8-57.70000111.4S89 L93 L175 A253 I254 I255 Y260 Q261S89-T257 WeakPolarHBondContact CB-OG1 3.49Å; S89-T257 PolarHBondContact OG-OG1 3.23Å; L93-T257 HydrophobicContact CD1-CG2 4.1Å; L93-T257 HydrophobicContact CD2-CG2 3.48Å; L93-T257 VanDerWaalsContact CD2-CG2 3.48Å; L93-T257 HydrophobicContact CG-CG2 3.63Å; L175-T257 HydrophobicContact CD1-CG2 4.31Å; A253-T257 WeakPolarHBondContact O-CB 3.45Å; A253-T257 PolarHBondContact O-N 3.37Å; A253-T257 PolarHBondContact O-OG1 3.2Å; I254-T257 PolarHBondContact O-N 3.41Å; I255-T257 VanDerWaalsContact C-N 3.35Å; I255-T257 PolarHBondContact O-N 2.95Å; T257-Y260 PolarHBondContact O-N 3.45Å; T257-Q261 HydrophobicContact CG2-CG 4.47Å; T257-Q261 WeakPolarHBondContact O-CB 3.36Å; T257-Q261 VanDerWaalsContact O-CG 3.28Å; T257-Q261 WeakPolarHBondContact O-CG 3.45Å; T257-Q261 PolarHBondContact O-N 3.5Å
258M98.1Very high96.6Very high111 Ų11147.4 Ų47.455%0.54724%0.24SC..Hα-helixtrans-61.8-45.9178.9-72.5179.669.400111.9I254 I255 Q261 L262I254-M258 HydrophobicContact CG2-SD 4.01Å; I254-M258 WeakPolarHBondContact O-CG 3.34Å; I254-M258 PolarHBondContact O-N 3.3Å; I255-M258 PolarHBondContact O-N 3.49Å; M258-Q261 PolarHBondContact O-N 3.23Å; M258-L262 WeakPolarHBondContact O-CB 3.49Å; M258-L262 VanDerWaalsContact O-CG 3.26Å; M258-L262 WeakPolarHBondContact O-CG 3.26Å; M258-L262 PolarHBondContact O-N 3.24Å
259V98.3Very high95.8Very high58 Ų5850.4 Ų50.435%0.35225%0.254SS..Hα-helixtrans-59.4-49178.5167.10000110.6V172 I255 G256 Q261 M263V172-V259 HydrophobicContact CG2-CB 4.31Å; V172-V259 HydrophobicContact CG2-CG1 4.08Å; I255-V259 HydrophobicContact CG2-CG2 4.16Å; I255-V259 WeakPolarHBondContact O-CB 3.48Å; I255-V259 VanDerWaalsContact O-CG2 3.24Å; I255-V259 WeakPolarHBondContact O-CG2 3.36Å; I255-V259 PolarHBondContact O-N 3.25Å; G256-V259 PolarHBondContact O-N 3.41Å; V259-Q261 PolarHBondContact O-N 2.98Å; V259-M263 HydrophobicContact CG1-SD 3.78Å; V259-M263 VanDerWaalsContact O-CB 3.28Å; V259-M263 WeakPolarHBondContact O-CB 3.13Å; V259-M263 WeakPolarHBondContact O-CG 3.5Å; V259-M263 PolarHBondContact O-N 2.99Å
260Y97.8Very high95Very high4 Ų451.1 Ų51.12%0.01626%0.261CS..Hα-helixtrans-61.4-47.3179.3-178.2-99.7000112.1V172 L175 A176 D179 G256 T257 V264 G265V172-Y260 HydrophobicContact CG1-CD2 4.34Å; L175-Y260 HydrophobicContact CB-CD1 3.48Å; L175-Y260 VanDerWaalsContact CB-CD1 3.48Å; L175-Y260 HydrophobicContact CB-CD2 4.11Å; L175-Y260 HydrophobicContact CB-CE1 3.75Å; L175-Y260 HydrophobicContact CB-CE2 4.37Å; L175-Y260 HydrophobicContact CB-CG 3.67Å; L175-Y260 HydrophobicContact CD1-CD1 3.87Å; L175-Y260 HydrophobicContact CD1-CG 4.05Å; L175-Y260 HydrophobicContact CG-CD1 4.29Å; A176-Y260 VanDerWaalsContact