A0A087XQV4_POEFO Loading...

Syntaxin-1B

Potentially involved in docking of synaptic vesicles at presynaptic active zones. May mediate Ca(2+)-regulation of exocytosis acrosomal reaction in sperm.

AlphaFold DB (A0A3B4UTU9), UniProt , Accession A0A087XQV4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 288 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
1M44.1Very low65.3Low245 Ų245135.6 Ų135.6100%1.20770%0.695SS**  0124.80-141168.2-175.500106.7
2K62Low64.3Low195 Ų195134.9 Ų134.985%0.84868%0.683SS**  trans-74133176.8-78.4176176.9173.40108.4R4K2-R4 PolarHBondContact O-N 3.14Å
3D66.3Low63.3Low131 Ų131136.8 Ų136.870%0.70170%0.696SS**  trans-66.5114.3178.8-173.92.9000109.9T5D3-T5 VanDerWaalsContact CG-OG1 3.3Å; D3-T5 VanDerWaalsContact OD1-CB 3.31Å; D3-T5 WeakPolarHBondContact OD1-CB 3.06Å; D3-T5 WeakPolarHBondContact OD1-CG2 3.32Å; D3-T5 PolarHBondContact OD1-N 3.33Å; D3-T5 PolarHBondContact OD1-OG1 2.99Å; D3-T5 PolarHBondContact OD2-OG1 2.65Å
4R77.5Confident62.5Low163 Ų163133.2 Ų133.262%0.61569%0.689SS**  trans-112.313.6178.6-65.3-179.271.9-173.10.8111.8K2 A6 E7 L8K2-R4 PolarHBondContact O-N 3.14Å; R4-A6 PolarHBondContact O-N 2.9Å; R4-E7 IonicContact CZ-OE2 3.79Å; R4-E7 IonicContact NE-OE1 2.57Å; R4-E7 IonicContact NE-OE2 2.75Å; R4-E7 PolarHBondContact NE-OE2 3.42Å; R4-E7 IonicContact NH2-OE2 3.32Å; R4-E7 PolarHBondContact NH2-OE2 3.06Å; R4-E7 PolarHBondContact O-N 3.12Å; R4-E7 VanDerWaalsContact O-N 3.07Å; R4-L8 PolarHBondContact O-N 2.81Å
5T75.4Confident61.8Low82 Ų82135.1 Ų135.150%0.50370%0.701SS.*Hα-helixtrans-59.5-28.8179.449.70000112.9D3 L8 R9D3-T5 VanDerWaalsContact CG-OG1 3.3Å; D3-T5 VanDerWaalsContact OD1-CB 3.31Å; D3-T5 WeakPolarHBondContact OD1-CB 3.06Å; D3-T5 WeakPolarHBondContact OD1-CG2 3.32Å; D3-T5 PolarHBondContact OD1-N 3.33Å; D3-T5 PolarHBondContact OD1-OG1 2.99Å; D3-T5 PolarHBondContact OD2-OG1 2.65Å; T5-L8 PolarHBondContact O-N 3.43Å; T5-R9 PolarHBondContact O-N 3.35Å
6A71.2Confident60.8Low75 Ų75136.3 Ų136.362%0.6271%0.709SS**Hα-helixtrans-66.8-36.7174.900000113.3R4 L8 R9 S10R4-A6 PolarHBondContact O-N 2.9Å; A6-L8 VanDerWaalsContact C-N 3.32Å; A6-L8 PolarHBondContact O-N 3.27Å; A6-R9 PolarHBondContact O-N 2.83Å; A6-S10 PolarHBondContact O-N 2.95Å
7E72.9Confident60.1Low109 Ų109138.5 Ų138.551%0.50972%0.722SS.*Hα-helixtrans-69.1-32.9178.1-66.4177.2-173.400111.5R4 S10 A11R4-E7 IonicContact CZ-OE2 3.79Å; R4-E7 IonicContact NE-OE1 2.57Å; R4-E7 IonicContact NE-OE2 2.75Å; R4-E7 PolarHBondContact NE-OE2 3.42Å; R4-E7 IonicContact NH2-OE2 3.32Å; R4-E7 PolarHBondContact NH2-OE2 3.06Å; R4-E7 PolarHBondContact O-N 3.12Å; R4-E7 VanDerWaalsContact O-N 3.07Å; E7-S10 PolarHBondContact O-N 3.37Å; E7-A11 PolarHBondContact O-N 3.21Å
8L63.7Low59.3Low129 Ų129137.7 Ų137.768%0.67571%0.714SS**Hα-helixtrans-70.5-33.6175.9-71.6168.4000112.8R4 T5 A6 A11R4-L8 PolarHBondContact O-N 2.81Å; T5-L8 PolarHBondContact O-N 3.43Å; A6-L8 VanDerWaalsContact C-N 3.32Å; A6-L8 PolarHBondContact O-N 3.27Å; L8-A11 PolarHBondContact O-N 3.14Å
9R64.9Low58.7Low204 Ų204140.3 Ų140.377%0.7772%0.722SS**Hα-helixtrans-68.4-37.6173.8-73.4-174.7-178.4-168.50.7112T5 A6 A11 K12T5-R9 PolarHBondContact O-N 3.35Å; A6-R9 PolarHBondContact O-N 2.83Å; R9-A11 VanDerWaalsContact C-N 3.27Å; R9-A11 PolarHBondContact O-N 3.02Å; R9-K12 PolarHBondContact O-N 3.45Å
10S61.9Low57.9Low96 Ų96138.9 Ų138.967%0.67172%0.72SS**Hα-helixtrans-65.4-27.8176.61700000113.4A6 E7A6-S10 PolarHBondContact O-N 2.95Å; E7-S10 PolarHBondContact O-N 3.37Å
11A58.5Low57.3Low63 Ų63138 Ų13852%0.52172%0.72SS.*THydrogen-bonded Turntrans-85.5-9.1178.900000113.6E7 L8 R9 S14E7-A11 PolarHBondContact O-N 3.21Å; L8-A11 PolarHBondContact O-N 3.14Å; R9-A11 VanDerWaalsContact C-N 3.27Å; R9-A11 PolarHBondContact O-N 3.02Å; A11-S14 PolarHBondContact O-OG 3.47Å
12K53.1Low57.1Low127 Ų127134.6 Ų134.655%0.55270%0.702SS**THydrogen-bonded Turntrans-87.2-11.6-174.2-158.1175177.2171.80113.9R9 S14 E18R9-K12 PolarHBondContact O-N 3.45Å; K12-S14 PolarHBondContact O-N 3.43Å; K12-E18 WeakPolarHBondContact CE-OE1 3.4Å; K12-E18 WeakPolarHBondContact CE-OE2 3.45Å; K12-E18 IonicContact NZ-OE1 2.63Å; K12-E18 PolarHBondContact NZ-OE1 3.41Å; K12-E18 IonicContact NZ-OE2 2.83Å; K12-E18 PolarHBondContact NZ-OE2 3.36Å
13D50.8Low56.6Low159 Ų159130.5 Ų130.585%0.8569%0.693SS**THydrogen-bonded Turntrans-82.15.8179-88.4-10.2000114
14S52.8Low55.7Low87 Ų87131.6 Ų131.661%0.60870%0.698SS**SBendtrans-112.598.4175.347.90000111.2A11 K12 D16A11-S14 PolarHBondContact O-OG 3.47Å; K12-S14 PolarHBondContact O-N 3.43Å; S14-D16 PolarHBondContact O-N 3.2Å
15D52Low54.6Low162 Ų162134.3 Ų134.387%0.86671%0.709SS**  trans29.583.3157.4-76.3-16.1000117.4
16D46.2Very low53.5Low154 Ų154136.8 Ų136.882%0.82472%0.719SS**  trans-144.5120.2147.4-92.8-34.7000108.4S14 E18S14-D16 PolarHBondContact O-N 3.2Å; D16-E18 VanDerWaalsContact C-N 3.34Å; D16-E18 PolarHBondContact O-N 3.17Å
17D48.3Very low53.5Low174 Ų174140.6 Ų140.693%0.9372%0.724SS**  trans-57.596.3168.6-82.3-44.8000108.3E19D17-E19 PolarHBondContact O-N 2.89Å
18E46.5Very low53.8Low124 Ų124140.8 Ų140.858%0.57972%0.723SS**  trans-64.5101.4173.1-79.2-169.9150.800108.7K12 D16 V20K12-E18 WeakPolarHBondContact CE-OE1 3.4Å; K12-E18 WeakPolarHBondContact CE-OE2 3.45Å; K12-E18 IonicContact NZ-OE1 2.63Å; K12-E18 PolarHBondContact NZ-OE1 3.41Å; K12-E18 IonicContact NZ-OE2 2.83Å; K12-E18 PolarHBondContact NZ-OE2 3.36Å; D16-E18 VanDerWaalsContact C-N 3.34Å; D16-E18 PolarHBondContact O-N 3.17Å; E18-V20 PolarHBondContact O-N 2.85Å
19E47.2Very low54.8Low187 Ų187135.4 Ų135.487%0.87470%0.695SS**  trans-6292.2157.1-158.3174.9-148.500106.3D17 V21D17-E19 PolarHBondContact O-N 2.89Å; E19-V21 VanDerWaalsContact C-N 3.33Å; E19-V21 PolarHBondContact O-N 3.19Å
20V41.8Very low55.9Low112 Ų112129.2 Ų129.268%0.67968%0.677SS**  trans-61.497.6178.8-177.80000107E18 Q22E18-V20 PolarHBondContact O-N 2.85Å; V20-Q22 VanDerWaalsContact C-N 3.28Å; V20-Q22 PolarHBondContact O-N 3.35Å
21V46.7Very low57.2Low120 Ų120131.5 Ų131.573%0.72768%0.677SS**  trans-61.799.9163.6-179.50000105.3E19 V23E19-V21 VanDerWaalsContact C-N 3.33Å; E19-V21 PolarHBondContact O-N 3.19Å; V21-V23 HydrophobicContact CG1-CG2 4.2Å; V21-V23 PolarHBondContact O-N 3.36Å
22Q39.8Very low58.7Low174 Ų174128.7 Ų128.781%0.81365%0.653SS**  trans-6289.6164.5-79.3-176.2-22.300106.6V20 D24V20-Q22 VanDerWaalsContact C-N 3.28Å; V20-Q22 PolarHBondContact O-N 3.35Å; Q22-D24 PolarHBondContact O-N 3.23Å; Q22-D24 VanDerWaalsContact O-N 3.13Å
23V51.8Low60.6Low109 Ų109126.1 Ų126.166%0.66164%0.642SS**  trans-66.5106.4157.6-177.90000103.7V21 R25V21-V23 HydrophobicContact CG1-CG2 4.2Å; V21-V23 PolarHBondContact O-N 3.36Å; V23-R25 PolarHBondContact O-N 2.91Å
24D47.6Very low62.7Low153 Ų153125.2 Ų125.282%0.81863%0.632SS**  trans-56.191.4164.8-107.1-24.4000106.6Q22 D26Q22-D24 PolarHBondContact O-N 3.23Å; Q22-D24 VanDerWaalsContact O-N 3.13Å; D24-D26 VanDerWaalsContact C-N 3.3Å
25R52.9Low64.7Low220 Ų220124 Ų12483%0.8362%0.617SS**  trans-87.3-7.2-169.2-159.9175.9-174.3-169.20.8111.7V23V23-R25 PolarHBondContact O-N 2.91Å
26D53.5Low66.7Low135 Ų135116.7 Ų116.772%0.72258%0.578SS**THydrogen-bonded Turntrans-82.6-14.9-165.2-86-0.2000114.5D24D24-D26 VanDerWaalsContact C-N 3.3Å
27H70.7Confident69.1Low154 Ų154114.4 Ų114.471%0.71356%0.563SS**THydrogen-bonded Turntrans-147.255.6-179.4-66.7-54.2000114.6M29 D30H27-M29 PolarHBondContact O-N 3.4Å; H27-D30 IonicContact CE1-OD2 2.68Å; H27-D30 IonicContact CG-OD2 3.35Å; H27-D30 IonicContact ND1-OD2 2.99Å; H27-D30 PolarHBondContact ND1-OD2 2.77Å
28F79.9Confident71.4Confident113 Ų113109.7 Ų109.750%0.49654%0.535SS..SBendtrans-83108.2174177.6-101.1000111.1D30 F33 I114F28-D30 PolarHBondContact N-OD1 3.47Å; F28-D30 PolarHBondContact O-N 3.3Å; F28-F33 HydrophobicContact CD1-CE2 4.28Å; F28-F33 HydrophobicContact CE1-CE2 4.42Å; F28-I114 HydrophobicContact CE1-CD1 3.79Å; F28-I114 HydrophobicContact CZ-CD1 3.81Å
29M83.1Confident73.8Confident17 Ų17103.8 Ų103.88%0.08451%0.507CS..SBendtrans59.120.6176.6-62.2-173.980.500115.2H27 E31 F32 F33 D111 I114 R115H27-M29 PolarHBondContact O-N 3.4Å; M29-E31 VanDerWaalsContact C-N 3.34Å; M29-E31 PolarHBondContact O-N 3.24Å; M29-F32 HydrophobicContact CB-CB 4.3Å; M29-F32 HydrophobicContact CE-CB 4.16Å; M29-F32 HydrophobicContact CE-CD1 3.34Å; M29-F32 HydrophobicContact CE-CE1 3.88Å; M29-F32 HydrophobicContact CE-CG 3.79Å; M29-F32 WeakPolarHBondContact O-CA 3.47Å; M29-F32 WeakPolarHBondContact O-CB 3.43Å; M29-F32 PolarHBondContact O-N 3.34Å; M29-F33 HydrophobicContact CB-CD2 3.75Å; M29-F33 HydrophobicContact CB-CE2 3.57Å; M29-F33 HydrophobicContact CB-CZ 4.36Å; M29-F33 WeakPolarHBondContact O-CD2 3.47Å; M29-F33 PolarHBondContact O-N 3.14Å; M29-F33 HydrophobicContact SD-CE2 4.47Å; M29-F33 HydrophobicContact SD-CZ 4.45Å; M29-D111 HydrophobicContact CE-CB 4.48Å; M29-D111 VanDerWaalsContact CE-OD1 3.31Å; M29-D111 WeakPolarHBondContact CE-OD1 3.36Å; M29-D111 WeakPolarHBondContact CG-OD1 3.44Å; M29-D111 HydrophobicContact SD-CB 4.28Å; M29-I114 HydrophobicContact CE-CB 4.15Å; M29-I114 HydrophobicContact CE-CG2 3.89Å; M29-I114 HydrophobicContact SD-CB 4Å; M29-I114 HydrophobicContact SD-CD1 3.83Å; M29-I114 HydrophobicContact SD-CG2 3.83Å; M29-R115 HydrophobicContact CE-CG 3.65Å
30D89.2Confident76.2Confident74 Ų74100.7 Ų100.740%0.39649%0.488SS..Hα-helixtrans-52.1-47.9-174.5-72.815.3000113.4H27 F28 F32 F33 E34H27-D30 IonicContact CE1-OD2 2.68Å; H27-D30 IonicContact CG-OD2 3.35Å; H27-D30 IonicContact ND1-OD2 2.99Å; H27-D30 PolarHBondContact ND1-OD2 2.77Å; F28-D30 PolarHBondContact N-OD1 3.47Å; F28-D30 PolarHBondContact O-N 3.3Å; D30-F32 VanDerWaalsContact C-N 3.28Å; D30-F32 PolarHBondContact O-N 2.9Å; D30-F33 PolarHBondContact O-N 3.05Å; D30-E34 WeakPolarHBondContact O-CB 3.44Å; D30-E34 PolarHBondContact O-N 3.22Å
31E89.1Confident78.8Confident144 Ų14497.1 Ų97.167%0.67347%0.473SS*.Hα-helixtrans-60.6-39.2177.9-175-176.5175.900111.9M29 Q35M29-E31 VanDerWaalsContact C-N 3.34Å; M29-E31 PolarHBondContact O-N 3.24Å; E31-Q35 WeakPolarHBondContact O-CG 3.5Å; E31-Q35 PolarHBondContact O-N 2.96Å; E31-Q35 VanDerWaalsContact O-N 3.09Å
32F90.3Very high81.3Confident4 Ų492 Ų922%0.01844%0.443CS..Hα-helixtrans-68.8-42.6177.4172.3-100.8000111.4M29 D30 E34 Q35 V36 I95 I114 R115 Q118M29-F32 HydrophobicContact CB-CB 4.3Å; M29-F32 HydrophobicContact CE-CB 4.16Å; M29-F32 HydrophobicContact CE-CD1 3.34Å; M29-F32 HydrophobicContact CE-CE1 3.88Å; M29-F32 HydrophobicContact CE-CG 3.79Å; M29-F32 WeakPolarHBondContact O-CA 3.47Å; M29-F32 WeakPolarHBondContact O-CB 3.43Å; M29-F32 PolarHBondContact O-N 3.34Å; D30-F32 VanDerWaalsContact C-N 3.28Å; D30-F32 PolarHBondContact O-N 2.9Å; F32-E34 VanDerWaalsContact C-N 3.34Å; F32-Q35 WeakPolarHBondContact O-CB 3.36Å; F32-Q35 PolarHBondContact O-N 2.84Å; F32-V36 HydrophobicContact CD1-CG2 4.21Å; F32-V36 HydrophobicContact CE1-CG2 3.65Å; F32-V36 HydrophobicContact CE2-CG2 4.01Å; F32-V36 HydrophobicContact CZ-CG2 3.52Å; F32-V36 WeakPolarHBondContact O-CG2 3.39Å; F32-V36 PolarHBondContact O-N 3.5Å; F32-I95 HydrophobicContact CE2-CD1 4.14Å; F32-I95 HydrophobicContact CE2-CG1 4.31Å; F32-I95 HydrophobicContact CE2-CG2 4.02Å; F32-I114 HydrophobicContact CE1-CG2 4.02Å; F32-R115 HydrophobicContact CD2-CG 4.05Å; F32-R115 HydrophobicContact CE1-CG 4.27Å; F32-R115 HydrophobicContact CE2-CB 4.21Å; F32-R115 HydrophobicContact CE2-CG 3.81Å; F32-R115 HydrophobicContact CG-CG 4.39Å; F32-R115 HydrophobicContact CZ-CB 4.15Å; F32-R115 HydrophobicContact CZ-CG 3.93Å; F32-Q118 HydrophobicContact CE1-CB 4.08Å; F32-Q118 HydrophobicContact CE1-CG 3.95Å; F32-Q118 HydrophobicContact CZ-CB 3.74Å; F32-Q118 HydrophobicContact CZ-CG 4.15Å
33F93.3Very high84Confident72 Ų7284.1 Ų84.132%0.31641%0.406SS..Hα-helixtrans-67.7-34.3177.2-72.5-56000112.5F28 M29 D30 Q35 V36 E37 I114F28-F33 HydrophobicContact CD1-CE2 4.28Å; F28-F33 HydrophobicContact CE1-CE2 4.42Å; M29-F33 HydrophobicContact CB-CD2 3.75Å; M29-F33 HydrophobicContact CB-CE2 3.57Å; M29-F33 HydrophobicContact CB-CZ 4.36Å; M29-F33 WeakPolarHBondContact O-CD2 3.47Å; M29-F33 PolarHBondContact O-N 3.14Å; M29-F33 HydrophobicContact SD-CE2 4.47Å; M29-F33 HydrophobicContact SD-CZ 4.45Å; D30-F33 PolarHBondContact O-N 3.05Å; F33-Q35 VanDerWaalsContact C-N 3.34Å; F33-V36 PolarHBondContact O-N 2.94Å; F33-E37 PolarHBondContact O-N 3.31Å; F33-I114 HydrophobicContact CE1-CG2 4.1Å; F33-I114 HydrophobicContact CZ-CG2 4.01Å
34E94.3Very high86.2Confident140 Ų14084 Ų8465%0.65440%0.399SS*.Hα-helixtrans-61.3-43.1171.1-172.1176-171.500111D30 F32 E37 E38D30-E34 WeakPolarHBondContact O-CB 3.44Å; D30-E34 PolarHBondContact O-N 3.22Å; F32-E34 VanDerWaalsContact C-N 3.34Å; E34-E37 PolarHBondContact O-N 2.97Å; E34-E38 WeakPolarHBondContact O-CB 3.48Å; E34-E38 PolarHBondContact O-N 3.2Å
35Q94.3Very high88.6Confident63 Ų6380.5 Ų80.529%0.29438%0.376SS..Hα-helixtrans-62.9-41.9173.8-70.3178.310.800112.5E31 F32 F33 E38 I39E31-Q35 WeakPolarHBondContact O-CG 3.5Å; E31-Q35 PolarHBondContact O-N 2.96Å; E31-Q35 VanDerWaalsContact O-N 3.09Å; F32-Q35 WeakPolarHBondContact O-CB 3.36Å; F32-Q35 PolarHBondContact O-N 2.84Å; F33-Q35 VanDerWaalsContact C-N 3.34Å; Q35-E38 PolarHBondContact O-N 2.79Å; Q35-I39 VanDerWaalsContact O-CG1 3.25Å; Q35-I39 WeakPolarHBondContact O-CG1 3.5Å; Q35-I39 PolarHBondContact O-N 3.27Å
36V94.7Very high90.7Very high7 Ų770 Ų704%0.04234%0.336CS..Hα-helixtrans-61.4-47.9177.2162.90000111.2F32 F33 E38 I39 R40 Q118 L122F32-V36 HydrophobicContact CD1-CG2 4.21Å; F32-V36 HydrophobicContact CE1-CG2 3.65Å; F32-V36 HydrophobicContact CE2-CG2 4.01Å; F32-V36 HydrophobicContact CZ-CG2 3.52Å; F32-V36 WeakPolarHBondContact O-CG2 3.39Å; F32-V36 PolarHBondContact O-N 3.5Å; F33-V36 PolarHBondContact O-N 2.94Å; V36-E38 VanDerWaalsContact C-N 3.33Å; V36-E38 PolarHBondContact O-N 3.09Å; V36-I39 PolarHBondContact O-N 3.48Å; V36-R40 WeakPolarHBondContact O-CB 3.45Å; V36-R40 PolarHBondContact O-N 3.02Å; V36-Q118 HydrophobicContact CG2-CB 4.06Å; V36-Q118 HydrophobicContact CG2-CG 4.34Å; V36-L122 HydrophobicContact CB-CD1 4.34Å; V36-L122 HydrophobicContact CG1-CD1 4.13Å; V36-L122 HydrophobicContact CG2-CD1 4.12Å
37E95.6Very high92.8Very high106 Ų10666.2 Ų66.250%0.49532%0.32SS..Hα-helixtrans-66-36.1178.2-74.5-59.2147.900111.8F33 E34 R40 G41F33-E37 PolarHBondContact O-N 3.31Å; E34-E37 PolarHBondContact O-N 2.97Å; E37-R40 PolarHBondContact O-N 3.12Å; E37-R40 IonicContact OE1-NH1 3.95Å; E37-G41 PolarHBondContact O-N 3.29Å
38E96.6Very high94.1Very high75 Ų7564.5 Ų64.535%0.3531%0.313SS..Hα-helixtrans-64.6-42.9174-165.9-173159.200112.1E34 Q35 V36 G41 C42 K87 K91E34-E38 WeakPolarHBondContact O-CB 3.48Å; E34-E38 PolarHBondContact O-N 3.2Å; Q35-E38 PolarHBondContact O-N 2.79Å; V36-E38 VanDerWaalsContact C-N 3.33Å; V36-E38 PolarHBondContact O-N 3.09Å; E38-G41 PolarHBondContact O-N 2.79Å; E38-C42 PolarHBondContact O-N 3.32Å; E38-C42 PolarHBondContact O-SG 3.09Å; E38-K87 WeakPolarHBondContact OE1-CE 3.46Å; E38-K87 IonicContact OE1-NZ 2.63Å; E38-K87 PolarHBondContact OE1-NZ 2.98Å; E38-K91 WeakPolarHBondContact OE1-CE 3.22Å; E38-K91 IonicContact OE1-NZ 3.65Å; E38-K91 PolarHBondContact OE1-NZ 2.86Å; E38-K91 VanDerWaalsContact OE2-CE 3.29Å; E38-K91 WeakPolarHBondContact OE2-CE 3.48Å; E38-K91 IonicContact OE2-NZ 2.67Å; E38-K91 PolarHBondContact OE2-NZ 2.83Å
39I97.1Very high94.9Very high0 Ų059.5 Ų59.50%029%0.291CS..Hα-helixtrans-62.8-46.5175.7-66.9164.5000109.8Q35 V36 G41 C42 I43 V88 K91 L92 I95 L122Q35-I39 VanDerWaalsContact O-CG1 3.25Å; Q35-I39 WeakPolarHBondContact O-CG1 3.5Å; Q35-I39 PolarHBondContact O-N 3.27Å; V36-I39 PolarHBondContact O-N 3.48Å; I39-G41 PolarHBondContact O-N 2.92Å; I39-C42 WeakPolarHBondContact O-CB 3.42Å; I39-C42 PolarHBondContact O-N 3.01Å; I39-C42 VanDerWaalsContact O-N 3.14Å; I39-I43 HydrophobicContact CG2-CD1 3.79Å; I39-I43 HydrophobicContact CG2-CG1 4.34Å; I39-I43 WeakPolarHBondContact O-CG1 3.4Å; I39-I43 PolarHBondContact O-N 2.65Å; I39-V88 HydrophobicContact CG2-CG1 4.08Å; I39-K91 HydrophobicContact CD1-CB 3.8Å; I39-K91 HydrophobicContact CG1-CB 3.71Å; I39-K91 HydrophobicContact CG1-CD 3.82Å; I39-K91 HydrophobicContact CG1-CG 4.42Å; I39-L92 HydrophobicContact CD1-CD2 4.35Å; I39-L92 HydrophobicContact CG2-CD2 4.42Å; I39-I95 HydrophobicContact CD1-CD1 3.43Å; I39-I95 VanDerWaalsContact CD1-CD1 3.43Å; I39-L122 HydrophobicContact CB-CD1 4.09Å; I39-L122 HydrophobicContact CD1-CD1 4.04Å; I39-L122 HydrophobicContact CG2-CB 4.22Å; I39-L122 HydrophobicContact CG2-CD1 3.96Å; I39-L122 HydrophobicContact CG2-CD2 4.14Å; I39-L122 HydrophobicContact CG2-CG 4.35Å
40R97.3Very high95.5Very high123 Ų12358.9 Ų58.946%0.46429%0.288SS..Hα-helixtrans-57.6-48.8178.3-177.9-176172.4174.22.5111.5V36 E37 C42 I43 E44 L122V36-R40 WeakPolarHBondContact O-CB 3.45Å; V36-R40 PolarHBondContact O-N 3.02Å; E37-R40 PolarHBondContact O-N 3.12Å; E37-R40 IonicContact OE1-NH1 3.95Å; R40-C42 VanDerWaalsContact C-N 3.27Å; R40-C42 PolarHBondContact O-N 3.27Å; R40-I43 PolarHBondContact O-N 3.29Å; R40-I43 VanDerWaalsContact O-N 3.09Å; R40-E44 IonicContact CZ-OE1 2.74Å; R40-E44 IonicContact NE-OE1 3.99Å; R40-E44 PolarHBondContact NE-OE1 3.41Å; R40-E44 IonicContact NH2-OE1 3.67Å; R40-E44 WeakPolarHBondContact O-CG 3.04Å; R40-E44 PolarHBondContact O-N 3.14Å; R40-L122 HydrophobicContact CB-CD2 4.2Å
41G98.1Very high95.9Very high36 Ų3659.3 Ų59.337%0.37129%0.288SS..Hα-helixtrans-60.4-36.2176.400000112.8E37 E38 I39 E44 K45E37-G41 PolarHBondContact O-N 3.29Å; E38-G41 PolarHBondContact O-N 2.79Å; I39-G41 PolarHBondContact O-N 2.92Å; G41-E44 PolarHBondContact O-N 3.45Å; G41-K45 PolarHBondContact O-N 2.92Å
42C97.9Very high96.2Very high14 Ų1455.7 Ų55.710%0.09527%0.271CS..Hα-helixtrans-67.3-38.6173.7-65.90000112.5E38 I39 R40 K45 L46 T84 V88E38-C42 PolarHBondContact O-N 3.32Å; E38-C42 PolarHBondContact O-SG 3.09Å; I39-C42 WeakPolarHBondContact O-CB 3.42Å; I39-C42 PolarHBondContact O-N 3.01Å; I39-C42 VanDerWaalsContact O-N 3.14Å; R40-C42 VanDerWaalsContact C-N 3.27Å; R40-C42 PolarHBondContact O-N 3.27Å; C42-K45 PolarHBondContact O-N 2.86Å; C42-L46 WeakPolarHBondContact O-CG 3.25Å; C42-L46 PolarHBondContact O-N 3.02Å; C42-T84 HydrophobicContact CB-CG2 3.81Å; C42-T84 WeakPolarHBondContact O-CG2 3.47Å; C42-V88 HydrophobicContact CB-CG2 3.43Å; C42-V88 VanDerWaalsContact CB-CG2 3.43Å
43I97.3Very high96.5Very high7 Ų755.5 Ų55.54%0.03627%0.27CS..Hα-helixtrans-67.6-40.4176-66.7168.3000110.9I39 R40 L46 S47 V88 L122 K125 F126 V129I39-I43 HydrophobicContact CG2-CD1 3.79Å; I39-I43 HydrophobicContact CG2-CG1 4.34Å; I39-I43 WeakPolarHBondContact O-CG1 3.4Å; I39-I43 PolarHBondContact O-N 2.65Å; R40-I43 PolarHBondContact O-N 3.29Å; R40-I43 VanDerWaalsContact O-N 3.09Å; I43-L46 WeakPolarHBondContact O-CB 3.33Å; I43-L46 PolarHBondContact O-N 2.67Å; I43-S47 PolarHBondContact O-N 3.16Å; I43-V88 HydrophobicContact CD1-CG1 4.37Å; I43-V88 HydrophobicContact CG1-CG1 4.11Å; I43-V88 HydrophobicContact CG1-CG2 4.17Å; I43-L122 HydrophobicContact CD1-CB 4.46Å; I43-L122 HydrophobicContact CD1-CD2 4.27Å; I43-K125 HydrophobicContact CG2-CB 4.4Å; I43-K125 HydrophobicContact CG2-CG 3.73Å; I43-F126 HydrophobicContact CD1-CB 3.94Å; I43-F126 HydrophobicContact CG1-CB 4.22Å; I43-F126 HydrophobicContact CG1-CD2 4.38Å; I43-V129 HydrophobicContact CG2-CG2 4.01Å
44E97.9Very high96.6Very high108 Ų10854.4 Ų54.451%0.50527%0.265SS..Hα-helixtrans-62.5-44.9174.9-72.2175.1-171.800110.9R40 G41 L46 S47 E48R40-E44 IonicContact CZ-OE1 2.74Å; R40-E44 IonicContact NE-OE1 3.99Å; R40-E44 PolarHBondContact NE-OE1 3.41Å; R40-E44 IonicContact NH2-OE1 3.67Å; R40-E44 WeakPolarHBondContact O-CG 3.04Å; R40-E44 PolarHBondContact O-N 3.14Å; G41-E44 PolarHBondContact O-N 3.45Å; E44-L46 PolarHBondContact O-N 2.97Å; E44-S47 WeakPolarHBondContact O-CB 3.15Å; E44-S47 PolarHBondContact O-N 3.16Å; E44-E48 PolarHBondContact O-N 3.38Å
45K97.6Very high96.6Very high78 Ų7854.7 Ų54.734%0.33926%0.264SS..Hα-helixtrans-58-47.1172.3-172.4-169.9173-163.50111.6G41 C42 S47 E48 D49 D80G41-K45 PolarHBondContact O-N 2.92Å; C42-K45 PolarHBondContact O-N 2.86Å; K45-S47 VanDerWaalsContact C-N 3.27Å; K45-S47 PolarHBondContact O-N 3.36Å; K45-E48 WeakPolarHBondContact O-CB 3.36Å; K45-E48 PolarHBondContact O-N 3.4Å; K45-D49 WeakPolarHBondContact CE-OD2 3.37Å; K45-D49 IonicContact NZ-OD2 3.27Å; K45-D49 PolarHBondContact O-N 3.26Å; K45-D80 IonicContact NZ-OD2 3.14Å; K45-D80 PolarHBondContact NZ-OD2 3.25Å
