A0A087Y3B9_POEFO Loading...

Ribosome biogenesis protein NSA2 homolog

Involved in the biogenesis of the 60S ribosomal subunit. May play a part in the quality control of pre-60S particles.

AlphaFold DB , UniProt , Accession A0A087Y3B9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 260 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
1M58Low85.2Confident233 Ų233121.2 Ų121.2100%1.14859%0.594SS**  0138.30-72.9-171.8170.800108.1Q3M1-Q3 PolarHBondContact O-N 2.9Å
2P76.8Confident85.9Confident97 Ų97124.3 Ų124.363%0.6360%0.602SS**  trans-63.5135.6174.727.6-32.4000109.7H6P2-H6 VanDerWaalsContact CB-CE1 3.45Å; P2-H6 WeakPolarHBondContact CB-CE1 3.41Å
3Q80.8Confident86.5Confident167 Ų167129.3 Ų129.378%0.7861%0.611SS**  trans-85.9135.1-172.9-140.2172.63.900110M1M1-Q3 PolarHBondContact O-N 2.9Å
4N86.9Confident87Confident136 Ų136129.6 Ų129.673%0.72761%0.611SS**SBendtrans57.6-168.4175.6-53.8-15000115.2H6N4-H6 PolarHBondContact O-N 3.11Å; N4-H6 PolarHBondContact O-ND1 2.95Å; N4-H6 VanDerWaalsContact O-ND1 3.16Å
5E88.9Confident87.3Confident124 Ų124123.2 Ų123.258%0.57959%0.594SS**SBendtrans-77.351.3175.6-62.1-177.7162.800112.7I7 E8 L9E5-I7 PolarHBondContact O-N 3.19Å; E5-I7 VanDerWaalsContact O-N 3.09Å; E5-E8 HydrophobicContact CB-CB 4.24Å; E5-E8 HydrophobicContact CB-CG 4.36Å; E5-E8 PolarHBondContact O-N 3.21Å; E5-L9 PolarHBondContact O-N 2.73Å
6H89.4Confident87.6Confident89 Ų89122.2 Ų122.241%0.41258%0.583SS.*Hα-helixtrans-53.9-30.2-177.364.1-73.4000114.2P2 N4 H10P2-H6 VanDerWaalsContact CB-CE1 3.45Å; P2-H6 WeakPolarHBondContact CB-CE1 3.41Å; N4-H6 PolarHBondContact O-N 3.11Å; N4-H6 PolarHBondContact O-ND1 2.95Å; N4-H6 VanDerWaalsContact O-ND1 3.16Å; H6-H10 VanDerWaalsContact O-CB 3.28Å; H6-H10 WeakPolarHBondContact O-CB 3.3Å; H6-H10 PolarHBondContact O-N 2.91Å
7I90.1Very high87.9Confident99 Ų99125.1 Ų125.151%0.50859%0.587SS.*Hα-helixtrans-69.8-41.2175.8-63175.6000111.8E5 H10 R11E5-I7 PolarHBondContact O-N 3.19Å; E5-I7 VanDerWaalsContact O-N 3.09Å; I7-H10 PolarHBondContact O-N 3.05Å; I7-R11 WeakPolarHBondContact O-CG 3.16Å; I7-R11 PolarHBondContact O-N 2.88Å
8E90.4Very high88.3Confident96 Ų96128.1 Ų128.145%0.44961%0.606SS.*Hα-helixtrans-69.9-41.4176.6-63.3-156.2170.900111.1E5 H10 R11 K12E5-E8 HydrophobicContact CB-CB 4.24Å; E5-E8 HydrophobicContact CB-CG 4.36Å; E5-E8 PolarHBondContact O-N 3.21Å; E8-H10 VanDerWaalsContact C-N 3.31Å; E8-H10 PolarHBondContact O-N 3.45Å; E8-R11 PolarHBondContact O-N 2.79Å; E8-K12 WeakPolarHBondContact O-CG 3.45Å; E8-K12 PolarHBondContact O-N 3.25Å
9L91.3Very high88.6Confident72 Ų72123.6 Ų123.638%0.37759%0.586SS.*Hα-helixtrans-59.1-43.1173.7-69.5174.4000111.5E5 K12 R13E5-L9 PolarHBondContact O-N 2.73Å; L9-K12 PolarHBondContact O-N 3.25Å; L9-R13 WeakPolarHBondContact O-CB 3.3Å; L9-R13 VanDerWaalsContact O-CG 3.3Å; L9-R13 WeakPolarHBondContact O-CG 3.48Å; L9-R13 PolarHBondContact O-N 2.71Å
10H92.3Very high88.9Confident109 Ų109120.9 Ų120.951%0.50557%0.573SS.*Hα-helixtrans-61.6-43.7174.9-179.4-78.7000111.7H6 I7 E8 K12 R13 H14H6-H10 VanDerWaalsContact O-CB 3.28Å; H6-H10 WeakPolarHBondContact O-CB 3.3Å; H6-H10 PolarHBondContact O-N 2.91Å; I7-H10 PolarHBondContact O-N 3.05Å; E8-H10 VanDerWaalsContact C-N 3.31Å; E8-H10 PolarHBondContact O-N 3.45Å; H10-K12 VanDerWaalsContact C-N 3.34Å; H10-K12 PolarHBondContact O-N 3.48Å; H10-R13 PolarHBondContact O-N 3.06Å; H10-H14 AromaticContact CD2-CD2 3.71Å; H10-H14 AromaticContact NE2-CD2 3.79Å; H10-H14 WeakPolarHBondContact O-CB 3.32Å; H10-H14 PolarHBondContact O-N 2.77Å
11R92.6Very high89.2Confident111 Ų111120.9 Ų120.942%0.41957%0.572SS.*Hα-helixtrans-65.3-34.6175.8-72.9171.2179.1-175.46.5112.9I7 E8 G15 Y16I7-R11 WeakPolarHBondContact O-CG 3.16Å; I7-R11 PolarHBondContact O-N 2.88Å; E8-R11 PolarHBondContact O-N 2.79Å; R11-G15 CarbonylContact O-C 3.56Å; R11-G15 WeakPolarHBondContact O-CA 3.47Å; R11-G15 PolarHBondContact O-N 3.31Å; R11-Y16 HydrophobicContact CG-CD1 4.45Å; R11-Y16 HydrophobicContact CG-CE1 4.11Å
12K93.1Very high91Very high158 Ų158114.8 Ų114.869%0.68754%0.541SS*.Hα-helixtrans-68.6-38.6174.6-73.4173.4-178.8170.20111.8E8 L9 H10E8-K12 WeakPolarHBondContact O-CG 3.45Å; E8-K12 PolarHBondContact O-N 3.25Å; L9-K12 PolarHBondContact O-N 3.25Å; H10-K12 VanDerWaalsContact C-N 3.34Å; H10-K12 PolarHBondContact O-N 3.48Å
13R93.5Very high91.9Very high190 Ų190117.3 Ų117.372%0.71754%0.538SS*.Hα-helixtrans-79.9-43.8-178.4-70.3175.5-173.8179.71.3113.9L9 H10L9-R13 WeakPolarHBondContact O-CB 3.3Å; L9-R13 VanDerWaalsContact O-CG 3.3Å; L9-R13 WeakPolarHBondContact O-CG 3.48Å; L9-R13 PolarHBondContact O-N 2.71Å; H10-R13 PolarHBondContact O-N 3.06Å
14H93.4Very high92.7Very high133 Ų133114.8 Ų114.862%0.61652%0.524SS*.Hα-helixtrans-115.20.5-171-59.1-69.1000113.3H10H10-H14 AromaticContact CD2-CD2 3.71Å; H10-H14 AromaticContact NE2-CD2 3.79Å; H10-H14 WeakPolarHBondContact O-CB 3.32Å; H10-H14 PolarHBondContact O-N 2.77Å
15G91.3Very high93.1Very high34 Ų34115.7 Ų115.735%0.35152%0.517SS..  trans73.1-167.2-179.400000113.5R11R11-G15 CarbonylContact O-C 3.56Å; R11-G15 WeakPolarHBondContact O-CA 3.47Å; R11-G15 PolarHBondContact O-N 3.31Å
16Y93.1Very high93.5Very high107 Ų107114.7 Ų114.742%0.4251%0.511SS..SBendtrans-91163.5168.4-69-88.8000109.8R11 L18 H20 H21R11-Y16 HydrophobicContact CG-CD1 4.45Å; R11-Y16 HydrophobicContact CG-CE1 4.11Å; Y16-L18 PolarHBondContact O-N 3.2Å; Y16-H20 AromaticContact CD1-CE1 3.67Å; Y16-H20 AromaticContact CD1-CG 4Å; Y16-H20 AromaticContact CD1-ND1 3.67Å; Y16-H20 AromaticContact CE1-CE1 3.92Å; Y16-H20 AromaticContact CG-ND1 3.86Å; Y16-H21 AromaticContact CD2-NE2 3.93Å