CA-CE2 3.48Å; A176-Y260 HydrophobicContact CB-CD2 4.4Å; A176-Y260 HydrophobicContact CB-CE2 3.68Å; D179-Y260 HydrophobicContact CB-CE1 4.47Å; D179-Y260 WeakPolarHBondContact CB-OH 3.42Å; D179-Y260 PolarHBondContact OD2-OH 2.8Å; G256-Y260 WeakPolarHBondContact O-CB 3.45Å; G256-Y260 PolarHBondContact O-N 3.39Å; T257-Y260 PolarHBondContact O-N 3.45Å; Y260-V264 HydrophobicContact CD2-CB 4.16Å; Y260-V264 HydrophobicContact CE2-CB 3.86Å; Y260-V264 HydrophobicContact CE2-CG1 3.83Å; Y260-V264 HydrophobicContact CE2-CG2 4.41Å; Y260-V264 CarbonylContact O-C 3.56Å; Y260-V264 WeakPolarHBondContact O-CA 3.26Å; Y260-V264 PolarHBondContact O-N 2.97Å; Y260-G265 PolarHBondContact O-N 3.26Å
261Q96Very high94.2Very high14 Ų1454.5 Ų54.57%0.06528%0.277CS..Iπ-helixtrans-63.9-48.2-178.2-72.3-62.2-2800112.1L93 T257 M258 V259 M263 G265 F266L93-Q261 HydrophobicContact CD2-CG 3.66Å; T257-Q261 HydrophobicContact CG2-CG 4.47Å; T257-Q261 WeakPolarHBondContact O-CB 3.36Å; T257-Q261 VanDerWaalsContact O-CG 3.28Å; T257-Q261 WeakPolarHBondContact O-CG 3.45Å; T257-Q261 PolarHBondContact O-N 3.5Å; M258-Q261 PolarHBondContact O-N 3.23Å; V259-Q261 PolarHBondContact O-N 2.98Å; Q261-M263 PolarHBondContact O-N 3.46Å; Q261-G265 PolarHBondContact O-N 3.42Å; Q261-F266 HydrophobicContact CB-CD1 4.45Å; Q261-F266 HydrophobicContact CB-CD2 4.5Å; Q261-F266 HydrophobicContact CB-CE1 4.07Å; Q261-F266 HydrophobicContact CB-CE2 4.12Å; Q261-F266 HydrophobicContact CB-CZ 3.9Å; Q261-F266 HydrophobicContact CG-CE1 4.48Å; Q261-F266 WeakPolarHBondContact O-CB 3.47Å; Q261-F266 WeakPolarHBondContact O-CD2 3.36Å; Q261-F266 VanDerWaalsContact O-CG 3.26Å; Q261-F266 WeakPolarHBondContact O-CG 3.38Å; Q261-F266 PolarHBondContact O-N 3.47Å; Q261-F266 VanDerWaalsContact OE1-CE1 3.26Å
262L96.6Very high93.4Very high103 Ų10352.7 Ų52.754%0.53927%0.269SS..Iπ-helixtrans-67.9-35.6-178.2-68.6171.8000112.8M258 F266 H267M258-L262 WeakPolarHBondContact O-CB 3.49Å; M258-L262 VanDerWaalsContact O-CG 3.26Å; M258-L262 WeakPolarHBondContact O-CG 3.26Å; M258-L262 PolarHBondContact O-N 3.24Å; L262-F266 HydrophobicContact CD2-CD2 4.18Å; L262-F266 HydrophobicContact CD2-CE2 3.95Å; L262-H267 PolarHBondContact O-CE1 3.01Å; L262-H267 PolarHBondContact O-ND1 3.42Å
263M96.6Very high92.7Very high139 Ų13960.1 Ų60.169%0.68530%0.297SS*.Iπ-helixtrans-95.7-26.4-173.2-61.7-178.767.200113.9V259 Q261V259-M263 HydrophobicContact CG1-SD 3.78Å; V259-M263 VanDerWaalsContact O-CB 3.28Å; V259-M263 WeakPolarHBondContact O-CB 3.13Å; V259-M263 WeakPolarHBondContact O-CG 3.5Å; V259-M263 PolarHBondContact O-N 2.99Å; Q261-M263 PolarHBondContact O-N 3.46Å