46L96.9Very high96.5Very high0 Ų053.2 Ų53.20%026%0.257CS..Hα-helixtrans-56.5-44.2177-79.4168.3000111.6C42 I43 E44 E48 D49 V50 I81 T84 A85 V88 F126 V129C42-L46 WeakPolarHBondContact O-CG 3.25Å; C42-L46 PolarHBondContact O-N 3.02Å; I43-L46 WeakPolarHBondContact O-CB 3.33Å; I43-L46 PolarHBondContact O-N 2.67Å; E44-L46 PolarHBondContact O-N 2.97Å; L46-E48 VanDerWaalsContact C-N 3.27Å; L46-E48 PolarHBondContact O-N 2.99Å; L46-D49 PolarHBondContact O-N 2.97Å; L46-V50 WeakPolarHBondContact O-CB 3.27Å; L46-V50 WeakPolarHBondContact O-CG2 3.36Å; L46-V50 PolarHBondContact O-N 3.11Å; L46-I81 HydrophobicContact CD2-CB 4.23Å; L46-I81 HydrophobicContact CD2-CG1 4.34Å; L46-I81 HydrophobicContact CD2-CG2 3.96Å; L46-I81 WeakPolarHBondContact CD2-O 3.46Å; L46-T84 HydrophobicContact CD1-CG2 4.19Å; L46-T84 HydrophobicContact CD2-CG2 4.12Å; L46-T84 HydrophobicContact CG-CG2 3.71Å; L46-A85 HydrophobicContact CD1-CB 4.23Å; L46-A85 HydrophobicContact CD2-CB 4.16Å; L46-V88 HydrophobicContact CD1-CG2 4.2Å; L46-F126 HydrophobicContact CD1-CD2 3.96Å; L46-F126 HydrophobicContact CD1-CE2 3.66Å; L46-V129 HydrophobicContact CB-CG1 3.85Å
47S97.5Very high96.5Very high55 Ų5553.3 Ų53.339%0.38526%0.257SS..Hα-helixtrans-61.1-38.3177.3-169.80000111.9I43 E44 K45 E51I43-S47 PolarHBondContact O-N 3.16Å; E44-S47 WeakPolarHBondContact O-CB 3.15Å; E44-S47 PolarHBondContact O-N 3.16Å; K45-S47 VanDerWaalsContact C-N 3.27Å; K45-S47 PolarHBondContact O-N 3.36Å; S47-E51 PolarHBondContact O-N 3.11Å
48E97.8Very high96.4Very high119 Ų11952 Ų5256%0.55626%0.26SS*.Hα-helixtrans-67.4-47.4175.4-172.8179.5179.100111.7E44 K45 L46 V50 E51 Q52E44-E48 PolarHBondContact O-N 3.38Å; K45-E48 WeakPolarHBondContact O-CB 3.36Å; K45-E48 PolarHBondContact O-N 3.4Å; L46-E48 VanDerWaalsContact C-N 3.27Å; L46-E48 PolarHBondContact O-N 2.99Å; E48-V50 VanDerWaalsContact C-N 3.27Å; E48-V50 PolarHBondContact O-N 3.26Å; E48-E51 WeakPolarHBondContact O-CB 3.48Å; E48-E51 PolarHBondContact O-N 2.91Å; E48-E51 VanDerWaalsContact O-N 3.08Å; E48-Q52 WeakPolarHBondContact O-CG 3.49Å; E48-Q52 PolarHBondContact O-N 3.22Å; E48-Q52 PolarHBondContact OE1-NE2 3.35Å
49D97.2Very high96.1Very high8 Ų850.8 Ų50.84%0.04326%0.262CS..Hα-helixtrans-59.5-39.8179-66.1-20.3000110.8K45 L46 E51 Q52 V53 L77 I81K45-D49 WeakPolarHBondContact CE-OD2 3.37Å; K45-D49 IonicContact NZ-OD2 3.27Å; K45-D49 PolarHBondContact O-N 3.26Å; L46-D49 PolarHBondContact O-N 2.97Å; D49-E51 PolarHBondContact O-N 3.38Å; D49-Q52 WeakPolarHBondContact O-CB 3.43Å; D49-Q52 PolarHBondContact O-N 2.89Å; D49-V53 WeakPolarHBondContact O-CG2 3.47Å; D49-V53 PolarHBondContact O-N 2.63Å; D49-L77 HydrophobicContact CB-CD2 4.41Å; D49-I81 HydrophobicContact CB-CD1 3.92Å; D49-I81 HydrophobicContact CB-CG1 3.53Å
50V96.1Very high95.9Very high3 Ų350.8 Ų50.82%0.01826%0.263CS..Hα-helixtrans-60.9-42.3174.7172.20000111.7L46 E48 Q52 V53 K54 I81 V129 E132 Y133L46-V50 WeakPolarHBondContact O-CB 3.27Å; L46-V50 WeakPolarHBondContact O-CG2 3.36Å; L46-V50 PolarHBondContact O-N 3.11Å; E48-V50 VanDerWaalsContact C-N 3.27Å; E48-V50 PolarHBondContact O-N 3.26Å; V50-Q52 VanDerWaalsContact C-N 3.33Å; V50-V53 PolarHBondContact O-N 3.07Å; V50-K54 PolarHBondContact O-N 2.83Å; V50-K54 VanDerWaalsContact O-N 3.12Å; V50-I81 HydrophobicContact CG2-CD1 4.28Å; V50-V129 HydrophobicContact CG2-CG1 4.26Å; V50-E132 HydrophobicContact CG1-CG 4.24Å; V50-Y133 HydrophobicContact CG2-CD2 3.84Å; V50-Y133 HydrophobicContact CG2-CG 4.2Å
51E96.7Very high95.5Very high84 Ų8446 Ų4639%0.39325%0.246SC..Hα-helixtrans-67.3-34.4175.2-72.4-57.9136.500112.4S47 E48 D49 K54 K55S47-E51 PolarHBondContact O-N 3.11Å; E48-E51 WeakPolarHBondContact O-CB 3.48Å; E48-E51 PolarHBondContact O-N 2.91Å; E48-E51 VanDerWaalsContact O-N 3.08Å; D49-E51 PolarHBondContact O-N 3.38Å; E51-K54 PolarHBondContact O-N 3.05Å; E51-K54 IonicContact OE1-NZ 2.7Å; E51-K54 PolarHBondContact OE1-NZ 2.92Å; E51-K54 IonicContact OE2-NZ 3.15Å; E51-K55 PolarHBondContact O-N 3.04Å
52Q96.6Very high95.2Very high68 Ų6848.1 Ų48.132%0.31826%0.26SS..Hα-helixtrans-66.4-41.8173.1-65.7-174.83400111.5E48 D49 V50 K54 K55 Q56 L77E48-Q52 WeakPolarHBondContact O-CG 3.49Å; E48-Q52 PolarHBondContact O-N 3.22Å; E48-Q52 PolarHBondContact OE1-NE2 3.35Å; D49-Q52 WeakPolarHBondContact O-CB 3.43Å; D49-Q52 PolarHBondContact O-N 2.89Å; V50-Q52 VanDerWaalsContact C-N 3.33Å; Q52-K54 VanDerWaalsContact C-N 3.32Å; Q52-K54 PolarHBondContact O-N 3.34Å; Q52-K55 WeakPolarHBondContact O-CB 3.27Å; Q52-K55 PolarHBondContact O-N 3.13Å; Q52-K55 VanDerWaalsContact O-N 3.08Å; Q52-Q56 WeakPolarHBondContact O-CG 3.37Å; Q52-Q56 PolarHBondContact O-N 2.99Å; Q52-L77 HydrophobicContact CB-CD1 3.77Å; Q52-L77 HydrophobicContact CB-CD2 4.01Å
53V95.6Very high94.6Very high0 Ų049 Ų490%027%0.269CS..Hα-helixtrans-56.8-43.8174.2165.70000111.4D49 V50 K55 Q56 H57 L74 L77 I81 Y133 T136D49-V53 WeakPolarHBondContact O-CG2 3.47Å; D49-V53 PolarHBondContact O-N 2.63Å; V50-V53 PolarHBondContact O-N 3.07Å; V53-K55 VanDerWaalsContact C-N 3.3Å; V53-K55 PolarHBondContact O-N 3.25Å; V53-Q56 PolarHBondContact O-N 3.49Å; V53-H57 VanDerWaalsContact CG1-NE2 3.3Å; V53-H57 WeakPolarHBondContact CG1-NE2 3.49Å; V53-H57 WeakPolarHBondContact O-CB 3.35Å; V53-H57 PolarHBondContact O-CD2 2.99Å; V53-H57 PolarHBondContact O-N 3.5Å; V53-L74 HydrophobicContact CB-CD1 4.39Å; V53-L74 HydrophobicContact CG1-CD1 3.94Å; V53-L74 HydrophobicContact CG2-CD1 4.13Å; V53-L77 HydrophobicContact CG2-CB 3.85Å; V53-L77 HydrophobicContact CG2-CD1 4.19Å; V53-I81 HydrophobicContact CG2-CD1 3.73Å; V53-Y133 HydrophobicContact CG1-CE2 4.37Å; V53-Y133 HydrophobicContact CG2-CE2 4.44Å; V53-T136 HydrophobicContact CG1-CG2 4.24Å
54K94.9Very high93.7Very high49 Ų4951.4 Ų51.421%0.21329%0.285CS..Hα-helixtrans-57.4-41.2175.2-70.3173.9-176.4173.70112.7V50 E51 Q52 S58 E132 T136V50-K54 PolarHBondContact O-N 2.83Å; V50-K54 VanDerWaalsContact O-N 3.12Å; E51-K54 PolarHBondContact O-N 3.05Å; E51-K54 IonicContact OE1-NZ 2.7Å; E51-K54 PolarHBondContact OE1-NZ 2.92Å; E51-K54 IonicContact OE2-NZ 3.15Å; Q52-K54 VanDerWaalsContact C-N 3.32Å; Q52-K54 PolarHBondContact O-N 3.34Å; K54-S58 PolarHBondContact O-N 3.34Å; K54-S58 VanDerWaalsContact O-N 3.09Å; K54-S58 PolarHBondContact O-OG 3.08Å; K54-E132 VanDerWaalsContact CE-OE1 3.31Å; K54-E132 WeakPolarHBondContact CE-OE1 3.49Å; K54-E132 IonicContact NZ-OE1 2.75Å; K54-E132 PolarHBondContact NZ-OE1 3.4Å; K54-T136 WeakPolarHBondContact CE-OG1 3.45Å; K54-T136 HydrophobicContact CG-CG2 3.47Å; K54-T136 VanDerWaalsContact CG-CG2 3.47Å
55K94.6Very high92.9Very high145 Ų14550.7 Ų50.763%0.6328%0.284SS*.Hα-helixtrans-66.4-45.4177.7-67.7173.3-174.7171.50110.9E51 Q52 V53 S58 A59E51-K55 PolarHBondContact O-N 3.04Å; Q52-K55 WeakPolarHBondContact O-CB 3.27Å; Q52-K55 PolarHBondContact O-N 3.13Å; Q52-K55 VanDerWaalsContact O-N 3.08Å; V53-K55 VanDerWaalsContact C-N 3.3Å; V53-K55 PolarHBondContact O-N 3.25Å; K55-S58 WeakPolarHBondContact O-CB 3.44Å; K55-S58 PolarHBondContact O-N 3.23Å; K55-A59 PolarHBondContact O-N 3.41Å
56Q93.4Very high92.2Very high32 Ų3247.5 Ų47.515%0.1527%0.271CS..Hα-helixtrans-65-44.4179-63.4-61.36.100112Q52 V53 S58 A59 I60 T70 E73 L74 L77Q52-Q56 WeakPolarHBondContact O-CG 3.37Å; Q52-Q56 PolarHBondContact O-N 2.99Å; V53-Q56 PolarHBondContact O-N 3.49Å; Q56-S58 VanDerWaalsContact C-N 3.26Å; Q56-S58 PolarHBondContact O-N 2.93Å; Q56-A59 PolarHBondContact O-N 2.88Å; Q56-A59 VanDerWaalsContact O-N 3.12Å; Q56-I60 WeakPolarHBondContact O-CB 3.43Å; Q56-I60 VanDerWaalsContact O-CG1 3.25Å; Q56-I60 WeakPolarHBondContact O-CG1 3.49Å; Q56-I60 PolarHBondContact O-N 3.46Å; Q56-T70 VanDerWaalsContact OE1-CG2 3.22Å; Q56-E73 PolarHBondContact NE2-OE2 2.96Å; Q56-L74 HydrophobicContact CB-CB 4.33Å; Q56-L74 HydrophobicContact CB-CD1 4.32Å; Q56-L77 HydrophobicContact CG-CD1 3.91Å
57H93.8Very high91.8Very high10 Ų1051.5 Ų51.55%0.04629%0.293CS..Hα-helixtrans-53.3-44171.3-79.3-23.3000112.7V53 I60 L61 Y140V53-H57 VanDerWaalsContact CG1-NE2 3.3Å; V53-H57 WeakPolarHBondContact CG1-NE2 3.49Å; V53-H57 WeakPolarHBondContact O-CB 3.35Å; V53-H57 PolarHBondContact O-CD2 2.99Å; V53-H57 PolarHBondContact O-N 3.5Å; H57-I60 PolarHBondContact O-N 3.27Å; H57-L61 WeakPolarHBondContact O-CB 3.44Å; H57-L61 WeakPolarHBondContact O-CG 3.42Å; H57-L61 PolarHBondContact O-N 3.37Å; H57-Y140 HydrophobicContact CB-CD2 3.34Å; H57-Y140 HydrophobicContact CB-CE2 3.56Å; H57-Y140 HydrophobicContact CB-CG 4.12Å; H57-Y140 AromaticContact CD2-CD2 3.91Å; H57-Y140 AromaticContact CD2-CG 3.78Å; H57-Y140 AromaticContact CE1-CD1 3.57Å; H57-Y140 AromaticContact CE1-CE1 3.92Å; H57-Y140 AromaticContact CE1-CG 3.64Å; H57-Y140 AromaticContact CG-CD2 3.27Å; H57-Y140 AromaticContact CG-CE2 3.62Å; H57-Y140 AromaticContact CG-CG 3.55Å; H57-Y140 AromaticContact ND1-CD1 3.62Å; H57-Y140 AromaticContact ND1-CD2 3.39Å; H57-Y140 WeakPolarHBondContact ND1-CD2 3.49Å; H57-Y140 AromaticContact ND1-CE1 3.7Å; H57-Y140 AromaticContact ND1-CE2 3.4Å; H57-Y140 WeakPolarHBondContact ND1-CE2 3.11Å; H57-Y140 AromaticContact ND1-CG 3.46Å; H57-Y140 AromaticContact ND1-CZ 3.59Å; H57-Y140 AromaticContact NE2-CG 3.84Å; H57-Y140 WeakPolarHBondContact O-CE2 3.29Å
58S92.8Very high91.4Very high79 Ų7954.8 Ų54.855%0.55230%0.302SS*.Hα-helixtrans-65.5-41.8177.6-58.50000112.2K54 K55 Q56 L61 A62K54-S58 PolarHBondContact O-N 3.34Å; K54-S58 VanDerWaalsContact O-N 3.09Å; K54-S58 PolarHBondContact O-OG 3.08Å; K55-S58 WeakPolarHBondContact O-CB 3.44Å; K55-S58 PolarHBondContact O-N 3.23Å; Q56-S58 VanDerWaalsContact C-N 3.26Å; Q56-S58 PolarHBondContact O-N 2.93Å; S58-L61 PolarHBondContact O-N 3.12Å; S58-A62 WeakPolarHBondContact O-CB 3.45Å; S58-A62 PolarHBondContact O-N 2.94Å
59A92.3Very high91Very high48 Ų4855.9 Ų55.940%0.39731%0.305SS..Hα-helixtrans-64.4-44.8176.900000111.9K55 Q56 L61 A62 T70K55-A59 PolarHBondContact O-N 3.41Å; Q56-A59 PolarHBondContact O-N 2.88Å; Q56-A59 VanDerWaalsContact O-N 3.12Å; A59-L61 VanDerWaalsContact C-N 3.32Å; A59-L61 PolarHBondContact O-N 3.35Å; A59-A62 WeakPolarHBondContact O-CB 3.45Å; A59-A62 PolarHBondContact O-N 3.18Å; A59-T70 HydrophobicContact CB-CG2 4.14Å
60I91.3Very high90.7Very high1 Ų156.3 Ų56.31%0.00531%0.308CS..Hα-helixtrans-63.6-38.6179.3-69.6170.1000111.1Q56 H57 P66 T70 L74 Y140 R197 E200Q56-I60 WeakPolarHBondContact O-CB 3.43Å; Q56-I60 VanDerWaalsContact O-CG1 3.25Å; Q56-I60 WeakPolarHBondContact O-CG1 3.49Å; Q56-I60 PolarHBondContact O-N 3.46Å; H57-I60 PolarHBondContact O-N 3.27Å; I60-P66 HydrophobicContact CB-CB 4.37Å; I60-P66 HydrophobicContact CG1-CB 4.32Å; I60-P66 HydrophobicContact CG2-CB 4.09Å; I60-P66 HydrophobicContact CG2-CG 3.75Å; I60-T70 HydrophobicContact CD1-CG2 4.12Å; I60-T70 HydrophobicContact CG1-CG2 3.48Å; I60-T70 VanDerWaalsContact CG1-CG2 3.48Å; I60-L74 HydrophobicContact CD1-CB 4.17Å; I60-L74 HydrophobicContact CD1-CD2 3.56Å; I60-L74 HydrophobicContact CD1-CG 4.48Å; I60-Y140 WeakPolarHBondContact CG2-OH 3.37Å; I60-R197 VanDerWaalsContact CG2-NH1 3.28Å; I60-R197 PolarHBondContact O-NH1 3.1Å; I60-R197 VanDerWaalsContact O-NH1 3.09Å; I60-R197 PolarHBondContact O-NH2 3.04Å; I60-E200 WeakPolarHBondContact CG2-OE1 3.4Å
61L90.3Very high90.4Very high22 Ų2258.1 Ų58.112%0.11532%0.316CS..Hα-helixtrans-72.8-26.5173.9-71.3166.6000112.4H57 S58 A59 A63 Y140 R143 R147H57-L61 WeakPolarHBondContact O-CB 3.44Å; H57-L61 WeakPolarHBondContact O-CG 3.42Å; H57-L61 PolarHBondContact O-N 3.37Å; S58-L61 PolarHBondContact O-N 3.12Å; A59-L61 VanDerWaalsContact C-N 3.32Å; A59-L61 PolarHBondContact O-N 3.35Å; L61-A63 VanDerWaalsContact C-N 3.26Å; L61-A63 PolarHBondContact O-N 3.44Å; L61-Y140 HydrophobicContact CD1-CD2 3.72Å; L61-Y140 HydrophobicContact CD1-CE2 3.65Å; L61-Y140 HydrophobicContact CD2-CE2 4.18Å; L61-Y140 HydrophobicContact CG-CD2 4.22Å; L61-Y140 HydrophobicContact CG-CE2 3.62Å; L61-R143 HydrophobicContact CD1-CB 3.72Å; L61-R143 HydrophobicContact CD1-CG 4.42Å; L61-R143 HydrophobicContact CD2-CB 4.37Å; L61-R147 HydrophobicContact CD2-CG 4.46Å; L61-R147 PolarHBondContact O-NE 3.41Å; L61-R147 PolarHBondContact O-NH2 2.93Å
62A90.3Very high90.2Very high81 Ų8158.3 Ų58.367%0.66932%0.316SS*.Hα-helixtrans-68.7-25-176.800000113.4S58 A59S58-A62 WeakPolarHBondContact O-CB 3.45Å; S58-A62 PolarHBondContact O-N 2.94Å; A59-A62 WeakPolarHBondContact O-CB 3.45Å; A59-A62 PolarHBondContact O-N 3.18Å
63A85.9Confident90Very high33 Ų3358.3 Ų58.327%0.27332%0.316SS..SBendtrans-109.6137.9-179.900000111.8L61 N65 R197L61-A63 VanDerWaalsContact C-N 3.26Å; L61-A63 PolarHBondContact O-N 3.44Å; A63-N65 VanDerWaalsContact C-N 3.27Å; A63-N65 PolarHBondContact O-N 3.33Å; A63-R197 PolarHBondContact O-NH2 3.49Å
64P78.6Confident89.9Confident57 Ų5759.4 Ų59.437%0.3732%0.322SS..SBendtrans-59-40.7171.4-2433.8000112.2
65N80Confident89.8Confident92 Ų9260.5 Ų60.549%0.49233%0.328SS..SBendtrans-120.193176.1-68.3-16.2000108.3A63 N192A63-N65 VanDerWaalsContact C-N 3.27Å; A63-N65 PolarHBondContact O-N 3.33Å; N65-N192 PolarHBondContact OD1-OD1 2.86Å
66P84.1Confident89.8Confident11 Ų1157.7 Ų57.77%0.07132%0.32CS..  trans-66.7144.5176.98.1-0.1000110.2I60 T196I60-P66 HydrophobicContact CB-CB 4.37Å; I60-P66 HydrophobicContact CG1-CB 4.32Å; I60-P66 HydrophobicContact CG2-CB 4.09Å; I60-P66 HydrophobicContact CG2-CG 3.75Å; P66-T196 HydrophobicContact CG-CG2 4.34Å
67D87.6Confident89.9Confident85 Ų8556.9 Ų56.946%0.45532%0.317SS..  trans-68.2148.9176.765.9-74.6000111.2K69 T70 K71D67-K69 PolarHBondContact O-N 2.96Å; D67-K69 WeakPolarHBondContact OD2-CB 3.37Å; D67-K69 PolarHBondContact OD2-N 3.29Å; D67-T70 PolarHBondContact O-N 3.3Å; D67-T70 WeakPolarHBondContact OD1-CB 3.39Å; D67-T70 PolarHBondContact OD1-OG1 3.18Å; D67-T70 PolarHBondContact OD2-N 3.08Å; D67-T70 PolarHBondContact OD2-OG1 2.92Å; D67-K71 PolarHBondContact O-N 3.48Å
68E88.8Confident89.8Confident123 Ų12358 Ų5858%0.57532%0.324SS*.Hα-helixtrans-65.5-26-175.6-159.761-163.900112.4K71 Q72E68-K71 PolarHBondContact O-N 2.65Å; E68-K71 IonicContact OE2-NZ 3.38Å; E68-Q72 WeakPolarHBondContact O-CB 3.44Å; E68-Q72 PolarHBondContact O-N 2.84Å
69K91Very high89.8Confident142 Ų14256.9 Ų56.962%0.61732%0.32SS*.Hα-helixtrans-67.1-47.7178179.2-173.2173.6-166.30110.9D67 K71 Q72 E73D67-K69 PolarHBondContact O-N 2.96Å; D67-K69 WeakPolarHBondContact OD2-CB 3.37Å; D67-K69 PolarHBondContact OD2-N 3.29Å; K69-K71 VanDerWaalsContact C-N 3.26Å; K69-K71 PolarHBondContact O-N 3.18Å; K69-Q72 PolarHBondContact O-N 3.22Å; K69-E73 WeakPolarHBondContact CE-OE1 3.46Å; K69-E73 IonicContact NZ-OE1 3.82Å; K69-E73 WeakPolarHBondContact O-CG 3.42Å; K69-E73 PolarHBondContact O-N 2.69Å
70T90.6Very high90Very high18 Ų1857.6 Ų57.611%0.1132%0.317CS..Hα-helixtrans-59-38.4175.3-58.30000111.8Q56 A59 I60 D67 L74Q56-T70 VanDerWaalsContact OE1-CG2 3.22Å; A59-T70 HydrophobicContact CB-CG2 4.14Å; I60-T70 HydrophobicContact CD1-CG2 4.12Å; I60-T70 HydrophobicContact CG1-CG2 3.48Å; I60-T70 VanDerWaalsContact CG1-CG2 3.48Å; D67-T70 PolarHBondContact O-N 3.3Å; D67-T70 WeakPolarHBondContact OD1-CB 3.39Å; D67-T70 PolarHBondContact OD1-OG1 3.18Å; D67-T70 PolarHBondContact OD2-N 3.08Å; D67-T70 PolarHBondContact OD2-OG1 2.92Å; T70-L74 PolarHBondContact O-N 3.31Å; T70-L74 VanDerWaalsContact O-N 3.14Å
71K89.1Confident90.1Very high41 Ų4157.5 Ų57.518%0.17832%0.317CS..Hα-helixtrans-65.9-44.7175-66.8179.5-174.5169.60112.1D67 E68 K69 E73 L74 E75D67-K71 PolarHBondContact O-N 3.48Å; E68-K71 PolarHBondContact O-N 2.65Å; E68-K71 IonicContact OE2-NZ 3.38Å; K69-K71 VanDerWaalsContact C-N 3.26Å; K69-K71 PolarHBondContact O-N 3.18Å; K71-E73 VanDerWaalsContact C-N 3.35Å; K71-L74 PolarHBondContact O-N 3.18Å; K71-E75 PolarHBondContact O-N 3.23Å
72Q92.1Very high90.3Very high87 Ų8760 Ų6041%0.40733%0.326SS..Hα-helixtrans-61.9-43.1176.8-173.262.956.700111.4E68 K69 L74 E75 D76E68-Q72 WeakPolarHBondContact O-CB 3.44Å; E68-Q72 PolarHBondContact O-N 2.84Å; K69-Q72 PolarHBondContact O-N 3.22Å; Q72-L74 VanDerWaalsContact C-N 3.28Å; Q72-L74 PolarHBondContact O-N 3.11Å; Q72-E75 PolarHBondContact O-N 2.93Å; Q72-E75 VanDerWaalsContact O-N 3.13Å; Q72-D76 PolarHBondContact NE2-OD1 3.13Å; Q72-D76 VanDerWaalsContact O-CG 3.24Å; Q72-D76 PolarHBondContact O-N 3.2Å
73E93.6Very high90.4Very high68 Ų6863.3 Ų63.332%0.31833%0.326SS..Hα-helixtrans-60-38.2176.5-73.4176.3-178.200111.9Q56 K69 K71 L77Q56-E73 PolarHBondContact NE2-OE2 2.96Å; K69-E73 WeakPolarHBondContact CE-OE1 3.46Å; K69-E73 IonicContact NZ-OE1 3.82Å; K69-E73 WeakPolarHBondContact O-CG 3.42Å; K69-E73 PolarHBondContact O-N 2.69Å; K71-E73 VanDerWaalsContact C-N 3.35Å; E73-L77 WeakPolarHBondContact O-CB 3.25Å; E73-L77 VanDerWaalsContact O-CG 3.27Å; E73-L77 WeakPolarHBondContact O-CG 3.42Å; E73-L77 PolarHBondContact O-N 3.48Å
74L93.6Very high90.9Very high23 Ų2362.3 Ų62.312%0.1232%0.316CS..Hα-helixtrans-66.4-40.4174.4176.863.9000112.4V53 Q56 I60 T70 K71 Q72 L77 T78V53-L74 HydrophobicContact CB-CD1 4.39Å; V53-L74 HydrophobicContact CG1-CD1 3.94Å; V53-L74 HydrophobicContact CG2-CD1 4.13Å; Q56-L74 HydrophobicContact CB-CB 4.33Å; Q56-L74 HydrophobicContact CB-CD1 4.32Å; I60-L74 HydrophobicContact CD1-CB 4.17Å; I60-L74 HydrophobicContact CD1-CD2 3.56Å; I60-L74 HydrophobicContact CD1-CG 4.48Å; T70-L74 PolarHBondContact O-N 3.31Å; T70-L74 VanDerWaalsContact O-N 3.14Å; K71-L74 PolarHBondContact O-N 3.18Å; Q72-L74 VanDerWaalsContact C-N 3.28Å; Q72-L74 PolarHBondContact O-N 3.11Å; L74-L77 PolarHBondContact O-N 3.42Å; L74-T78 WeakPolarHBondContact O-CB 3.41Å; L74-T78 PolarHBondContact O-N 2.9Å; L74-T78 PolarHBondContact O-OG1 3.31Å
75E91.9Very high91.6Very high72 Ų7259.6 Ų59.634%0.33630%0.299SS..Hα-helixtrans-64.7-43176.4-72.1-178.6-17100111.6K71 Q72 T78 A79 K203K71-E75 PolarHBondContact O-N 3.23Å; Q72-E75 PolarHBondContact O-N 2.93Å; Q72-E75 VanDerWaalsContact O-N 3.13Å; E75-T78 WeakPolarHBondContact O-CB 3.27Å; E75-T78 PolarHBondContact O-N 3.43Å; E75-A79 PolarHBondContact O-N 3.41Å; E75-K203 WeakPolarHBondContact OE1-CE 3.01Å; E75-K203 IonicContact OE1-NZ 3.2Å; E75-K203 PolarHBondContact OE1-NZ 3.17Å
76D94.8Very high92.2Very high86 Ų8657.3 Ų57.346%0.4629%0.287SS..Hα-helixtrans-62.1-46.2176.8-66.5-13000110.6Q72 T78 A79 D80Q72-D76 PolarHBondContact NE2-OD1 3.13Å; Q72-D76 VanDerWaalsContact O-CG 3.24Å; Q72-D76 PolarHBondContact O-N 3.2Å; D76-T78 VanDerWaalsContact C-N 3.32Å; D76-T78 PolarHBondContact O-N 2.89Å; D76-A79 PolarHBondContact O-N 3.36Å; D76-D80 WeakPolarHBondContact O-CB 3.44Å; D76-D80 PolarHBondContact O-N 3.49Å
77L95.1Very high92.7Very high16 Ų1661 Ų618%0.08430%0.301CS..Hα-helixtrans-59.5-41.8174.4-76.2169.6000112.1D49 Q52 V53 Q56 E73 L74 A79 D80 I81D49-L77 HydrophobicContact CB-CD2 4.41Å; Q52-L77 HydrophobicContact CB-CD1 3.77Å; Q52-L77 HydrophobicContact CB-CD2 4.01Å; V53-L77 HydrophobicContact CG2-CB 3.85Å; V53-L77 HydrophobicContact CG2-CD1 4.19Å; Q56-L77 HydrophobicContact CG-CD1 3.91Å; E73-L77 WeakPolarHBondContact O-CB 3.25Å; E73-L77 VanDerWaalsContact O-CG 3.27Å; E73-L77 WeakPolarHBondContact O-CG 3.42Å; E73-L77 PolarHBondContact O-N 3.48Å; L74-L77 PolarHBondContact O-N 3.42Å; L77-A79 VanDerWaalsContact C-N 3.35Å; L77-A79 PolarHBondContact O-N 3.25Å; L77-D80 PolarHBondContact O-N 3.23Å; L77-I81 WeakPolarHBondContact O-CB 3.48Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.29Å; L77-I81 PolarHBondContact O-N 2.89Å
78T92.6Very high93.1Very high32 Ų3256.9 Ų56.920%0.19628%0.28CS..Hα-helixtrans-63.2-42.8178.1-59.70000111.2L74 E75 D76 K82 S207L74-T78 WeakPolarHBondContact O-CB 3.41Å; L74-T78 PolarHBondContact O-N 2.9Å; L74-T78 PolarHBondContact O-OG1 3.31Å; E75-T78 WeakPolarHBondContact O-CB 3.27Å; E75-T78 PolarHBondContact O-N 3.43Å; D76-T78 VanDerWaalsContact C-N 3.32Å; D76-T78 PolarHBondContact O-N 2.89Å; T78-K82 WeakPolarHBondContact O-CB 3.46Å; T78-K82 PolarHBondContact O-N 2.77Å; T78-S207 WeakPolarHBondContact CG2-OG 3.13Å
79A93.1Very high93.2Very high57 Ų5754 Ų5447%0.47126%0.263SS..Hα-helixtrans-65.2-40.4176.100000111.9E75 D76 L77 K82 K83E75-A79 PolarHBondContact O-N 3.41Å; D76-A79 PolarHBondContact O-N 3.36Å; L77-A79 VanDerWaalsContact C-N 3.35Å; L77-A79 PolarHBondContact O-N 3.25Å; A79-K82 PolarHBondContact O-N 2.94Å; A79-K83 WeakPolarHBondContact O-CB 3.41Å; A79-K83 PolarHBondContact O-N 3.44Å
80D95.3Very high93.3Very high62 Ų6250.8 Ų50.833%0.33226%0.259SS..Hα-helixtrans-66.3-42.2177.8-103.823.2000112.5K45 D76 L77 K83 T84K45-D80 IonicContact NZ-OD2 3.14Å; K45-D80 PolarHBondContact NZ-OD2 3.25Å; D76-D80 WeakPolarHBondContact O-CB 3.44Å; D76-D80 PolarHBondContact O-N 3.49Å; L77-D80 PolarHBondContact O-N 3.23Å; D80-K83 PolarHBondContact O-N 3.22Å; D80-T84 WeakPolarHBondContact O-CB 3.43Å; D80-T84 PolarHBondContact O-N 3.36Å; D80-T84 PolarHBondContact O-OG1 3.03Å