17R93.1Very high93.8Very high172 Ų172117.4 Ų117.465%0.64952%0.522SS*.  trans-53.6138.3166.5-169.4179.3150.1141.81.1109.6D19 H20R17-D19 WeakPolarHBondContact CD-OD1 3.37Å; R17-D19 WeakPolarHBondContact CG-OD1 3.36Å; R17-D19 IonicContact CZ-OD1 2.69Å; R17-D19 IonicContact CZ-OD2 3.24Å; R17-D19 VanDerWaalsContact NE-CG 3.26Å; R17-D19 IonicContact NE-OD1 3.07Å; R17-D19 PolarHBondContact NE-OD1 2.98Å; R17-D19 IonicContact NE-OD2 3.37Å; R17-D19 PolarHBondContact NE-OD2 3.15Å; R17-D19 VanDerWaalsContact NE-OD2 3.07Å; R17-D19 IonicContact NH2-OD2 2.88Å; R17-D19 PolarHBondContact NH2-OD2 3.32Å; R17-D19 PolarHBondContact O-N 3.1Å; R17-D19 VanDerWaalsContact O-N 3.11Å; R17-H20 HydrophobicContact CB-CB 4.42Å; R17-H20 WeakPolarHBondContact O-CB 3.3Å; R17-H20 PolarHBondContact O-N 3.04Å
18L93.7Very high94Very high178 Ų178118.2 Ų118.293%0.93252%0.523SS*.THydrogen-bonded Turntrans-54-36.1-172.5-63172.6000113.5Y16Y16-L18 PolarHBondContact O-N 3.2Å
19D95.4Very high94.3Very high44 Ų44118 Ų11824%0.23553%0.532CS..THydrogen-bonded Turntrans-87.50.6179.866.9-5000114.4R17 H21 E22 R23R17-D19 WeakPolarHBondContact CD-OD1 3.37Å; R17-D19 WeakPolarHBondContact CG-OD1 3.36Å; R17-D19 IonicContact CZ-OD1 2.69Å; R17-D19 IonicContact CZ-OD2 3.24Å; R17-D19 VanDerWaalsContact NE-CG 3.26Å; R17-D19 IonicContact NE-OD1 3.07Å; R17-D19 PolarHBondContact NE-OD1 2.98Å; R17-D19 IonicContact NE-OD2 3.37Å; R17-D19 PolarHBondContact NE-OD2 3.15Å; R17-D19 VanDerWaalsContact NE-OD2 3.07Å; R17-D19 IonicContact NH2-OD2 2.88Å; R17-D19 PolarHBondContact NH2-OD2 3.32Å; R17-D19 PolarHBondContact O-N 3.1Å; R17-D19 VanDerWaalsContact O-N 3.11Å; D19-H21 PolarHBondContact O-N 2.81Å; D19-E22 PolarHBondContact O-N 2.84Å; D19-R23 HydrophobicContact CB-CG 4.4Å; D19-R23 WeakPolarHBondContact O-CB 3.35Å; D19-R23 VanDerWaalsContact O-CG 3.28Å; D19-R23 WeakPolarHBondContact O-CG 3.45Å; D19-R23 PolarHBondContact O-N 2.72Å; D19-R23 WeakPolarHBondContact OD2-CD 3.46Å; D19-R23 IonicContact OD2-NH1 3.63Å
20H94.6Very high94.5Very high68 Ų68121.1 Ų121.132%0.31554%0.539SS..Hα-helixtrans-60.2-49.7-170.1173.4-101.1000112.5Y16 R17 R23 K24Y16-H20 AromaticContact CD1-CE1 3.67Å; Y16-H20 AromaticContact CD1-CG 4Å; Y16-H20 AromaticContact CD1-ND1 3.67Å; Y16-H20 AromaticContact CE1-CE1 3.92Å; Y16-H20 AromaticContact CG-ND1 3.86Å; R17-H20 HydrophobicContact CB-CB 4.42Å; R17-H20 WeakPolarHBondContact O-CB 3.3Å; R17-H20 PolarHBondContact O-N 3.04Å; H20-R23 PolarHBondContact O-N 3.45Å; H20-K24 WeakPolarHBondContact O-CB 3.34Å; H20-K24 PolarHBondContact O-N 2.99Å
21H94.9Very high94.6Very high121 Ų121120.2 Ų120.256%0.5654%0.535SS*.Hα-helixtrans-68.9-38.6-177.3-68-79.1000111.8Y16 D19 K24 R25Y16-H21 AromaticContact CD2-NE2 3.93Å; D19-H21 PolarHBondContact O-N 2.81Å; H21-K24 PolarHBondContact O-N 2.84Å; H21-R25 WeakPolarHBondContact O-CB 3.41Å; H21-R25 PolarHBondContact O-N 2.78Å
22E95.5Very high94.7Very high106 Ų106117.7 Ų117.750%0.49554%0.538SS..Hα-helixtrans-64.5-43.6175.2-65.2-160.115700112.2D19 R25 K26D19-E22 PolarHBondContact O-N 2.84Å; E22-R25 PolarHBondContact O-N 3.34Å; E22-K26 WeakPolarHBondContact O-CB 3.16Å; E22-K26 WeakPolarHBondContact O-CG 3.25Å; E22-K26 PolarHBondContact O-N 2.85Å
23R96.1Very high94.9Very high150 Ų150117.3 Ų117.357%0.56654%0.538SS*.Hα-helixtrans-65.2-41.7178-71.6179.579.5173.55.9111.4D19 H20 K26 K27D19-R23 HydrophobicContact CB-CG 4.4Å; D19-R23 WeakPolarHBondContact O-CB 3.35Å; D19-R23 VanDerWaalsContact O-CG 3.28Å; D19-R23 WeakPolarHBondContact O-CG 3.45Å; D19-R23 PolarHBondContact O-N 2.72Å; D19-R23 WeakPolarHBondContact OD2-CD 3.46Å; D19-R23 IonicContact OD2-NH1 3.63Å; H20-R23 PolarHBondContact O-N 3.45Å; R23-K26 PolarHBondContact O-N 3.08Å; R23-K27 WeakPolarHBondContact O-CB 3.5Å; R23-K27 PolarHBondContact O-N 3.47Å
24K96.3Very high94.9Very high113 Ų113112.2 Ų112.249%0.49152%0.523SS..Hα-helixtrans-61.9-49.8176-174.1175.7176.5-175.90111.3H20 H21 K26 K27 E28H20-K24 WeakPolarHBondContact O-CB 3.34Å; H20-K24 PolarHBondContact O-N 2.99Å; H21-K24 PolarHBondContact O-N 2.84Å; K24-K26 PolarHBondContact O-N 3.45Å; K24-K27 WeakPolarHBondContact O-CB 3.5Å; K24-K27 PolarHBondContact O-N 3.5Å; K24-E28 WeakPolarHBondContact CE-OE1 3.41Å; K24-E28 PolarHBondContact O-N 2.97Å
25R96.4Very high94.9Very high155 Ų155109.9 Ų109.959%0.58551%0.509SS*.Hα-helixtrans-56.5-48.6175.8-173.6-169.770.4-169.4-1.7112H21 E22 K27 E28 S29H21-R25 WeakPolarHBondContact O-CB 3.41Å; H21-R25 PolarHBondContact O-N 2.78Å; E22-R25 PolarHBondContact O-N 3.34Å; R25-K27 VanDerWaalsContact C-N 3.26Å; R25-K27 PolarHBondContact O-N 3.1Å; R25-E28 PolarHBondContact O-N 2.81Å; R25-S29 WeakPolarHBondContact O-CB 3.38Å; R25-S29 PolarHBondContact O-N 3.47Å
26K96.5Very high95Very high103 Ų103111 Ų11145%0.44851%0.511SS..Hα-helixtrans-64.4-29.2178-73.7177.8179.8172.50112.3E22 R23 K24 R30E22-K26 WeakPolarHBondContact O-CB 3.16Å; E22-K26 WeakPolarHBondContact O-CG 3.25Å; E22-K26 PolarHBondContact O-N 2.85Å; R23-K26 PolarHBondContact O-N 3.08Å; K24-K26 PolarHBondContact O-N 3.45Å; K26-R30 WeakPolarHBondContact O-CB 3.15Å; K26-R30 WeakPolarHBondContact O-CG 3.37Å; K26-R30 PolarHBondContact O-N 2.8Å; K26-R30 PolarHBondContact O-NE 3.48Å
27K95.9Very high95.1Very high147 Ų147110.7 Ų110.764%0.63951%0.513SS*.Hα-helixtrans-73.1-48.3176.7-173.3-179.2179.8-176.50111.1R23 K24 R25 S29 R30 E31R23-K27 WeakPolarHBondContact O-CB 3.5Å; R23-K27 PolarHBondContact O-N 3.47Å; K24-K27 WeakPolarHBondContact O-CB 3.5Å; K24-K27 PolarHBondContact O-N 3.5Å; R25-K27 VanDerWaalsContact C-N 3.26Å; R25-K27 PolarHBondContact O-N 3.1Å; K27-S29 VanDerWaalsContact C-N 3.34Å; K27-S29 PolarHBondContact O-N 2.84Å; K27-R30 PolarHBondContact O-N 3.37Å; K27-E31 PolarHBondContact O-N 2.83Å; K27-E31 VanDerWaalsContact O-N 3.11Å