264V95.3Very high92.2Very high50 Ų5064.8 Ų64.830%0.30332%0.319SS..Iπ-helixtrans-130.9-60.8-174.4-177.90000111Y260 F266 H267 V268Y260-V264 HydrophobicContact CD2-CB 4.16Å; Y260-V264 HydrophobicContact CE2-CB 3.86Å; Y260-V264 HydrophobicContact CE2-CG1 3.83Å; Y260-V264 HydrophobicContact CE2-CG2 4.41Å; Y260-V264 CarbonylContact O-C 3.56Å; Y260-V264 WeakPolarHBondContact O-CA 3.26Å; Y260-V264 PolarHBondContact O-N 2.97Å; V264-F266 PolarHBondContact O-N 3.45Å; V264-H267 PolarHBondContact O-N 3.21Å; V264-V268 HydrophobicContact CG1-CG2 4.16Å; V264-V268 PolarHBondContact O-N 3.04Å; V264-V268 VanDerWaalsContact O-N 3.08Å
265G91.5Very high91.5Very high0 Ų068.5 Ų68.50%033%0.329CS..Iπ-helixtrans-51.7-55.8-170.100000113.3Y260 Q261 H267 V268 E269Y260-G265 PolarHBondContact O-N 3.26Å; Q261-G265 PolarHBondContact O-N 3.42Å; G265-H267 VanDerWaalsContact C-N 3.25Å; G265-H267 PolarHBondContact O-N 3.36Å; G265-V268 PolarHBondContact O-N 2.88Å; G265-E269 VanDerWaalsContact O-CB 3.31Å; G265-E269 WeakPolarHBondContact O-CB 3.36Å; G265-E269 WeakPolarHBondContact O-CG 3.09Å; G265-E269 PolarHBondContact O-N 3.48Å
266F92.3Very high91Very high117 Ų11770.4 Ų70.451%0.51334%0.336SS..Hα-helixtrans-64.4-26.8-178.5-65.1-24.3000114.3Q261 L262 V264 G270Q261-F266 HydrophobicContact CB-CD1 4.45Å; Q261-F266 HydrophobicContact CB-CD2 4.5Å; Q261-F266 HydrophobicContact CB-CE1 4.07Å; Q261-F266 HydrophobicContact CB-CE2 4.12Å; Q261-F266 HydrophobicContact CB-CZ 3.9Å; Q261-F266 HydrophobicContact CG-CE1 4.48Å; Q261-F266 WeakPolarHBondContact O-CB 3.47Å; Q261-F266 WeakPolarHBondContact O-CD2 3.36Å; Q261-F266 VanDerWaalsContact O-CG 3.26Å; Q261-F266 WeakPolarHBondContact O-CG 3.38Å; Q261-F266 PolarHBondContact O-N 3.47Å; Q261-F266 VanDerWaalsContact OE1-CE1 3.26Å; L262-F266 HydrophobicContact CD2-CD2 4.18Å; L262-F266 HydrophobicContact CD2-CE2 3.95Å; V264-F266 PolarHBondContact O-N 3.45Å; F266-G270 PolarHBondContact O-N 2.83Å; F266-G270 VanDerWaalsContact O-N 3.09Å
267H91Very high90.5Very high122 Ų12275 Ų7557%0.56536%0.358SS*.Hα-helixtrans-76.4-42.6178.8-66.782.7000110.8L262 V264 G265 E271L262-H267 PolarHBondContact O-CE1 3.01Å; L262-H267 PolarHBondContact O-ND1 3.42Å; V264-H267 PolarHBondContact O-N 3.21Å; G265-H267 VanDerWaalsContact C-N 3.25Å; G265-H267 PolarHBondContact O-N 3.36Å; H267-E271 PolarHBondContact O-N 3.47Å
268V88.6Confident90.1Very high36 Ų3680.5 Ų80.522%0.21838%0.378CS..Hα-helixtrans-75.3-44.6-179.9-1750000111.2Y181 V264 G265 G270 E271 V272Y181-V268 VanDerWaalsContact CB-CG1 3.48Å; Y181-V268 WeakPolarHBondContact O-CG1 3.06Å; V264-V268 HydrophobicContact CG1-CG2 4.16Å; V264-V268 PolarHBondContact O-N 3.04Å; V264-V268 VanDerWaalsContact O-N 3.08Å; G265-V268 PolarHBondContact O-N 2.88Å; V268-G270 VanDerWaalsContact C-N 3.26Å; V268-G270 PolarHBondContact O-N 3.32Å; V268-E271 PolarHBondContact O-N 3.39Å; V268-V272 WeakPolarHBondContact O-CG2 3.36Å; V268-V272 PolarHBondContact O-N 3.11Å