81I94.8Very high93.5Very high0 Ų052.2 Ų52.20%026%0.264CS..Hα-helixtrans-59.1-50.6172.5-73.2170.2000109.6L46 D49 V50 V53 L77 K83 T84 A85 Y133L46-I81 HydrophobicContact CD2-CB 4.23Å; L46-I81 HydrophobicContact CD2-CG1 4.34Å; L46-I81 HydrophobicContact CD2-CG2 3.96Å; L46-I81 WeakPolarHBondContact CD2-O 3.46Å; D49-I81 HydrophobicContact CB-CD1 3.92Å; D49-I81 HydrophobicContact CB-CG1 3.53Å; V50-I81 HydrophobicContact CG2-CD1 4.28Å; V53-I81 HydrophobicContact CG2-CD1 3.73Å; L77-I81 WeakPolarHBondContact O-CB 3.48Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.29Å; L77-I81 PolarHBondContact O-N 2.89Å; I81-K83 VanDerWaalsContact C-N 3.33Å; I81-K83 PolarHBondContact O-N 2.99Å; I81-T84 PolarHBondContact O-N 3.06Å; I81-A85 WeakPolarHBondContact O-CB 3.37Å; I81-A85 PolarHBondContact O-N 2.88Å; I81-Y133 HydrophobicContact CD1-CD2 3.82Å; I81-Y133 HydrophobicContact CD1-CE2 3.44Å; I81-Y133 VanDerWaalsContact CD1-CE2 3.44Å; I81-Y133 HydrophobicContact CG2-CD1 4.48Å; I81-Y133 HydrophobicContact CG2-CD2 4.44Å; I81-Y133 HydrophobicContact CG2-CE1 4.35Å; I81-Y133 HydrophobicContact CG2-CE2 4.25Å
82K92.5Very high93.6Very high73 Ų7350.3 Ų50.332%0.31726%0.255SS..Hα-helixtrans-57.6-45.3178.7-179.5-179.4-178.6178.10112T78 A79 N86 E210 L211T78-K82 WeakPolarHBondContact O-CB 3.46Å; T78-K82 PolarHBondContact O-N 2.77Å; A79-K82 PolarHBondContact O-N 2.94Å; K82-N86 WeakPolarHBondContact O-CB 3.47Å; K82-N86 PolarHBondContact O-N 3.24Å; K82-N86 PolarHBondContact O-ND2 3.49Å; K82-E210 WeakPolarHBondContact CE-OE2 3.2Å; K82-E210 IonicContact NZ-OE1 3.74Å; K82-E210 PolarHBondContact NZ-OE1 2.95Å; K82-E210 IonicContact NZ-OE2 3.8Å; K82-E210 PolarHBondContact NZ-OE2 3.49Å; K82-L211 HydrophobicContact CG-CD2 4.48Å
83K94.3Very high93.5Very high152 Ų15251 Ų5166%0.66126%0.257SS*.Hα-helixtrans-64.2-48.2179.6-178.3-179.2176.8-176.10111.4A79 D80 I81 N86 K87A79-K83 WeakPolarHBondContact O-CB 3.41Å; A79-K83 PolarHBondContact O-N 3.44Å; D80-K83 PolarHBondContact O-N 3.22Å; I81-K83 VanDerWaalsContact C-N 3.33Å; I81-K83 PolarHBondContact O-N 2.99Å; K83-N86 PolarHBondContact O-N 3.42Å; K83-K87 PolarHBondContact O-N 3.23Å
84T95.9Very high93.5Very high12 Ų1250.2 Ų50.27%0.07426%0.262CS..Hα-helixtrans-67.9-41-177.5-51.90000111C42 L46 D80 I81 N86 K87 V88C42-T84 HydrophobicContact CB-CG2 3.81Å; C42-T84 WeakPolarHBondContact O-CG2 3.47Å; L46-T84 HydrophobicContact CD1-CG2 4.19Å; L46-T84 HydrophobicContact CD2-CG2 4.12Å; L46-T84 HydrophobicContact CG-CG2 3.71Å; D80-T84 WeakPolarHBondContact O-CB 3.43Å; D80-T84 PolarHBondContact O-N 3.36Å; D80-T84 PolarHBondContact O-OG1 3.03Å; I81-T84 PolarHBondContact O-N 3.06Å; T84-N86 PolarHBondContact O-N 3.38Å; T84-K87 WeakPolarHBondContact O-CB 3.49Å; T84-K87 PolarHBondContact O-N 3.18Å; T84-V88 WeakPolarHBondContact O-CG2 3.15Å; T84-V88 PolarHBondContact O-N 2.88Å
85A93.6Very high93.3Very high0 Ų049.2 Ų49.20%026%0.257CS..Hα-helixtrans-64.4-40.317700000112.3L46 I81 K87 V88 R89 F126 M130 M214L46-A85 HydrophobicContact CD1-CB 4.23Å; L46-A85 HydrophobicContact CD2-CB 4.16Å; I81-A85 WeakPolarHBondContact O-CB 3.37Å; I81-A85 PolarHBondContact O-N 2.88Å; A85-K87 VanDerWaalsContact C-N 3.33Å; A85-K87 PolarHBondContact O-N 3.09Å; A85-V88 PolarHBondContact O-N 3.17Å; A85-R89 WeakPolarHBondContact O-CB 3.34Å; A85-R89 PolarHBondContact O-N 3.42Å; A85-F126 HydrophobicContact CB-CE2 3.96Å; A85-F126 HydrophobicContact CB-CZ 4Å; A85-M130 HydrophobicContact CB-CE 4.14Å; A85-M130 HydrophobicContact CB-SD 3.88Å; A85-M214 HydrophobicContact CB-CE 3.69Å; A85-M214 HydrophobicContact CB-SD 3.58Å; A85-M214 VanDerWaalsContact CB-SD 3.58Å
86N92.6Very high93.2Very high44 Ų4447.9 Ų47.924%0.23525%0.25CS..Hα-helixtrans-65-35.8173-82.5-59.3000113K82 K83 T84 R89 S90K82-N86 WeakPolarHBondContact O-CB 3.47Å; K82-N86 PolarHBondContact O-N 3.24Å; K82-N86 PolarHBondContact O-ND2 3.49Å; K83-N86 PolarHBondContact O-N 3.42Å; T84-N86 PolarHBondContact O-N 3.38Å; N86-R89 PolarHBondContact OD1-NH2 3.47Å; N86-S90 WeakPolarHBondContact O-CB 3.38Å; N86-S90 PolarHBondContact O-N 3.32Å; N86-S90 PolarHBondContact O-OG 3.06Å
87K94.6Very high93Very high87 Ų8749.1 Ų49.138%0.37825%0.254SS..Hα-helixtrans-63.5-47.4174.3-174-176.2177.5-167.20111.1E38 K83 T84 A85 S90 K91E38-K87 WeakPolarHBondContact OE1-CE 3.46Å; E38-K87 IonicContact OE1-NZ 2.63Å; E38-K87 PolarHBondContact OE1-NZ 2.98Å; K83-K87 PolarHBondContact O-N 3.23Å; T84-K87 WeakPolarHBondContact O-CB 3.49Å; T84-K87 PolarHBondContact O-N 3.18Å; A85-K87 VanDerWaalsContact C-N 3.33Å; A85-K87 PolarHBondContact O-N 3.09Å; K87-S90 PolarHBondContact O-N 3.15Å; K87-K91 HydrophobicContact CG-CD 4.47Å; K87-K91 PolarHBondContact O-N 3.23Å; K87-K91 VanDerWaalsContact O-N 3.1Å
88V94.5Very high92.6Very high0 Ų050 Ų500%026%0.261CS..Hα-helixtrans-59.6-50.5175.9171.90000110.7I39 C42 I43 L46 T84 A85 S90 K91 L92 F126I39-V88 HydrophobicContact CG2-CG1 4.08Å; C42-V88 HydrophobicContact CB-CG2 3.43Å; C42-V88 VanDerWaalsContact CB-CG2 3.43Å; I43-V88 HydrophobicContact CD1-CG1 4.37Å; I43-V88 HydrophobicContact CG1-CG1 4.11Å; I43-V88 HydrophobicContact CG1-CG2 4.17Å; L46-V88 HydrophobicContact CD1-CG2 4.2Å; T84-V88 WeakPolarHBondContact O-CG2 3.15Å; T84-V88 PolarHBondContact O-N 2.88Å; A85-V88 PolarHBondContact O-N 3.17Å; V88-S90 VanDerWaalsContact C-N 3.32Å; V88-S90 PolarHBondContact O-N 2.86Å; V88-K91 PolarHBondContact O-N 3.34Å; V88-L92 HydrophobicContact CG1-CD1 3.82Å; V88-L92 HydrophobicContact CG1-CG 4.24Å; V88-L92 WeakPolarHBondContact O-CG 3.44Å; V88-L92 PolarHBondContact O-N 3.08Å; V88-F126 HydrophobicContact CB-CD2 4.09Å; V88-F126 HydrophobicContact CB-CE2 3.93Å; V88-F126 HydrophobicContact CB-CZ 4.24Å; V88-F126 HydrophobicContact CG1-CB 4.09Å; V88-F126 HydrophobicContact CG1-CD1 3.93Å; V88-F126 HydrophobicContact CG1-CD2 3.5Å; V88-F126 HydrophobicContact CG1-CE1 4.2Å; V88-F126 HydrophobicContact CG1-CE2 3.81Å; V88-F126 HydrophobicContact CG1-CG 3.56Å; V88-F126 HydrophobicContact CG1-CZ 4.13Å
89R92Very high92.3Very high62 Ų6249 Ų4923%0.23425%0.254CS..Hα-helixtrans-53.5-48.4177178.1174.864.6155.2-4.9112.1A85 N86 K91 L92 K93 D217 M218A85-R89 WeakPolarHBondContact O-CB 3.34Å; A85-R89 PolarHBondContact O-N 3.42Å; N86-R89 PolarHBondContact OD1-NH2 3.47Å; R89-K91 VanDerWaalsContact C-N 3.33Å; R89-K91 PolarHBondContact O-N 2.95Å; R89-L92 PolarHBondContact O-N 2.88Å; R89-K93 WeakPolarHBondContact O-CB 3.49Å; R89-K93 PolarHBondContact O-N 3.05Å; R89-D217 IonicContact CZ-OD2 3.7Å; R89-D217 IonicContact NH1-OD2 3.1Å; R89-D217 PolarHBondContact NH1-OD2 3.2Å; R89-M218 HydrophobicContact CG-CE 3.94Å
90S92.8Very high92Very high75 Ų7551.8 Ų51.852%0.52426%0.257SS..Hα-helixtrans-63.6-39.9-177.5-56.40000112N86 K87 V88 A94N86-S90 WeakPolarHBondContact O-CB 3.38Å; N86-S90 PolarHBondContact O-N 3.32Å; N86-S90 PolarHBondContact O-OG 3.06Å; K87-S90 PolarHBondContact O-N 3.15Å; V88-S90 VanDerWaalsContact C-N 3.32Å; V88-S90 PolarHBondContact O-N 2.86Å; S90-A94 PolarHBondContact O-N 3.39Å; S90-A94 VanDerWaalsContact O-N 3.08Å
91K94Very high91.6Very high48 Ų4855.7 Ų55.721%0.20927%0.274CS..Hα-helixtrans-71-42177.8-75.5178165.3-82.30112.8E38 I39 K87 V88 R89 K93 A94 I95E38-K91 WeakPolarHBondContact OE1-CE 3.22Å; E38-K91 IonicContact OE1-NZ 3.65Å; E38-K91 PolarHBondContact OE1-NZ 2.86Å; E38-K91 VanDerWaalsContact OE2-CE 3.29Å; E38-K91 WeakPolarHBondContact OE2-CE 3.48Å; E38-K91 IonicContact OE2-NZ 2.67Å; E38-K91 PolarHBondContact OE2-NZ 2.83Å; I39-K91 HydrophobicContact CD1-CB 3.8Å; I39-K91 HydrophobicContact CG1-CB 3.71Å; I39-K91 HydrophobicContact CG1-CD 3.82Å; I39-K91 HydrophobicContact CG1-CG 4.42Å; K87-K91 HydrophobicContact CG-CD 4.47Å; K87-K91 PolarHBondContact O-N 3.23Å; K87-K91 VanDerWaalsContact O-N 3.1Å; V88-K91 PolarHBondContact O-N 3.34Å; R89-K91 VanDerWaalsContact C-N 3.33Å; R89-K91 PolarHBondContact O-N 2.95Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 2.94Å; K91-A94 WeakPolarHBondContact O-CB 3.43Å; K91-A94 PolarHBondContact O-N 3.3Å; K91-I95 WeakPolarHBondContact O-CG1 3.3Å; K91-I95 PolarHBondContact O-N 3.05Å
92L92.3Very high90.8Very high0 Ų057.3 Ų57.30%028%0.281CS..Hα-helixtrans-58.7-46.4174.2-74.8175.3000110.8I39 V88 R89 A94 I95 E96 H119 L122 F126I39-L92 HydrophobicContact CD1-CD2 4.35Å; I39-L92 HydrophobicContact CG2-CD2 4.42Å; V88-L92 HydrophobicContact CG1-CD1 3.82Å; V88-L92 HydrophobicContact CG1-CG 4.24Å; V88-L92 WeakPolarHBondContact O-CG 3.44Å; V88-L92 PolarHBondContact O-N 3.08Å; R89-L92 PolarHBondContact O-N 2.88Å; L92-A94 VanDerWaalsContact C-N 3.3Å; L92-A94 PolarHBondContact O-N 2.91Å; L92-I95 WeakPolarHBondContact O-CB 3.31Å; L92-I95 PolarHBondContact O-N 2.94Å; L92-I95 VanDerWaalsContact O-N 3.1Å; L92-E96 PolarHBondContact O-N 3.42Å; L92-H119 PolarHBondContact O-CD2 3.03Å; L92-H119 PolarHBondContact O-NE2 3.02Å; L92-L122 HydrophobicContact CD2-CB 3.83Å; L92-F126 HydrophobicContact CD1-CB 4.33Å; L92-F126 HydrophobicContact CD1-CD1 4.01Å; L92-F126 HydrophobicContact CD1-CG 4.42Å
93K90.6Very high90.2Very high102 Ų10257.8 Ų57.844%0.44329%0.285SS..Hα-helixtrans-62.1-34.4176.6-168166.5-171.5163.70113.4R89 K91 E96 Q97R89-K93 WeakPolarHBondContact O-CB 3.49Å; R89-K93 PolarHBondContact O-N 3.05Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 2.94Å; K93-E96 PolarHBondContact O-N 3.33Å; K93-Q97 WeakPolarHBondContact O-CG 3.34Å; K93-Q97 PolarHBondContact O-N 3.37Å
94A92.2Very high89.2Confident51 Ų5153.7 Ų53.742%0.42129%0.285SS..Hα-helixtrans-66.9-40.1174.100000111.9S90 K91 L92 S98S90-A94 PolarHBondContact O-N 3.39Å; S90-A94 VanDerWaalsContact O-N 3.08Å; K91-A94 WeakPolarHBondContact O-CB 3.43Å; K91-A94 PolarHBondContact O-N 3.3Å; L92-A94 VanDerWaalsContact C-N 3.3Å; L92-A94 PolarHBondContact O-N 2.91Å; A94-S98 PolarHBondContact O-N 3.28Å; A94-S98 VanDerWaalsContact O-N 3.08Å
95I90.8Very high88.2Confident2 Ų258.3 Ų58.31%0.0131%0.309CS..Hα-helixtrans-65.8-42.8174.7-66.3171.5000110.5F32 I39 K91 L92 Q97 S98 I99 H119F32-I95 HydrophobicContact CE2-CD1 4.14Å; F32-I95 HydrophobicContact CE2-CG1 4.31Å; F32-I95 HydrophobicContact CE2-CG2 4.02Å; I39-I95 HydrophobicContact CD1-CD1 3.43Å; I39-I95 VanDerWaalsContact CD1-CD1 3.43Å; K91-I95 WeakPolarHBondContact O-CG1 3.3Å; K91-I95 PolarHBondContact O-N 3.05Å; L92-I95 WeakPolarHBondContact O-CB 3.31Å; L92-I95 PolarHBondContact O-N 2.94Å; L92-I95 VanDerWaalsContact O-N 3.1Å; I95-Q97 PolarHBondContact O-N 3.47Å; I95-S98 WeakPolarHBondContact O-CB 3.01Å; I95-S98 PolarHBondContact O-N 3.05Å; I95-I99 HydrophobicContact CG2-CD1 3.87Å; I95-I99 HydrophobicContact CG2-CG1 4.44Å; I95-I99 WeakPolarHBondContact O-CG1 3.32Å; I95-I99 PolarHBondContact O-N 3.38Å; I95-H119 HydrophobicContact CG2-CB 3.86Å
96E88.9Confident86.6Confident44 Ų4465.9 Ų65.921%0.20635%0.349CS..Hα-helixtrans-55.7-50.8175.2-176.8-178.2-155.200111.7L92 K93 S98 I99 E100 L221L92-E96 PolarHBondContact O-N 3.42Å; K93-E96 PolarHBondContact O-N 3.33Å; E96-S98 VanDerWaalsContact C-N 3.28Å; E96-S98 PolarHBondContact O-N 3.18Å; E96-I99 WeakPolarHBondContact O-CB 3.49Å; E96-I99 PolarHBondContact O-N 2.68Å; E96-E100 PolarHBondContact O-N 3.01Å; E96-L221 VanDerWaalsContact CD-CD2 3.41Å; E96-L221 WeakPolarHBondContact OE1-CD2 3.37Å; E96-L221 WeakPolarHBondContact OE2-CD2 3.48Å
97Q89.9Confident85.1Confident113 Ų11371.5 Ų71.553%0.52837%0.367SS..Hα-helixtrans-60.1-38176.9-72.4176.1-2.100112.6K93 I95 I99 E100 Q101K93-Q97 WeakPolarHBondContact O-CG 3.34Å; K93-Q97 PolarHBondContact O-N 3.37Å; I95-Q97 PolarHBondContact O-N 3.47Å; Q97-I99 VanDerWaalsContact C-N 3.33Å; Q97-E100 PolarHBondContact O-N 2.93Å; Q97-Q101 WeakPolarHBondContact O-CB 3.37Å; Q97-Q101 PolarHBondContact O-N 3.21Å
98S87.8Confident83.6Confident33 Ų3370.3 Ų70.323%0.23137%0.37CS..Hα-helixtrans-63.7-38.7174.3179.80000111.9A94 I95 E96 E102A94-S98 PolarHBondContact O-N 3.28Å; A94-S98 VanDerWaalsContact O-N 3.08Å; I95-S98 WeakPolarHBondContact O-CB 3.01Å; I95-S98 PolarHBondContact O-N 3.05Å; E96-S98 VanDerWaalsContact C-N 3.28Å; E96-S98 PolarHBondContact O-N 3.18Å; S98-E102 WeakPolarHBondContact O-CG 3.43Å; S98-E102 PolarHBondContact O-N 3.29Å
99I86.4Confident82.6Confident13 Ų1371.8 Ų71.87%0.06738%0.38CS..Hα-helixtrans-65.6-50176.7-70.3162.5000110.1I95 E96 Q97 Q101 E102 E103 L112 R115 K116 H119I95-I99 HydrophobicContact CG2-CD1 3.87Å; I95-I99 HydrophobicContact CG2-CG1 4.44Å; I95-I99 WeakPolarHBondContact O-CG1 3.32Å; I95-I99 PolarHBondContact O-N 3.38Å; E96-I99 WeakPolarHBondContact O-CB 3.49Å; E96-I99 PolarHBondContact O-N 2.68Å; Q97-I99 VanDerWaalsContact C-N 3.33Å; I99-Q101 VanDerWaalsContact C-N 3.29Å; I99-Q101 PolarHBondContact O-N 2.85Å; I99-E102 PolarHBondContact O-N 2.97Å; I99-E102 VanDerWaalsContact O-N 3.15Å; I99-E103 HydrophobicContact CG2-CG 4.48Å; I99-E103 WeakPolarHBondContact O-CG 3.37Å; I99-E103 PolarHBondContact O-N 3.32Å; I99-L112 HydrophobicContact CB-CD1 4.41Å; I99-L112 HydrophobicContact CG2-CD1 3.96Å; I99-R115 HydrophobicContact CD1-CB 4.2Å; I99-R115 HydrophobicContact CG1-CB 3.84Å; I99-K116 HydrophobicContact CD1-CG 4.15Å; I99-K116 HydrophobicContact CG1-CG 4.34Å; I99-K116 HydrophobicContact CG2-CD 4.34Å; I99-K116 HydrophobicContact CG2-CG 3.66Å; I99-H119 HydrophobicContact CD1-CB 3.79Å
100E86.6Confident81.8Confident114 Ų11471.3 Ų71.353%0.53339%0.39SS..Hα-helixtrans-59.1-40.3179.7-69.1179.9162.100112E96 Q97 E103 G104E96-E100 PolarHBondContact O-N 3.01Å; Q97-E100 PolarHBondContact O-N 2.93Å; E100-E103 PolarHBondContact O-N 2.67Å; E100-G104 PolarHBondContact O-N 2.84Å; E100-G104 VanDerWaalsContact O-N 3.11Å
101Q85.9Confident81.2Confident144 Ų14469.5 Ų69.567%0.67337%0.374SS*.Hα-helixtrans-63.7-41177.1-173.2178.716.800112.2Q97 I99Q97-Q101 WeakPolarHBondContact O-CB 3.37Å; Q97-Q101 PolarHBondContact O-N 3.21Å; I99-Q101 VanDerWaalsContact C-N 3.29Å; I99-Q101 PolarHBondContact O-N 2.85Å
102E79.8Confident80.7Confident34 Ų3467.6 Ų67.616%0.15937%0.366CS..Hα-helixtrans-71.8-34.6178.3-77.5-172.8-151.700113S98 I99 L105 L112 R115S98-E102 WeakPolarHBondContact O-CG 3.43Å; S98-E102 PolarHBondContact O-N 3.29Å; I99-E102 PolarHBondContact O-N 2.97Å; I99-E102 VanDerWaalsContact O-N 3.15Å; E102-L105 PolarHBondContact O-N 3.48Å; E102-L112 HydrophobicContact CB-CD1 3.9Å; E102-R115 IonicContact OE1-CZ 2.75Å; E102-R115 IonicContact OE1-NE 2.96Å; E102-R115 PolarHBondContact OE1-NE 3.28Å
103E78.5Confident80.1Confident84 Ų8470.1 Ų70.139%0.39338%0.376SS..Hα-helixtrans-63-42.2173.4-75.4-172.3137.400112.4I99 E100 L105 N106 L112 K116I99-E103 HydrophobicContact CG2-CG 4.48Å; I99-E103 WeakPolarHBondContact O-CG 3.37Å; I99-E103 PolarHBondContact O-N 3.32Å; E100-E103 PolarHBondContact O-N 2.67Å; E103-L105 PolarHBondContact O-N 2.92Å; E103-N106 PolarHBondContact O-N 3.35Å; E103-L112 HydrophobicContact CG-CD1 4.36Å; E103-L112 HydrophobicContact CG-CD2 3.97Å; E103-K116 WeakPolarHBondContact OE1-CE 3.41Å; E103-K116 IonicContact OE1-NZ 3.72Å; E103-K116 PolarHBondContact OE1-NZ 3.37Å
104G73.9Confident79.8Confident65 Ų6567.5 Ų67.567%0.6737%0.366SS*.THydrogen-bonded Turntrans-59.5-19.6176.300000113.9E100E100-G104 PolarHBondContact O-N 2.84Å; E100-G104 VanDerWaalsContact O-N 3.11Å
105L74.6Confident79.6Confident109 Ų10967 Ų6757%0.57135%0.353SS*.THydrogen-bonded Turntrans-92.75.6176.7-62.1172.8000113.4E102 E103 R107E102-L105 PolarHBondContact O-N 3.48Å; E103-L105 PolarHBondContact O-N 2.92Å; L105-R107 HydrophobicContact CB-CG 4.29Å; L105-R107 PolarHBondContact O-N 3.38Å
106N60.6Low79.4Confident159 Ų15970.5 Ų70.585%0.8537%0.368SS*.THydrogen-bonded Turntrans53.429.4-176.3-83.1-45.1000113.9E103 S108E103-N106 PolarHBondContact O-N 3.35Å; N106-S108 PolarHBondContact O-N 3.36Å
107R60.8Low79.1Confident163 Ų16370.5 Ų70.562%0.61537%0.371SS*.  trans-88.183.4176.2-74-176.6170.5175.8-2.2109.8L105 S109 L112L105-R107 HydrophobicContact CB-CG 4.29Å; L105-R107 PolarHBondContact O-N 3.38Å; R107-S109 PolarHBondContact O-N 3.38Å; R107-L112 WeakPolarHBondContact O-CD2 3.44Å
108S62.9Low79.1Confident61 Ų6168 Ų6843%0.42736%0.36SS..  trans-72.249.2173.2-165.10000113N106 Y242N106-S108 PolarHBondContact O-N 3.36Å; S108-Y242 WeakPolarHBondContact O-CE2 3.44Å; S108-Y242 PolarHBondContact O-OH 3.15Å
109S73.3Confident79.2Confident31 Ų3166.8 Ų66.822%0.21735%0.35CS..  trans-79.7164.4-16973.20000113.5R107 D111 L112 R113R107-S109 PolarHBondContact O-N 3.38Å; S109-D111 PolarHBondContact O-N 3.34Å; S109-D111 WeakPolarHBondContact OG-CB 3.29Å; S109-D111 PolarHBondContact OG-N 3.49Å; S109-L112 PolarHBondContact O-N 2.8Å; S109-L112 PolarHBondContact OG-N 3.13Å; S109-L112 VanDerWaalsContact OG-N 3.11Å; S109-R113 PolarHBondContact O-N 2.86Å
110A74.9Confident79.2Confident53 Ų5366.3 Ų66.344%0.43835%0.349SS..Hα-helixtrans-57.8-35.4168.700000111.9R113 I114A110-R113 PolarHBondContact O-N 3.04Å; A110-I114 VanDerWaalsContact O-CG1 3.29Å; A110-I114 WeakPolarHBondContact O-CG1 3.48Å; A110-I114 PolarHBondContact O-N 3.14Å
111D81.1Confident79.3Confident36 Ų3664.4 Ų64.419%0.19335%0.345CS..Hα-helixtrans-59.9-51.4175.5-176.6102.7000111.5M29 S109 R113 I114 R115M29-D111 HydrophobicContact CE-CB 4.48Å; M29-D111 VanDerWaalsContact CE-OD1 3.31Å; M29-D111 WeakPolarHBondContact CE-OD1 3.36Å; M29-D111 WeakPolarHBondContact CG-OD1 3.44Å; M29-D111 HydrophobicContact SD-CB 4.28Å; S109-D111 PolarHBondContact O-N 3.34Å; S109-D111 WeakPolarHBondContact OG-CB 3.29Å; S109-D111 PolarHBondContact OG-N 3.49Å; D111-R113 VanDerWaalsContact C-N 3.28Å; D111-R113 PolarHBondContact O-N 2.97Å; D111-I114 WeakPolarHBondContact O-CB 3.26Å; D111-I114 PolarHBondContact O-N 3.49Å; D111-I114 VanDerWaalsContact O-N 3.09Å; D111-R115 WeakPolarHBondContact O-CG 3.39Å; D111-R115 PolarHBondContact O-N 3.03Å; D111-R115 IonicContact OD1-NH2 2.8Å; D111-R115 IonicContact OD2-CZ 3.96Å; D111-R115 IonicContact OD2-NE 2.67Å; D111-R115 PolarHBondContact OD2-NE 3.46Å; D111-R115 IonicContact OD2-NH2 3Å
112L82.4Confident79.6Confident9 Ų958.1 Ų58.15%0.04732%0.315CS..Hα-helixtrans-58-40.3177.9-179.660.9000112.3I99 E102 E103 R107 S109 R115 K116I99-L112 HydrophobicContact CB-CD1 4.41Å; I99-L112 HydrophobicContact CG2-CD1 3.96Å; E102-L112 HydrophobicContact CB-CD1 3.9Å; E103-L112 HydrophobicContact CG-CD1 4.36Å; E103-L112 HydrophobicContact CG-CD2 3.97Å; R107-L112 WeakPolarHBondContact O-CD2 3.44Å; S109-L112 PolarHBondContact O-N 2.8Å; S109-L112 PolarHBondContact OG-N 3.13Å; S109-L112 VanDerWaalsContact OG-N 3.11Å; L112-R115 PolarHBondContact O-N 2.82Å; L112-K116 HydrophobicContact CG-CD 4.43Å; L112-K116 WeakPolarHBondContact O-CG 3.47Å; L112-K116 PolarHBondContact O-N 3Å
113R80.2Confident80.1Confident52 Ų5256.6 Ų56.620%0.19631%0.309CS..Hα-helixtrans-68.1-38.4178.1-68.4-174.5-64.1174.54.4112.5S109 A110 D111 T117 N235 S239S109-R113 PolarHBondContact O-N 2.86Å; A110-R113 PolarHBondContact O-N 3.04Å; D111-R113 VanDerWaalsContact C-N 3.28Å; D111-R113 PolarHBondContact O-N 2.97Å; R113-T117 WeakPolarHBondContact O-CB 3.33Å; R113-T117 PolarHBondContact O-N 3.31Å; R113-T117 PolarHBondContact O-OG1 2.89Å; R113-N235 PolarHBondContact NH1-O 3.41Å; R113-N235 VanDerWaalsContact NH1-O 3.1Å; R113-S239 VanDerWaalsContact NH1-N 3.13Å; R113-S239 PolarHBondContact NH1-OG 2.87Å; R113-S239 PolarHBondContact NH2-OG 3.44Å
114I84.3Confident80.5Confident48 Ų4858.9 Ų58.925%0.24631%0.314CS..Hα-helixtrans-62.4-48.1173.6-69.1164.5000109.4F28 M29 F32 F33 A110 D111 K116 T117 Q118F28-I114 HydrophobicContact CE1-CD1 3.79Å; F28-I114 HydrophobicContact CZ-CD1 3.81Å; M29-I114 HydrophobicContact CE-CB 4.15Å; M29-I114 HydrophobicContact CE-CG2 3.89Å; M29-I114 HydrophobicContact SD-CB 4Å; M29-I114 HydrophobicContact SD-CD1 3.83Å; M29-I114 HydrophobicContact SD-CG2 3.83Å; F32-I114 HydrophobicContact CE1-CG2 4.02Å; F33-I114 HydrophobicContact CE1-CG2 4.1Å; F33-I114 HydrophobicContact CZ-CG2 4.01Å; A110-I114 VanDerWaalsContact O-CG1 3.29Å; A110-I114 WeakPolarHBondContact O-CG1 3.48Å; A110-I114 PolarHBondContact O-N 3.14Å; D111-I114 WeakPolarHBondContact O-CB 3.26Å; D111-I114 PolarHBondContact O-N 3.49Å; D111-I114 VanDerWaalsContact O-N 3.09Å; I114-K116 PolarHBondContact O-N 2.94Å; I114-T117 PolarHBondContact O-N 3.48Å; I114-Q118 HydrophobicContact CG2-CG 4.25Å; I114-Q118 WeakPolarHBondContact O-CB 3.38Å; I114-Q118 VanDerWaalsContact O-CG 3.3Å; I114-Q118 WeakPolarHBondContact O-CG 3.46Å; I114-Q118 PolarHBondContact O-N 2.99Å