28E95.5Very high95.1Very high115 Ų115107.1 Ų107.154%0.53750%0.503SS..Hα-helixtrans-61-43.1177.9-71.3170.6-17800111.5K24 R25 R30 E31K24-E28 WeakPolarHBondContact CE-OE1 3.41Å; K24-E28 PolarHBondContact O-N 2.97Å; R25-E28 PolarHBondContact O-N 2.81Å; E28-R30 PolarHBondContact O-N 2.77Å; E28-E31 VanDerWaalsContact O-CB 3.29Å; E28-E31 WeakPolarHBondContact O-CB 3.25Å; E28-E31 PolarHBondContact O-N 2.76Å
29S95.6Very high95.1Very high91 Ų91100.2 Ų100.264%0.63647%0.471SS*.Hα-helixtrans-61.2-41.4175.71740000113.1R25 K27 E31R25-S29 WeakPolarHBondContact O-CB 3.38Å; R25-S29 PolarHBondContact O-N 3.47Å; K27-S29 VanDerWaalsContact C-N 3.34Å; K27-S29 PolarHBondContact O-N 2.84Å; S29-E31 VanDerWaalsContact C-N 3.29Å; S29-E31 PolarHBondContact O-N 3Å
30R96.4Very high95Very high138 Ų138108.2 Ų108.252%0.52150%0.498SS..Hα-helixtrans-74.5-17.5178.9-77-179.1-79.5177.2-2.6113.8K26 K27 E28 A32 H33 E34K26-R30 WeakPolarHBondContact O-CB 3.15Å; K26-R30 WeakPolarHBondContact O-CG 3.37Å; K26-R30 PolarHBondContact O-N 2.8Å; K26-R30 PolarHBondContact O-NE 3.48Å; K27-R30 PolarHBondContact O-N 3.37Å; E28-R30 PolarHBondContact O-N 2.77Å; R30-A32 VanDerWaalsContact C-N 3.29Å; R30-A32 PolarHBondContact O-N 3.45Å; R30-H33 PolarHBondContact O-N 3.4Å; R30-H33 VanDerWaalsContact O-N 3.12Å; R30-E34 PolarHBondContact O-N 2.75Å
31E94.4Very high95.1Very high90 Ų90111.6 Ų111.642%0.42151%0.512SS..Hα-helixtrans-62.6-34.1-170.7-159.1-166.6-171.100112.8K27 E28 S29 R35K27-E31 PolarHBondContact O-N 2.83Å; K27-E31 VanDerWaalsContact O-N 3.11Å; E28-E31 VanDerWaalsContact O-CB 3.29Å; E28-E31 WeakPolarHBondContact O-CB 3.25Å; E28-E31 PolarHBondContact O-N 2.76Å; S29-E31 VanDerWaalsContact C-N 3.29Å; S29-E31 PolarHBondContact O-N 3Å; E31-R35 HydrophobicContact CG-CG 4.47Å; E31-R35 VanDerWaalsContact O-CB 3.23Å; E31-R35 WeakPolarHBondContact O-CB 3.33Å; E31-R35 WeakPolarHBondContact O-CG 3.45Å; E31-R35 PolarHBondContact O-N 3.3Å; E31-R35 PolarHBondContact O-NE 3.33Å; E31-R35 IonicContact OE2-CZ 3.52Å; E31-R35 IonicContact OE2-NE 3.82Å; E31-R35 IonicContact OE2-NH2 2.76Å; E31-R35 PolarHBondContact OE2-NH2 3.02Å
32A94.3Very high95.1Very high58 Ų58108.5 Ų108.548%0.47950%0.498SS..Hα-helixtrans-63.4-42.4176.800000111.9R30 R35 S36R30-A32 VanDerWaalsContact C-N 3.29Å; R30-A32 PolarHBondContact O-N 3.45Å; A32-R35 PolarHBondContact O-N 3.18Å; A32-S36 PolarHBondContact O-N 2.92Å; A32-S36 VanDerWaalsContact O-N 3.14Å
33H95.9Very high95.1Very high150 Ų150110.5 Ų110.569%0.69451%0.511SS*.Hα-helixtrans-71-44.3178.4-67.7-170.1000111R30 R35 S36 H37R30-H33 PolarHBondContact O-N 3.4Å; R30-H33 VanDerWaalsContact O-N 3.12Å; H33-R35 VanDerWaalsContact C-N 3.27Å; H33-R35 PolarHBondContact O-N 3.17Å; H33-S36 PolarHBondContact O-N 3.02Å; H33-H37 WeakPolarHBondContact O-CB 3.37Å; H33-H37 PolarHBondContact O-N 2.7Å
34E94.8Very high95.1Very high84 Ų84105.5 Ų105.539%0.39351%0.505SS..Hα-helixtrans-58.7-40.7173.9-74.7-168.4-169.600111.8R30 H37 K38R30-E34 PolarHBondContact O-N 2.75Å; E34-H37 PolarHBondContact O-N 3.1Å; E34-K38 VanDerWaalsContact O-CB 3.25Å; E34-K38 WeakPolarHBondContact O-CB 3.42Å; E34-K38 WeakPolarHBondContact O-CG 3.17Å; E34-K38 PolarHBondContact O-N 3.27Å; E34-K38 IonicContact OE2-NZ 3.31Å; E34-K38 PolarHBondContact OE2-NZ 3.02Å
35R93Very high95.2Very high83 Ų83106.2 Ų106.231%0.31351%0.514SS..Hα-helixtrans-62.4-43.1177.7-82.2-178.9-91.3174.8-10.8112E31 A32 H33 A39 Y50E31-R35 HydrophobicContact CG-CG 4.47Å; E31-R35 VanDerWaalsContact O-CB 3.23Å; E31-R35 WeakPolarHBondContact O-CB 3.33Å; E31-R35 WeakPolarHBondContact O-CG 3.45Å; E31-R35 PolarHBondContact O-N 3.3Å; E31-R35 PolarHBondContact O-NE 3.33Å; E31-R35 IonicContact OE2-CZ 3.52Å; E31-R35 IonicContact OE2-NE 3.82Å; E31-R35 IonicContact OE2-NH2 2.76Å; E31-R35 PolarHBondContact OE2-NH2 3.02Å; A32-R35 PolarHBondContact O-N 3.18Å; H33-R35 VanDerWaalsContact C-N 3.27Å; H33-R35 PolarHBondContact O-N 3.17Å; R35-A39 WeakPolarHBondContact O-CB 3.46Å; R35-A39 PolarHBondContact O-N 2.67Å; R35-A39 VanDerWaalsContact O-N 3.08Å; R35-Y50 VanDerWaalsContact CA-OH 3.31Å; R35-Y50 WeakPolarHBondContact CA-OH 3.45Å; R35-Y50 PolarHBondContact O-OH 2.86Å
36S93.4Very high95.1Very high57 Ų57106.5 Ų106.540%0.39952%0.519SS..Hα-helixtrans-66.5-44.1176.1-176.90000111.7A32 H33 A39 R40A32-S36 PolarHBondContact O-N 2.92Å; A32-S36 VanDerWaalsContact O-N 3.14Å; H33-S36 PolarHBondContact O-N 3.02Å; S36-A39 WeakPolarHBondContact O-CB 3.14Å; S36-A39 PolarHBondContact O-N 3.19Å; S36-R40 PolarHBondContact O-N 2.94Å; S36-R40 VanDerWaalsContact O-N 3.11Å
37H95.1Very high95.1Very high101 Ų101102.2 Ų102.247%0.46850%0.503SS..Hα-helixtrans-62.5-47.1178-179.3-84.2000112.2H33 E34 A39 R40 K41H33-H37 WeakPolarHBondContact O-CB 3.37Å; H33-H37 PolarHBondContact O-N 2.7Å; E34-H37 PolarHBondContact O-N 3.1Å; H37-A39 VanDerWaalsContact C-N 3.3Å; H37-A39 PolarHBondContact O-N 3.22Å; H37-R40 PolarHBondContact O-N 3.39Å; H37-R40 VanDerWaalsContact O-N 3.14Å; H37-K41 WeakPolarHBondContact CE1-CD 3.24Å; H37-K41 WeakPolarHBondContact NE2-CE 3.46Å; H37-K41 PolarHBondContact NE2-NZ 2.82Å; H37-K41 WeakPolarHBondContact O-CB 3.42Å; H37-K41 PolarHBondContact O-N 3.31Å