269E83.1Confident89.6Confident63 Ų6381.6 Ų81.629%0.29438%0.379SS..Hα-helixtrans-61.6-36.4174.9-70.5179179.600111.5R95 Y181 G265 V272 R273R95-E269 IonicContact NH2-OE1 3.02Å; Y181-E269 HydrophobicContact CD2-CG 3.78Å; Y181-E269 HydrophobicContact CE2-CG 4.04Å; G265-E269 VanDerWaalsContact O-CB 3.31Å; G265-E269 WeakPolarHBondContact O-CB 3.36Å; G265-E269 WeakPolarHBondContact O-CG 3.09Å; G265-E269 PolarHBondContact O-N 3.48Å; E269-V272 PolarHBondContact O-N 2.98Å; E269-R273 PolarHBondContact O-N 2.86Å
270G79.9Confident89.2Confident15 Ų1583 Ų8316%0.15539%0.385CS..Hα-helixtrans-60.5-48.717500000112.8F266 V268 V272 R273 E274F266-G270 PolarHBondContact O-N 2.83Å; F266-G270 VanDerWaalsContact O-N 3.09Å; V268-G270 VanDerWaalsContact C-N 3.26Å; V268-G270 PolarHBondContact O-N 3.32Å; G270-V272 VanDerWaalsContact C-N 3.28Å; G270-V272 PolarHBondContact O-N 3Å; G270-R273 PolarHBondContact O-N 3.16Å; G270-E274 WeakPolarHBondContact O-CG 3.49Å; G270-E274 PolarHBondContact O-N 3.31Å
271E82.9Confident88.8Confident103 Ų10388.7 Ų88.748%0.48141%0.412SS..Hα-helixtrans-59.6-39.4177.1-77.2-166.1-16300112.7H267 V268 R275H267-E271 PolarHBondContact O-N 3.47Å; V268-E271 PolarHBondContact O-N 3.39Å; E271-R275 VanDerWaalsContact O-CG 3.26Å; E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 3.05Å; E271-R275 IonicContact OE2-CZ 2.74Å; E271-R275 IonicContact OE2-NH2 2.94Å; E271-R275 PolarHBondContact OE2-NH2 3.21Å
272V82.5Confident88.4Confident32 Ų3293.6 Ų93.619%0.19444%0.435CS..Hα-helixtrans-66.3-46178.5175.80000110.3Y181 V268 E269 G270 E274 R275 E276Y181-V272 HydrophobicContact CD1-CB 4.24Å; Y181-V272 HydrophobicContact CD1-CG1 4.06Å; Y181-V272 HydrophobicContact CD1-CG2 3.61Å; Y181-V272 HydrophobicContact CE1-CB 4.31Å; Y181-V272 HydrophobicContact CE1-CG1 3.73Å; Y181-V272 HydrophobicContact CE1-CG2 4.16Å; Y181-V272 HydrophobicContact CG-CG2 4.05Å; V268-V272 WeakPolarHBondContact O-CG2 3.36Å; V268-V272 PolarHBondContact O-N 3.11Å; E269-V272 PolarHBondContact O-N 2.98Å; G270-V272 VanDerWaalsContact C-N 3.28Å; G270-V272 PolarHBondContact O-N 3Å; V272-E274 VanDerWaalsContact C-N 3.34Å; V272-E274 PolarHBondContact O-N 3.49Å; V272-R275 PolarHBondContact O-N 3.12Å; V272-R275 VanDerWaalsContact O-N 3.11Å; V272-E276 HydrophobicContact CG1-CG 4.48Å; V272-E276 WeakPolarHBondContact O-CG 3.43Å; V272-E276 PolarHBondContact O-N 2.85Å