115R88.3Confident81.4Confident40 Ų4060.2 Ų60.215%0.15130%0.301CS..Hα-helixtrans-56.3-50.8178-67.5-180-173.7-91.2-10.2112.5M29 F32 I99 E102 D111 L112 T117 Q118 H119M29-R115 HydrophobicContact CE-CG 3.65Å; F32-R115 HydrophobicContact CD2-CG 4.05Å; F32-R115 HydrophobicContact CE1-CG 4.27Å; F32-R115 HydrophobicContact CE2-CB 4.21Å; F32-R115 HydrophobicContact CE2-CG 3.81Å; F32-R115 HydrophobicContact CG-CG 4.39Å; F32-R115 HydrophobicContact CZ-CB 4.15Å; F32-R115 HydrophobicContact CZ-CG 3.93Å; I99-R115 HydrophobicContact CD1-CB 4.2Å; I99-R115 HydrophobicContact CG1-CB 3.84Å; E102-R115 IonicContact OE1-CZ 2.75Å; E102-R115 IonicContact OE1-NE 2.96Å; E102-R115 PolarHBondContact OE1-NE 3.28Å; D111-R115 WeakPolarHBondContact O-CG 3.39Å; D111-R115 PolarHBondContact O-N 3.03Å; D111-R115 IonicContact OD1-NH2 2.8Å; D111-R115 IonicContact OD2-CZ 3.96Å; D111-R115 IonicContact OD2-NE 2.67Å; D111-R115 PolarHBondContact OD2-NE 3.46Å; D111-R115 IonicContact OD2-NH2 3Å; L112-R115 PolarHBondContact O-N 2.82Å; R115-T117 PolarHBondContact O-N 3.15Å; R115-Q118 PolarHBondContact O-N 3.09Å; R115-H119 VanDerWaalsContact O-CB 3.27Å; R115-H119 WeakPolarHBondContact O-CB 3.13Å; R115-H119 PolarHBondContact O-N 2.99Å
116K85.4Confident82.3Confident75 Ų7555 Ų5533%0.32627%0.274SS..Hα-helixtrans-58.3-46.5177.4-75.6179172.6-1700113.1I99 E103 L112 I114 S120I99-K116 HydrophobicContact CD1-CG 4.15Å; I99-K116 HydrophobicContact CG1-CG 4.34Å; I99-K116 HydrophobicContact CG2-CD 4.34Å; I99-K116 HydrophobicContact CG2-CG 3.66Å; E103-K116 WeakPolarHBondContact OE1-CE 3.41Å; E103-K116 IonicContact OE1-NZ 3.72Å; E103-K116 PolarHBondContact OE1-NZ 3.37Å; L112-K116 HydrophobicContact CG-CD 4.43Å; L112-K116 WeakPolarHBondContact O-CG 3.47Å; L112-K116 PolarHBondContact O-N 3Å; I114-K116 PolarHBondContact O-N 2.94Å; K116-S120 WeakPolarHBondContact O-CB 3.44Å; K116-S120 PolarHBondContact O-N 2.92Å
117T84.2Confident83.7Confident44 Ų4449.1 Ų49.127%0.2724%0.244SC..Hα-helixtrans-65.2-44.3-178-55.70000111.2R113 I114 R115 S120 T121R113-T117 WeakPolarHBondContact O-CB 3.33Å; R113-T117 PolarHBondContact O-N 3.31Å; R113-T117 PolarHBondContact O-OG1 2.89Å; I114-T117 PolarHBondContact O-N 3.48Å; R115-T117 PolarHBondContact O-N 3.15Å; T117-S120 PolarHBondContact O-N 3.41Å; T117-T121 WeakPolarHBondContact O-CB 3.4Å; T117-T121 PolarHBondContact O-N 3.19Å; T117-T121 PolarHBondContact O-OG1 3.08Å
118Q89.4Confident85.1Confident60 Ų6046.6 Ų46.628%0.2824%0.239SC..Hα-helixtrans-66.6-46.3177.6-70.4-64.8-12.100111.7F32 V36 I114 R115 S120 T121 L122F32-Q118 HydrophobicContact CE1-CB 4.08Å; F32-Q118 HydrophobicContact CE1-CG 3.95Å; F32-Q118 HydrophobicContact CZ-CB 3.74Å; F32-Q118 HydrophobicContact CZ-CG 4.15Å; V36-Q118 HydrophobicContact CG2-CB 4.06Å; V36-Q118 HydrophobicContact CG2-CG 4.34Å; I114-Q118 HydrophobicContact CG2-CG 4.25Å; I114-Q118 WeakPolarHBondContact O-CB 3.38Å; I114-Q118 VanDerWaalsContact O-CG 3.3Å; I114-Q118 WeakPolarHBondContact O-CG 3.46Å; I114-Q118 PolarHBondContact O-N 2.99Å; R115-Q118 PolarHBondContact O-N 3.09Å; Q118-S120 VanDerWaalsContact C-N 3.3Å; Q118-S120 PolarHBondContact O-N 3.47Å; Q118-T121 PolarHBondContact O-N 2.88Å; Q118-L122 WeakPolarHBondContact O-CB 3.46Å; Q118-L122 VanDerWaalsContact O-CG 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.36Å; Q118-L122 PolarHBondContact O-N 3.09Å
119H89.9Confident86.6Confident8 Ų844.1 Ų44.14%0.03722%0.221CC..Hα-helixtrans-53.4-47.7175.3177.4-95.1000111.7L92 I95 I99 R115 S123 Q225L92-H119 PolarHBondContact O-CD2 3.03Å; L92-H119 PolarHBondContact O-NE2 3.02Å; I95-H119 HydrophobicContact CG2-CB 3.86Å; I99-H119 HydrophobicContact CD1-CB 3.79Å; R115-H119 VanDerWaalsContact O-CB 3.27Å; R115-H119 WeakPolarHBondContact O-CB 3.13Å; R115-H119 PolarHBondContact O-N 2.99Å; H119-S123 VanDerWaalsContact O-CB 3.23Å; H119-S123 WeakPolarHBondContact O-CB 3.47Å; H119-S123 PolarHBondContact O-N 3.22Å; H119-S123 PolarHBondContact O-OG 3.27Å; H119-Q225 PolarHBondContact ND1-OE1 2.92Å; H119-Q225 VanDerWaalsContact ND1-OE1 3.14Å
120S86.8Confident87.5Confident4 Ų442.8 Ų42.83%0.02821%0.211CC..Hα-helixtrans-65.7-43.7179.5-176.30000113.3K116 T117 Q118 S123 R124 Q225 I229K116-S120 WeakPolarHBondContact O-CB 3.44Å; K116-S120 PolarHBondContact O-N 2.92Å; T117-S120 PolarHBondContact O-N 3.41Å; Q118-S120 VanDerWaalsContact C-N 3.3Å; Q118-S120 PolarHBondContact O-N 3.47Å; S120-S123 PolarHBondContact O-N 2.88Å; S120-R124 WeakPolarHBondContact O-CB 3.46Å; S120-R124 PolarHBondContact O-N 2.67Å; S120-Q225 VanDerWaalsContact CB-OE1 3.25Å; S120-I229 VanDerWaalsContact CB-CD1 3.45Å; S120-I229 VanDerWaalsContact CB-CG1 3.49Å; S120-I229 VanDerWaalsContact OG-CD1 3.25Å; S120-I229 WeakPolarHBondContact OG-CD1 3.22Å; S120-I229 WeakPolarHBondContact OG-CG1 3.31Å
121T87.6Confident88.2Confident74 Ų7443.5 Ų43.545%0.45421%0.21SC..Hα-helixtrans-61.9-48.1179.5-57.60000110.9T117 Q118 R124 K125T117-T121 WeakPolarHBondContact O-CB 3.4Å; T117-T121 PolarHBondContact O-N 3.19Å; T117-T121 PolarHBondContact O-OG1 3.08Å; Q118-T121 PolarHBondContact O-N 2.88Å; T121-R124 PolarHBondContact O-N 2.87Å; T121-K125 PolarHBondContact O-N 3.29Å
122L92.4Very high88.8Confident11 Ų1145.1 Ų45.16%0.05822%0.217CC..Hα-helixtrans-65.7-42.1178.3-67171.6000111.9V36 I39 R40 I43 L92 Q118 R124 K125 F126V36-L122 HydrophobicContact CB-CD1 4.34Å; V36-L122 HydrophobicContact CG1-CD1 4.13Å; V36-L122 HydrophobicContact CG2-CD1 4.12Å; I39-L122 HydrophobicContact CB-CD1 4.09Å; I39-L122 HydrophobicContact CD1-CD1 4.04Å; I39-L122 HydrophobicContact CG2-CB 4.22Å; I39-L122 HydrophobicContact CG2-CD1 3.96Å; I39-L122 HydrophobicContact CG2-CD2 4.14Å; I39-L122 HydrophobicContact CG2-CG 4.35Å; R40-L122 HydrophobicContact CB-CD2 4.2Å; I43-L122 HydrophobicContact CD1-CB 4.46Å; I43-L122 HydrophobicContact CD1-CD2 4.27Å; L92-L122 HydrophobicContact CD2-CB 3.83Å; Q118-L122 WeakPolarHBondContact O-CB 3.46Å; Q118-L122 VanDerWaalsContact O-CG 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.36Å; Q118-L122 PolarHBondContact O-N 3.09Å; L122-R124 PolarHBondContact O-N 3.35Å; L122-K125 PolarHBondContact O-N 3.14Å; L122-F126 WeakPolarHBondContact O-CB 3.41Å; L122-F126 PolarHBondContact O-N 3.07Å
123S90.9Very high89.3Confident2 Ų244.9 Ų44.91%0.01422%0.215CC..Hα-helixtrans-58.6-48.2176.3-63.40000111.1H119 S120 K125 F126 V127H119-S123 VanDerWaalsContact O-CB 3.23Å; H119-S123 WeakPolarHBondContact O-CB 3.47Å; H119-S123 PolarHBondContact O-N 3.22Å; H119-S123 PolarHBondContact O-OG 3.27Å; S120-S123 PolarHBondContact O-N 2.88Å; S123-K125 PolarHBondContact O-N 2.94Å; S123-F126 PolarHBondContact O-N 2.99Å; S123-V127 WeakPolarHBondContact O-CG2 3.13Å; S123-V127 PolarHBondContact O-N 3.41Å
124R87.6Confident89.9Confident132 Ų13245.1 Ų45.150%0.49822%0.22SC..Hα-helixtrans-60.2-46.2178-171.7-175.5-54-81-5.1111.7S120 T121 L122 F126 V127 E128S120-R124 WeakPolarHBondContact O-CB 3.46Å; S120-R124 PolarHBondContact O-N 2.67Å; T121-R124 PolarHBondContact O-N 2.87Å; L122-R124 PolarHBondContact O-N 3.35Å; R124-F126 VanDerWaalsContact C-N 3.32Å; R124-F126 PolarHBondContact O-N 3.49Å; R124-V127 PolarHBondContact O-N 2.96Å; R124-E128 WeakPolarHBondContact O-CB 3.44Å; R124-E128 PolarHBondContact O-N 3.32Å
125K91.6Very high90.3Very high93 Ų9345.2 Ų45.240%0.40422%0.223SC..Hα-helixtrans-63.5-39.9179.1-166.673.9-156.2159.90111.7I43 T121 L122 S123 E128 V129I43-K125 HydrophobicContact CG2-CB 4.4Å; I43-K125 HydrophobicContact CG2-CG 3.73Å; T121-K125 PolarHBondContact O-N 3.29Å; L122-K125 PolarHBondContact O-N 3.14Å; S123-K125 PolarHBondContact O-N 2.94Å; K125-E128 WeakPolarHBondContact CD-OE2 3.39Å; K125-E128 IonicContact NZ-OE1 2.89Å; K125-E128 PolarHBondContact NZ-OE1 3.36Å; K125-E128 IonicContact NZ-OE2 3.99Å; K125-E128 PolarHBondContact NZ-OE2 3.29Å; K125-E128 WeakPolarHBondContact O-CB 3.46Å; K125-E128 PolarHBondContact O-N 3.37Å; K125-V129 WeakPolarHBondContact O-CG2 3.46Å; K125-V129 PolarHBondContact O-N 3.37Å; K125-V129 VanDerWaalsContact O-N 3.14Å
126F92.7Very high90.5Very high0 Ų043.7 Ų43.70%022%0.218CC..Hα-helixtrans-62.8-46.5175.6177.8-124.4000111.9I43 L46 A85 V88 L92 L122 S123 R124 E128 V129 M130 M214 M218I43-F126 HydrophobicContact CD1-CB 3.94Å; I43-F126 HydrophobicContact CG1-CB 4.22Å; I43-F126 HydrophobicContact CG1-CD2 4.38Å; L46-F126 HydrophobicContact CD1-CD2 3.96Å; L46-F126 HydrophobicContact CD1-CE2 3.66Å; A85-F126 HydrophobicContact CB-CE2 3.96Å; A85-F126 HydrophobicContact CB-CZ 4Å; V88-F126 HydrophobicContact CB-CD2 4.09Å; V88-F126 HydrophobicContact CB-CE2 3.93Å; V88-F126 HydrophobicContact CB-CZ 4.24Å; V88-F126 HydrophobicContact CG1-CB 4.09Å; V88-F126 HydrophobicContact CG1-CD1 3.93Å; V88-F126 HydrophobicContact CG1-CD2 3.5Å; V88-F126 HydrophobicContact CG1-CE1 4.2Å; V88-F126 HydrophobicContact CG1-CE2 3.81Å; V88-F126 HydrophobicContact CG1-CG 3.56Å; V88-F126 HydrophobicContact CG1-CZ 4.13Å; L92-F126 HydrophobicContact CD1-CB 4.33Å; L92-F126 HydrophobicContact CD1-CD1 4.01Å; L92-F126 HydrophobicContact CD1-CG 4.42Å; L122-F126 WeakPolarHBondContact O-CB 3.41Å; L122-F126 PolarHBondContact O-N 3.07Å; S123-F126 PolarHBondContact O-N 2.99Å; R124-F126 VanDerWaalsContact C-N 3.32Å; R124-F126 PolarHBondContact O-N 3.49Å; F126-E128 VanDerWaalsContact C-N 3.33Å; F126-E128 PolarHBondContact O-N 3.43Å; F126-V129 PolarHBondContact O-N 2.97Å; F126-M130 HydrophobicContact CD2-CG 3.93Å; F126-M130 HydrophobicContact CE1-CG 4.38Å; F126-M130 HydrophobicContact CE2-CG 3.53Å; F126-M130 HydrophobicContact CE2-SD 3.9Å; F126-M130 HydrophobicContact CZ-CG 3.8Å; F126-M130 HydrophobicContact CZ-SD 4.35Å; F126-M130 WeakPolarHBondContact O-CG 3.3Å; F126-M130 PolarHBondContact O-N 2.87Å; F126-M214 HydrophobicContact CE1-CG 4.44Å; F126-M214 HydrophobicContact CE1-SD 4.25Å; F126-M214 HydrophobicContact CZ-CG 4.38Å; F126-M214 HydrophobicContact CZ-SD 3.63Å; F126-M218 HydrophobicContact CD1-CG 4.13Å; F126-M218 HydrophobicContact CD1-SD 3.62Å; F126-M218 HydrophobicContact CE1-CG 3.88Å; F126-M218 HydrophobicContact CE1-SD 3.63Å
127V90.3Very high90.9Very high36 Ų3640.3 Ų40.322%0.21820%0.204CC..Hα-helixtrans-61.8-40.3176.81740000112.3S123 R124 M130 T131 M218 V222S123-V127 WeakPolarHBondContact O-CG2 3.13Å; S123-V127 PolarHBondContact O-N 3.41Å; R124-V127 PolarHBondContact O-N 2.96Å; V127-M130 PolarHBondContact O-N 2.63Å; V127-T131 VanDerWaalsContact O-CB 3.25Å; V127-T131 WeakPolarHBondContact O-CB 3.49Å; V127-T131 PolarHBondContact O-N 3Å; V127-T131 PolarHBondContact O-OG1 3.47Å; V127-M218 HydrophobicContact CG2-CB 3.71Å; V127-M218 HydrophobicContact CG2-CG 4.07Å; V127-M218 HydrophobicContact CG2-SD 4.46Å; V127-V222 HydrophobicContact CB-CG2 4.41Å; V127-V222 HydrophobicContact CG2-CG2 3.71Å
128E90.6Very high91.3Very high110 Ų11040.9 Ų40.951%0.51421%0.21SC..Hα-helixtrans-56.6-51.4175.3-173.5-167.7155.400111R124 K125 F126 M130 T131 E132R124-E128 WeakPolarHBondContact O-CB 3.44Å; R124-E128 PolarHBondContact O-N 3.32Å; K125-E128 WeakPolarHBondContact CD-OE2 3.39Å; K125-E128 IonicContact NZ-OE1 2.89Å; K125-E128 PolarHBondContact NZ-OE1 3.36Å; K125-E128 IonicContact NZ-OE2 3.99Å; K125-E128 PolarHBondContact NZ-OE2 3.29Å; K125-E128 WeakPolarHBondContact O-CB 3.46Å; K125-E128 PolarHBondContact O-N 3.37Å; F126-E128 VanDerWaalsContact C-N 3.33Å; F126-E128 PolarHBondContact O-N 3.43Å; E128-M130 PolarHBondContact O-N 2.75Å; E128-T131 PolarHBondContact O-N 2.89Å; E128-E132 PolarHBondContact O-N 3.11Å
129V94.3Very high91.6Very high8 Ų843.8 Ų43.85%0.04822%0.222CC..Hα-helixtrans-64.1-42.5179.9174.50000111.7I43 L46 V50 K125 F126 T131 E132 Y133I43-V129 HydrophobicContact CG2-CG2 4.01Å; L46-V129 HydrophobicContact CB-CG1 3.85Å; V50-V129 HydrophobicContact CG2-CG1 4.26Å; K125-V129 WeakPolarHBondContact O-CG2 3.46Å; K125-V129 PolarHBondContact O-N 3.37Å; K125-V129 VanDerWaalsContact O-N 3.14Å; F126-V129 PolarHBondContact O-N 2.97Å; V129-T131 VanDerWaalsContact C-N 3.33Å; V129-T131 PolarHBondContact O-N 2.83Å; V129-E132 PolarHBondContact O-N 3Å; V129-Y133 PolarHBondContact O-N 3.26Å
130M91.9Very high91.8Very high4 Ų443.9 Ų43.92%0.0222%0.221CC..Hα-helixtrans-69.1-32.8179.5-67.6-54.6-5900112.2A85 F126 V127 E128 Y133 N134 L211 M214 F215A85-M130 HydrophobicContact CB-CE 4.14Å; A85-M130 HydrophobicContact CB-SD 3.88Å; F126-M130 HydrophobicContact CD2-CG 3.93Å; F126-M130 HydrophobicContact CE1-CG 4.38Å; F126-M130 HydrophobicContact CE2-CG 3.53Å; F126-M130 HydrophobicContact CE2-SD 3.9Å; F126-M130 HydrophobicContact CZ-CG 3.8Å; F126-M130 HydrophobicContact CZ-SD 4.35Å; F126-M130 WeakPolarHBondContact O-CG 3.3Å; F126-M130 PolarHBondContact O-N 2.87Å; V127-M130 PolarHBondContact O-N 2.63Å; E128-M130 PolarHBondContact O-N 2.75Å; M130-Y133 HydrophobicContact CE-CD1 4.36Å; M130-Y133 WeakPolarHBondContact O-CB 3.41Å; M130-Y133 PolarHBondContact O-N 3.25Å; M130-N134 PolarHBondContact O-N 2.99Å; M130-L211 HydrophobicContact CE-CD1 4.04Å; M130-L211 HydrophobicContact CE-CD2 4.24Å; M130-M214 HydrophobicContact CE-SD 4.1Å; M130-F215 HydrophobicContact CB-CE1 3.64Å; M130-F215 HydrophobicContact CB-CZ 4.12Å; M130-F215 HydrophobicContact CE-CZ 4.29Å; M130-F215 WeakPolarHBondContact O-CE1 3.43Å; M130-F215 VanDerWaalsContact O-CZ 3.3Å; M130-F215 WeakPolarHBondContact O-CZ 3.36Å
131T90.8Very high92.2Very high67 Ų6745.4 Ų45.441%0.41123%0.227SC..Hα-helixtrans-68.6-38.8174-62.30000111.1V127 E128 V129 Y133 N134 T135V127-T131 VanDerWaalsContact O-CB 3.25Å; V127-T131 WeakPolarHBondContact O-CB 3.49Å; V127-T131 PolarHBondContact O-N 3Å; V127-T131 PolarHBondContact O-OG1 3.47Å; E128-T131 PolarHBondContact O-N 2.89Å; V129-T131 VanDerWaalsContact C-N 3.33Å; V129-T131 PolarHBondContact O-N 2.83Å; T131-Y133 VanDerWaalsContact C-N 3.34Å; T131-N134 PolarHBondContact O-N 3.45Å; T131-T135 WeakPolarHBondContact O-CB 3.43Å; T131-T135 PolarHBondContact O-N 3.48Å; T131-T135 PolarHBondContact O-OG1 2.99Å
132E92.9Very high92.5Very high71 Ų7145.7 Ų45.733%0.33223%0.225SC..Hα-helixtrans-64.4-38.7172.8-176.559-158.300111.7V50 K54 E128 V129 T135 T136V50-E132 HydrophobicContact CG1-CG 4.24Å; K54-E132 VanDerWaalsContact CE-OE1 3.31Å; K54-E132 WeakPolarHBondContact CE-OE1 3.49Å; K54-E132 IonicContact NZ-OE1 2.75Å; K54-E132 PolarHBondContact NZ-OE1 3.4Å; E128-E132 PolarHBondContact O-N 3.11Å; V129-E132 PolarHBondContact O-N 3Å; E132-T135 PolarHBondContact O-N 3.02Å; E132-T136 WeakPolarHBondContact O-CB 3.5Å; E132-T136 PolarHBondContact O-N 2.96Å; E132-T136 PolarHBondContact O-OG1 3.3Å
133Y93.9Very high92.6Very high3 Ų352.1 Ų52.11%0.01225%0.249CC..Hα-helixtrans-60.2-50.8172-179-110.1000111.7V50 V53 I81 V129 M130 T131 T135 T136 Q137 S207 L211V50-Y133 HydrophobicContact CG2-CD2 3.84Å; V50-Y133 HydrophobicContact CG2-CG 4.2Å; V53-Y133 HydrophobicContact CG1-CE2 4.37Å; V53-Y133 HydrophobicContact CG2-CE2 4.44Å; I81-Y133 HydrophobicContact CD1-CD2 3.82Å; I81-Y133 HydrophobicContact CD1-CE2 3.44Å; I81-Y133 VanDerWaalsContact CD1-CE2 3.44Å; I81-Y133 HydrophobicContact CG2-CD1 4.48Å; I81-Y133 HydrophobicContact CG2-CD2 4.44Å; I81-Y133 HydrophobicContact CG2-CE1 4.35Å; I81-Y133 HydrophobicContact CG2-CE2 4.25Å; V129-Y133 PolarHBondContact O-N 3.26Å; M130-Y133 HydrophobicContact CE-CD1 4.36Å; M130-Y133 WeakPolarHBondContact O-CB 3.41Å; M130-Y133 PolarHBondContact O-N 3.25Å; T131-Y133 VanDerWaalsContact C-N 3.34Å; Y133-T135 VanDerWaalsContact C-N 3.3Å; Y133-T135 PolarHBondContact O-N 2.8Å; Y133-T136 WeakPolarHBondContact O-CA 3.44Å; Y133-T136 VanDerWaalsContact O-CB 3.32Å; Y133-T136 WeakPolarHBondContact O-CB 3.47Å; Y133-T136 PolarHBondContact O-N 2.67Å; Y133-T136 VanDerWaalsContact O-N 3.08Å; Y133-Q137 HydrophobicContact CD1-CG 4.32Å; Y133-Q137 HydrophobicContact CD2-CG 4.45Å; Y133-Q137 HydrophobicContact CE1-CG 3.92Å; Y133-Q137 HydrophobicContact CE2-CG 4.13Å; Y133-Q137 WeakPolarHBondContact O-CG 3.17Å; Y133-Q137 PolarHBondContact O-N 3.38Å; Y133-Q137 PolarHBondContact OH-NE2 3.38Å; Y133-S207 PolarHBondContact OH-OG 2.76Å; Y133-L211 HydrophobicContact CD1-CD1 3.83Å; Y133-L211 HydrophobicContact CE1-CD1 3.35Å
134N91.7Very high92.8Very high57 Ų5752 Ų5231%0.30525%0.248SC..Hα-helixtrans-59.9-41.8178-175.850000112.1M130 T131 T136 Q137 S138 F215M130-N134 PolarHBondContact O-N 2.99Å; T131-N134 PolarHBondContact O-N 3.45Å; N134-T136 VanDerWaalsContact C-N 3.29Å; N134-T136 PolarHBondContact O-N 2.9Å; N134-Q137 PolarHBondContact O-N 2.58Å; N134-S138 WeakPolarHBondContact O-CB 3.3Å; N134-S138 PolarHBondContact O-N 3.07Å; N134-F215 HydrophobicContact CB-CE1 4.43Å; N134-F215 HydrophobicContact CB-CE2 4.27Å; N134-F215 HydrophobicContact CB-CZ 3.77Å
135T92.7Very high93.1Very high50 Ų5046.9 Ų46.931%0.30723%0.229SC..Hα-helixtrans-62.2-39.1175.7-59.80000111.4T131 E132 Y133 K139T131-T135 WeakPolarHBondContact O-CB 3.43Å; T131-T135 PolarHBondContact O-N 3.48Å; T131-T135 PolarHBondContact O-OG1 2.99Å; E132-T135 PolarHBondContact O-N 3.02Å; Y133-T135 VanDerWaalsContact C-N 3.3Å; Y133-T135 PolarHBondContact O-N 2.8Å; T135-K139 HydrophobicContact CG2-CD 4.2Å; T135-K139 WeakPolarHBondContact O-CB 3.18Å; T135-K139 VanDerWaalsContact O-CG 3.26Å; T135-K139 WeakPolarHBondContact O-CG 3.41Å; T135-K139 PolarHBondContact O-N 3.46Å
136T93.6Very high93.2Very high8 Ų844.9 Ų44.95%0.04922%0.223CC..Hα-helixtrans-63.5-46.2175.4-64.30000111.5V53 K54 E132 Y133 N134 K139 Y140V53-T136 HydrophobicContact CG1-CG2 4.24Å; K54-T136 WeakPolarHBondContact CE-OG1 3.45Å; K54-T136 HydrophobicContact CG-CG2 3.47Å; K54-T136 VanDerWaalsContact CG-CG2 3.47Å; E132-T136 WeakPolarHBondContact O-CB 3.5Å; E132-T136 PolarHBondContact O-N 2.96Å; E132-T136 PolarHBondContact O-OG1 3.3Å; Y133-T136 WeakPolarHBondContact O-CA 3.44Å; Y133-T136 VanDerWaalsContact O-CB 3.32Å; Y133-T136 WeakPolarHBondContact O-CB 3.47Å; Y133-T136 PolarHBondContact O-N 2.67Å; Y133-T136 VanDerWaalsContact O-N 3.08Å; N134-T136 VanDerWaalsContact C-N 3.29Å; N134-T136 PolarHBondContact O-N 2.9Å; T136-K139 PolarHBondContact O-N 3.27Å; T136-Y140 PolarHBondContact O-N 3.17Å
137Q93Very high93.2Very high4 Ų448.3 Ų48.32%0.01924%0.236CC..Hα-helixtrans-63.1-48177.3-64.4-64.3-23.400111.1Y133 N134 K139 Y140 R141 L204 I208Y133-Q137 HydrophobicContact CD1-CG 4.32Å; Y133-Q137 HydrophobicContact CD2-CG 4.45Å; Y133-Q137 HydrophobicContact CE1-CG 3.92Å; Y133-Q137 HydrophobicContact CE2-CG 4.13Å; Y133-Q137 WeakPolarHBondContact O-CG 3.17Å; Y133-Q137 PolarHBondContact O-N 3.38Å; Y133-Q137 PolarHBondContact OH-NE2 3.38Å; N134-Q137 PolarHBondContact O-N 2.58Å; Q137-K139 PolarHBondContact O-N 3.01Å; Q137-Y140 WeakPolarHBondContact O-CB 3.34Å; Q137-Y140 PolarHBondContact O-N 3.43Å; Q137-R141 PolarHBondContact O-N 2.57Å; Q137-L204 HydrophobicContact CB-CD1 3.93Å; Q137-L204 HydrophobicContact CB-CD2 4.4Å; Q137-L204 HydrophobicContact CB-CG 4.08Å; Q137-L204 WeakPolarHBondContact O-CD1 3.34Å; Q137-L204 VanDerWaalsContact OE1-CG 3.24Å; Q137-I208 HydrophobicContact CB-CD1 3.84Å; Q137-I208 HydrophobicContact CB-CG1 4.07Å; Q137-I208 HydrophobicContact CG-CG1 4.44Å
138S93.4Very high93.3Very high57 Ų5746.6 Ų46.640%0.39923%0.226SC..Hα-helixtrans-57.4-46.3177.6-177.10000112.2N134 Y140 R141 D142N134-S138 WeakPolarHBondContact O-CB 3.3Å; N134-S138 PolarHBondContact O-N 3.07Å; S138-Y140 VanDerWaalsContact C-N 3.31Å; S138-Y140 PolarHBondContact O-N 2.85Å; S138-R141 WeakPolarHBondContact O-CB 2.98Å; S138-R141 PolarHBondContact O-N 3.2Å; S138-D142 PolarHBondContact O-N 3.46Å
139K94.3Very high93.4Very high121 Ų12143.1 Ų43.153%0.52621%0.209SC..Hα-helixtrans-58.7-40.7173.5-74.5170-178167.70112.3T135 T136 Q137 R143T135-K139 HydrophobicContact CG2-CD 4.2Å; T135-K139 WeakPolarHBondContact O-CB 3.18Å; T135-K139 VanDerWaalsContact O-CG 3.26Å; T135-K139 WeakPolarHBondContact O-CG 3.41Å; T135-K139 PolarHBondContact O-N 3.46Å; T136-K139 PolarHBondContact O-N 3.27Å; Q137-K139 PolarHBondContact O-N 3.01Å; K139-R143 WeakPolarHBondContact O-CG 3.37Å; K139-R143 PolarHBondContact O-N 2.84Å; K139-R143 VanDerWaalsContact O-N 3.17Å