38K93.9Very high95.2Very high98 Ų98102.7 Ų102.743%0.42651%0.505SS..Hα-helixtrans-56.1-45.2173.5-77.5171-176.6163.80111E34 R40 K41 M42E34-K38 VanDerWaalsContact O-CB 3.25Å; E34-K38 WeakPolarHBondContact O-CB 3.42Å; E34-K38 WeakPolarHBondContact O-CG 3.17Å; E34-K38 PolarHBondContact O-N 3.27Å; E34-K38 IonicContact OE2-NZ 3.31Å; E34-K38 PolarHBondContact OE2-NZ 3.02Å; K38-R40 VanDerWaalsContact C-N 3.29Å; K38-R40 PolarHBondContact O-N 3.22Å; K38-K41 PolarHBondContact O-N 3.42Å; K38-M42 HydrophobicContact CB-CE 3.84Å; K38-M42 VanDerWaalsContact O-CB 3.31Å; K38-M42 WeakPolarHBondContact O-CB 3.43Å; K38-M42 WeakPolarHBondContact O-CE 3.37Å; K38-M42 VanDerWaalsContact O-CG 3.27Å; K38-M42 WeakPolarHBondContact O-CG 3.48Å; K38-M42 PolarHBondContact O-N 3.23Å
39A93.4Very high95.3Very high32 Ų32102.1 Ų102.126%0.26451%0.505SS..Hα-helixtrans-58.5-39.6178.100000112.8R35 S36 H37 Y50R35-A39 WeakPolarHBondContact O-CB 3.46Å; R35-A39 PolarHBondContact O-N 2.67Å; R35-A39 VanDerWaalsContact O-N 3.08Å; S36-A39 WeakPolarHBondContact O-CB 3.14Å; S36-A39 PolarHBondContact O-N 3.19Å; H37-A39 VanDerWaalsContact C-N 3.3Å; H37-A39 PolarHBondContact O-N 3.22Å; A39-Y50 HydrophobicContact CB-CE1 3.79Å
40R93.5Very high95.3Very high213 Ų21399.5 Ų99.580%0.80448%0.482SS*.Hα-helixtrans-80.7-36.2-178.5-68.5178.4179.4-175.6-1.1113.4S36 H37 K38S36-R40 PolarHBondContact O-N 2.94Å; S36-R40 VanDerWaalsContact O-N 3.11Å; H37-R40 PolarHBondContact O-N 3.39Å; H37-R40 VanDerWaalsContact O-N 3.14Å; K38-R40 VanDerWaalsContact C-N 3.29Å; K38-R40 PolarHBondContact O-N 3.22Å
41K95.8Very high95.3Very high139 Ų13997.5 Ų97.560%0.60448%0.478SS*.Hα-helixtrans-93.2-22.2-172.2-70-148-176.8-177.30114.7H37 K38H37-K41 WeakPolarHBondContact CE1-CD 3.24Å; H37-K41 WeakPolarHBondContact NE2-CE 3.46Å; H37-K41 PolarHBondContact NE2-NZ 2.82Å; H37-K41 WeakPolarHBondContact O-CB 3.42Å; H37-K41 PolarHBondContact O-N 3.31Å; K38-K41 PolarHBondContact O-N 3.42Å
42M95.1Very high95.4Very high55 Ų55100.7 Ų100.727%0.27149%0.491SS..  trans-70.1136.4177.6-74.8-168.9-67.800110.4K38 K46 A47 Y50K38-M42 HydrophobicContact CB-CE 3.84Å; K38-M42 VanDerWaalsContact O-CB 3.31Å; K38-M42 WeakPolarHBondContact O-CB 3.43Å; K38-M42 WeakPolarHBondContact O-CE 3.37Å; K38-M42 VanDerWaalsContact O-CG 3.27Å; K38-M42 WeakPolarHBondContact O-CG 3.48Å; K38-M42 PolarHBondContact O-N 3.23Å; M42-K46 HydrophobicContact SD-CB 4.45Å; M42-A47 HydrophobicContact CB-CB 3.99Å; M42-A47 VanDerWaalsContact O-CB 3.28Å; M42-A47 WeakPolarHBondContact O-CB 3.43Å; M42-Y50 HydrophobicContact CE-CD1 3.29Å; M42-Y50 HydrophobicContact CE-CD2 3.52Å; M42-Y50 HydrophobicContact CE-CE1 3.89Å; M42-Y50 HydrophobicContact CE-CE2 4.08Å; M42-Y50 HydrophobicContact CE-CG 3.06Å
43I95.6Very high95.5Very high149 Ų149103.3 Ų103.376%0.76449%0.493SS*.  trans-121.3152.5-177.9-59167.7000109.2
44G96.5Very high95.5Very high44 Ų4499.5 Ų99.545%0.45447%0.473SS..Hα-helixtrans68-139.8171.700000113.8K46 A47 K48G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.42Å; G44-A47 WeakPolarHBondContact O-CB 3.5Å; G44-A47 PolarHBondContact O-N 3.02Å; G44-K48 PolarHBondContact O-N 2.95Å
45L97Very high95.6Very high128 Ų128101.3 Ų101.367%0.6748%0.481SS*.Hα-helixtrans-62.3-36.2-174.8-174.963.4000112.7A47 K48 L49L45-A47 VanDerWaalsContact C-N 3.32Å; L45-A47 PolarHBondContact O-N 2.85Å; L45-K48 PolarHBondContact O-N 3.03Å; L45-L49 HydrophobicContact CD1-CG 4.49Å; L45-L49 HydrophobicContact CG-CD1 4.17Å; L45-L49 HydrophobicContact CG-CG 4.41Å; L45-L49 WeakPolarHBondContact O-CG 3.46Å; L45-L49 PolarHBondContact O-N 3.32Å
46K95.8Very high95.8Very high161 Ų161100 Ų10070%0.749%0.488SS*.Hα-helixtrans-62-40.8179.2-67.3-176.7-180178.40111.5M42 G44 Y50M42-K46 HydrophobicContact SD-CB 4.45Å; G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.42Å; K46-Y50 WeakPolarHBondContact O-CB 3.23Å; K46-Y50 PolarHBondContact O-N 2.93Å
47A96.9Very high96Very high13 Ų13100.2 Ų100.211%0.10748%0.482CS..Hα-helixtrans-62.9-46.8174.600000111.6M42 G44 L45 L49 Y50 H51M42-A47 HydrophobicContact CB-CB 3.99Å; M42-A47 VanDerWaalsContact O-CB 3.28Å; M42-A47 WeakPolarHBondContact O-CB 3.43Å; G44-A47 WeakPolarHBondContact O-CB 3.5Å; G44-A47 PolarHBondContact O-N 3.02Å; L45-A47 VanDerWaalsContact C-N 3.32Å; L45-A47 PolarHBondContact O-N 2.85Å; A47-L49 PolarHBondContact O-N 2.92Å; A47-Y50 PolarHBondContact O-N 3.44Å; A47-H51 PolarHBondContact O-CD2 3.16Å; A47-H51 PolarHBondContact O-N 2.91Å
48K96.9Very high96.1Very high157 Ų157101.8 Ų101.868%0.68349%0.488SS*.Hα-helixtrans-59.1-46178.9-67.7-177.6178.9-177.40112G44 L45 H51 K52G44-K48 PolarHBondContact O-N 2.95Å; L45-K48 PolarHBondContact O-N 3.03Å; K48-H51 PolarHBondContact O-N 2.83Å; K48-K52 WeakPolarHBondContact O-CB 3.15Å; K48-K52 PolarHBondContact O-N 2.91Å
49L97Very high96.3Very high103 Ų103100.4 Ų100.454%0.53948%0.484SS..Hα-helixtrans-62.7-44.5177.3-71.4173.6000111.7L45 A47 K52 Q53L45-L49 HydrophobicContact CD1-CG 4.49Å; L45-L49 HydrophobicContact CG-CD1 4.17Å; L45-L49 HydrophobicContact CG-CG 4.41Å; L45-L49 WeakPolarHBondContact O-CG 3.46Å; L45-L49 PolarHBondContact O-N 3.32Å; A47-L49 PolarHBondContact O-N 2.92Å; L49-K52 PolarHBondContact O-N 2.79Å; L49-Q53 PolarHBondContact O-N 3.15Å
50Y96.4Very high96.5Very high36 Ų36105 Ų10514%0.14150%0.5CS..Hα-helixtrans-61.7-46.3177.7178.6-108.2000112.6R35 A39 M42 K46 A47 K52 Q53 R54R35-Y50 VanDerWaalsContact CA-OH 3.31Å; R35-Y50 WeakPolarHBondContact CA-OH 3.45Å; R35-Y50 PolarHBondContact O-OH 2.86Å; A39-Y50 HydrophobicContact CB-CE1 3.79Å; M42-Y50 HydrophobicContact CE-CD1 3.29Å; M42-Y50 HydrophobicContact CE-CD2 3.52Å; M42-Y50 HydrophobicContact CE-CE1 3.89Å; M42-Y50 HydrophobicContact CE-CE2 4.08Å; M42-Y50 HydrophobicContact CE-CG 3.06Å; K46-Y50 WeakPolarHBondContact O-CB 3.23Å; K46-Y50 PolarHBondContact O-N 2.93Å; A47-Y50 PolarHBondContact O-N 3.44Å; Y50-K52 VanDerWaalsContact C-N 3.33Å; Y50-K52 PolarHBondContact O-N 3.09Å; Y50-Q53 PolarHBondContact O-N 2.87Å; Y50-R54 HydrophobicContact CD1-CG 4.28Å; Y50-R54 HydrophobicContact CD2-CG 4.39Å; Y50-R54 HydrophobicContact CE1-CG 3.99Å; Y50-R54 HydrophobicContact CE2-CG 4.1Å; Y50-R54 HydrophobicContact CG-CG 4.48Å; Y50-R54 VanDerWaalsContact O-CG 3.32Å; Y50-R54 WeakPolarHBondContact O-CG 3.34Å; Y50-R54 PolarHBondContact O-N 3.41Å