273R84.1Confident88Confident156 Ų15694.3 Ų94.359%0.58944%0.435SS*.Hα-helixtrans-58.3-45.8177-168.1176.673.6-148.1-2.2111.6E269 G270 R275 E276 E277E269-R273 PolarHBondContact O-N 2.86Å; G270-R273 PolarHBondContact O-N 3.16Å; R273-R275 VanDerWaalsContact C-N 3.31Å; R273-R275 PolarHBondContact O-N 3.13Å; R273-E276 PolarHBondContact O-N 3.39Å; R273-E277 WeakPolarHBondContact CG-OE1 3.25Å; R273-E277 IonicContact NE-OE1 3.27Å; R273-E277 WeakPolarHBondContact O-CB 3.47Å; R273-E277 WeakPolarHBondContact O-CG 3.37Å; R273-E277 PolarHBondContact O-N 3.23Å
274E86.5Confident87.4Confident99 Ų9992.4 Ų92.446%0.46343%0.428SS..Hα-helixtrans-64.4-33.6176.7-70.4176.5-171.700112.9G270 V272 R278G270-E274 WeakPolarHBondContact O-CG 3.49Å; G270-E274 PolarHBondContact O-N 3.31Å; V272-E274 VanDerWaalsContact C-N 3.34Å; V272-E274 PolarHBondContact O-N 3.49Å; E274-R278 WeakPolarHBondContact O-CB 3.35Å; E274-R278 WeakPolarHBondContact O-CG 3.47Å; E274-R278 PolarHBondContact O-N 3.14Å; E274-R278 VanDerWaalsContact O-N 3.12Å; E274-R278 PolarHBondContact O-NE 2.95Å
275R85.8Confident86.9Confident141 Ų14195.6 Ų95.653%0.53244%0.442SS..Hα-helixtrans-69.8-39.6174.2-73.7175.6-161.4-173.110111.6E271 V272 R273 K279E271-R275 VanDerWaalsContact O-CG 3.26Å; E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 3.05Å; E271-R275 IonicContact OE2-CZ 2.74Å; E271-R275 IonicContact OE2-NH2 2.94Å; E271-R275 PolarHBondContact OE2-NH2 3.21Å; V272-R275 PolarHBondContact O-N 3.12Å; V272-R275 VanDerWaalsContact O-N 3.11Å; R273-R275 VanDerWaalsContact C-N 3.31Å; R273-R275 PolarHBondContact O-N 3.13Å; R275-K279 WeakPolarHBondContact O-CG 3.15Å; R275-K279 PolarHBondContact O-N 2.85Å; R275-K279 VanDerWaalsContact O-N 3.08Å
276E86.4Confident86.4Confident107 Ų107101.4 Ų101.450%0.547%0.469SS..Hα-helixtrans-67.6-43176.1-72-178.5171.200111.8V272 R273 K279 N280V272-E276 HydrophobicContact CG1-CG 4.48Å; V272-E276 WeakPolarHBondContact O-CG 3.43Å; V272-E276 PolarHBondContact O-N 2.85Å; R273-E276 PolarHBondContact O-N 3.39Å; E276-K279 PolarHBondContact O-N 3.38Å; E276-N280 PolarHBondContact O-N 3.11Å; E276-N280 PolarHBondContact O-ND2 3.48Å
277E89.1Confident85.8Confident97 Ų97101.1 Ų101.145%0.45347%0.473SS..Hα-helixtrans-58.4-48.5174.7-74.5170.5-175.200111.2R273 K279 N280 E281R273-E277 WeakPolarHBondContact CG-OE1 3.25Å; R273-E277 IonicContact NE-OE1 3.27Å; R273-E277 WeakPolarHBondContact O-CB 3.47Å; R273-E277 WeakPolarHBondContact O-CG 3.37Å; R273-E277 PolarHBondContact O-N 3.23Å; E277-K279 PolarHBondContact O-N 3.15Å; E277-N280 PolarHBondContact O-N 3.42Å; E277-E281 WeakPolarHBondContact O-CG 3.37Å; E277-E281 PolarHBondContact O-N 3.03Å