140Y94.8Very high93.3Very high9 Ų948.8 Ų48.84%0.03523%0.23CC..Hα-helixtrans-66.3-40.9178.6-176.1-106.7000112.3H57 I60 L61 T136 Q137 S138 R143 C144 E200 L204H57-Y140 HydrophobicContact CB-CD2 3.34Å; H57-Y140 HydrophobicContact CB-CE2 3.56Å; H57-Y140 HydrophobicContact CB-CG 4.12Å; H57-Y140 AromaticContact CD2-CD2 3.91Å; H57-Y140 AromaticContact CD2-CG 3.78Å; H57-Y140 AromaticContact CE1-CD1 3.57Å; H57-Y140 AromaticContact CE1-CE1 3.92Å; H57-Y140 AromaticContact CE1-CG 3.64Å; H57-Y140 AromaticContact CG-CD2 3.27Å; H57-Y140 AromaticContact CG-CE2 3.62Å; H57-Y140 AromaticContact CG-CG 3.55Å; H57-Y140 AromaticContact ND1-CD1 3.62Å; H57-Y140 AromaticContact ND1-CD2 3.39Å; H57-Y140 WeakPolarHBondContact ND1-CD2 3.49Å; H57-Y140 AromaticContact ND1-CE1 3.7Å; H57-Y140 AromaticContact ND1-CE2 3.4Å; H57-Y140 WeakPolarHBondContact ND1-CE2 3.11Å; H57-Y140 AromaticContact ND1-CG 3.46Å; H57-Y140 AromaticContact ND1-CZ 3.59Å; H57-Y140 AromaticContact NE2-CG 3.84Å; H57-Y140 WeakPolarHBondContact O-CE2 3.29Å; I60-Y140 WeakPolarHBondContact CG2-OH 3.37Å; L61-Y140 HydrophobicContact CD1-CD2 3.72Å; L61-Y140 HydrophobicContact CD1-CE2 3.65Å; L61-Y140 HydrophobicContact CD2-CE2 4.18Å; L61-Y140 HydrophobicContact CG-CD2 4.22Å; L61-Y140 HydrophobicContact CG-CE2 3.62Å; T136-Y140 PolarHBondContact O-N 3.17Å; Q137-Y140 WeakPolarHBondContact O-CB 3.34Å; Q137-Y140 PolarHBondContact O-N 3.43Å; S138-Y140 VanDerWaalsContact C-N 3.31Å; S138-Y140 PolarHBondContact O-N 2.85Å; Y140-R143 PolarHBondContact O-N 2.69Å; Y140-C144 WeakPolarHBondContact CE1-SG 3.31Å; Y140-C144 PolarHBondContact O-N 3.26Å; Y140-C144 PolarHBondContact O-SG 2.93Å; Y140-E200 HydrophobicContact CE1-CB 4.26Å; Y140-E200 PolarHBondContact OH-OE2 2.83Å; Y140-L204 HydrophobicContact CD1-CD1 3.58Å; Y140-L204 HydrophobicContact CG-CD1 4.29Å
141R94.9Very high93.2Very high37 Ų3749.9 Ų49.914%0.1424%0.235CC..Hα-helixtrans-58.4-48176.1-169.1-94.1-163.2-164.7-1.8111.8Q137 S138 R143 C144 K145 E165 I201 L204 E205Q137-R141 PolarHBondContact O-N 2.57Å; S138-R141 WeakPolarHBondContact O-CB 2.98Å; S138-R141 PolarHBondContact O-N 3.2Å; R141-R143 VanDerWaalsContact C-N 3.29Å; R141-R143 PolarHBondContact O-N 3.23Å; R141-C144 WeakPolarHBondContact O-CB 3.43Å; R141-C144 PolarHBondContact O-N 2.97Å; R141-K145 PolarHBondContact O-N 3.09Å; R141-E165 IonicContact CZ-OE1 2.74Å; R141-E165 IonicContact CZ-OE2 3.98Å; R141-E165 VanDerWaalsContact NH1-CD 3.29Å; R141-E165 IonicContact NH1-OE1 3.6Å; R141-E165 PolarHBondContact NH1-OE1 2.7Å; R141-E165 IonicContact NH1-OE2 2.69Å; R141-E165 PolarHBondContact NH1-OE2 2.94Å; R141-E165 IonicContact NH2-OE1 3.82Å; R141-E165 PolarHBondContact NH2-OE1 2.75Å; R141-I201 HydrophobicContact CG-CG1 4.5Å; R141-I201 HydrophobicContact CG-CG2 4.31Å; R141-L204 HydrophobicContact CB-CD1 4.3Å; R141-L204 HydrophobicContact CB-CD2 3.71Å; R141-L204 HydrophobicContact CG-CD2 3.91Å; R141-E205 IonicContact NE-OE1 2.77Å; R141-E205 IonicContact NH2-OE1 2.93Å; R141-E205 PolarHBondContact NH2-OE1 3.39Å
142D94.8Very high93.2Very high79 Ų7946.7 Ų46.742%0.42222%0.215SC..Hα-helixtrans-60.4-39.8175.9-69.3-17.3000111.7S138 C144 K145 D146S138-D142 PolarHBondContact O-N 3.46Å; D142-C144 PolarHBondContact O-N 3.29Å; D142-K145 WeakPolarHBondContact O-CB 3.42Å; D142-K145 PolarHBondContact O-N 3.36Å; D142-D146 PolarHBondContact O-N 2.9Å
143R94.8Very high93Very high146 Ų14648 Ų4855%0.55122%0.222SC*.Hα-helixtrans-69.1-33.3177.9-64.4-70.9-105.5178.1-4.9112.7L61 K139 Y140 R141 R147L61-R143 HydrophobicContact CD1-CB 3.72Å; L61-R143 HydrophobicContact CD1-CG 4.42Å; L61-R143 HydrophobicContact CD2-CB 4.37Å; K139-R143 WeakPolarHBondContact O-CG 3.37Å; K139-R143 PolarHBondContact O-N 2.84Å; K139-R143 VanDerWaalsContact O-N 3.17Å; Y140-R143 PolarHBondContact O-N 2.69Å; R141-R143 VanDerWaalsContact C-N 3.29Å; R141-R143 PolarHBondContact O-N 3.23Å; R143-R147 WeakPolarHBondContact O-CG 3.46Å; R143-R147 PolarHBondContact O-N 2.9Å
144C93.8Very high92.7Very high0 Ų052.4 Ų52.40%024%0.244CC..Hα-helixtrans-67.3-44.4171.7-68.10000110.9Y140 R141 D142 D146 R147 I148 R197 I201Y140-C144 WeakPolarHBondContact CE1-SG 3.31Å; Y140-C144 PolarHBondContact O-N 3.26Å; Y140-C144 PolarHBondContact O-SG 2.93Å; R141-C144 WeakPolarHBondContact O-CB 3.43Å; R141-C144 PolarHBondContact O-N 2.97Å; D142-C144 PolarHBondContact O-N 3.29Å; C144-D146 PolarHBondContact O-N 3.38Å; C144-R147 WeakPolarHBondContact O-CB 3.25Å; C144-R147 PolarHBondContact O-N 3.07Å; C144-R147 VanDerWaalsContact O-N 3.11Å; C144-I148 WeakPolarHBondContact O-CG1 3.44Å; C144-I148 PolarHBondContact O-N 3.48Å; C144-R197 HydrophobicContact CB-CB 4.4Å; C144-I201 HydrophobicContact CB-CD1 3.76Å; C144-I201 HydrophobicContact CB-CG1 3.62Å
145K94.1Very high92.4Very high24 Ų2451 Ų5110%0.10424%0.238CC..Hα-helixtrans-56.3-49.9174.1-179.7179.6176171.40111.4R141 D142 R147 I148 Q149 N161 L164 E165 L168R141-K145 PolarHBondContact O-N 3.09Å; D142-K145 WeakPolarHBondContact O-CB 3.42Å; D142-K145 PolarHBondContact O-N 3.36Å; K145-R147 PolarHBondContact O-N 3.36Å; K145-I148 PolarHBondContact O-N 2.95Å; K145-I148 VanDerWaalsContact O-N 3.13Å; K145-Q149 PolarHBondContact O-N 3.38Å; K145-N161 PolarHBondContact NZ-O 3.1Å; K145-L164 HydrophobicContact CD-CD2 4.41Å; K145-L164 HydrophobicContact CG-CD2 3.57Å; K145-L164 HydrophobicContact CG-CG 4.1Å; K145-E165 WeakPolarHBondContact CE-OE2 3.44Å; K145-E165 IonicContact NZ-OE2 3.55Å; K145-E165 PolarHBondContact NZ-OE2 3.07Å; K145-L168 HydrophobicContact CB-CD1 4.34Å; K145-L168 HydrophobicContact CD-CD1 4.3Å; K145-L168 HydrophobicContact CG-CD1 4.1Å
146D93.6Very high91.9Very high52 Ų5251.8 Ų51.828%0.27826%0.256SS..Hα-helixtrans-56-36.9175.9-78.9-6.1000112.7D142 C144 R150D142-D146 PolarHBondContact O-N 2.9Å; C144-D146 PolarHBondContact O-N 3.38Å; D146-R150 WeakPolarHBondContact O-CG 3.45Å; D146-R150 PolarHBondContact O-N 3.48Å
147R92.4Very high91.4Very high71 Ų7154.1 Ų54.127%0.26826%0.264SS..Hα-helixtrans-70.4-45.4177-79.3-169.2173.7-90.4-12.5111.6L61 R143 C144 K145 Q149 R150 Q151 E193 R197L61-R147 HydrophobicContact CD2-CG 4.46Å; L61-R147 PolarHBondContact O-NE 3.41Å; L61-R147 PolarHBondContact O-NH2 2.93Å; R143-R147 WeakPolarHBondContact O-CG 3.46Å; R143-R147 PolarHBondContact O-N 2.9Å; C144-R147 WeakPolarHBondContact O-CB 3.25Å; C144-R147 PolarHBondContact O-N 3.07Å; C144-R147 VanDerWaalsContact O-N 3.11Å; K145-R147 PolarHBondContact O-N 3.36Å; R147-Q149 VanDerWaalsContact C-N 3.28Å; R147-Q149 PolarHBondContact O-N 3.14Å; R147-R150 PolarHBondContact O-N 3.25Å; R147-Q151 WeakPolarHBondContact O-CG 3.3Å; R147-Q151 PolarHBondContact O-N 2.88Å; R147-E193 IonicContact NH1-OE1 2.69Å; R147-E193 PolarHBondContact NH1-OE1 2.89Å; R147-E193 VanDerWaalsContact NH1-OE1 3.14Å; R147-R197 HydrophobicContact CB-CG 4.27Å
148I92.4Very high91.1Very high0 Ų059.9 Ų59.90%030%0.299CS..Hα-helixtrans-58-45.2176.6-66.9168.4000109.9C144 K145 R150 Q151 L152 L164 L168 F176 I194 R197 H198 I201C144-I148 WeakPolarHBondContact O-CG1 3.44Å; C144-I148 PolarHBondContact O-N 3.48Å; K145-I148 PolarHBondContact O-N 2.95Å; K145-I148 VanDerWaalsContact O-N 3.13Å; I148-R150 PolarHBondContact O-N 3.43Å; I148-Q151 PolarHBondContact O-N 2.92Å; I148-Q151 VanDerWaalsContact O-N 3.16Å; I148-L152 HydrophobicContact CG2-CD1 4.03Å; I148-L152 HydrophobicContact CG2-CG 4.4Å; I148-L152 WeakPolarHBondContact O-CG 3.44Å; I148-L152 PolarHBondContact O-N 3.33Å; I148-L164 HydrophobicContact CG2-CD1 3.73Å; I148-L168 HydrophobicContact CD1-CD2 4Å; I148-F176 HydrophobicContact CG2-CD1 4.07Å; I148-F176 HydrophobicContact CG2-CE1 3.72Å; I148-I194 HydrophobicContact CG2-CG1 4.29Å; I148-I194 HydrophobicContact CG2-CG2 4.08Å; I148-R197 HydrophobicContact CD1-CB 3.89Å; I148-R197 HydrophobicContact CG1-CB 3.68Å; I148-R197 HydrophobicContact CG1-CG 4.47Å; I148-H198 HydrophobicContact CD1-CB 4.45Å; I148-I201 HydrophobicContact CD1-CD1 3.77Å
149Q93.3Very high90.8Very high37 Ų3757.4 Ų57.417%0.17328%0.282CS..Hα-helixtrans-56.8-49.5177.3-167.6175.90.400112.1K145 R147 Q151 L152 E153 N161 L164K145-Q149 PolarHBondContact O-N 3.38Å; R147-Q149 VanDerWaalsContact C-N 3.28Å; R147-Q149 PolarHBondContact O-N 3.14Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 2.94Å; Q149-L152 PolarHBondContact O-N 3.06Å; Q149-E153 WeakPolarHBondContact O-CG 3.31Å; Q149-E153 PolarHBondContact O-N 3.45Å; Q149-N161 PolarHBondContact OE1-OD1 3.25Å; Q149-L164 HydrophobicContact CB-CD2 3.65Å; Q149-L164 HydrophobicContact CG-CD2 4.2Å
150R91.8Very high90.6Very high127 Ų12755.1 Ų55.148%0.47928%0.279SS..Hα-helixtrans-60.9-39177.2-71.8179.1-170.1106.16.4112.4D146 R147 I148 E153 I154D146-R150 WeakPolarHBondContact O-CG 3.45Å; D146-R150 PolarHBondContact O-N 3.48Å; R147-R150 PolarHBondContact O-N 3.25Å; I148-R150 PolarHBondContact O-N 3.43Å; R150-E153 PolarHBondContact O-N 3.48Å; R150-I154 WeakPolarHBondContact O-CG1 3.36Å; R150-I154 PolarHBondContact O-N 2.76Å; R150-I154 VanDerWaalsContact O-N 3.11Å
151Q90.4Very high90.4Very high27 Ų2759.1 Ų59.113%0.12630%0.3CS..Hα-helixtrans-68.5-37.2177.9-66.9-55.2-26.700111.9R147 I148 Q149 I154 T155 A190 E193 I194R147-Q151 WeakPolarHBondContact O-CG 3.3Å; R147-Q151 PolarHBondContact O-N 2.88Å; I148-Q151 PolarHBondContact O-N 2.92Å; I148-Q151 VanDerWaalsContact O-N 3.16Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 2.94Å; Q151-I154 WeakPolarHBondContact O-CB 3.39Å; Q151-I154 PolarHBondContact O-N 3.11Å; Q151-T155 WeakPolarHBondContact O-CG2 3.36Å; Q151-T155 PolarHBondContact O-N 3.43Å; Q151-T155 VanDerWaalsContact O-N 3.16Å; Q151-A190 HydrophobicContact CB-CB 4.28Å; Q151-A190 VanDerWaalsContact OE1-CB 3.3Å; Q151-E193 HydrophobicContact CG-CB 4.25Å; Q151-E193 HydrophobicContact CG-CG 4.21Å; Q151-E193 PolarHBondContact NE2-OE2 3.37Å; Q151-I194 HydrophobicContact CB-CD1 3.73Å; Q151-I194 HydrophobicContact CB-CG1 3.52Å; Q151-I194 HydrophobicContact CG-CG1 4.31Å
152L89.7Confident90.1Very high0 Ų064.6 Ų64.60%033%0.327CS..Hα-helixtrans-62.2-42172.8-71.2170000111.6I148 Q149 I154 T155 G156 R157 L164 M167 F176 I180 I194I148-L152 HydrophobicContact CG2-CD1 4.03Å; I148-L152 HydrophobicContact CG2-CG 4.4Å; I148-L152 WeakPolarHBondContact O-CG 3.44Å; I148-L152 PolarHBondContact O-N 3.33Å; Q149-L152 PolarHBondContact O-N 3.06Å; L152-I154 VanDerWaalsContact C-N 3.33Å; L152-I154 PolarHBondContact O-N 3.45Å; L152-T155 PolarHBondContact O-N 2.96Å; L152-T155 VanDerWaalsContact O-N 3.11Å; L152-T155 PolarHBondContact O-OG1 2.96Å; L152-G156 PolarHBondContact O-N 3.48Å; L152-R157 CarbonylContact C-O 3.28Å; L152-R157 VanDerWaalsContact C-O 3.28Å; L152-R157 PolarHBondContact O-N 2.89Å; L152-L164 HydrophobicContact CD1-CD1 4Å; L152-M167 HydrophobicContact CD1-CE 4.37Å; L152-F176 HydrophobicContact CD1-CD1 4.25Å; L152-F176 HydrophobicContact CD2-CD1 4.33Å; L152-I180 HydrophobicContact CD2-CD1 4.1Å; L152-I194 HydrophobicContact CD2-CD1 3.87Å; L152-I194 HydrophobicContact CG-CD1 4.03Å
153E89.8Confident89.9Confident100 Ų10065.5 Ų65.547%0.46733%0.329SS..Hα-helixtrans-60.8-39.9174.7-70.1173.8-178.400112.4Q149 R150 T155 G156Q149-E153 WeakPolarHBondContact O-CG 3.31Å; Q149-E153 PolarHBondContact O-N 3.45Å; R150-E153 PolarHBondContact O-N 3.48Å; E153-T155 VanDerWaalsContact C-N 3.26Å; E153-T155 PolarHBondContact O-N 3.32Å; E153-G156 WeakPolarHBondContact O-CA 3.27Å; E153-G156 PolarHBondContact O-N 3.46Å
154I87.1Confident89.7Confident94 Ų9458.6 Ų58.648%0.48230%0.303SS..Hα-helixtrans-61.7-35.8175.5-69.8165.4000111.4R150 Q151 L152 G156R150-I154 WeakPolarHBondContact O-CG1 3.36Å; R150-I154 PolarHBondContact O-N 2.76Å; R150-I154 VanDerWaalsContact O-N 3.11Å; Q151-I154 WeakPolarHBondContact O-CB 3.39Å; Q151-I154 PolarHBondContact O-N 3.11Å; L152-I154 VanDerWaalsContact C-N 3.33Å; L152-I154 PolarHBondContact O-N 3.45Å; I154-G156 PolarHBondContact O-N 3.43Å
155T85.3Confident89.5Confident27 Ų2760.5 Ų60.517%0.16631%0.312CS..THydrogen-bonded Turntrans-76.9-3.2175.1670000114Q151 L152 E153 I180 T187 A190Q151-T155 WeakPolarHBondContact O-CG2 3.36Å; Q151-T155 PolarHBondContact O-N 3.43Å; Q151-T155 VanDerWaalsContact O-N 3.16Å; L152-T155 PolarHBondContact O-N 2.96Å; L152-T155 VanDerWaalsContact O-N 3.11Å; L152-T155 PolarHBondContact O-OG1 2.96Å; E153-T155 VanDerWaalsContact C-N 3.26Å; E153-T155 PolarHBondContact O-N 3.32Å; T155-I180 HydrophobicContact CG2-CD1 4Å; T155-I180 HydrophobicContact CG2-CG2 4.13Å; T155-I180 VanDerWaalsContact OG1-CD1 3.25Å; T155-I180 WeakPolarHBondContact OG1-CD1 3.22Å; T155-T187 HydrophobicContact CG2-CG2 3.89Å; T155-A190 HydrophobicContact CG2-CB 3.66Å
156G82.9Confident89.3Confident67 Ų6763.8 Ų63.869%0.69133%0.331SS*.THydrogen-bonded Turntrans87.712.8179.700000114.4L152 E153 I154L152-G156 PolarHBondContact O-N 3.48Å; E153-G156 WeakPolarHBondContact O-CA 3.27Å; E153-G156 PolarHBondContact O-N 3.46Å; I154-G156 PolarHBondContact O-N 3.43Å
157R83.7Confident89Confident57 Ų5761.8 Ų61.822%0.21532%0.32CS..  trans-104.6102.2176.8-177.4175.2171.6173.21.4110.4L152 T159 I175L152-R157 CarbonylContact C-O 3.28Å; L152-R157 VanDerWaalsContact C-O 3.28Å; L152-R157 PolarHBondContact O-N 2.89Å; R157-T159 PolarHBondContact O-N 3.28Å; R157-I175 PolarHBondContact NH1-O 3.33Å
158T85.1Confident88.9Confident125 Ų12558.8 Ų58.877%0.76731%0.309SS*.  trans-72.4123.2169.5-49.70000109
159T87.4Confident88.6Confident5 Ų565.7 Ų65.73%0.03134%0.342CS..  trans-127.5131.6-179.6-47.20000108.5R157 E163 L164 M167R157-T159 PolarHBondContact O-N 3.28Å; T159-E163 HydrophobicContact CG2-CB 3.68Å; T159-L164 HydrophobicContact CG2-CB 4.01Å; T159-M167 HydrophobicContact CG2-SD 3.92Å
160T90.9Very high88.1Confident74 Ų7466.1 Ų66.145%0.45435%0.348SS..  trans-73.1163.5174.563.50000111E162 E163 L164T160-E162 PolarHBondContact O-N 2.86Å; T160-E163 WeakPolarHBondContact CB-OE2 3.48Å; T160-E163 PolarHBondContact N-OE2 3.28Å; T160-E163 PolarHBondContact O-N 2.79Å; T160-E163 WeakPolarHBondContact OG1-CB 3.23Å; T160-E163 WeakPolarHBondContact OG1-CG 3.48Å; T160-E163 PolarHBondContact OG1-N 3.43Å; T160-E163 PolarHBondContact OG1-OE2 3.39Å; T160-L164 WeakPolarHBondContact O-CB 3.25Å; T160-L164 PolarHBondContact O-N 3.23Å
161N89.5Confident87.3Confident92 Ų9262.1 Ų62.149%0.49235%0.347SS..Hα-helixtrans-62.5-31.2178.4-89.3-39000113.6K145 Q149 E165K145-N161 PolarHBondContact NZ-O 3.1Å; Q149-N161 PolarHBondContact OE1-OD1 3.25Å; N161-E165 PolarHBondContact O-N 3.49Å
162E90Very high86.8Confident152 Ų15267.5 Ų67.571%0.7137%0.37SS*.Hα-helixtrans-76.2-49.2179.5-170.3171.1-168.600110.2T160 L164 E165 D166T160-E162 PolarHBondContact O-N 2.86Å; E162-L164 VanDerWaalsContact C-N 3.27Å; E162-L164 PolarHBondContact O-N 3.37Å; E162-E165 WeakPolarHBondContact O-CA 3.41Å; E162-E165 VanDerWaalsContact O-CB 3.3Å; E162-E165 WeakPolarHBondContact O-CB 3.35Å; E162-E165 PolarHBondContact O-N 3.44Å; E162-D166 PolarHBondContact O-N 3.24Å
163E89.1Confident86.3Confident99 Ų9970.2 Ų70.246%0.46338%0.384SS..Hα-helixtrans-57.8-40.3174.2-70.6164.6155.200112.2T159 T160 E165 D166 M167T159-E163 HydrophobicContact CG2-CB 3.68Å; T160-E163 WeakPolarHBondContact CB-OE2 3.48Å; T160-E163 PolarHBondContact N-OE2 3.28Å; T160-E163 PolarHBondContact O-N 2.79Å; T160-E163 WeakPolarHBondContact OG1-CB 3.23Å; T160-E163 WeakPolarHBondContact OG1-CG 3.48Å; T160-E163 PolarHBondContact OG1-N 3.43Å; T160-E163 PolarHBondContact OG1-OE2 3.39Å; E163-E165 VanDerWaalsContact C-N 3.29Å; E163-E165 PolarHBondContact O-N 3.42Å; E163-D166 PolarHBondContact O-N 2.74Å; E163-M167 WeakPolarHBondContact O-CG 3.45Å; E163-M167 PolarHBondContact O-N 2.76Å
164L90.4Very high85.7Confident0 Ų067.8 Ų67.80%038%0.381CS..Hα-helixtrans-66-34.1177179.757.8000111.9K145 I148 Q149 L152 T159 T160 E162 M167 L168 F176K145-L164 HydrophobicContact CD-CD2 4.41Å; K145-L164 HydrophobicContact CG-CD2 3.57Å; K145-L164 HydrophobicContact CG-CG 4.1Å; I148-L164 HydrophobicContact CG2-CD1 3.73Å; Q149-L164 HydrophobicContact CB-CD2 3.65Å; Q149-L164 HydrophobicContact CG-CD2 4.2Å; L152-L164 HydrophobicContact CD1-CD1 4Å; T159-L164 HydrophobicContact CG2-CB 4.01Å; T160-L164 WeakPolarHBondContact O-CB 3.25Å; T160-L164 PolarHBondContact O-N 3.23Å; E162-L164 VanDerWaalsContact C-N 3.27Å; E162-L164 PolarHBondContact O-N 3.37Å; L164-M167 PolarHBondContact O-N 3.29Å; L164-L168 VanDerWaalsContact O-CG 3.29Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 3.47Å; L164-L168 VanDerWaalsContact O-N 3.11Å; L164-F176 HydrophobicContact CD1-CE1 3.94Å
165E90.9Very high85.3Confident40 Ų4065.6 Ų65.619%0.18737%0.37CS..Hα-helixtrans-65.9-48.1175.5-16265.5-153.500110.7R141 K145 N161 E162 E163 M167 L168 E169R141-E165 IonicContact CZ-OE1 2.74Å; R141-E165 IonicContact CZ-OE2 3.98Å; R141-E165 VanDerWaalsContact NH1-CD 3.29Å; R141-E165 IonicContact NH1-OE1 3.6Å; R141-E165 PolarHBondContact NH1-OE1 2.7Å; R141-E165 IonicContact NH1-OE2 2.69Å; R141-E165 PolarHBondContact NH1-OE2 2.94Å; R141-E165 IonicContact NH2-OE1 3.82Å; R141-E165 PolarHBondContact NH2-OE1 2.75Å; K145-E165 WeakPolarHBondContact CE-OE2 3.44Å; K145-E165 IonicContact NZ-OE2 3.55Å; K145-E165 PolarHBondContact NZ-OE2 3.07Å; N161-E165 PolarHBondContact O-N 3.49Å; E162-E165 WeakPolarHBondContact O-CA 3.41Å; E162-E165 VanDerWaalsContact O-CB 3.3Å; E162-E165 WeakPolarHBondContact O-CB 3.35Å; E162-E165 PolarHBondContact O-N 3.44Å; E163-E165 VanDerWaalsContact C-N 3.29Å; E163-E165 PolarHBondContact O-N 3.42Å; E165-M167 PolarHBondContact O-N 3.2Å; E165-L168 WeakPolarHBondContact O-CA 3.39Å; E165-L168 WeakPolarHBondContact O-CB 3.45Å; E165-L168 PolarHBondContact O-N 3.38Å; E165-E169 WeakPolarHBondContact O-CG 3.39Å; E165-E169 PolarHBondContact O-N 3.21Å
166D89.1Confident84.9Confident94 Ų9464.3 Ų64.350%0.50336%0.362SS..Hα-helixtrans-57.5-38.9176.4-66.7-16.9000111.8E162 E163 S170E162-D166 PolarHBondContact O-N 3.24Å; E163-D166 PolarHBondContact O-N 2.74Å; D166-S170 PolarHBondContact O-N 3.34Å; D166-S170 VanDerWaalsContact O-N 3.11Å
167M88.1Confident84.6Confident10 Ų1063.9 Ų63.95%0.04935%0.346CS..Hα-helixtrans-63.2-42.1175.1-69.6171.37200111.9L152 T159 E163 L164 E165 S170 I175 F176L152-M167 HydrophobicContact CD1-CE 4.37Å; T159-M167 HydrophobicContact CG2-SD 3.92Å; E163-M167 WeakPolarHBondContact O-CG 3.45Å; E163-M167 PolarHBondContact O-N 2.76Å; L164-M167 PolarHBondContact O-N 3.29Å; E165-M167 PolarHBondContact O-N 3.2Å; M167-S170 PolarHBondContact O-OG 2.74Å; M167-I175 HydrophobicContact CB-CG2 4.35Å; M167-I175 HydrophobicContact CE-CG2 3.9Å; M167-I175 HydrophobicContact CG-CG2 3.72Å; M167-I175 HydrophobicContact SD-CG2 4.47Å; M167-F176 HydrophobicContact CB-CE1 4.06Å; M167-F176 HydrophobicContact CB-CZ 3.92Å; M167-F176 HydrophobicContact CE-CD1 3.34Å; M167-F176 HydrophobicContact CE-CE1 3.52Å; M167-F176 HydrophobicContact CE-CG 3.99Å; M167-F176 HydrophobicContact CE-CZ 4.3Å; M167-F176 HydrophobicContact SD-CE1 4.47Å
168L88.9Confident84.1Confident8 Ų866.8 Ų66.84%0.04237%0.366CS..Hα-helixtrans-67.7-44.1177.1-68.4171.6000111.5K145 I148 L164 E165 S170 G171 F176 I201K145-L168 HydrophobicContact CB-CD1 4.34Å; K145-L168 HydrophobicContact CD-CD1 4.3Å; K145-L168 HydrophobicContact CG-CD1 4.1Å; I148-L168 HydrophobicContact CD1-CD2 4Å; L164-L168 VanDerWaalsContact O-CG 3.29Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 3.47Å; L164-L168 VanDerWaalsContact O-N 3.11Å; E165-L168 WeakPolarHBondContact O-CA 3.39Å; E165-L168 WeakPolarHBondContact O-CB 3.45Å; E165-L168 PolarHBondContact O-N 3.38Å; L168-S170 PolarHBondContact O-N 3.24Å; L168-G171 PolarHBondContact O-N 3.18Å; L168-F176 HydrophobicContact CD2-CZ 4.01Å; L168-I201 HydrophobicContact CD1-CD1 4.15Å; L168-I201 HydrophobicContact CD2-CD1 3.76Å
169E86.3Confident83.3Confident145 Ų14566.9 Ų66.968%0.67836%0.361SS*.Hα-helixtrans-61.5-31.7178.8-72.6-172.3179.200112.8E165 G171E165-E169 WeakPolarHBondContact O-CG 3.39Å; E165-E169 PolarHBondContact O-N 3.21Å; E169-G171 PolarHBondContact O-N 2.88Å
170S83Confident82.7Confident45 Ų4567.5 Ų67.532%0.31536%0.364SS..THydrogen-bonded Turntrans-62.4-24.1176.883.40000113.6D166 M167 L168 K172 I175D166-S170 PolarHBondContact O-N 3.34Å; D166-S170 VanDerWaalsContact O-N 3.11Å; M167-S170 PolarHBondContact O-OG 2.74Å; L168-S170 PolarHBondContact O-N 3.24Å; S170-K172 PolarHBondContact O-N 2.94Å; S170-K172 VanDerWaalsContact O-N 3.08Å; S170-K172 PolarHBondContact OG-N 3.43Å; S170-I175 WeakPolarHBondContact OG-CD1 3.48Å
171G75.4Confident81.9Confident43 Ų4371.5 Ų71.544%0.44338%0.376SS..  trans62.75.6-174.600000115.4L168 E169L168-G171 PolarHBondContact O-N 3.18Å; E169-G171 PolarHBondContact O-N 2.88Å
172K79.9Confident81Confident140 Ų14072.6 Ų72.661%0.60938%0.379SS*.  trans-97.7112-174.7-71.6174.9-172.8171.90111S170 A174 I175S170-K172 PolarHBondContact O-N 2.94Å; S170-K172 VanDerWaalsContact O-N 3.08Å; S170-K172 PolarHBondContact OG-N 3.43Å; K172-A174 PolarHBondContact O-N 3.47Å; K172-I175 HydrophobicContact CB-CD1 4.04Å; K172-I175 HydrophobicContact CB-CG1 3.9Å; K172-I175 HydrophobicContact CD-CD1 4.47Å; K172-I175 PolarHBondContact O-N 2.9Å