51H95.9Very high96.6Very high96 Ų96100.1 Ų100.144%0.44449%0.488SS..Hα-helixtrans-64.4-37.9177.2-70-57.8000112.4A47 K48 R54 H55A47-H51 PolarHBondContact O-CD2 3.16Å; A47-H51 PolarHBondContact O-N 2.91Å; K48-H51 PolarHBondContact O-N 2.83Å; H51-R54 PolarHBondContact O-N 2.73Å; H51-H55 WeakPolarHBondContact O-CB 3.47Å; H51-H55 PolarHBondContact O-N 3.19Å
52K97.3Very high96.7Very high158 Ų158100.9 Ų100.969%0.68749%0.491SS*.Hα-helixtrans-60.4-45.5174-174.4179.4-179.7-178.60111.5K48 L49 Y50 H55 A56K48-K52 WeakPolarHBondContact O-CB 3.15Å; K48-K52 PolarHBondContact O-N 2.91Å; L49-K52 PolarHBondContact O-N 2.79Å; Y50-K52 VanDerWaalsContact C-N 3.33Å; Y50-K52 PolarHBondContact O-N 3.09Å; K52-H55 PolarHBondContact O-N 2.78Å; K52-A56 PolarHBondContact O-N 3.31Å; K52-A56 VanDerWaalsContact O-N 3.11Å
53Q96.8Very high96.8Very high112 Ų112105.1 Ų105.152%0.52351%0.508SS..Hα-helixtrans-61.5-49.2176-177.5-177.7-800111.3L49 Y50 H55 A56 E57L49-Q53 PolarHBondContact O-N 3.15Å; Y50-Q53 PolarHBondContact O-N 2.87Å; Q53-H55 VanDerWaalsContact C-N 3.27Å; Q53-H55 PolarHBondContact O-N 2.83Å; Q53-A56 WeakPolarHBondContact O-CB 3.43Å; Q53-A56 PolarHBondContact O-N 2.82Å; Q53-A56 VanDerWaalsContact O-N 3.12Å; Q53-E57 WeakPolarHBondContact CG-OE1 3.44Å; Q53-E57 PolarHBondContact NE2-OE1 3.41Å; Q53-E57 WeakPolarHBondContact O-CG 3.34Å; Q53-E57 PolarHBondContact O-N 2.91Å
54R95.4Very high96.8Very high71 Ų71101 Ų10127%0.26849%0.49SS..Hα-helixtrans-61.9-34.2179-67.4-59.2-61.6168.3-0.5112.7Y50 H51 E57 K58Y50-R54 HydrophobicContact CD1-CG 4.28Å; Y50-R54 HydrophobicContact CD2-CG 4.39Å; Y50-R54 HydrophobicContact CE1-CG 3.99Å; Y50-R54 HydrophobicContact CE2-CG 4.1Å; Y50-R54 HydrophobicContact CG-CG 4.48Å; Y50-R54 VanDerWaalsContact O-CG 3.32Å; Y50-R54 WeakPolarHBondContact O-CG 3.34Å; Y50-R54 PolarHBondContact O-N 3.41Å; H51-R54 PolarHBondContact O-N 2.73Å; R54-E57 WeakPolarHBondContact CD-OE2 3.17Å; R54-E57 IonicContact CZ-OE2 3.33Å; R54-E57 IonicContact NE-OE2 3.62Å; R54-E57 IonicContact NH1-OE2 2.6Å; R54-E57 PolarHBondContact NH1-OE2 3.47Å; R54-K58 WeakPolarHBondContact O-CG 3.47Å; R54-K58 PolarHBondContact O-N 2.99Å; R54-K58 VanDerWaalsContact O-N 3.09Å
55H96.9Very high96.8Very high122 Ų122103 Ų10357%0.56549%0.489SS*.Hα-helixtrans-65.4-44.5174.5-177.1-101.3000111.6H51 K52 Q53 K58 I59H51-H55 WeakPolarHBondContact O-CB 3.47Å; H51-H55 PolarHBondContact O-N 3.19Å; K52-H55 PolarHBondContact O-N 2.78Å; Q53-H55 VanDerWaalsContact C-N 3.27Å; Q53-H55 PolarHBondContact O-N 2.83Å; H55-K58 PolarHBondContact O-N 3.33Å; H55-I59 WeakPolarHBondContact CE1-CD1 3.48Å; H55-I59 WeakPolarHBondContact O-CG1 3.28Å; H55-I59 PolarHBondContact O-N 2.96Å
56A97.9Very high96.7Very high56 Ų56102.7 Ų102.746%0.46348%0.483SS..Hα-helixtrans-62.1-45.117600000112.2K52 Q53 K58 I59 Q60K52-A56 PolarHBondContact O-N 3.31Å; K52-A56 VanDerWaalsContact O-N 3.11Å; Q53-A56 WeakPolarHBondContact O-CB 3.43Å; Q53-A56 PolarHBondContact O-N 2.82Å; Q53-A56 VanDerWaalsContact O-N 3.12Å; A56-K58 VanDerWaalsContact C-N 3.35Å; A56-K58 PolarHBondContact O-N 3.09Å; A56-I59 PolarHBondContact O-N 2.91Å; A56-Q60 PolarHBondContact O-N 3.07Å
57E96.6Very high96.5Very high61 Ų61101.2 Ų101.229%0.28548%0.48SS..Hα-helixtrans-60-42.5176.8-70.6169.2-173.100112Q53 R54 Q60 M61Q53-E57 WeakPolarHBondContact CG-OE1 3.44Å; Q53-E57 PolarHBondContact NE2-OE1 3.41Å; Q53-E57 WeakPolarHBondContact O-CG 3.34Å; Q53-E57 PolarHBondContact O-N 2.91Å; R54-E57 WeakPolarHBondContact CD-OE2 3.17Å; R54-E57 IonicContact CZ-OE2 3.33Å; R54-E57 IonicContact NE-OE2 3.62Å; R54-E57 IonicContact NH1-OE2 2.6Å; R54-E57 PolarHBondContact NH1-OE2 3.47Å; E57-Q60 PolarHBondContact O-N 3.06Å; E57-M61 WeakPolarHBondContact O-CG 3.44Å; E57-M61 PolarHBondContact O-N 2.97Å
58K96.9Very high96.3Very high133 Ų133105.4 Ų105.458%0.57850%0.497SS*.Hα-helixtrans-62.6-42.1175.1-77.1-179.7178.5-174.20112R54 H55 A56 K62R54-K58 WeakPolarHBondContact O-CG 3.47Å; R54-K58 PolarHBondContact O-N 2.99Å; R54-K58 VanDerWaalsContact O-N 3.09Å; H55-K58 PolarHBondContact O-N 3.33Å; A56-K58 VanDerWaalsContact C-N 3.35Å; A56-K58 PolarHBondContact O-N 3.09Å; K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 VanDerWaalsContact O-CG 3.29Å; K58-K62 WeakPolarHBondContact O-CG 3.4Å; K58-K62 PolarHBondContact O-N 3.15Å
59I97.7Very high96Very high69 Ų69103.2 Ų103.235%0.35449%0.489SS..Hα-helixtrans-64.4-44.5177.2-71.7171.5000110.5H55 A56 K62 K63H55-I59 WeakPolarHBondContact CE1-CD1 3.48Å; H55-I59 WeakPolarHBondContact O-CG1 3.28Å; H55-I59 PolarHBondContact O-N 2.96Å; A56-I59 PolarHBondContact O-N 2.91Å; I59-K62 PolarHBondContact O-N 3.2Å; I59-K63 HydrophobicContact CG2-CD 4.22Å; I59-K63 HydrophobicContact CG2-CG 4.46Å; I59-K63 WeakPolarHBondContact O-CG 3.46Å; I59-K63 PolarHBondContact O-N 3.06Å
60Q97.7Very high95.5Very high128 Ų128103.9 Ų103.960%0.59849%0.489SS*.Hα-helixtrans-59.7-49.2178.3-175.2173.2-2.500110.9A56 E57 K62 K63 T64A56-Q60 PolarHBondContact O-N 3.07Å; E57-Q60 PolarHBondContact O-N 3.06Å; Q60-K62 VanDerWaalsContact C-N 3.35Å; Q60-K62 PolarHBondContact O-N 2.83Å; Q60-K63 PolarHBondContact O-N 2.89Å; Q60-K63 VanDerWaalsContact O-N 3.15Å; Q60-T64 WeakPolarHBondContact O-CG2 3.46Å; Q60-T64 PolarHBondContact O-N 2.87Å; Q60-T64 PolarHBondContact O-OG1 2.84Å