278R89.4Confident85.1Confident123 Ų12399.4 Ų99.446%0.46447%0.471SS..Hα-helixtrans-59.4-43.4175.5-78.5178.9-71.9-143.6-4.4113.1E274 N280 E281 E282E274-R278 WeakPolarHBondContact O-CB 3.35Å; E274-R278 WeakPolarHBondContact O-CG 3.47Å; E274-R278 PolarHBondContact O-N 3.14Å; E274-R278 VanDerWaalsContact O-N 3.12Å; E274-R278 PolarHBondContact O-NE 2.95Å; R278-N280 PolarHBondContact O-N 3.29Å; R278-E281 PolarHBondContact O-N 3.49Å; R278-E282 WeakPolarHBondContact O-CG 3.23Å; R278-E282 PolarHBondContact O-N 3.34Å
279K89.1Confident84.6Confident135 Ų135102 Ų10259%0.58749%0.487SS*.Hα-helixtrans-61.8-43.4176.8-79.1179.6177.2-176.80111.9R275 E276 E277 E281 E282 E283R275-K279 WeakPolarHBondContact O-CG 3.15Å; R275-K279 PolarHBondContact O-N 2.85Å; R275-K279 VanDerWaalsContact O-N 3.08Å; E276-K279 PolarHBondContact O-N 3.38Å; E277-K279 PolarHBondContact O-N 3.15Å; K279-E281 VanDerWaalsContact C-N 3.33Å; K279-E281 PolarHBondContact O-N 3.45Å; K279-E282 PolarHBondContact O-N 3.15Å; K279-E283 PolarHBondContact O-N 2.81Å
280N88.6Confident84Confident88 Ų88105.3 Ų105.347%0.47151%0.507SS..Hα-helixtrans-65.2-38.3178.2-67.9-21.5000111.4E276 E277 R278 N284E276-N280 PolarHBondContact O-N 3.11Å; E276-N280 PolarHBondContact O-ND2 3.48Å; E277-N280 PolarHBondContact O-N 3.42Å; R278-N280 PolarHBondContact O-N 3.29Å; N280-N284 VanDerWaalsContact O-CB 3.32Å; N280-N284 WeakPolarHBondContact O-CB 3.32Å; N280-N284 PolarHBondContact O-N 2.99Å; N280-N284 PolarHBondContact O-ND2 3.24Å
281E89Confident83.5Confident123 Ų123108.9 Ų108.958%0.57553%0.529SS*.Hα-helixtrans-62.8-45.3173.2-73.9179.2176.200112E277 R278 K279 N284 L285E277-E281 WeakPolarHBondContact O-CG 3.37Å; E277-E281 PolarHBondContact O-N 3.03Å; R278-E281 PolarHBondContact O-N 3.49Å; K279-E281 VanDerWaalsContact C-N 3.33Å; K279-E281 PolarHBondContact O-N 3.45Å; E281-N284 PolarHBondContact O-N 2.98Å; E281-L285 WeakPolarHBondContact O-CB 3.33Å; E281-L285 VanDerWaalsContact O-CG 3.32Å; E281-L285 WeakPolarHBondContact O-CG 3.41Å; E281-L285 PolarHBondContact O-N 3.49Å
282E88.1Confident82.4Confident117 Ų117108.6 Ų108.655%0.54753%0.531SS..Hα-helixtrans-62.2-44.6176.3-73.8177.1-176.700112.4R278 K279 L285 Q286R278-E282 WeakPolarHBondContact O-CG 3.23Å; R278-E282 PolarHBondContact O-N 3.34Å; K279-E282 PolarHBondContact O-N 3.15Å; E282-L285 PolarHBondContact O-N 3.41Å; E282-Q286 WeakPolarHBondContact O-CG 3.49Å; E282-Q286 PolarHBondContact O-N 3.1Å
283E87.6Confident81.1Confident118 Ų118112.2 Ų112.255%0.55156%0.555SS**Hα-helixtrans-62.6-43.5176.1-77.5-175178.200111.7K279 L285 Q286 L287K279-E283 PolarHBondContact O-N 2.81Å; E283-L285 VanDerWaalsContact C-N 3.34Å; E283-L285 PolarHBondContact O-N 2.56Å; E283-Q286 PolarHBondContact O-N 3.03Å; E283-L287 WeakPolarHBondContact O-CG 3.29Å; E283-L287 PolarHBondContact O-N 3.12Å