173L78.3Confident80.3Confident58 Ų5872 Ų7230%0.30438%0.381SS..THydrogen-bonded Turntrans-58.3-32.4176.7-174.366.3000113.2I175 F176 E195L173-I175 PolarHBondContact O-N 3.05Å; L173-I175 VanDerWaalsContact O-N 3.15Å; L173-F176 HydrophobicContact CD1-CD2 4.27Å; L173-F176 WeakPolarHBondContact O-CB 3.49Å; L173-F176 WeakPolarHBondContact O-CD2 3.41Å; L173-F176 PolarHBondContact O-N 3.21Å; L173-F176 VanDerWaalsContact O-N 3.09Å; L173-E195 HydrophobicContact CD1-CB 3.92Å; L173-E195 HydrophobicContact CD1-CG 4.11Å; L173-E195 HydrophobicContact CD2-CB 4.17Å; L173-E195 HydrophobicContact CD2-CG 3.64Å
174A78.8Confident79.9Confident49 Ų4969.8 Ų69.841%0.40538%0.376SS..Hα-helixtrans-57.7-30-178.700000113.5K172 F176 T177 D178K172-A174 PolarHBondContact O-N 3.47Å; A174-F176 PolarHBondContact O-N 3.44Å; A174-F176 VanDerWaalsContact O-N 3.17Å; A174-T177 WeakPolarHBondContact CA-OG1 3.43Å; A174-T177 PolarHBondContact O-N 3.19Å; A174-T177 PolarHBondContact O-OG1 2.98Å; A174-D178 PolarHBondContact O-N 3.08Å
175I78.2Confident79.5Confident48 Ų4877.7 Ų77.725%0.24641%0.413CS..Hα-helixtrans-64.1-26.3-178.6-56.1-171.7000111.5R157 M167 S170 K172 L173R157-I175 PolarHBondContact NH1-O 3.33Å; M167-I175 HydrophobicContact CB-CG2 4.35Å; M167-I175 HydrophobicContact CE-CG2 3.9Å; M167-I175 HydrophobicContact CG-CG2 3.72Å; M167-I175 HydrophobicContact SD-CG2 4.47Å; S170-I175 WeakPolarHBondContact OG-CD1 3.48Å; K172-I175 HydrophobicContact CB-CD1 4.04Å; K172-I175 HydrophobicContact CB-CG1 3.9Å; K172-I175 HydrophobicContact CD-CD1 4.47Å; K172-I175 PolarHBondContact O-N 2.9Å; L173-I175 PolarHBondContact O-N 3.05Å; L173-I175 VanDerWaalsContact O-N 3.15Å
176F77.8Confident79.2Confident0 Ų081.8 Ų81.80%043%0.434CS..Hα-helixtrans-77.3-23.2174-60.1-79.8000112.6I148 L152 L164 M167 L168 L173 A174 I180 I194 H198I148-F176 HydrophobicContact CG2-CD1 4.07Å; I148-F176 HydrophobicContact CG2-CE1 3.72Å; L152-F176 HydrophobicContact CD1-CD1 4.25Å; L152-F176 HydrophobicContact CD2-CD1 4.33Å; L164-F176 HydrophobicContact CD1-CE1 3.94Å; M167-F176 HydrophobicContact CB-CE1 4.06Å; M167-F176 HydrophobicContact CB-CZ 3.92Å; M167-F176 HydrophobicContact CE-CD1 3.34Å; M167-F176 HydrophobicContact CE-CE1 3.52Å; M167-F176 HydrophobicContact CE-CG 3.99Å; M167-F176 HydrophobicContact CE-CZ 4.3Å; M167-F176 HydrophobicContact SD-CE1 4.47Å; L168-F176 HydrophobicContact CD2-CZ 4.01Å; L173-F176 HydrophobicContact CD1-CD2 4.27Å; L173-F176 WeakPolarHBondContact O-CB 3.49Å; L173-F176 WeakPolarHBondContact O-CD2 3.41Å; L173-F176 PolarHBondContact O-N 3.21Å; L173-F176 VanDerWaalsContact O-N 3.09Å; A174-F176 PolarHBondContact O-N 3.44Å; A174-F176 VanDerWaalsContact O-N 3.17Å; F176-I180 WeakPolarHBondContact O-CD1 3.19Å; F176-I194 HydrophobicContact CB-CG2 3.85Å; F176-I194 HydrophobicContact CD1-CG2 3.78Å; F176-I194 HydrophobicContact CD2-CG2 4.3Å; F176-I194 HydrophobicContact CE1-CG2 4.47Å; F176-I194 HydrophobicContact CG-CG2 3.7Å; F176-H198 AromaticContact CE2-CD2 3.71Å
177T76.1Confident78.9Confident58 Ų5878.2 Ų78.236%0.35642%0.415SS..Hα-helixtrans-103.3-22.8-173.153.50000114.9A174 D179 I180 L191A174-T177 WeakPolarHBondContact CA-OG1 3.43Å; A174-T177 PolarHBondContact O-N 3.19Å; A174-T177 PolarHBondContact O-OG1 2.98Å; T177-D179 VanDerWaalsContact C-N 3.32Å; T177-D179 PolarHBondContact O-N 3.01Å; T177-I180 PolarHBondContact O-N 2.83Å; T177-L191 HydrophobicContact CG2-CD1 4.24Å; T177-L191 HydrophobicContact CG2-CD2 3.74Å
178D72.6Confident78.8Confident117 Ų11783.3 Ų83.363%0.62644%0.437SS*.THydrogen-bonded Turntrans-59.8-34.7-166.5-75.9-17.1000114.7A174A174-D178 PolarHBondContact O-N 3.08Å
179D69.1Low78.7Confident127 Ų12787.9 Ų87.968%0.67946%0.458SS*.THydrogen-bonded Turntrans-101.63.3-177.6-68.6-40.2000113.9T177T177-D179 VanDerWaalsContact C-N 3.32Å; T177-D179 PolarHBondContact O-N 3.01Å
180I75Confident78.7Confident18 Ų1881.1 Ų81.19%0.09243%0.427CS..  trans-101.6115.4-171.6-62.8-179.6000110.5L152 T155 F176 T177 M182 T187 L191L152-I180 HydrophobicContact CD2-CD1 4.1Å; T155-I180 HydrophobicContact CG2-CD1 4Å; T155-I180 HydrophobicContact CG2-CG2 4.13Å; T155-I180 VanDerWaalsContact OG1-CD1 3.25Å; T155-I180 WeakPolarHBondContact OG1-CD1 3.22Å; F176-I180 WeakPolarHBondContact O-CD1 3.19Å; T177-I180 PolarHBondContact O-N 2.83Å; I180-M182 PolarHBondContact O-N 2.93Å; I180-T187 HydrophobicContact CG2-CG2 3.13Å; I180-L191 HydrophobicContact CD1-CD2 3.78Å; I180-L191 HydrophobicContact CG2-CD1 4.27Å
181K73.6Confident78.9Confident159 Ų15979.8 Ų79.869%0.69142%0.416SS*.  trans-69.6117.3174.4-62.4-173.3179.1-178.50110.8D183K181-D183 WeakPolarHBondContact CB-OD2 3.37Å; K181-D183 PolarHBondContact O-N 3.19Å
182M71.2Confident79.5Confident115 Ų11581 Ų8157%0.56741%0.412SS*.THydrogen-bonded Turntrans-75.542.3179.5-66.9-173.885.200113.9I180 K188 L191I180-M182 PolarHBondContact O-N 2.93Å; M182-K188 HydrophobicContact CE-CG 4.02Å; M182-L191 HydrophobicContact CE-CD1 4.44Å; M182-L191 HydrophobicContact CG-CD1 4.24Å
183D73.8Confident80Confident140 Ų14074.6 Ų74.675%0.74939%0.385SS*.THydrogen-bonded Turntrans-88.2-18.2-169-62.4-13.6000112.6K181K181-D183 WeakPolarHBondContact CB-OD2 3.37Å; K181-D183 PolarHBondContact O-N 3.19Å
184S81.3Confident80.6Confident51 Ų5171.9 Ų71.936%0.35737%0.371SS..SBendtrans-121.1145.9-177.4176.30000112.6M186 T187 K188S184-M186 PolarHBondContact O-N 2.94Å; S184-M186 PolarHBondContact OG-N 3.47Å; S184-M186 VanDerWaalsContact OG-N 3.14Å; S184-T187 WeakPolarHBondContact O-CB 3.28Å; S184-T187 PolarHBondContact O-N 2.94Å; S184-T187 VanDerWaalsContact O-N 3.17Å; S184-K188 PolarHBondContact O-N 3.01Å
185Q83Confident81.1Confident167 Ų16773.8 Ų73.878%0.7837%0.371SS*.Hα-helixtrans-59.2-32.6170.3-174.1175.2-11.900111.6K188 Q189Q185-K188 PolarHBondContact O-N 3Å; Q185-Q189 PolarHBondContact O-N 3.06Å; Q185-Q189 VanDerWaalsContact O-N 3.14Å
186M83.4Confident81.6Confident126 Ų12672.4 Ų72.462%0.62137%0.365SS*.Hα-helixtrans-64.2-43.1174.9-67.5-17265.900111.8S184 K188 Q189 A190S184-M186 PolarHBondContact O-N 2.94Å; S184-M186 PolarHBondContact OG-N 3.47Å; S184-M186 VanDerWaalsContact OG-N 3.14Å; M186-K188 VanDerWaalsContact C-N 3.32Å; M186-K188 PolarHBondContact O-N 3.22Å; M186-Q189 PolarHBondContact O-N 3.37Å; M186-A190 PolarHBondContact O-N 3.24Å
187T83.8Confident82.3Confident19 Ų1972.4 Ų72.412%0.11737%0.365CS..Hα-helixtrans-62.5-40.3178.1-50.60000111.7T155 I180 S184 Q189 A190 L191T155-T187 HydrophobicContact CG2-CG2 3.89Å; I180-T187 HydrophobicContact CG2-CG2 3.13Å; S184-T187 WeakPolarHBondContact O-CB 3.28Å; S184-T187 PolarHBondContact O-N 2.94Å; S184-T187 VanDerWaalsContact O-N 3.17Å; T187-Q189 VanDerWaalsContact C-N 3.33Å; T187-Q189 PolarHBondContact O-N 2.77Å; T187-A190 PolarHBondContact O-N 3.34Å; T187-L191 HydrophobicContact CG2-CD1 4.49Å; T187-L191 WeakPolarHBondContact O-CG 3.47Å; T187-L191 PolarHBondContact O-N 2.95Å
188K85Confident83.1Confident117 Ų11770 Ų7051%0.50935%0.35SS..Hα-helixtrans-62.8-40.1175.9-67.5-178.9179.71790112.2M182 S184 Q185 M186 N192M182-K188 HydrophobicContact CE-CG 4.02Å; S184-K188 PolarHBondContact O-N 3.01Å; Q185-K188 PolarHBondContact O-N 3Å; M186-K188 VanDerWaalsContact C-N 3.32Å; M186-K188 PolarHBondContact O-N 3.22Å; K188-N192 PolarHBondContact O-N 3.03Å; K188-N192 VanDerWaalsContact O-N 3.12Å
189Q86.8Confident83.9Confident104 Ų10467.3 Ų67.349%0.48634%0.338SS..Hα-helixtrans-67.8-42.7177.2-174.8176.8-12.600111.7Q185 M186 T187 L191 N192 E193Q185-Q189 PolarHBondContact O-N 3.06Å; Q185-Q189 VanDerWaalsContact O-N 3.14Å; M186-Q189 PolarHBondContact O-N 3.37Å; T187-Q189 VanDerWaalsContact C-N 3.33Å; T187-Q189 PolarHBondContact O-N 2.77Å; Q189-L191 VanDerWaalsContact C-N 3.33Å; Q189-L191 PolarHBondContact O-N 2.74Å; Q189-N192 PolarHBondContact O-N 3.5Å; Q189-E193 PolarHBondContact O-N 2.93Å
190A87.4Confident84.9Confident2 Ų262.3 Ų62.32%0.01731%0.31CS..Hα-helixtrans-59.8-44.3176.600000111.5Q151 T155 M186 T187 N192 E193 I194Q151-A190 HydrophobicContact CB-CB 4.28Å; Q151-A190 VanDerWaalsContact OE1-CB 3.3Å; T155-A190 HydrophobicContact CG2-CB 3.66Å; M186-A190 PolarHBondContact O-N 3.24Å; T187-A190 PolarHBondContact O-N 3.34Å; A190-N192 PolarHBondContact O-N 2.94Å; A190-E193 PolarHBondContact O-N 3.4Å; A190-I194 VanDerWaalsContact O-CG1 3.27Å; A190-I194 WeakPolarHBondContact O-CG1 3.48Å; A190-I194 PolarHBondContact O-N 3.27Å
191L87.1Confident85.7Confident17 Ų1761.6 Ų61.69%0.08931%0.306CS..Hα-helixtrans-61.8-40.7176-74.3177.2000112.9T177 I180 M182 T187 Q189 I194 E195T177-L191 HydrophobicContact CG2-CD1 4.24Å; T177-L191 HydrophobicContact CG2-CD2 3.74Å; I180-L191 HydrophobicContact CD1-CD2 3.78Å; I180-L191 HydrophobicContact CG2-CD1 4.27Å; M182-L191 HydrophobicContact CE-CD1 4.44Å; M182-L191 HydrophobicContact CG-CD1 4.24Å; T187-L191 HydrophobicContact CG2-CD1 4.49Å; T187-L191 WeakPolarHBondContact O-CG 3.47Å; T187-L191 PolarHBondContact O-N 2.95Å; Q189-L191 VanDerWaalsContact C-N 3.33Å; Q189-L191 PolarHBondContact O-N 2.74Å; L191-I194 HydrophobicContact CD2-CD1 4.4Å; L191-I194 PolarHBondContact O-N 2.82Å; L191-E195 WeakPolarHBondContact O-CB 3.46Å; L191-E195 PolarHBondContact O-N 3.03Å
192N88.1Confident86.6Confident68 Ų6856.9 Ų56.936%0.36429%0.288SS..Hα-helixtrans-66.9-37.6177.4-176.8-115.4000112.6N65 K188 Q189 A190 T196N65-N192 PolarHBondContact OD1-OD1 2.86Å; K188-N192 PolarHBondContact O-N 3.03Å; K188-N192 VanDerWaalsContact O-N 3.12Å; Q189-N192 PolarHBondContact O-N 3.5Å; A190-N192 PolarHBondContact O-N 2.94Å; N192-T196 WeakPolarHBondContact O-CB 3.22Å; N192-T196 PolarHBondContact O-N 2.72Å; N192-T196 PolarHBondContact O-OG1 3.2Å
193E89.6Confident87.4Confident7 Ų755.8 Ų55.83%0.03328%0.28CS..Hα-helixtrans-66.8-42.4172.9-173.8171.5170.800110.7R147 Q151 Q189 A190 E195 T196 R197R147-E193 IonicContact NH1-OE1 2.69Å; R147-E193 PolarHBondContact NH1-OE1 2.89Å; R147-E193 VanDerWaalsContact NH1-OE1 3.14Å; Q151-E193 HydrophobicContact CG-CB 4.25Å; Q151-E193 HydrophobicContact CG-CG 4.21Å; Q151-E193 PolarHBondContact NE2-OE2 3.37Å; Q189-E193 PolarHBondContact O-N 2.93Å; A190-E193 PolarHBondContact O-N 3.4Å; E193-E195 PolarHBondContact O-N 2.88Å; E193-T196 PolarHBondContact O-N 3.43Å; E193-R197 HydrophobicContact CG-CG 4.32Å; E193-R197 WeakPolarHBondContact O-CG 3.45Å; E193-R197 PolarHBondContact O-N 3.02Å
194I90.8Very high88.2Confident1 Ų149.5 Ų49.51%0.00525%0.247CC..Hα-helixtrans-57.2-49175.5-70.4164.9000110.9I148 Q151 L152 F176 A190 L191 T196 R197 H198I148-I194 HydrophobicContact CG2-CG1 4.29Å; I148-I194 HydrophobicContact CG2-CG2 4.08Å; Q151-I194 HydrophobicContact CB-CD1 3.73Å; Q151-I194 HydrophobicContact CB-CG1 3.52Å; Q151-I194 HydrophobicContact CG-CG1 4.31Å; L152-I194 HydrophobicContact CD2-CD1 3.87Å; L152-I194 HydrophobicContact CG-CD1 4.03Å; F176-I194 HydrophobicContact CB-CG2 3.85Å; F176-I194 HydrophobicContact CD1-CG2 3.78Å; F176-I194 HydrophobicContact CD2-CG2 4.3Å; F176-I194 HydrophobicContact CE1-CG2 4.47Å; F176-I194 HydrophobicContact CG-CG2 3.7Å; A190-I194 VanDerWaalsContact O-CG1 3.27Å; A190-I194 WeakPolarHBondContact O-CG1 3.48Å; A190-I194 PolarHBondContact O-N 3.27Å; L191-I194 HydrophobicContact CD2-CD1 4.4Å; L191-I194 PolarHBondContact O-N 2.82Å; I194-T196 VanDerWaalsContact C-N 3.32Å; I194-T196 PolarHBondContact O-N 3.13Å; I194-R197 PolarHBondContact O-N 2.94Å; I194-H198 VanDerWaalsContact O-CB 3.27Å; I194-H198 WeakPolarHBondContact O-CB 3.44Å; I194-H198 PolarHBondContact O-N 3.48Å
195E89.2Confident88.6Confident89 Ų8949.8 Ų49.842%0.41624%0.242SC..Hα-helixtrans-58.5-44177.8177.2175.4-160.400112.1L173 L191 E193 H198 T199L173-E195 HydrophobicContact CD1-CB 3.92Å; L173-E195 HydrophobicContact CD1-CG 4.11Å; L173-E195 HydrophobicContact CD2-CB 4.17Å; L173-E195 HydrophobicContact CD2-CG 3.64Å; L191-E195 WeakPolarHBondContact O-CB 3.46Å; L191-E195 PolarHBondContact O-N 3.03Å; E193-E195 PolarHBondContact O-N 2.88Å; E195-H198 PolarHBondContact O-N 3.44Å; E195-T199 WeakPolarHBondContact O-CB 3.23Å; E195-T199 PolarHBondContact O-N 3.29Å; E195-T199 PolarHBondContact O-OG1 2.89Å
196T90.1Very high88.9Confident19 Ų1945.2 Ų45.212%0.11722%0.223CC..Hα-helixtrans-61.3-48.9177.8-60.90000111P66 N192 E193 I194 T199 E200P66-T196 HydrophobicContact CG-CG2 4.34Å; N192-T196 WeakPolarHBondContact O-CB 3.22Å; N192-T196 PolarHBondContact O-N 2.72Å; N192-T196 PolarHBondContact O-OG1 3.2Å; E193-T196 PolarHBondContact O-N 3.43Å; I194-T196 VanDerWaalsContact C-N 3.32Å; I194-T196 PolarHBondContact O-N 3.13Å; T196-T199 PolarHBondContact O-N 3.32Å; T196-E200 WeakPolarHBondContact O-CG 3.42Å; T196-E200 PolarHBondContact O-N 2.75Å
197R92.1Very high89Confident0 Ų039.7 Ų39.70%020%0.197CC..Hα-helixtrans-67.4-38.7179.7-62.3-53.6168.5-166-4.6113I60 A63 C144 R147 I148 E193 I194 T199 E200 I201I60-R197 VanDerWaalsContact CG2-NH1 3.28Å; I60-R197 PolarHBondContact O-NH1 3.1Å; I60-R197 VanDerWaalsContact O-NH1 3.09Å; I60-R197 PolarHBondContact O-NH2 3.04Å; A63-R197 PolarHBondContact O-NH2 3.49Å; C144-R197 HydrophobicContact CB-CB 4.4Å; R147-R197 HydrophobicContact CB-CG 4.27Å; I148-R197 HydrophobicContact CD1-CB 3.89Å; I148-R197 HydrophobicContact CG1-CB 3.68Å; I148-R197 HydrophobicContact CG1-CG 4.47Å; E193-R197 HydrophobicContact CG-CG 4.32Å; E193-R197 WeakPolarHBondContact O-CG 3.45Å; E193-R197 PolarHBondContact O-N 3.02Å; I194-R197 PolarHBondContact O-N 2.94Å; R197-T199 VanDerWaalsContact C-N 3.32Å; R197-T199 PolarHBondContact O-N 3.41Å; R197-E200 WeakPolarHBondContact CD-OE2 3.37Å; R197-E200 IonicContact CZ-OE2 3.79Å; R197-E200 IonicContact NH1-OE1 2.79Å; R197-E200 PolarHBondContact NH1-OE1 3.08Å; R197-E200 IonicContact NH1-OE2 3.76Å; R197-E200 PolarHBondContact NH1-OE2 3.34Å; R197-E200 WeakPolarHBondContact O-CB 3.42Å; R197-E200 PolarHBondContact O-N 2.83Å; R197-I201 WeakPolarHBondContact O-CG1 3.3Å; R197-I201 PolarHBondContact O-N 3.5Å
198H91.5Very high89.1Confident7 Ų741 Ų413%0.03220%0.203CC..Hα-helixtrans-61.6-43.5175.2178.2-105.2000111.2I148 F176 I194 E195 E200 I201 I202I148-H198 HydrophobicContact CD1-CB 4.45Å; F176-H198 AromaticContact CE2-CD2 3.71Å; I194-H198 VanDerWaalsContact O-CB 3.27Å; I194-H198 WeakPolarHBondContact O-CB 3.44Å; I194-H198 PolarHBondContact O-N 3.48Å; E195-H198 PolarHBondContact O-N 3.44Å; H198-E200 VanDerWaalsContact C-N 3.31Å; H198-E200 PolarHBondContact O-N 2.87Å; H198-I201 PolarHBondContact O-N 3.34Å; H198-I202 WeakPolarHBondContact CE1-CD1 3.42Å; H198-I202 WeakPolarHBondContact O-CG1 3.46Å; H198-I202 PolarHBondContact O-N 2.79Å
199T89.8Confident89.2Confident61 Ų6142.4 Ų42.437%0.37421%0.205SC..Hα-helixtrans-61.9-39.9175.5-57.20000111.8E195 T196 R197 I202 K203E195-T199 WeakPolarHBondContact O-CB 3.23Å; E195-T199 PolarHBondContact O-N 3.29Å; E195-T199 PolarHBondContact O-OG1 2.89Å; T196-T199 PolarHBondContact O-N 3.32Å; R197-T199 VanDerWaalsContact C-N 3.32Å; R197-T199 PolarHBondContact O-N 3.41Å; T199-I202 PolarHBondContact O-N 2.93Å; T199-K203 WeakPolarHBondContact O-CG 3.37Å; T199-K203 PolarHBondContact O-N 3.26Å
200E90.2Very high88.9Confident21 Ų2142.8 Ų42.810%0.09821%0.207CC..Hα-helixtrans-63-42174.9-71.7169.5-171.100112.2I60 Y140 T196 R197 H198 K203 L204I60-E200 WeakPolarHBondContact CG2-OE1 3.4Å; Y140-E200 HydrophobicContact CE1-CB 4.26Å; Y140-E200 PolarHBondContact OH-OE2 2.83Å; T196-E200 WeakPolarHBondContact O-CG 3.42Å; T196-E200 PolarHBondContact O-N 2.75Å; R197-E200 WeakPolarHBondContact CD-OE2 3.37Å; R197-E200 IonicContact CZ-OE2 3.79Å; R197-E200 IonicContact NH1-OE1 2.79Å; R197-E200 PolarHBondContact NH1-OE1 3.08Å; R197-E200 IonicContact NH1-OE2 3.76Å; R197-E200 PolarHBondContact NH1-OE2 3.34Å; R197-E200 WeakPolarHBondContact O-CB 3.42Å; R197-E200 PolarHBondContact O-N 2.83Å; H198-E200 VanDerWaalsContact C-N 3.31Å; H198-E200 PolarHBondContact O-N 2.87Å; E200-K203 PolarHBondContact O-N 3.09Å; E200-L204 WeakPolarHBondContact O-CB 3.49Å; E200-L204 PolarHBondContact O-N 2.87Å
201I93Very high88.6Confident3 Ų342.9 Ų42.92%0.01521%0.207CC..Hα-helixtrans-59.9-46.3174.6-69.7171000110.7R141 C144 I148 L168 R197 H198 K203 L204 E205R141-I201 HydrophobicContact CG-CG1 4.5Å; R141-I201 HydrophobicContact CG-CG2 4.31Å; C144-I201 HydrophobicContact CB-CD1 3.76Å; C144-I201 HydrophobicContact CB-CG1 3.62Å; I148-I201 HydrophobicContact CD1-CD1 3.77Å; L168-I201 HydrophobicContact CD1-CD1 4.15Å; L168-I201 HydrophobicContact CD2-CD1 3.76Å; R197-I201 WeakPolarHBondContact O-CG1 3.3Å; R197-I201 PolarHBondContact O-N 3.5Å; H198-I201 PolarHBondContact O-N 3.34Å; I201-K203 PolarHBondContact O-N 3.46Å; I201-L204 WeakPolarHBondContact O-CB 3.38Å; I201-L204 PolarHBondContact O-N 3.43Å; I201-E205 HydrophobicContact CG2-CG 4.27Å; I201-E205 WeakPolarHBondContact O-CG 3.5Å; I201-E205 PolarHBondContact O-N 3.36Å
202I90.9Very high88.3Confident60 Ų6047 Ų4731%0.30823%0.225SC..Hα-helixtrans-60.1-45.8178.7-69.3168.8000111.3H198 T199 L204 E205 N206H198-I202 WeakPolarHBondContact CE1-CD1 3.42Å; H198-I202 WeakPolarHBondContact O-CG1 3.46Å; H198-I202 PolarHBondContact O-N 2.79Å; T199-I202 PolarHBondContact O-N 2.93Å; I202-L204 VanDerWaalsContact C-N 3.3Å; I202-L204 PolarHBondContact O-N 3.14Å; I202-E205 PolarHBondContact O-N 3.39Å; I202-N206 WeakPolarHBondContact O-CB 3.33Å; I202-N206 PolarHBondContact O-N 2.98Å; I202-N206 PolarHBondContact O-ND2 3.05Å
203K89.6Confident87.7Confident93 Ų9349 Ų4940%0.40424%0.236SC..Hα-helixtrans-60.8-42178-73.2-179.8-178.7-176.80111.3E75 T199 E200 I201 N206 S207E75-K203 WeakPolarHBondContact OE1-CE 3.01Å; E75-K203 IonicContact OE1-NZ 3.2Å; E75-K203 PolarHBondContact OE1-NZ 3.17Å; T199-K203 WeakPolarHBondContact O-CG 3.37Å; T199-K203 PolarHBondContact O-N 3.26Å; E200-K203 PolarHBondContact O-N 3.09Å; I201-K203 PolarHBondContact O-N 3.46Å; K203-N206 PolarHBondContact O-N 3.4Å; K203-S207 PolarHBondContact O-N 3.29Å
204L90.7Very high87.3Confident7 Ų748.9 Ų48.94%0.03724%0.236CC..Hα-helixtrans-63.9-48.3177.4179.4142.6000112.5Q137 Y140 R141 E200 I201 I202 N206 S207 I208Q137-L204 HydrophobicContact CB-CD1 3.93Å; Q137-L204 HydrophobicContact CB-CD2 4.4Å; Q137-L204 HydrophobicContact CB-CG 4.08Å; Q137-L204 WeakPolarHBondContact O-CD1 3.34Å; Q137-L204 VanDerWaalsContact OE1-CG 3.24Å; Y140-L204 HydrophobicContact CD1-CD1 3.58Å; Y140-L204 HydrophobicContact CG-CD1 4.29Å; R141-L204 HydrophobicContact CB-CD1 4.3Å; R141-L204 HydrophobicContact CB-CD2 3.71Å; R141-L204 HydrophobicContact CG-CD2 3.91Å; E200-L204 WeakPolarHBondContact O-CB 3.49Å; E200-L204 PolarHBondContact O-N 2.87Å; I201-L204 WeakPolarHBondContact O-CB 3.38Å; I201-L204 PolarHBondContact O-N 3.43Å; I202-L204 VanDerWaalsContact C-N 3.3Å; I202-L204 PolarHBondContact O-N 3.14Å; L204-N206 VanDerWaalsContact C-N 3.28Å; L204-N206 PolarHBondContact O-N 2.87Å; L204-S207 WeakPolarHBondContact O-CB 3.07Å; L204-S207 PolarHBondContact O-N 3.45Å; L204-S207 VanDerWaalsContact O-N 3.09Å; L204-I208 HydrophobicContact CD2-CD1 3.6Å; L204-I208 HydrophobicContact CD2-CG1 4.43Å; L204-I208 HydrophobicContact CG-CD1 4.31Å; L204-I208 WeakPolarHBondContact O-CG1 3.31Å; L204-I208 PolarHBondContact O-N 3.03Å
205E89.3Confident86.7Confident57 Ų5751.1 Ų51.127%0.26625%0.246SC..Hα-helixtrans-62.6-36.8178.5-73.2179.417400111.7R141 I201 I202 R209R141-E205 IonicContact NE-OE1 2.77Å; R141-E205 IonicContact NH2-OE1 2.93Å; R141-E205 PolarHBondContact NH2-OE1 3.39Å; I201-E205 HydrophobicContact CG2-CG 4.27Å; I201-E205 WeakPolarHBondContact O-CG 3.5Å; I201-E205 PolarHBondContact O-N 3.36Å; I202-E205 PolarHBondContact O-N 3.39Å; E205-R209 VanDerWaalsContact O-CB 3.27Å; E205-R209 WeakPolarHBondContact O-CB 3.46Å; E205-R209 PolarHBondContact O-N 2.85Å
206N88.4Confident86.2Confident71 Ų7150 Ų5038%0.3824%0.244SC..Hα-helixtrans-63.4-45.1171.8-70-22.4000111.6I202 K203 L204 I208 R209 E210I202-N206 WeakPolarHBondContact O-CB 3.33Å; I202-N206 PolarHBondContact O-N 2.98Å; I202-N206 PolarHBondContact O-ND2 3.05Å; K203-N206 PolarHBondContact O-N 3.4Å; L204-N206 VanDerWaalsContact C-N 3.28Å; L204-N206 PolarHBondContact O-N 2.87Å; N206-I208 PolarHBondContact O-N 2.96Å; N206-R209 PolarHBondContact O-N 3.39Å; N206-R209 PolarHBondContact OD1-NH1 2.93Å; N206-E210 VanDerWaalsContact O-CG 3.3Å; N206-E210 WeakPolarHBondContact O-CG 3.27Å; N206-E210 PolarHBondContact O-N 3.17Å
207S86Confident85.5Confident10 Ų1051.3 Ų51.37%0.0725%0.251CS..Hα-helixtrans-59.9-45.1176.6-177.10000112.3T78 Y133 K203 L204 E210 L211T78-S207 WeakPolarHBondContact CG2-OG 3.13Å; Y133-S207 PolarHBondContact OH-OG 2.76Å; K203-S207 PolarHBondContact O-N 3.29Å; L204-S207 WeakPolarHBondContact O-CB 3.07Å; L204-S207 PolarHBondContact O-N 3.45Å; L204-S207 VanDerWaalsContact O-N 3.09Å; S207-E210 PolarHBondContact O-N 3.35Å; S207-L211 WeakPolarHBondContact O-CG 3.33Å; S207-L211 PolarHBondContact O-N 3.49Å