61M97.1Very high94.8Very high112 Ų112112.4 Ų112.455%0.55252%0.522SS*.Hα-helixtrans-60.7-41.2177.1-73.4-57.4-68.400112.8E57 K63 T64 I65E57-M61 WeakPolarHBondContact O-CG 3.44Å; E57-M61 PolarHBondContact O-N 2.97Å; M61-K63 VanDerWaalsContact C-N 3.35Å; M61-K63 PolarHBondContact O-N 2.69Å; M61-T64 WeakPolarHBondContact CA-OG1 3.35Å; M61-T64 PolarHBondContact O-N 3.24Å; M61-T64 PolarHBondContact O-OG1 2.9Å; M61-I65 WeakPolarHBondContact O-CB 3.45Å; M61-I65 WeakPolarHBondContact O-CD1 3.49Å; M61-I65 VanDerWaalsContact O-CG1 3.23Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.04Å
62K97.5Very high94.1Very high155 Ų155115.2 Ų115.267%0.67453%0.532SS*.Hα-helixtrans-61.6-43174.6-76.6179.7177.1-168.30111.7K58 I59 Q60 K66K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 VanDerWaalsContact O-CG 3.29Å; K58-K62 WeakPolarHBondContact O-CG 3.4Å; K58-K62 PolarHBondContact O-N 3.15Å; I59-K62 PolarHBondContact O-N 3.2Å; Q60-K62 VanDerWaalsContact C-N 3.35Å; Q60-K62 PolarHBondContact O-N 2.83Å; K62-K66 WeakPolarHBondContact O-CB 3.35Å; K62-K66 PolarHBondContact O-N 3.44Å
63K97Very high92.8Very high144 Ų144112 Ų11263%0.62653%0.526SS*.Hα-helixtrans-64.8-41.3177.1-74.2-177.8176.4-172.90112I59 Q60 M61 K66 M67I59-K63 HydrophobicContact CG2-CD 4.22Å; I59-K63 HydrophobicContact CG2-CG 4.46Å; I59-K63 WeakPolarHBondContact O-CG 3.46Å; I59-K63 PolarHBondContact O-N 3.06Å; Q60-K63 PolarHBondContact O-N 2.89Å; Q60-K63 VanDerWaalsContact O-N 3.15Å; M61-K63 VanDerWaalsContact C-N 3.35Å; M61-K63 PolarHBondContact O-N 2.69Å; K63-K66 PolarHBondContact O-N 3.32Å; K63-M67 WeakPolarHBondContact O-CB 3.31Å; K63-M67 PolarHBondContact O-N 2.94Å
64T96.4Very high91.3Very high62 Ų62116.2 Ų116.238%0.3854%0.543SS..Hα-helixtrans-68.6-40.4179.252.30000112.2Q60 M61 M67 H68Q60-T64 WeakPolarHBondContact O-CG2 3.46Å; Q60-T64 PolarHBondContact O-N 2.87Å; Q60-T64 PolarHBondContact O-OG1 2.84Å; M61-T64 WeakPolarHBondContact CA-OG1 3.35Å; M61-T64 PolarHBondContact O-N 3.24Å; M61-T64 PolarHBondContact O-OG1 2.9Å; T64-M67 PolarHBondContact O-N 2.84Å; T64-H68 WeakPolarHBondContact O-CB 3.3Å; T64-H68 PolarHBondContact O-N 3.02Å
65I95.6Very high89.6Confident85 Ų85120.9 Ų120.944%0.43657%0.568SS.*Hα-helixtrans-62.3-49.1174.7-68.1165.3000109.5M61 M67 H68 E69M61-I65 WeakPolarHBondContact O-CB 3.45Å; M61-I65 WeakPolarHBondContact O-CD1 3.49Å; M61-I65 VanDerWaalsContact O-CG1 3.23Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.04Å; I65-M67 PolarHBondContact O-N 3.18Å; I65-H68 PolarHBondContact O-N 2.86Å; I65-H68 VanDerWaalsContact O-N 3.12Å; I65-E69 HydrophobicContact CG2-CG 4.35Å; I65-E69 WeakPolarHBondContact CG2-OE1 3.21Å; I65-E69 WeakPolarHBondContact O-CG 3.5Å; I65-E69 PolarHBondContact O-N 3.02Å
66K94Very high87.7Confident123 Ų123124 Ų12454%0.53558%0.579SS.*Hα-helixtrans-58.6-44.4177.8-173.7177.4-178.3-179.80112.4K62 K63 H68 E69 Q70K62-K66 WeakPolarHBondContact O-CB 3.35Å; K62-K66 PolarHBondContact O-N 3.44Å; K63-K66 PolarHBondContact O-N 3.32Å; K66-H68 VanDerWaalsContact C-N 3.32Å; K66-H68 PolarHBondContact O-N 3.01Å; K66-E69 PolarHBondContact O-N 3.48Å; K66-Q70 HydrophobicContact CG-CG 4.45Å; K66-Q70 WeakPolarHBondContact O-CB 3.4Å; K66-Q70 VanDerWaalsContact O-CG 3.27Å; K66-Q70 WeakPolarHBondContact O-CG 3.37Å; K66-Q70 PolarHBondContact O-N 3.28Å
67M92.4Very high85.6Confident129 Ų129128.6 Ų128.664%0.63560%0.596SS**Hα-helixtrans-61.4-41.4176.7-177.7-166.8-67.500111.5K63 T64 I65 R71K63-M67 WeakPolarHBondContact O-CB 3.31Å; K63-M67 PolarHBondContact O-N 2.94Å; T64-M67 PolarHBondContact O-N 2.84Å; I65-M67 PolarHBondContact O-N 3.18Å; M67-R71 WeakPolarHBondContact O-CB 3.36Å; M67-R71 PolarHBondContact O-N 2.95Å
68H93.2Very high83.5Confident102 Ų102133 Ų13347%0.47262%0.622SS.*Hα-helixtrans-69.3-39.3178.2179-107.6000112.4T64 I65 K66 R71 K72T64-H68 WeakPolarHBondContact O-CB 3.3Å; T64-H68 PolarHBondContact O-N 3.02Å; I65-H68 PolarHBondContact O-N 2.86Å; I65-H68 VanDerWaalsContact O-N 3.12Å; K66-H68 VanDerWaalsContact C-N 3.32Å; K66-H68 PolarHBondContact O-N 3.01Å; H68-R71 PolarHBondContact O-N 2.86Å; H68-K72 WeakPolarHBondContact CE1-CE 3.46Å; H68-K72 PolarHBondContact CE1-NZ 2.82Å; H68-K72 VanDerWaalsContact CE1-NZ 3.26Å; H68-K72 WeakPolarHBondContact O-CG 3.45Å; H68-K72 PolarHBondContact O-N 2.83Å; H68-K72 VanDerWaalsContact O-N 3.1Å
69E90.4Very high81.4Confident110 Ų110133.4 Ų133.451%0.51463%0.63SS.*Hα-helixtrans-61.5-49.3172-72.5169.7174.800111.1I65 K66 R71 K72 T73I65-E69 HydrophobicContact CG2-CG 4.35Å; I65-E69 WeakPolarHBondContact CG2-OE1 3.21Å; I65-E69 WeakPolarHBondContact O-CG 3.5Å; I65-E69 PolarHBondContact O-N 3.02Å; K66-E69 PolarHBondContact O-N 3.48Å; E69-R71 VanDerWaalsContact C-N 3.28Å; E69-R71 PolarHBondContact O-N 2.93Å; E69-K72 WeakPolarHBondContact O-CB 3.4Å; E69-K72 PolarHBondContact O-N 2.86Å; E69-T73 PolarHBondContact O-N 2.82Å; E69-T73 PolarHBondContact O-OG1 2.89Å
70Q86.1Confident79.4Confident117 Ų117139.9 Ų139.955%0.54766%0.656SS.*Hα-helixtrans-61.3-34.4176.5-73177.2-32.100112.8K66 K72 T73K66-Q70 HydrophobicContact CG-CG 4.45Å; K66-Q70 WeakPolarHBondContact O-CB 3.4Å; K66-Q70 VanDerWaalsContact O-CG 3.27Å; K66-Q70 WeakPolarHBondContact O-CG 3.37Å; K66-Q70 PolarHBondContact O-N 3.28Å; Q70-K72 VanDerWaalsContact C-N 3.34Å; Q70-T73 CarbonylContact O-C 3.6Å