284N84.4Confident79.7Confident99 Ų99113.4 Ų113.453%0.52957%0.565SS.*Hα-helixtrans-63.5-39.4176.4-76-34.8000112N280 E281 L287 T288N280-N284 VanDerWaalsContact O-CB 3.32Å; N280-N284 WeakPolarHBondContact O-CB 3.32Å; N280-N284 PolarHBondContact O-N 2.99Å; N280-N284 PolarHBondContact O-ND2 3.24Å; E281-N284 PolarHBondContact O-N 2.98Å; N284-L287 PolarHBondContact O-N 2.85Å; N284-T288 WeakPolarHBondContact O-CB 3.43Å; N284-T288 PolarHBondContact O-N 2.87Å; N284-T288 PolarHBondContact O-OG1 3.43Å
285L85.5Confident78Confident116 Ų116112.7 Ų112.761%0.60757%0.571SS**Hα-helixtrans-62.9-45.5173.8-76.6165.4000111.2E281 E282 E283 L287 T288 V289E281-L285 WeakPolarHBondContact O-CB 3.33Å; E281-L285 VanDerWaalsContact O-CG 3.32Å; E281-L285 WeakPolarHBondContact O-CG 3.41Å; E281-L285 PolarHBondContact O-N 3.49Å; E282-L285 PolarHBondContact O-N 3.41Å; E283-L285 VanDerWaalsContact C-N 3.34Å; E283-L285 PolarHBondContact O-N 2.56Å; L285-L287 PolarHBondContact O-N 3.2Å; L285-T288 PolarHBondContact O-N 2.81Å; L285-V289 VanDerWaalsContact O-CG2 3.29Å; L285-V289 WeakPolarHBondContact O-CG2 3.1Å; L285-V289 PolarHBondContact O-N 3.36Å
286Q79.9Confident76.2Confident122 Ų122113.6 Ų113.657%0.5759%0.586SS**Hα-helixtrans-62.2-42.2177.3-71.6178.724.400112.4E282 E283 T288 V289 N290E282-Q286 WeakPolarHBondContact O-CG 3.49Å; E282-Q286 PolarHBondContact O-N 3.1Å; E283-Q286 PolarHBondContact O-N 3.03Å; Q286-T288 VanDerWaalsContact C-N 3.34Å; Q286-V289 PolarHBondContact O-N 3.23Å; Q286-N290 WeakPolarHBondContact O-CB 2.94Å; Q286-N290 VanDerWaalsContact O-CG 3.31Å; Q286-N290 PolarHBondContact O-N 2.67Å; Q286-N290 PolarHBondContact O-ND2 3.38Å
287L79.5Confident74.1Confident112 Ų112112.6 Ų112.659%0.58659%0.59SS**Hα-helixtrans-64.2-39.2175-71.8168.5000111.9E283 N284 L285 N290 S291E283-L287 WeakPolarHBondContact O-CG 3.29Å; E283-L287 PolarHBondContact O-N 3.12Å; N284-L287 PolarHBondContact O-N 2.85Å; L285-L287 PolarHBondContact O-N 3.2Å; L287-N290 PolarHBondContact O-N 3.11Å; L287-S291 VanDerWaalsContact O-CB 3.26Å; L287-S291 WeakPolarHBondContact O-CB 3.32Å; L287-S291 PolarHBondContact O-N 3.3Å; L287-S291 PolarHBondContact O-OG 3.45Å
288T77.4Confident72.1Confident85 Ų85115.5 Ų115.552%0.52161%0.609SS.*Hα-helixtrans-66.9-38.5176.7-52.60000111.6N284 L285 Q286 S291N284-T288 WeakPolarHBondContact O-CB 3.43Å; N284-T288 PolarHBondContact O-N 2.87Å; N284-T288 PolarHBondContact O-OG1 3.43Å; L285-T288 PolarHBondContact O-N 2.81Å; Q286-T288 VanDerWaalsContact C-N 3.34Å; T288-S291 WeakPolarHBondContact CA-OG 3.32Å; T288-S291 PolarHBondContact O-OG 3.09Å
289V77.4Confident70Confident92 Ų92113.1 Ų113.156%0.55862%0.623SS**Hα-helixtrans-67.8-43.3175.1171.90000111.2L285 Q286 N292L285-V289 VanDerWaalsContact O-CG2 3.29Å; L285-V289 WeakPolarHBondContact O-CG2 3.1Å; L285-V289 PolarHBondContact O-N 3.36Å; Q286-V289 PolarHBondContact O-N 3.23Å; V289-N292 PolarHBondContact O-N 3.01Å