208I86.1Confident84.5Confident46 Ų4651.7 Ų51.724%0.23625%0.253CS..Hα-helixtrans-63-44.4176.3-65.6175.4000110.4Q137 L204 N206 E210 L211 H212Q137-I208 HydrophobicContact CB-CD1 3.84Å; Q137-I208 HydrophobicContact CB-CG1 4.07Å; Q137-I208 HydrophobicContact CG-CG1 4.44Å; L204-I208 HydrophobicContact CD2-CD1 3.6Å; L204-I208 HydrophobicContact CD2-CG1 4.43Å; L204-I208 HydrophobicContact CG-CD1 4.31Å; L204-I208 WeakPolarHBondContact O-CG1 3.31Å; L204-I208 PolarHBondContact O-N 3.03Å; N206-I208 PolarHBondContact O-N 2.96Å; I208-E210 VanDerWaalsContact C-N 3.33Å; I208-E210 PolarHBondContact O-N 3.29Å; I208-L211 CarbonylContact O-C 3.52Å; I208-L211 PolarHBondContact O-N 3.18Å; I208-L211 VanDerWaalsContact O-N 3.14Å; I208-H212 PolarHBondContact O-N 2.99Å
209R86.8Confident83.6Confident147 Ų14754.2 Ų54.256%0.55528%0.275SS*.Hα-helixtrans-62.2-40179.5-169.6-178.4-60.1105.41.7112.1E205 N206 L211 H212E205-R209 VanDerWaalsContact O-CB 3.27Å; E205-R209 WeakPolarHBondContact O-CB 3.46Å; E205-R209 PolarHBondContact O-N 2.85Å; N206-R209 PolarHBondContact O-N 3.39Å; N206-R209 PolarHBondContact OD1-NH1 2.93Å; R209-L211 PolarHBondContact O-N 2.98Å; R209-H212 WeakPolarHBondContact O-CB 3.47Å; R209-H212 PolarHBondContact O-N 3.44Å
210E80.4Confident82.8Confident113 Ų11356.1 Ų56.153%0.52828%0.281SS..Hα-helixtrans-66.8-25.6177-72.3-177154.300113.4K82 N206 S207 I208K82-E210 WeakPolarHBondContact CE-OE2 3.2Å; K82-E210 IonicContact NZ-OE1 3.74Å; K82-E210 PolarHBondContact NZ-OE1 2.95Å; K82-E210 IonicContact NZ-OE2 3.8Å; K82-E210 PolarHBondContact NZ-OE2 3.49Å; N206-E210 VanDerWaalsContact O-CG 3.3Å; N206-E210 WeakPolarHBondContact O-CG 3.27Å; N206-E210 PolarHBondContact O-N 3.17Å; S207-E210 PolarHBondContact O-N 3.35Å; I208-E210 VanDerWaalsContact C-N 3.33Å; I208-E210 PolarHBondContact O-N 3.29Å
211L81.4Confident81.8Confident3 Ų356 Ų562%0.01628%0.281CS..Hα-helixtrans-93.6-7.5175.7-64.7171.5000112.8K82 M130 Y133 S207 I208 R209 D213 M214 F215K82-L211 HydrophobicContact CG-CD2 4.48Å; M130-L211 HydrophobicContact CE-CD1 4.04Å; M130-L211 HydrophobicContact CE-CD2 4.24Å; Y133-L211 HydrophobicContact CD1-CD1 3.83Å; Y133-L211 HydrophobicContact CE1-CD1 3.35Å; S207-L211 WeakPolarHBondContact O-CG 3.33Å; S207-L211 PolarHBondContact O-N 3.49Å; I208-L211 CarbonylContact O-C 3.52Å; I208-L211 PolarHBondContact O-N 3.18Å; I208-L211 VanDerWaalsContact O-N 3.14Å; R209-L211 PolarHBondContact O-N 2.98Å; L211-D213 VanDerWaalsContact C-N 3.34Å; L211-D213 PolarHBondContact O-N 3.33Å; L211-M214 HydrophobicContact CD2-CE 3.83Å; L211-M214 HydrophobicContact CD2-SD 4.28Å; L211-M214 WeakPolarHBondContact O-CA 3.29Å; L211-M214 VanDerWaalsContact O-CB 3.28Å; L211-M214 WeakPolarHBondContact O-CB 3.37Å; L211-M214 PolarHBondContact O-N 3.33Å; L211-F215 HydrophobicContact CB-CD2 4.26Å; L211-F215 HydrophobicContact CB-CE2 3.92Å; L211-F215 VanDerWaalsContact O-CD2 3.23Å; L211-F215 WeakPolarHBondContact O-CD2 3.29Å; L211-F215 PolarHBondContact O-N 3.21Å
212H80.6Confident80.6Confident103 Ų10358.5 Ų58.548%0.47730%0.296SS..Hα-helixtrans-56.3-46.8-179.3178.2-88.8000112I208 R209 M214 F215 V216I208-H212 PolarHBondContact O-N 2.99Å; R209-H212 WeakPolarHBondContact O-CB 3.47Å; R209-H212 PolarHBondContact O-N 3.44Å; H212-M214 PolarHBondContact O-N 2.96Å; H212-F215 WeakPolarHBondContact O-CB 3.17Å; H212-F215 PolarHBondContact O-N 2.92Å; H212-V216 VanDerWaalsContact CE1-CG2 3.44Å; H212-V216 WeakPolarHBondContact CE1-CG2 3.43Å; H212-V216 WeakPolarHBondContact O-CG2 3Å; H212-V216 PolarHBondContact O-N 3.39Å
213D75.9Confident79.5Confident110 Ų11063.3 Ų63.359%0.58832%0.317SS*.Hα-helixtrans-59.7-34.3178.5-67.3-9.2000111.7L211 D217L211-D213 VanDerWaalsContact C-N 3.34Å; L211-D213 PolarHBondContact O-N 3.33Å; D213-D217 WeakPolarHBondContact O-CB 2.9Å; D213-D217 PolarHBondContact O-N 3.5Å
214M80.4Confident78.1Confident5 Ų563 Ų633%0.02533%0.326CS..Hα-helixtrans-69.7-40.8174.8-174-176.3-55.200111.6A85 F126 M130 L211 H212 D217 M218A85-M214 HydrophobicContact CB-CE 3.69Å; A85-M214 HydrophobicContact CB-SD 3.58Å; A85-M214 VanDerWaalsContact CB-SD 3.58Å; F126-M214 HydrophobicContact CE1-CG 4.44Å; F126-M214 HydrophobicContact CE1-SD 4.25Å; F126-M214 HydrophobicContact CZ-CG 4.38Å; F126-M214 HydrophobicContact CZ-SD 3.63Å; M130-M214 HydrophobicContact CE-SD 4.1Å; L211-M214 HydrophobicContact CD2-CE 3.83Å; L211-M214 HydrophobicContact CD2-SD 4.28Å; L211-M214 WeakPolarHBondContact O-CA 3.29Å; L211-M214 VanDerWaalsContact O-CB 3.28Å; L211-M214 WeakPolarHBondContact O-CB 3.37Å; L211-M214 PolarHBondContact O-N 3.33Å; H212-M214 PolarHBondContact O-N 2.96Å; M214-D217 PolarHBondContact O-N 3.5Å; M214-M218 HydrophobicContact CG-CG 4.47Å; M214-M218 WeakPolarHBondContact O-CB 3.47Å; M214-M218 WeakPolarHBondContact O-CG 3.45Å; M214-M218 PolarHBondContact O-N 3.02Å
215F77.8Confident76.4Confident49 Ų4964.5 Ų64.522%0.21533%0.333CS..Hα-helixtrans-64-40.1176-74.7-61.6000112.5M130 N134 L211 H212 M218 A219M130-F215 HydrophobicContact CB-CE1 3.64Å; M130-F215 HydrophobicContact CB-CZ 4.12Å; M130-F215 HydrophobicContact CE-CZ 4.29Å; M130-F215 WeakPolarHBondContact O-CE1 3.43Å; M130-F215 VanDerWaalsContact O-CZ 3.3Å; M130-F215 WeakPolarHBondContact O-CZ 3.36Å; N134-F215 HydrophobicContact CB-CE1 4.43Å; N134-F215 HydrophobicContact CB-CE2 4.27Å; N134-F215 HydrophobicContact CB-CZ 3.77Å; L211-F215 HydrophobicContact CB-CD2 4.26Å; L211-F215 HydrophobicContact CB-CE2 3.92Å; L211-F215 VanDerWaalsContact O-CD2 3.23Å; L211-F215 WeakPolarHBondContact O-CD2 3.29Å; L211-F215 PolarHBondContact O-N 3.21Å; H212-F215 WeakPolarHBondContact O-CB 3.17Å; H212-F215 PolarHBondContact O-N 2.92Å; F215-M218 PolarHBondContact O-N 3.03Å; F215-A219 WeakPolarHBondContact O-CB 3.43Å; F215-A219 PolarHBondContact O-N 3.09Å
216V80Confident74.8Confident64 Ų6463.5 Ų63.539%0.38834%0.339SS..Hα-helixtrans-64.3-49.1176.4174.80000110.8H212 M218 A219 M220H212-V216 VanDerWaalsContact CE1-CG2 3.44Å; H212-V216 WeakPolarHBondContact CE1-CG2 3.43Å; H212-V216 WeakPolarHBondContact O-CG2 3Å; H212-V216 PolarHBondContact O-N 3.39Å; V216-M218 VanDerWaalsContact C-N 3.29Å; V216-M218 PolarHBondContact O-N 3.5Å; V216-A219 PolarHBondContact O-N 3.39Å; V216-M220 HydrophobicContact CG1-CE 4.05Å; V216-M220 WeakPolarHBondContact O-CG 3.49Å; V216-M220 PolarHBondContact O-N 3.11Å
217D73.8Confident73Confident48 Ų4868.9 Ų68.926%0.25736%0.362SS..Hα-helixtrans-55.4-45.6175-82.2-13.6000111.3R89 D213 M214 M220 L221R89-D217 IonicContact CZ-OD2 3.7Å; R89-D217 IonicContact NH1-OD2 3.1Å; R89-D217 PolarHBondContact NH1-OD2 3.2Å; D213-D217 WeakPolarHBondContact O-CB 2.9Å; D213-D217 PolarHBondContact O-N 3.5Å; M214-D217 PolarHBondContact O-N 3.5Å; D217-M220 PolarHBondContact O-N 3.2Å; D217-L221 WeakPolarHBondContact O-CG 3.15Å; D217-L221 PolarHBondContact O-N 3.32Å
218M72Confident71.2Confident7 Ų773.6 Ų73.63%0.03438%0.384CS..Hα-helixtrans-71-35.7-177.4-72.6-48.897.500113.3R89 F126 V127 M214 F215 V216 M220 L221 V222R89-M218 HydrophobicContact CG-CE 3.94Å; F126-M218 HydrophobicContact CD1-CG 4.13Å; F126-M218 HydrophobicContact CD1-SD 3.62Å; F126-M218 HydrophobicContact CE1-CG 3.88Å; F126-M218 HydrophobicContact CE1-SD 3.63Å; V127-M218 HydrophobicContact CG2-CB 3.71Å; V127-M218 HydrophobicContact CG2-CG 4.07Å; V127-M218 HydrophobicContact CG2-SD 4.46Å; M214-M218 HydrophobicContact CG-CG 4.47Å; M214-M218 WeakPolarHBondContact O-CB 3.47Å; M214-M218 WeakPolarHBondContact O-CG 3.45Å; M214-M218 PolarHBondContact O-N 3.02Å; F215-M218 PolarHBondContact O-N 3.03Å; V216-M218 VanDerWaalsContact C-N 3.29Å; V216-M218 PolarHBondContact O-N 3.5Å; M218-M220 VanDerWaalsContact C-N 3.3Å; M218-M220 PolarHBondContact O-N 3.35Å; M218-L221 HydrophobicContact CE-CD1 3.3Å; M218-L221 HydrophobicContact CE-CG 4.33Å; M218-L221 PolarHBondContact O-N 3.03Å; M218-L221 HydrophobicContact SD-CD1 3.92Å; M218-V222 WeakPolarHBondContact O-CG2 3.37Å; M218-V222 PolarHBondContact O-N 2.77Å
219A71.8Confident69.5Low60 Ų6073.3 Ų73.350%0.49638%0.382SS..Hα-helixtrans-60.5-43.9174.500000110.5F215 V216 V222 E223F215-A219 WeakPolarHBondContact O-CB 3.43Å; F215-A219 PolarHBondContact O-N 3.09Å; V216-A219 PolarHBondContact O-N 3.39Å; A219-V222 PolarHBondContact O-N 2.97Å; A219-E223 VanDerWaalsContact O-CB 3.29Å; A219-E223 WeakPolarHBondContact O-CB 3.25Å; A219-E223 PolarHBondContact O-N 3.36Å
220M72.8Confident67.9Low102 Ų10273.4 Ų73.450%0.50239%0.394SS..Hα-helixtrans-65.3-40.4175.1-66.5-174.1-65.500112.4V216 D217 M218 S224V216-M220 HydrophobicContact CG1-CE 4.05Å; V216-M220 WeakPolarHBondContact O-CG 3.49Å; V216-M220 PolarHBondContact O-N 3.11Å; D217-M220 PolarHBondContact O-N 3.2Å; M218-M220 VanDerWaalsContact C-N 3.3Å; M218-M220 PolarHBondContact O-N 3.35Å; M220-S224 VanDerWaalsContact O-CB 3.31Å; M220-S224 WeakPolarHBondContact O-CB 3.45Å; M220-S224 PolarHBondContact O-N 2.96Å; M220-S224 PolarHBondContact O-OG 3.45Å
221L69.2Low66.5Low19 Ų1975.8 Ų75.810%0.09940%0.398CS..Hα-helixtrans-64.7-39.3176.8-76.6-178.6000112.9E96 D217 M218 S224 Q225E96-L221 VanDerWaalsContact CD-CD2 3.41Å; E96-L221 WeakPolarHBondContact OE1-CD2 3.37Å; E96-L221 WeakPolarHBondContact OE2-CD2 3.48Å; D217-L221 WeakPolarHBondContact O-CG 3.15Å; D217-L221 PolarHBondContact O-N 3.32Å; M218-L221 HydrophobicContact CE-CD1 3.3Å; M218-L221 HydrophobicContact CE-CG 4.33Å; M218-L221 PolarHBondContact O-N 3.03Å; M218-L221 HydrophobicContact SD-CD1 3.92Å; L221-S224 PolarHBondContact O-OG 3.24Å; L221-Q225 WeakPolarHBondContact O-CB 3.39Å; L221-Q225 WeakPolarHBondContact O-CG 3.39Å; L221-Q225 PolarHBondContact O-N 2.57Å; L221-Q225 PolarHBondContact O-NE2 3.22Å
222V68.6Low65.1Low55 Ų5582.4 Ų82.433%0.33343%0.432SS..Hα-helixtrans-74.4-38.7178.81740000111.1V127 M218 A219 Q225V127-V222 HydrophobicContact CB-CG2 4.41Å; V127-V222 HydrophobicContact CG2-CG2 3.71Å; M218-V222 WeakPolarHBondContact O-CG2 3.37Å; M218-V222 PolarHBondContact O-N 2.77Å; A219-V222 PolarHBondContact O-N 2.97Å; V222-Q225 PolarHBondContact O-N 3.43Å
223E68.5Low63.5Low160 Ų16084.4 Ų84.475%0.74844%0.441SS*.Hα-helixtrans-64.9-45.7177.8-175.6172.8-163.700112A219 Q225 G226A219-E223 VanDerWaalsContact O-CB 3.29Å; A219-E223 WeakPolarHBondContact O-CB 3.25Å; A219-E223 PolarHBondContact O-N 3.36Å; E223-Q225 VanDerWaalsContact C-N 3.31Å; E223-Q225 PolarHBondContact O-N 3.12Å; E223-G226 PolarHBondContact O-N 2.69Å
224S60.1Low62.7Low86 Ų8682.9 Ų82.960%0.60143%0.428SS*.Hα-helixtrans-67.4-27.7179.456.60000113.9M220 L221 G226M220-S224 VanDerWaalsContact O-CB 3.31Å; M220-S224 WeakPolarHBondContact O-CB 3.45Å; M220-S224 PolarHBondContact O-N 2.96Å; M220-S224 PolarHBondContact O-OG 3.45Å; L221-S224 PolarHBondContact O-OG 3.24Å; S224-G226 VanDerWaalsContact C-N 3.31Å; S224-G226 PolarHBondContact O-N 3.18Å
225Q55.3Low61.5Low39 Ų3985 Ų8518%0.18244%0.439CS..Hα-helixtrans-74.3-18.5178.8-77.417881.500113.7H119 S120 L221 V222 E223 I229H119-Q225 PolarHBondContact ND1-OE1 2.92Å; H119-Q225 VanDerWaalsContact ND1-OE1 3.14Å; S120-Q225 VanDerWaalsContact CB-OE1 3.25Å; L221-Q225 WeakPolarHBondContact O-CB 3.39Å; L221-Q225 WeakPolarHBondContact O-CG 3.39Å; L221-Q225 PolarHBondContact O-N 2.57Å; L221-Q225 PolarHBondContact O-NE2 3.22Å; V222-Q225 PolarHBondContact O-N 3.43Å; E223-Q225 VanDerWaalsContact C-N 3.31Å; E223-Q225 PolarHBondContact O-N 3.12Å; Q225-I229 HydrophobicContact CB-CD1 4.46Å
226G54.4Low60.7Low37 Ų3786.7 Ų86.738%0.38145%0.454SS..G310 helixtrans60.5172.4175.900000115.5E223 S224 M228E223-G226 PolarHBondContact O-N 2.69Å; S224-G226 VanDerWaalsContact C-N 3.31Å; S224-G226 PolarHBondContact O-N 3.18Å; G226-M228 PolarHBondContact O-N 2.99Å
227E51.1Low59.6Low184 Ų18489.7 Ų89.786%0.8646%0.463SS*.G310 helixtrans-66.510.2172.4-79.1-171.8149.500113.9I229E227-I229 VanDerWaalsContact C-N 3.32Å; E227-I229 PolarHBondContact O-N 3.33Å
228M48Very low58.7Low108 Ų10890.7 Ų90.753%0.53247%0.466SS..G310 helixtrans-82-5.1-166.6-148.3-176.9-6700114.3G226 Y234G226-M228 PolarHBondContact O-N 2.99Å; M228-Y234 HydrophobicContact CG-CD1 3.86Å; M228-Y234 HydrophobicContact CG-CE1 3.62Å; M228-Y234 HydrophobicContact CG-CE2 4.47Å; M228-Y234 HydrophobicContact CG-CG 4.4Å; M228-Y234 HydrophobicContact SD-CD1 4.25Å; M228-Y234 HydrophobicContact SD-CE1 3.39Å; M228-Y234 WeakPolarHBondContact SD-CE1 3.01Å; M228-Y234 HydrophobicContact SD-CE2 4.28Å; M228-Y234 PolarHBondContact SD-OH 3.1Å; M228-Y234 VanDerWaalsContact SD-OH 3.33Å
229I51.8Low58.1Low40 Ų4092.3 Ų92.321%0.20548%0.478CS..G310 helixtrans-89.1-22.5177.8-80.3100.7000113.4S120 Q225 E227 R231S120-I229 VanDerWaalsContact CB-CD1 3.45Å; S120-I229 VanDerWaalsContact CB-CG1 3.49Å; S120-I229 VanDerWaalsContact OG-CD1 3.25Å; S120-I229 WeakPolarHBondContact OG-CD1 3.22Å; S120-I229 WeakPolarHBondContact OG-CG1 3.31Å; Q225-I229 HydrophobicContact CB-CD1 4.46Å; E227-I229 VanDerWaalsContact C-N 3.32Å; E227-I229 PolarHBondContact O-N 3.33Å; I229-R231 VanDerWaalsContact C-N 3.31Å; I229-R231 PolarHBondContact O-N 3.34Å
230D51.5Low57.3Low149 Ų14993.6 Ų93.680%0.79748%0.48SS*.SBendtrans-86.8-0.3-172.8-145.221.9000114.1I232D230-I232 PolarHBondContact O-N 3.46Å
231R51.7Low56.5Low164 Ų16493.1 Ų93.162%0.61948%0.479SS*.  trans-96.291.6173-67.8-169.7-172.5-154.33.9109.8I229 E233 Y234 N235I229-R231 VanDerWaalsContact C-N 3.31Å; I229-R231 PolarHBondContact O-N 3.34Å; R231-E233 PolarHBondContact O-N 3.4Å; R231-E233 VanDerWaalsContact O-N 3.09Å; R231-Y234 PolarHBondContact O-N 3.42Å; R231-N235 PolarHBondContact O-N 3.23Å
232I51.7Low55.9Low141 Ų14196.7 Ų96.772%0.72349%0.492SS*.Hα-helixtrans-44.8-37.9159.8-64.7173.5000109.8D230 V236D230-I232 PolarHBondContact O-N 3.46Å; I232-V236 HydrophobicContact CG2-CG2 4.3Å; I232-V236 WeakPolarHBondContact O-CB 3.39Å; I232-V236 WeakPolarHBondContact O-CG2 3.37Å; I232-V236 PolarHBondContact O-N 3.32Å
233E48Very low55.6Low145 Ų14598.7 Ų98.768%0.67850%0.504SS*.Hα-helixtrans-60-43.6175.7-168.2171.3-153.700113.7R231 V236 E237R231-E233 PolarHBondContact O-N 3.4Å; R231-E233 VanDerWaalsContact O-N 3.09Å; E233-V236 PolarHBondContact O-N 3.35Å; E233-E237 WeakPolarHBondContact O-CB 3.37Å; E233-E237 PolarHBondContact O-N 3.15Å
234Y58.3Low55Low79 Ų7997.5 Ų97.531%0.3150%0.498SS..Hα-helixtrans-68.5-43.3180-175.9-97.1000111.8M228 R231 V236 E237 H238M228-Y234 HydrophobicContact CG-CD1 3.86Å; M228-Y234 HydrophobicContact CG-CE1 3.62Å; M228-Y234 HydrophobicContact CG-CE2 4.47Å; M228-Y234 HydrophobicContact CG-CG 4.4Å; M228-Y234 HydrophobicContact SD-CD1 4.25Å; M228-Y234 HydrophobicContact SD-CE1 3.39Å; M228-Y234 WeakPolarHBondContact SD-CE1 3.01Å; M228-Y234 HydrophobicContact SD-CE2 4.28Å; M228-Y234 PolarHBondContact SD-OH 3.1Å; M228-Y234 VanDerWaalsContact SD-OH 3.33Å; R231-Y234 PolarHBondContact O-N 3.42Å; Y234-V236 VanDerWaalsContact C-N 3.28Å; Y234-V236 PolarHBondContact O-N 3.22Å; Y234-E237 PolarHBondContact O-N 3.35Å; Y234-H238 AromaticContact CD1-CD2 3.86Å; Y234-H238 AromaticContact CD2-NE2 3.98Å; Y234-H238 AromaticContact CE1-CD2 3.53Å; Y234-H238 AromaticContact CE1-NE2 3.53Å; Y234-H238 AromaticContact CE2-CD2 3.96Å; Y234-H238 AromaticContact CE2-NE2 3.34Å; Y234-H238 VanDerWaalsContact CE2-NE2 3.34Å; Y234-H238 WeakPolarHBondContact CE2-NE2 3.17Å; Y234-H238 AromaticContact CZ-CD2 3.6Å; Y234-H238 AromaticContact CZ-NE2 3.07Å; Y234-H238 PolarHBondContact O-CD2 2.85Å; Y234-H238 PolarHBondContact O-N 2.79Å; Y234-H238 PolarHBondContact OH-NE2 3.23Å
235N55.6Low55Low48 Ų48101.7 Ų101.726%0.25750%0.501SS..Hα-helixtrans-66.6-31.2176.3-80.2-16.9000112.5R113 R231 S239R113-N235 PolarHBondContact NH1-O 3.41Å; R113-N235 VanDerWaalsContact NH1-O 3.1Å; R231-N235 PolarHBondContact O-N 3.23Å; N235-S239 PolarHBondContact O-OG 3.48Å; N235-S239 VanDerWaalsContact O-OG 3.12Å
236V61.3Low55.5Low86 Ų86102.4 Ų102.452%0.52151%0.514SS..Hα-helixtrans-74.3-40.5174.1171.10000111.3I232 E233 Y234 H238 S239I232-V236 HydrophobicContact CG2-CG2 4.3Å; I232-V236 WeakPolarHBondContact O-CB 3.39Å; I232-V236 WeakPolarHBondContact O-CG2 3.37Å; I232-V236 PolarHBondContact O-N 3.32Å; E233-V236 PolarHBondContact O-N 3.35Å; Y234-V236 VanDerWaalsContact C-N 3.28Å; Y234-V236 PolarHBondContact O-N 3.22Å; V236-H238 PolarHBondContact O-N 3.17Å; V236-S239 WeakPolarHBondContact O-CB 3.44Å; V236-S239 PolarHBondContact O-N 3.43Å
237E56.3Low56.2Low126 Ų126104.7 Ų104.759%0.58952%0.52SS*.Hα-helixtrans-56.9-46.7177.6-171.7174.3-168.500111.7E233 Y234 S239 V240E233-E237 WeakPolarHBondContact O-CB 3.37Å; E233-E237 PolarHBondContact O-N 3.15Å; Y234-E237 PolarHBondContact O-N 3.35Å; E237-S239 PolarHBondContact O-N 2.96Å; E237-V240 WeakPolarHBondContact O-CB 2.85Å; E237-V240 WeakPolarHBondContact O-CG2 3.26Å; E237-V240 PolarHBondContact O-N 3.31Å; E237-V240 VanDerWaalsContact O-N 3.16Å
238H55.2Low57.2Low69 Ų6998.5 Ų98.532%0.31950%0.497SS..THydrogen-bonded Turntrans-70.9-8.6176.3-71.4-68.7000114.8Y234 V236 V240Y234-H238 AromaticContact CD1-CD2 3.86Å; Y234-H238 AromaticContact CD2-NE2 3.98Å; Y234-H238 AromaticContact CE1-CD2 3.53Å; Y234-H238 AromaticContact CE1-NE2 3.53Å; Y234-H238 AromaticContact CE2-CD2 3.96Å; Y234-H238 AromaticContact CE2-NE2 3.34Å; Y234-H238 VanDerWaalsContact CE2-NE2 3.34Å; Y234-H238 WeakPolarHBondContact CE2-NE2 3.17Å; Y234-H238 AromaticContact CZ-CD2 3.6Å; Y234-H238 AromaticContact CZ-NE2 3.07Å; Y234-H238 PolarHBondContact O-CD2 2.85Å; Y234-H238 PolarHBondContact O-N 2.79Å; Y234-H238 PolarHBondContact OH-NE2 3.23Å; V236-H238 PolarHBondContact O-N 3.17Å; H238-V240 VanDerWaalsContact C-N 3.32Å
239S58.4Low58.5Low41 Ų4197.6 Ų97.629%0.28750%0.495SS..THydrogen-bonded Turntrans-76.2-22171.9-58.30000112.6R113 N235 V236 E237 D241 Y242R113-S239 VanDerWaalsContact NH1-N 3.13Å; R113-S239 PolarHBondContact NH1-OG 2.87Å; R113-S239 PolarHBondContact NH2-OG 3.44Å; N235-S239 PolarHBondContact O-OG 3.48Å; N235-S239 VanDerWaalsContact O-OG 3.12Å; V236-S239 WeakPolarHBondContact O-CB 3.44Å; V236-S239 PolarHBondContact O-N 3.43Å; E237-S239 PolarHBondContact O-N 2.96Å; S239-D241 VanDerWaalsContact C-N 3.33Å; S239-D241 PolarHBondContact O-N 3.11Å; S239-Y242 PolarHBondContact O-N 2.75Å
240V56.3Low59.6Low88 Ų8899.8 Ų99.853%0.53351%0.51SS..Hα-helixtrans-67.3-35.4-172.1177.20000111.3E237 H238 Y242 V243 E244E237-V240 WeakPolarHBondContact O-CB 2.85Å; E237-V240 WeakPolarHBondContact O-CG2 3.26Å; E237-V240 PolarHBondContact O-N 3.31Å; E237-V240 VanDerWaalsContact O-N 3.16Å; H238-V240 VanDerWaalsContact C-N 3.32Å; V240-Y242 VanDerWaalsContact C-N 3.26Å; V240-Y242 PolarHBondContact O-N 3.18Å; V240-V243 PolarHBondContact O-N 3.48Å; V240-V243 VanDerWaalsContact O-N 3.15Å; V240-E244 PolarHBondContact O-N 3.18Å
241D54.4Low60.6Low91 Ų9199.4 Ų99.449%0.48750%0.501SS..Hα-helixtrans-59.4-31.3-179.8-76.88.1000114S239 R245S239-D241 VanDerWaalsContact C-N 3.33Å; S239-D241 PolarHBondContact O-N 3.11Å; D241-R245 PolarHBondContact O-N 3.01Å
242Y57.5Low61.9Low95 Ų9596.2 Ų96.237%0.37349%0.492SS..Hα-helixtrans-73.4-37.7178.9-85.8-89.7000112.6S108 S239 V240 E244 R245 A246S108-Y242 WeakPolarHBondContact O-CE2 3.44Å; S108-Y242 PolarHBondContact O-OH 3.15Å; S239-Y242 PolarHBondContact O-N 2.75Å; V240-Y242 VanDerWaalsContact C-N 3.26Å; V240-Y242 PolarHBondContact O-N 3.18Å; Y242-E244 VanDerWaalsContact C-N 3.3Å; Y242-R245 PolarHBondContact O-N 3.49Å; Y242-A246 WeakPolarHBondContact O-CB 3.36Å; Y242-A246 PolarHBondContact O-N 3.16Å
243V61.9Low63.1Low96 Ų9692.1 Ų92.158%0.58248%0.479SS*.Hα-helixtrans-66.2-39.2175.4179.30000109.7V240 R245 A246 V247V240-V243 PolarHBondContact O-N 3.48Å; V240-V243 VanDerWaalsContact O-N 3.15Å; V243-R245 PolarHBondContact O-N 3.2Å; V243-A246 PolarHBondContact O-N 3.19Å; V243-V247 HydrophobicContact CG1-CG2 4.27Å; V243-V247 WeakPolarHBondContact O-CB 3.42Å; V243-V247 WeakPolarHBondContact O-CG2 3.22Å; V243-V247 PolarHBondContact O-N 3.26Å
244E57.2Low64.5Low135 Ų13589.5 Ų89.563%0.63147%0.473SS*.Hα-helixtrans-65-40.7178.9-166.1170.6-165.200112.6V240 Y242 V247 S248V240-E244 PolarHBondContact O-N 3.18Å; Y242-E244 VanDerWaalsContact C-N 3.3Å; E244-V247 PolarHBondContact O-N 2.92Å; E244-S248 WeakPolarHBondContact O-CB 3.34Å; E244-S248 PolarHBondContact O-N 3.46Å
245R60Low65.5Low174 Ų17491.9 Ų91.966%0.65749%0.485SS*.Hα-helixtrans-65.6-43.6172.6-73.1-175.2-175.6-176.94112.5D241 Y242 V243 V247 S248 D249D241-R245 PolarHBondContact O-N 3.01Å; Y242-R245 PolarHBondContact O-N 3.49Å; V243-R245 PolarHBondContact O-N 3.2Å; R245-V247 VanDerWaalsContact C-N 3.33Å; R245-V247 PolarHBondContact O-N 3.06Å; R245-S248 WeakPolarHBondContact O-CB 3.43Å; R245-S248 PolarHBondContact O-N 2.95Å; R245-S248 VanDerWaalsContact O-N 3.13Å; R245-D249 PolarHBondContact O-N 3.22Å