71R82.3Confident77.4Confident216 Ų216139.2 Ų139.282%0.81566%0.661SS**Hα-helixtrans-67.9-34.7174.2-175.9177.5176.5-178.2-0.5112.3M67 H68 E69M67-R71 WeakPolarHBondContact O-CB 3.36Å; M67-R71 PolarHBondContact O-N 2.95Å; H68-R71 PolarHBondContact O-N 2.86Å; E69-R71 VanDerWaalsContact C-N 3.28Å; E69-R71 PolarHBondContact O-N 2.93Å
72K80.7Confident75.7Confident155 Ų155138.4 Ų138.467%0.67466%0.664SS**Hα-helixtrans-71.7-36.1177.6-76.6177.8167.5-174.30111.8H68 E69 Q70H68-K72 WeakPolarHBondContact CE1-CE 3.46Å; H68-K72 PolarHBondContact CE1-NZ 2.82Å; H68-K72 VanDerWaalsContact CE1-NZ 3.26Å; H68-K72 WeakPolarHBondContact O-CG 3.45Å; H68-K72 PolarHBondContact O-N 2.83Å; H68-K72 VanDerWaalsContact O-N 3.1Å; E69-K72 WeakPolarHBondContact O-CB 3.4Å; E69-K72 PolarHBondContact O-N 2.86Å; Q70-K72 VanDerWaalsContact C-N 3.34Å
73T71.1Confident73.4Confident91 Ų91141 Ų14156%0.55868%0.678SS**SBendtrans-98.696.6179.6-21.90000109.8E69 Q70 Q75E69-T73 PolarHBondContact O-N 2.82Å; E69-T73 PolarHBondContact O-OG1 2.89Å; Q70-T73 CarbonylContact O-C 3.6Å; T73-Q75 VanDerWaalsContact C-N 3.32Å; T73-Q75 PolarHBondContact O-N 3.3Å
74K64.6Low71.9Confident200 Ų200137.2 Ų137.287%0.8768%0.68SS**  trans-68.693.8166.4-69.8-175.4-179-178.60108.2K76K74-K76 PolarHBondContact O-N 2.84Å
75Q59.7Low70.4Confident169 Ų169138.1 Ų138.179%0.7969%0.694SS**  trans-67127.3162.4-71.6-175.3-26.700107T73 D77T73-Q75 VanDerWaalsContact C-N 3.32Å; T73-Q75 PolarHBondContact O-N 3.3Å; Q75-D77 PolarHBondContact O-N 3.27Å
76K55.9Low69Low187 Ų187137.3 Ų137.381%0.81369%0.693SS**  trans-70.8122.4165-76.1-178.9176.4179.50105.8K74 D78K74-K76 PolarHBondContact O-N 2.84Å; K76-D78 PolarHBondContact O-N 2.85Å; K76-D78 VanDerWaalsContact O-N 3.16Å
77D55.4Low68.2Low153 Ų153134.5 Ų134.582%0.81869%0.687SS**  trans-65.9110.2167.6-72.6-39.1000107.4Q75Q75-D77 PolarHBondContact O-N 3.27Å
78D52Low67.2Low154 Ų154132.2 Ų132.282%0.82469%0.689SS**  trans-83.51.5176.5-93.4-27.2000112.6K76 K80K76-D78 PolarHBondContact O-N 2.85Å; K76-D78 VanDerWaalsContact O-N 3.16Å; D78-K80 PolarHBondContact O-N 2.81Å
79D51.8Low66.1Low141 Ų141135.6 Ų135.675%0.75470%0.698SS**  trans-82.1103.5177.6-84.6-28.6000111.3T81D79-T81 PolarHBondContact O-N 2.98Å; D79-T81 VanDerWaalsContact O-N 3.14Å
80K56Low64.8Low205 Ų205133.1 Ų133.189%0.89169%0.689SS**SBendtrans-64.9-10.6178.1-85.1178.5176.7174.40114.9D78D78-K80 PolarHBondContact O-N 2.81Å
81T56.5Low63.7Low113 Ų113132.9 Ų132.969%0.69369%0.691SS**SBendtrans-160110.6171.3420000110.3D79 E83D79-T81 PolarHBondContact O-N 2.98Å; D79-T81 VanDerWaalsContact O-N 3.14Å; T81-E83 PolarHBondContact O-N 3.45Å
82P60Low62.5Low95 Ų95130.4 Ų130.462%0.61769%0.693SS**  trans-64.9135.3172.824.9-30.8000110.2G84 A85P82-G84 PolarHBondContact O-N 3.31Å; P82-A85 PolarHBondContact O-N 3.42Å
83E50.8Low61.4Low210 Ų210131.7 Ų131.798%0.98169%0.694SS**THydrogen-bonded Turntrans-59.8105.6175.3-142.1177.8-171.100108.7T81T81-E83 PolarHBondContact O-N 3.45Å
84G64.8Low60.7Low64 Ų64136.9 Ų136.966%0.6671%0.712SS**THydrogen-bonded Turntrans118.918.1-170.900000115.8P82 V86P82-G84 PolarHBondContact O-N 3.31Å; G84-V86 WeakPolarHBondContact O-CG2 3.19Å; G84-V86 PolarHBondContact O-N 2.81Å
85A65.3Low59.8Low81 Ų81130.4 Ų130.467%0.66970%0.702SS**  trans-54.6108.1171.700000111.5P82P82-A85 PolarHBondContact O-N 3.42Å
86V65.9Low59.1Low68 Ų68128 Ų12841%0.41269%0.69SS.*  trans-104.3143.5174-150.90000107.7G84 L90G84-V86 WeakPolarHBondContact O-CG2 3.19Å; G84-V86 PolarHBondContact O-N 2.81Å; V86-L90 HydrophobicContact CB-CB 4.09Å; V86-L90 HydrophobicContact CG1-CB 3.33Å; V86-L90 HydrophobicContact CG1-CD1 3.56Å; V86-L90 HydrophobicContact CG1-CG 4.06Å
87P77.1Confident58.7Low64 Ų64124.7 Ų124.742%0.41669%0.686SS.*  trans-48.9148.9173.6-32.335.5000113.2Y89 L90P87-Y89 HydrophobicContact CB-CD1 3.74Å; P87-Y89 HydrophobicContact CB-CE1 3.2Å; P87-Y89 HydrophobicContact CB-CE2 4.35Å; P87-Y89 HydrophobicContact CB-CG 4.49Å; P87-Y89 HydrophobicContact CG-CE1 4.11Å; P87-Y89 PolarHBondContact O-N 3.37Å; P87-L90 WeakPolarHBondContact O-CA 3.41Å; P87-L90 WeakPolarHBondContact O-CB 3.49Å; P87-L90 PolarHBondContact O-N 2.98Å
88A71.6Confident58.3Low82 Ų82124.6 Ų124.668%0.67867%0.674SS**G310 helixtrans-51.9-33.2-170.900000114.7L90 L91A88-L90 PolarHBondContact O-N 3.05Å; A88-L91 HydrophobicContact CB-CD1 4.28Å; A88-L91 PolarHBondContact O-N 3.36Å
89Y69.9Low58Low172 Ų172120.7 Ų120.768%0.67566%0.664SS**G310 helixtrans-73.8-1.2177.561.3-93.4000114.9P87P87-Y89 HydrophobicContact CB-CD1 3.74Å; P87-Y89 HydrophobicContact CB-CE1 3.2Å; P87-Y89 HydrophobicContact CB-CE2 4.35Å; P87-Y89 HydrophobicContact CB-CG 4.49Å; P87-Y89 HydrophobicContact CG-CE1 4.11Å; P87-Y89 PolarHBondContact O-N 3.37Å
90L63Low57.6Low59 Ų59123 Ų12331%0.30967%0.667SS.*G310 helixtrans-122.4-0.3178.7-66.8172.8000112.9V86 P87 A88V86-L90 HydrophobicContact CB-CB 4.09Å; V86-L90 HydrophobicContact CG1-CB 3.33Å; V86-L90 HydrophobicContact CG1-CD1 3.56Å; V86-L90 HydrophobicContact CG1-CG 4.06Å; P87-L90 WeakPolarHBondContact O-CA 3.41Å; P87-L90 WeakPolarHBondContact O-CB 3.49Å; P87-L90 PolarHBondContact O-N 2.98Å; A88-L90 PolarHBondContact O-N 3.05Å
91L62.7Low57.2Low112 Ų112118 Ų11859%0.58665%0.653SS**THydrogen-bonded Turntrans-66.4-37.9-177.4-73.3172.3000113.2A88A88-L91 HydrophobicContact CB-CD1 4.28Å; A88-L91 PolarHBondContact O-N 3.36Å
92D58.9Low56.7Low163 Ų163117.3 Ų117.387%0.87265%0.645SS**THydrogen-bonded Turntrans-94.21.7-176.6-64.9-37.6000114
93R57.4Low56Low183 Ų183116.1 Ų116.169%0.69164%0.639SS**SBendtrans-90.1109.4173.2-66.3-175.9-179.2-174.6-0.4107.2G95R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.23Å
94E55.3Low56.1Low200 Ų200111.2 Ų111.294%0.93562%0.619SS**  trans-52.1101.3165.9-76.2-171.3163.700108.1Q96E94-Q96 PolarHBondContact O-N 3.06Å