290N71.6Confident68Low132 Ų132116.5 Ų116.571%0.70664%0.638SS**Hα-helixtrans-75.2-24.4-178.2-73.6-21.4000114Q286 L287 N292Q286-N290 WeakPolarHBondContact O-CB 2.94Å; Q286-N290 VanDerWaalsContact O-CG 3.31Å; Q286-N290 PolarHBondContact O-N 2.67Å; Q286-N290 PolarHBondContact O-ND2 3.38Å; L287-N290 PolarHBondContact O-N 3.11Å; N290-N292 VanDerWaalsContact C-N 3.35Å
291S69.2Low66Low89 Ų89121.5 Ų121.562%0.62266%0.658SS**THydrogen-bonded Turntrans-84.7-6.2176.955.10000113.8L287 T288 P293L287-S291 VanDerWaalsContact O-CB 3.26Å; L287-S291 WeakPolarHBondContact O-CB 3.32Å; L287-S291 PolarHBondContact O-N 3.3Å; L287-S291 PolarHBondContact O-OG 3.45Å; T288-S291 WeakPolarHBondContact CA-OG 3.32Å; T288-S291 PolarHBondContact O-OG 3.09Å; S291-P293 VanDerWaalsContact O-CD 3.29Å; S291-P293 WeakPolarHBondContact O-CD 3.39Å
292N59.5Low64.1Low97 Ų97120.1 Ų120.152%0.51967%0.668SS.*  trans-89.6108.4-179.4-124.4-18.9000110.8V289 N290 K294 S295V289-N292 PolarHBondContact O-N 3.01Å; N290-N292 VanDerWaalsContact C-N 3.35Å; N292-K294 PolarHBondContact O-N 2.77Å; N292-S295 PolarHBondContact O-OG 3.38Å
293P55.5Low62Low109 Ų109123 Ų12371%0.70869%0.687SS**G310 helixtrans-69.1-6.1-171.9-17.431.2000115.1S291S291-P293 VanDerWaalsContact O-CD 3.29Å; S291-P293 WeakPolarHBondContact O-CD 3.39Å
294K54.8Low59.9Low181 Ų181127.1 Ų127.179%0.78773%0.726SS**G310 helixtrans-85-5.4-173.6-68.8-173.3177.2-1790114.7N292N292-K294 PolarHBondContact O-N 2.77Å
295S51Low58.7Low84 Ų84128.5 Ų128.559%0.58774%0.736SS**G310 helixtrans-93.6-12.6178.461.10000114.2N292N292-S295 PolarHBondContact O-OG 3.38Å
296N47.3Very low57.3Low160 Ų160129.2 Ų129.286%0.85674%0.743SS**SBendtrans-1009-175.4-108.6-4.4000115
297S43.1Very low56Low85 Ų85129.6 Ų129.659%0.59475%0.753SS**  trans-108.33.5-172.964.90000117
298N45.2Very low54.6Low159 Ų159130.6 Ų130.685%0.8576%0.762SS**SBendtrans-106.850.3-174.4-73.42000114.4
299G46.3Very low53.2Low73 Ų73133.4 Ų133.475%0.75378%0.777SS**SBendtrans-146.76.6-177.600000118.5
300K47.9Very low51.6Low205 Ų205136.2 Ų136.289%0.89179%0.792SS**  trans-136.972.2178.5-75.7-171.8177.1179.70112.8
301E46.4Very low50.2Low194 Ų194136.5 Ų136.591%0.90780%0.798SS**  trans-132.5104.9153.7-73.4-175.1162.500105.5
302A48.7Very low48.7Very low93 Ų93140.2 Ų140.277%0.76981%0.812SS**  104.192.485.300000109.4
303N43.9Very low47.8Very low177 Ų177143.8 Ų143.895%0.94784%0.836SS**  trans-119.4100.5157.9-89-15.2000106.7
304C43.6Very low47.1Very low205 Ų205146.9 Ų146.9100%1.38585%0.848SS**  trans-1070162.7-1460000107.5

Retrieved 304 of 304 residues in 110.9 ms (Link to these results)