246A64.7Low66.7Low54 Ų5497.1 Ų97.145%0.44650%0.502SS..Hα-helixtrans-61.9-40.4176.600000112.1Y242 V243 S248 D249 T250Y242-A246 WeakPolarHBondContact O-CB 3.36Å; Y242-A246 PolarHBondContact O-N 3.16Å; V243-A246 PolarHBondContact O-N 3.19Å; A246-S248 VanDerWaalsContact C-N 3.34Å; A246-D249 PolarHBondContact O-N 3.45Å; A246-T250 WeakPolarHBondContact O-CB 3.37Å; A246-T250 VanDerWaalsContact O-CG2 3.26Å; A246-T250 WeakPolarHBondContact O-CG2 3.27Å; A246-T250 PolarHBondContact O-N 3.33Å; A246-T250 PolarHBondContact O-OG1 2.84Å
247V69.9Low67.4Low85 Ų8598.3 Ų98.352%0.51550%0.502SS..Hα-helixtrans-64.4-38.8173.5170.90000111.2V243 E244 R245 T250 K251V243-V247 HydrophobicContact CG1-CG2 4.27Å; V243-V247 WeakPolarHBondContact O-CB 3.42Å; V243-V247 WeakPolarHBondContact O-CG2 3.22Å; V243-V247 PolarHBondContact O-N 3.26Å; E244-V247 PolarHBondContact O-N 2.92Å; R245-V247 VanDerWaalsContact C-N 3.33Å; R245-V247 PolarHBondContact O-N 3.06Å; V247-T250 WeakPolarHBondContact CA-OG1 3.49Å; V247-T250 PolarHBondContact O-OG1 2.95Å; V247-K251 VanDerWaalsContact O-CB 3.27Å; V247-K251 WeakPolarHBondContact O-CB 3.36Å; V247-K251 PolarHBondContact O-N 3.44Å; V247-K251 VanDerWaalsContact O-N 3.09Å
248S71.9Confident68.5Low54 Ų5494 Ų9438%0.37849%0.486SS..Hα-helixtrans-65.4-45.2176.3-171.20000112.3E244 R245 A246 K251 K252E244-S248 WeakPolarHBondContact O-CB 3.34Å; E244-S248 PolarHBondContact O-N 3.46Å; R245-S248 WeakPolarHBondContact O-CB 3.43Å; R245-S248 PolarHBondContact O-N 2.95Å; R245-S248 VanDerWaalsContact O-N 3.13Å; A246-S248 VanDerWaalsContact C-N 3.34Å; S248-K251 WeakPolarHBondContact O-CB 3.43Å; S248-K251 PolarHBondContact O-N 2.9Å; S248-K252 WeakPolarHBondContact O-CG 3.45Å; S248-K252 PolarHBondContact O-N 3.13Å
249D74.2Confident69.7Low90 Ų9095.6 Ų95.648%0.48149%0.494SS..Hα-helixtrans-73.3-37.1-177.5-71.8-19000112.4R245 A246 K251 K252 A253R245-D249 PolarHBondContact O-N 3.22Å; A246-D249 PolarHBondContact O-N 3.45Å; D249-K251 VanDerWaalsContact C-N 3.32Å; D249-K251 PolarHBondContact O-N 2.85Å; D249-K252 PolarHBondContact O-N 3.44Å; D249-K252 IonicContact OD1-NZ 2.57Å; D249-K252 PolarHBondContact OD1-NZ 2.98Å; D249-A253 WeakPolarHBondContact O-CB 3.49Å; D249-A253 PolarHBondContact O-N 3.09Å
250T74.8Confident70.7Confident86 Ų8696 Ų9653%0.52850%0.499SS..Hα-helixtrans-61.6-40.2169.851.10000111.5A246 V247 K252 A253 V254A246-T250 WeakPolarHBondContact O-CB 3.37Å; A246-T250 VanDerWaalsContact O-CG2 3.26Å; A246-T250 WeakPolarHBondContact O-CG2 3.27Å; A246-T250 PolarHBondContact O-N 3.33Å; A246-T250 PolarHBondContact O-OG1 2.84Å; V247-T250 WeakPolarHBondContact CA-OG1 3.49Å; V247-T250 PolarHBondContact O-OG1 2.95Å; T250-K252 PolarHBondContact O-N 2.95Å; T250-A253 PolarHBondContact O-N 3.42Å; T250-V254 WeakPolarHBondContact O-CG2 3.41Å; T250-V254 PolarHBondContact O-N 2.94Å
251K73.9Confident71.9Confident141 Ų14198 Ų9861%0.61350%0.497SS*.Hα-helixtrans-64.5-36.8175.3-165.4173-171.9172.90112.6V247 S248 D249 K255V247-K251 VanDerWaalsContact O-CB 3.27Å; V247-K251 WeakPolarHBondContact O-CB 3.36Å; V247-K251 PolarHBondContact O-N 3.44Å; V247-K251 VanDerWaalsContact O-N 3.09Å; S248-K251 WeakPolarHBondContact O-CB 3.43Å; S248-K251 PolarHBondContact O-N 2.9Å; D249-K251 VanDerWaalsContact C-N 3.32Å; D249-K251 PolarHBondContact O-N 2.85Å; K251-K255 WeakPolarHBondContact O-CG 3.41Å; K251-K255 PolarHBondContact O-N 3.45Å
252K78.8Confident73.2Confident96 Ų96100.8 Ų100.842%0.41751%0.505SS..Hα-helixtrans-68.1-43.5172.3-68.6173.4-158.3151.50111.4S248 D249 T250 V254 K255 Y256S248-K252 WeakPolarHBondContact O-CG 3.45Å; S248-K252 PolarHBondContact O-N 3.13Å; D249-K252 PolarHBondContact O-N 3.44Å; D249-K252 IonicContact OD1-NZ 2.57Å; D249-K252 PolarHBondContact OD1-NZ 2.98Å; T250-K252 PolarHBondContact O-N 2.95Å; K252-V254 PolarHBondContact O-N 3.33Å; K252-K255 WeakPolarHBondContact O-CB 3.39Å; K252-K255 PolarHBondContact O-N 2.96Å; K252-K255 VanDerWaalsContact O-N 3.13Å; K252-Y256 HydrophobicContact CB-CD2 4.43Å; K252-Y256 HydrophobicContact CB-CE2 4.19Å; K252-Y256 WeakPolarHBondContact O-CD2 3.44Å; K252-Y256 PolarHBondContact O-N 2.86Å
253A75.8Confident74.5Confident56 Ų56103 Ų10346%0.46352%0.516SS..Hα-helixtrans-59.2-45.7178.400000111.8D249 T250 K255 Y256 Q257D249-A253 WeakPolarHBondContact O-CB 3.49Å; D249-A253 PolarHBondContact O-N 3.09Å; T250-A253 PolarHBondContact O-N 3.42Å; A253-K255 VanDerWaalsContact C-N 3.33Å; A253-K255 PolarHBondContact O-N 3.27Å; A253-Y256 PolarHBondContact O-N 2.89Å; A253-Q257 WeakPolarHBondContact O-CB 3.15Å; A253-Q257 PolarHBondContact O-N 2.73Å
254V78.2Confident75.6Confident90 Ų90105.5 Ų105.555%0.54552%0.519SS..Hα-helixtrans-60.4-41.8174.4172.60000111.4T250 K252 Q257 S258T250-V254 WeakPolarHBondContact O-CG2 3.41Å; T250-V254 PolarHBondContact O-N 2.94Å; K252-V254 PolarHBondContact O-N 3.33Å; V254-Q257 PolarHBondContact O-N 3.23Å; V254-S258 WeakPolarHBondContact O-CB 3.4Å; V254-S258 PolarHBondContact O-N 3.13Å
255K80.1Confident76.9Confident129 Ų129103.9 Ų103.956%0.56151%0.514SS*.Hα-helixtrans-60.7-48.5174.7-80.1-177.2177.9-178.20111.5K251 K252 A253 Q257 S258 Q259K251-K255 WeakPolarHBondContact O-CG 3.41Å; K251-K255 PolarHBondContact O-N 3.45Å; K252-K255 WeakPolarHBondContact O-CB 3.39Å; K252-K255 PolarHBondContact O-N 2.96Å; K252-K255 VanDerWaalsContact O-N 3.13Å; A253-K255 VanDerWaalsContact C-N 3.33Å; A253-K255 PolarHBondContact O-N 3.27Å; K255-Q257 PolarHBondContact O-N 2.89Å; K255-S258 PolarHBondContact O-N 2.83Å; K255-S258 PolarHBondContact O-OG 3.49Å; K255-Q259 WeakPolarHBondContact O-CG 3.44Å; K255-Q259 PolarHBondContact O-N 3.44Å
256Y80.9Confident78.1Confident158 Ų158101.5 Ų101.562%0.6251%0.512SS*.Hα-helixtrans-61.9-43.2178.1-72.1-54.9000112.3K252 A253 S258 Q259 A260K252-Y256 HydrophobicContact CB-CD2 4.43Å; K252-Y256 HydrophobicContact CB-CE2 4.19Å; K252-Y256 WeakPolarHBondContact O-CD2 3.44Å; K252-Y256 PolarHBondContact O-N 2.86Å; A253-Y256 PolarHBondContact O-N 2.89Å; Y256-S258 VanDerWaalsContact C-N 3.34Å; Y256-S258 PolarHBondContact O-N 3.21Å; Y256-Q259 PolarHBondContact O-N 3.26Å; Y256-A260 WeakPolarHBondContact O-CB 3.44Å; Y256-A260 PolarHBondContact O-N 3.05Å
257Q75.8Confident79.2Confident110 Ų110104 Ų10451%0.51452%0.517SS..Hα-helixtrans-59.6-44.4176-163.5-162.840.600111.2A253 V254 K255 Q259 A260 R261A253-Q257 WeakPolarHBondContact O-CB 3.15Å; A253-Q257 PolarHBondContact O-N 2.73Å; V254-Q257 PolarHBondContact O-N 3.23Å; K255-Q257 PolarHBondContact O-N 2.89Å; Q257-Q259 PolarHBondContact O-N 3.41Å; Q257-A260 PolarHBondContact O-N 3.25Å; Q257-R261 WeakPolarHBondContact O-CG 3.47Å; Q257-R261 PolarHBondContact O-N 3.49Å
258S77.9Confident80.1Confident37 Ų37105 Ų10526%0.25952%0.518SS..Hα-helixtrans-64.2-37.9178.377.90000113V254 K255 Y256 K262V254-S258 WeakPolarHBondContact O-CB 3.4Å; V254-S258 PolarHBondContact O-N 3.13Å; K255-S258 PolarHBondContact O-N 2.83Å; K255-S258 PolarHBondContact O-OG 3.49Å; Y256-S258 VanDerWaalsContact C-N 3.34Å; Y256-S258 PolarHBondContact O-N 3.21Å; S258-K262 WeakPolarHBondContact O-CG 3.43Å; S258-K262 PolarHBondContact O-N 3.24Å
259Q81.6Confident81Confident102 Ų102106.2 Ų106.248%0.47752%0.52SS..Hα-helixtrans-70.8-39.7176.2-70.3-178.95.500111.6K255 Y256 Q257 K262 K263K255-Q259 WeakPolarHBondContact O-CG 3.44Å; K255-Q259 PolarHBondContact O-N 3.44Å; Y256-Q259 PolarHBondContact O-N 3.26Å; Q257-Q259 PolarHBondContact O-N 3.41Å; Q259-K262 PolarHBondContact O-N 3Å; Q259-K263 WeakPolarHBondContact O-CG 3.36Å; Q259-K263 PolarHBondContact O-N 3.45Å
260A79.1Confident81.8Confident49 Ų49105.4 Ų105.441%0.40552%0.52SS..Hα-helixtrans-62.2-41.6175.400000111.7Y256 Q257 K262 K263 K264Y256-A260 WeakPolarHBondContact O-CB 3.44Å; Y256-A260 PolarHBondContact O-N 3.05Å; Q257-A260 PolarHBondContact O-N 3.25Å; A260-K262 PolarHBondContact O-N 3Å; A260-K263 PolarHBondContact O-N 3.44Å; A260-K264 WeakPolarHBondContact O-CG 3.33Å; A260-K264 PolarHBondContact O-N 3.07Å
261R81.4Confident82.5Confident130 Ų130105 Ų10549%0.49152%0.52SS..Hα-helixtrans-59.5-45.6173.9-72.6-167.3-65.4-1090.8112.2Q257 K263 K264 I265Q257-R261 WeakPolarHBondContact O-CG 3.47Å; Q257-R261 PolarHBondContact O-N 3.49Å; R261-K263 PolarHBondContact O-N 2.99Å; R261-K264 PolarHBondContact O-N 3.29Å; R261-I265 WeakPolarHBondContact O-CG1 3.48Å; R261-I265 PolarHBondContact O-N 3.32Å
262K81.6Confident83.4Confident149 Ų149102.5 Ų102.565%0.64852%0.516SS*.Hα-helixtrans-62.1-41.8177.1-70.7178.9-178.9-176.10112.3S258 Q259 A260 I265 M266S258-K262 WeakPolarHBondContact O-CG 3.43Å; S258-K262 PolarHBondContact O-N 3.24Å; Q259-K262 PolarHBondContact O-N 3Å; A260-K262 PolarHBondContact O-N 3Å; K262-I265 PolarHBondContact O-N 2.92Å; K262-M266 WeakPolarHBondContact O-CG 3.35Å; K262-M266 PolarHBondContact O-N 3.1Å; K262-M266 VanDerWaalsContact O-N 3.1Å
263K84.4Confident84Confident141 Ų141102.7 Ų102.761%0.61352%0.521SS*.Hα-helixtrans-64.7-41.4175.8-71.4-179.5-179.8-176.80112.1Q259 A260 R261 I265 M266 I267Q259-K263 WeakPolarHBondContact O-CG 3.36Å; Q259-K263 PolarHBondContact O-N 3.45Å; A260-K263 PolarHBondContact O-N 3.44Å; R261-K263 PolarHBondContact O-N 2.99Å; K263-I265 PolarHBondContact O-N 3.3Å; K263-M266 PolarHBondContact O-N 3.49Å; K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.42Å
264K84.8Confident84.7Confident149 Ų149105.3 Ų105.365%0.64853%0.526SS*.Hα-helixtrans-59.2-45.3174.7-78.4-172.8176.2-173.40112A260 R261 M266 I267 I268A260-K264 WeakPolarHBondContact O-CG 3.33Å; A260-K264 PolarHBondContact O-N 3.07Å; R261-K264 PolarHBondContact O-N 3.29Å; K264-M266 PolarHBondContact O-N 3.48Å; K264-I267 PolarHBondContact O-N 2.99Å; K264-I268 WeakPolarHBondContact O-CG1 3.46Å; K264-I268 PolarHBondContact O-N 3Å
265I86Confident85.2Confident102 Ų102102.9 Ų102.952%0.52352%0.519SS..Hα-helixtrans-61.9-44178-67.1169.2000111R261 K262 K263 I267 I268 I269R261-I265 WeakPolarHBondContact O-CG1 3.48Å; R261-I265 PolarHBondContact O-N 3.32Å; K262-I265 PolarHBondContact O-N 2.92Å; K263-I265 PolarHBondContact O-N 3.3Å; I265-I267 VanDerWaalsContact C-N 3.35Å; I265-I267 PolarHBondContact O-N 3.32Å; I265-I268 PolarHBondContact O-N 3.31Å; I265-I269 HydrophobicContact CG2-CD1 3.87Å; I265-I269 HydrophobicContact CG2-CG1 4.5Å; I265-I269 WeakPolarHBondContact O-CG1 3.43Å; I265-I269 PolarHBondContact O-N 3.5Å
266M84.4Confident85.7Confident123 Ų123100.9 Ų100.961%0.60652%0.518SS*.Hα-helixtrans-62-41.1177-74.2-67.5164.500112.5K262 K263 K264 I268 I269 C270K262-M266 WeakPolarHBondContact O-CG 3.35Å; K262-M266 PolarHBondContact O-N 3.1Å; K262-M266 VanDerWaalsContact O-N 3.1Å; K263-M266 PolarHBondContact O-N 3.49Å; K264-M266 PolarHBondContact O-N 3.48Å; M266-I268 PolarHBondContact O-N 3.23Å; M266-I269 PolarHBondContact O-N 3.24Å; M266-C270 PolarHBondContact O-N 3.01Å; M266-C270 PolarHBondContact O-SG 3.47Å; M266-C270 VanDerWaalsContact O-SG 3.35Å
267I88.1Confident86.1Confident107 Ų10797.2 Ų97.255%0.54951%0.512SS..Hα-helixtrans-62.4-43.2175.5-68.8167.1000111K263 K264 I265 C270 C271K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.42Å; K264-I267 PolarHBondContact O-N 2.99Å; I265-I267 VanDerWaalsContact C-N 3.35Å; I265-I267 PolarHBondContact O-N 3.32Å; I267-C270 PolarHBondContact O-N 3.46Å; I267-C271 PolarHBondContact O-N 3.43Å; I267-C271 PolarHBondContact O-SG 3.45Å
268I89.7Confident86.6Confident106 Ų10697 Ų9754%0.54451%0.513SS..Hα-helixtrans-60.9-46.8177.6-68.2166000110.5K264 I265 M266 C270 C271 V272K264-I268 WeakPolarHBondContact O-CG1 3.46Å; K264-I268 PolarHBondContact O-N 3Å; I265-I268 PolarHBondContact O-N 3.31Å; M266-I268 PolarHBondContact O-N 3.23Å; I268-C270 VanDerWaalsContact C-N 3.35Å; I268-C270 PolarHBondContact O-N 3.46Å; I268-C271 PolarHBondContact O-N 3.48Å; I268-V272 HydrophobicContact CG2-CG2 4.44Å; I268-V272 WeakPolarHBondContact O-CG2 3.35Å; I268-V272 PolarHBondContact O-N 3.16Å
269I90.6Very high86.9Confident80 Ų8098.2 Ų98.241%0.4153%0.526SS..Hα-helixtrans-59.5-45.7177.8-67.2166.6000110.8I265 M266 C271 V272 I273I265-I269 HydrophobicContact CG2-CD1 3.87Å; I265-I269 HydrophobicContact CG2-CG1 4.5Å; I265-I269 WeakPolarHBondContact O-CG1 3.43Å; I265-I269 PolarHBondContact O-N 3.5Å; M266-I269 PolarHBondContact O-N 3.24Å; I269-C271 VanDerWaalsContact C-N 3.34Å; I269-C271 PolarHBondContact O-N 3.29Å; I269-V272 PolarHBondContact O-N 3.43Å; I269-I273 HydrophobicContact CG2-CD1 3.88Å; I269-I273 WeakPolarHBondContact O-CG1 3.33Å; I269-I273 PolarHBondContact O-N 3.19Å
270C89.6Confident86.9Confident73 Ų7397.1 Ų97.149%0.49353%0.53SS..Hα-helixtrans-59.8-42.5176.1-71.30000112.4M266 I267 I268 I273 L274M266-C270 PolarHBondContact O-N 3.01Å; M266-C270 PolarHBondContact O-SG 3.47Å; M266-C270 VanDerWaalsContact O-SG 3.35Å; I267-C270 PolarHBondContact O-N 3.46Å; I268-C270 VanDerWaalsContact C-N 3.35Å; I268-C270 PolarHBondContact O-N 3.46Å; C270-I273 PolarHBondContact O-N 3.24Å; C270-L274 WeakPolarHBondContact O-CG 3.41Å; C270-L274 PolarHBondContact O-N 2.92Å
271C90Very high87Confident76 Ų7698.4 Ų98.451%0.51453%0.533SS..Hα-helixtrans-64.7-40.2178.1-660000112.1I267 I268 I269 L274 G275I267-C271 PolarHBondContact O-N 3.43Å; I267-C271 PolarHBondContact O-SG 3.45Å; I268-C271 PolarHBondContact O-N 3.48Å; I269-C271 VanDerWaalsContact C-N 3.34Å; I269-C271 PolarHBondContact O-N 3.29Å; C271-L274 PolarHBondContact O-N 2.96Å; C271-G275 PolarHBondContact O-N 3.02Å
272V91.8Very high86.9Confident90 Ų9096.7 Ų96.755%0.54553%0.532SS..Hα-helixtrans-63.3-46.2176.9171.60000110.9I268 I269 L274 G275 V276I268-V272 HydrophobicContact CG2-CG2 4.44Å; I268-V272 WeakPolarHBondContact O-CG2 3.35Å; I268-V272 PolarHBondContact O-N 3.16Å; I269-V272 PolarHBondContact O-N 3.43Å; V272-L274 PolarHBondContact O-N 2.95Å; V272-G275 PolarHBondContact O-N 3.43Å; V272-V276 WeakPolarHBondContact O-CG2 3.34Å; V272-V276 PolarHBondContact O-N 2.99Å
273I91.4Very high86.4Confident100 Ų10091.8 Ų91.851%0.51352%0.524SS..Hα-helixtrans-61-46.5178.1-66.2167.1000110.7I269 C270 G275 V276 V277I269-I273 HydrophobicContact CG2-CD1 3.88Å; I269-I273 WeakPolarHBondContact O-CG1 3.33Å; I269-I273 PolarHBondContact O-N 3.19Å; C270-I273 PolarHBondContact O-N 3.24Å; I273-G275 VanDerWaalsContact C-N 3.32Å; I273-G275 PolarHBondContact O-N 3.04Å; I273-V276 PolarHBondContact O-N 3.36Å; I273-V277 WeakPolarHBondContact O-CG2 3.43Å; I273-V277 PolarHBondContact O-N 3.4Å
274L90.4Very high85.6Confident110 Ų11088.1 Ų88.158%0.57653%0.527SS*.Hα-helixtrans-60.2-42.2176.8-73.6171.5000111.9C270 C271 V272 V276 V277 L278C270-L274 WeakPolarHBondContact O-CG 3.41Å; C270-L274 PolarHBondContact O-N 2.92Å; C271-L274 PolarHBondContact O-N 2.96Å; V272-L274 PolarHBondContact O-N 2.95Å; L274-V276 PolarHBondContact O-N 3.35Å; L274-V277 PolarHBondContact O-N 2.92Å; L274-L278 WeakPolarHBondContact O-CB 3.43Å; L274-L278 WeakPolarHBondContact O-CG 3.45Å; L274-L278 PolarHBondContact O-N 2.99Å
275G90.1Very high84.7Confident39 Ų3986.5 Ų86.540%0.40253%0.529SS..Hα-helixtrans-59.3-42.9175.400000113C271 V272 I273 L278 A279C271-G275 PolarHBondContact O-N 3.02Å; V272-G275 PolarHBondContact O-N 3.43Å; I273-G275 VanDerWaalsContact C-N 3.32Å; I273-G275 PolarHBondContact O-N 3.04Å; G275-L278 PolarHBondContact O-N 3.32Å; G275-A279 WeakPolarHBondContact O-CB 3.2Å; G275-A279 PolarHBondContact O-N 2.93Å
276V89.8Confident83.5Confident87 Ų8788.2 Ų88.253%0.52754%0.539SS..Hα-helixtrans-65.9-41.4177.5173.20000111.8V272 I273 L274 A279 S280V272-V276 WeakPolarHBondContact O-CG2 3.34Å; V272-V276 PolarHBondContact O-N 2.99Å; I273-V276 PolarHBondContact O-N 3.36Å; L274-V276 PolarHBondContact O-N 3.35Å; V276-A279 PolarHBondContact O-N 2.84Å; V276-S280 WeakPolarHBondContact O-CB 3.44Å; V276-S280 PolarHBondContact O-N 3.26Å; V276-S280 PolarHBondContact O-OG 3.01Å
277V89.3Confident82Confident81 Ų8184.9 Ų84.949%0.49154%0.536SS..Hα-helixtrans-64.7-44.1177.41730000111I273 L274 S280 T281I273-V277 WeakPolarHBondContact O-CG2 3.43Å; I273-V277 PolarHBondContact O-N 3.4Å; L274-V277 PolarHBondContact O-N 2.92Å; V277-S280 PolarHBondContact O-N 3Å; V277-T281 WeakPolarHBondContact O-CG2 3.4Å; V277-T281 PolarHBondContact O-N 3.41Å; V277-T281 PolarHBondContact O-OG1 2.93Å
278L86.6Confident80.1Confident105 Ų10593.2 Ų93.255%0.5557%0.569SS.*Hα-helixtrans-64-43.9176.1-70.7172.4000111.5L274 G275 S280 T281 I282L274-L278 WeakPolarHBondContact O-CB 3.43Å; L274-L278 WeakPolarHBondContact O-CG 3.45Å; L274-L278 PolarHBondContact O-N 2.99Å; G275-L278 PolarHBondContact O-N 3.32Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 3.49Å; L278-T281 WeakPolarHBondContact CA-OG1 3.44Å; L278-T281 PolarHBondContact O-N 2.95Å; L278-T281 PolarHBondContact O-OG1 3.42Å; L278-I282 WeakPolarHBondContact O-CB 3.47Å; L278-I282 WeakPolarHBondContact O-CD1 3.39Å; L278-I282 WeakPolarHBondContact O-CG1 3.32Å; L278-I282 PolarHBondContact O-N 2.9Å
279A83.9Confident79.6Confident64 Ų6492.6 Ų92.653%0.52957%0.57SS.*Hα-helixtrans-62.4-39.3176.500000112.5G275 V276 G283G275-A279 WeakPolarHBondContact O-CB 3.2Å; G275-A279 PolarHBondContact O-N 2.93Å; V276-A279 PolarHBondContact O-N 2.84Å; A279-G283 PolarHBondContact O-N 2.78Å
280S81.8Confident79Confident78 Ų7893.3 Ų93.355%0.54558%0.578SS.*Hα-helixtrans-70.4-37.9179.7-56.10000112.6V276 V277 L278 G284V276-S280 WeakPolarHBondContact O-CB 3.44Å; V276-S280 PolarHBondContact O-N 3.26Å; V276-S280 PolarHBondContact O-OG 3.01Å; V277-S280 PolarHBondContact O-N 3Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 3.49Å; S280-G284 PolarHBondContact O-N 3.37Å
281T80.9Confident78.4Confident77 Ų7794.4 Ų94.447%0.47258%0.583SS.*Hα-helixtrans-71.8-38.1177.148.50000112.1V277 L278 T285V277-T281 WeakPolarHBondContact O-CG2 3.4Å; V277-T281 PolarHBondContact O-N 3.41Å; V277-T281 PolarHBondContact O-OG1 2.93Å; L278-T281 WeakPolarHBondContact CA-OG1 3.44Å; L278-T281 PolarHBondContact O-N 2.95Å; L278-T281 PolarHBondContact O-OG1 3.42Å; T281-T285 WeakPolarHBondContact O-CB 3.39Å; T281-T285 VanDerWaalsContact O-CG2 3.31Å; T281-T285 WeakPolarHBondContact O-CG2 3.42Å; T281-T285 PolarHBondContact O-N 2.96Å; T281-T285 VanDerWaalsContact O-N 3.17Å; T281-T285 PolarHBondContact O-OG1 3.33Å
282I78.9Confident77.7Confident93 Ų9395.5 Ų95.548%0.47759%0.587SS.*Hα-helixtrans-69.9-41.7174.1-64.9168.1000110.6L278 G284 T285 L286L278-I282 WeakPolarHBondContact O-CB 3.47Å; L278-I282 WeakPolarHBondContact O-CD1 3.39Å; L278-I282 WeakPolarHBondContact O-CG1 3.32Å; L278-I282 PolarHBondContact O-N 2.9Å; I282-G284 PolarHBondContact O-N 2.93Å; I282-T285 WeakPolarHBondContact CA-OG1 3.31Å; I282-T285 PolarHBondContact O-N 3.42Å; I282-T285 PolarHBondContact O-OG1 3.03Å; I282-L286 HydrophobicContact CG2-CD1 3.67Å; I282-L286 WeakPolarHBondContact O-CB 3.44Å; I282-L286 PolarHBondContact O-N 2.71Å
283G71.9Confident76.8Confident46 Ų4695.8 Ų95.847%0.47459%0.59SS.*Hα-helixtrans-64.8-36.6175.800000113.5A279 T285 G287A279-G283 PolarHBondContact O-N 2.78Å; G283-T285 VanDerWaalsContact C-N 3.34Å; G283-G287 WeakPolarHBondContact O-CA 3.4Å; G283-G287 PolarHBondContact O-N 3.15Å
284G66.9Low75.9Confident65 Ų6595.5 Ų95.567%0.6760%0.595SS**Hα-helixtrans-76.2-17.3175.200000114.7S280 I282S280-G284 PolarHBondContact O-N 3.37Å; I282-G284 PolarHBondContact O-N 2.93Å
285T67.4Low74.8Confident115 Ų11594.5 Ų94.571%0.70660%0.596SS**Hα-helixtrans-100.4-23.3178.848.90000113.5T281 I282 G283T281-T285 WeakPolarHBondContact O-CB 3.39Å; T281-T285 VanDerWaalsContact O-CG2 3.31Å; T281-T285 WeakPolarHBondContact O-CG2 3.42Å; T281-T285 PolarHBondContact O-N 2.96Å; T281-T285 VanDerWaalsContact O-N 3.17Å; T281-T285 PolarHBondContact O-OG1 3.33Å; I282-T285 WeakPolarHBondContact CA-OG1 3.31Å; I282-T285 PolarHBondContact O-N 3.42Å; I282-T285 PolarHBondContact O-OG1 3.03Å; G283-T285 VanDerWaalsContact C-N 3.34Å
286L60.8Low73.6Confident137 Ų13798.8 Ų98.872%0.71761%0.611SS**Hα-helixtrans-108-4.5176.5-70.5166.4000114I282 F288I282-L286 HydrophobicContact CG2-CD1 3.67Å; I282-L286 WeakPolarHBondContact O-CB 3.44Å; I282-L286 PolarHBondContact O-N 2.71Å; L286-F288 PolarHBondContact O-N 3.17Å
287G51.1Low72.3Confident53 Ų5399.8 Ų99.855%0.54662%0.618SS.*  trans-77.5110.1171.200000111.3G283G283-G287 WeakPolarHBondContact O-CA 3.4Å; G283-G287 PolarHBondContact O-N 3.15Å
288F48.1Very low70.8Confident283 Ų283101.5 Ų101.5100%1.24163%0.63SS**  trans-60.40152.4-92-92.2000110.9L286L286-F288 PolarHBondContact O-N 3.17Å

Retrieved 288 of 288 residues in 973.7 ms (Link to these results)

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