95G45.3Very low55.7Low64 Ų64111.7 Ų111.766%0.6661%0.605SS**  trans-65.9107.8-165.800000111.6R93 T97R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.23Å; G95-T97 VanDerWaalsContact C-N 3.31Å; G95-T97 PolarHBondContact O-N 3.45Å; G95-T97 VanDerWaalsContact O-N 3.1Å
96Q46.4Very low55.3Low117 Ų117110.1 Ų110.155%0.54759%0.585SS.*  trans-58.8106.1136.8-83.3-173.7-2.400106.5E94 R98 L188E94-Q96 PolarHBondContact O-N 3.06Å; Q96-R98 VanDerWaalsContact C-N 3.26Å; Q96-R98 PolarHBondContact O-N 2.99Å; Q96-L188 HydrophobicContact CG-CD2 4.1Å
97T46.7Very low55Low118 Ų118114.2 Ų114.272%0.72460%0.598SS**  trans-60.788.116938.80000108.9G95G95-T97 VanDerWaalsContact C-N 3.31Å; G95-T97 PolarHBondContact O-N 3.45Å; G95-T97 VanDerWaalsContact O-N 3.1Å
98R46.3Very low54Low151 Ų151117.1 Ų117.157%0.5761%0.605SS**  trans-118.4128.8177.5-93.6-175.6170.6179.4-3.9112.9Q96Q96-R98 VanDerWaalsContact C-N 3.26Å; Q96-R98 PolarHBondContact O-N 2.99Å
99A46.3Very low53.4Low73 Ų73117 Ų11760%0.60359%0.59SS**SBendtrans106.4-19.2135.700000120.1
100K43.9Very low52.6Low189 Ų189117.5 Ų117.582%0.82259%0.59SS**SBendtrans-99.3-12.4174.1-87.8-175.1177178.10116.2L102 S103K100-L102 VanDerWaalsContact C-N 3.32Å; K100-S103 PolarHBondContact O-OG 3.01Å
101V47.3Very low52.3Low99 Ų99124 Ų12460%0.662%0.616SS**Hα-helixtrans-78.8-18.7174.2-179.30000112S103 M105V101-S103 PolarHBondContact O-N 3.48Å; V101-M105 HydrophobicContact CG1-CE 3.69Å; V101-M105 HydrophobicContact CG1-CG 4.01Å; V101-M105 HydrophobicContact CG1-SD 3.96Å; V101-M105 VanDerWaalsContact O-CB 3.29Å; V101-M105 WeakPolarHBondContact O-CB 3.35Å; V101-M105 WeakPolarHBondContact O-CG 3.47Å; V101-M105 PolarHBondContact O-N 3.49Å
102L46Very low51.7Low100 Ų100124 Ų12452%0.52461%0.613SS.*Hα-helixtrans-67-37.1-178.7-75.7166000113.3K100 I106K100-L102 VanDerWaalsContact C-N 3.32Å; L102-I106 WeakPolarHBondContact O-CB 3.38Å; L102-I106 WeakPolarHBondContact O-CD1 3.45Å; L102-I106 WeakPolarHBondContact O-CG1 3.43Å; L102-I106 PolarHBondContact O-N 3.32Å
103S46.1Very low51.3Low69 Ų69125.1 Ų125.148%0.48361%0.61SS.*Hα-helixtrans-73.3-35.2-176.359.30000113.2K100 V101K100-S103 PolarHBondContact O-OG 3.01Å; V101-S103 PolarHBondContact O-N 3.48Å
104N52.6Low50.6Low107 Ų107121.3 Ų121.357%0.57262%0.618SS**Hα-helixtrans-79.6-34.8174.5-76.7-16.1000112.1I106 K107 Q108N104-I106 VanDerWaalsContact C-N 3.31Å; N104-I106 PolarHBondContact O-N 3.43Å; N104-K107 PolarHBondContact O-N 3.11Å; N104-Q108 PolarHBondContact O-N 2.75Å
105M55.2Low50.4Low74 Ų74113.2 Ų113.237%0.36559%0.588SS.*Hα-helixtrans-62.6-34.2170.3-89.1-175.8-17900112.7V101 K107 Q108 K109V101-M105 HydrophobicContact CG1-CE 3.69Å; V101-M105 HydrophobicContact CG1-CG 4.01Å; V101-M105 HydrophobicContact CG1-SD 3.96Å; V101-M105 VanDerWaalsContact O-CB 3.29Å; V101-M105 WeakPolarHBondContact O-CB 3.35Å; V101-M105 WeakPolarHBondContact O-CG 3.47Å; V101-M105 PolarHBondContact O-N 3.49Å; M105-K107 VanDerWaalsContact C-N 3.33Å; M105-K107 PolarHBondContact O-N 2.91Å; M105-Q108 PolarHBondContact O-N 2.85Å; M105-K109 VanDerWaalsContact O-CB 3.29Å; M105-K109 WeakPolarHBondContact O-CB 3.3Å; M105-K109 WeakPolarHBondContact O-CG 3.36Å; M105-K109 PolarHBondContact O-N 3.07Å
106I57.7Low50.9Low49 Ų49118.9 Ų118.925%0.25159%0.594SS.*Hα-helixtrans-67.5-35.6177-71.7160000111.4L102 N104 R110L102-I106 WeakPolarHBondContact O-CB 3.38Å; L102-I106 WeakPolarHBondContact O-CD1 3.45Å; L102-I106 WeakPolarHBondContact O-CG1 3.43Å; L102-I106 PolarHBondContact O-N 3.32Å; N104-I106 VanDerWaalsContact C-N 3.31Å; N104-I106 PolarHBondContact O-N 3.43Å; I106-R110 WeakPolarHBondContact O-CB 2.9Å; I106-R110 WeakPolarHBondContact O-CG 3.38Å; I106-R110 PolarHBondContact O-N 2.91Å
107K58.8Low52.2Low154 Ų154121.4 Ų121.467%0.6760%0.599SS**Hα-helixtrans-68.9-37.6173.2-73-178177.6178.90111.8N104 M105 K111N104-K107 PolarHBondContact O-N 3.11Å; M105-K107 VanDerWaalsContact C-N 3.33Å; M105-K107 PolarHBondContact O-N 2.91Å; K107-K111 PolarHBondContact O-N 2.88Å
108Q57.4Low53.8Low124 Ų124122.3 Ų122.358%0.57960%0.595SS**Hα-helixtrans-68.6-46.8171.9-81.1174.6-28.100112.6N104 M105 R110 K111 E112N104-Q108 PolarHBondContact O-N 2.75Å; M105-Q108 PolarHBondContact O-N 2.85Å; Q108-R110 VanDerWaalsContact C-N 3.25Å; Q108-R110 PolarHBondContact O-N 3.26Å; Q108-K111 CarbonylContact O-C 3.5Å; Q108-K111 WeakPolarHBondContact O-CA 3.48Å; Q108-K111 WeakPolarHBondContact O-CB 3.03Å; Q108-K111 PolarHBondContact O-N 3.04Å; Q108-E112 PolarHBondContact O-N 2.95Å
109K57.6Low55.8Low81 Ų81117.6 Ų117.635%0.35258%0.583SS.*Hα-helixtrans-60.2-29.7176.4-78.4-166.5173.9-168.50113.1M105 W117M105-K109 VanDerWaalsContact O-CB 3.29Å; M105-K109 WeakPolarHBondContact O-CB 3.3Å; M105-K109 WeakPolarHBondContact O-CG 3.36Å; M105-K109 PolarHBondContact O-N 3.07Å; K109-W117 HydrophobicContact CD-CH2 4.14Å; K109-W117 HydrophobicContact CG-CH2 4.28Å
110R52.9Low57.9Low182 Ų182117.8 Ų117.869%0.68758%0.578SS**Hα-helixtrans-74-30.8172.5-77.8-178.6-176.6-173.42.1113I106 Q108I106-R110 WeakPolarHBondContact O-CB 2.9Å; I106-R110 WeakPolarHBondContact O-CG 3.38Å; I106-R110 PolarHBondContact O-N 2.91Å; Q108-R110 VanDerWaalsContact C-N 3.25Å; Q108-R110 PolarHBondContact O-N 3.26Å
111K57.2Low60.2Low196 Ų196111 Ų11185%0.85255%0.55SS**Hα-helixtrans-77.7-31.1172.7-92.4-178.1172-177.10112.3K107 Q108 K113K107-K111 PolarHBondContact O-N 2.88Å; Q108-K111 CarbonylContact O-C 3.5Å; Q108-K111 WeakPolarHBondContact O-CA 3.48Å; Q108-K111 WeakPolarHBondContact O-CB 3.03Å; Q108-K111 PolarHBondContact O-N 3.04Å; K111-K113 PolarHBondContact O-N 3.42Å
112E50.5Low62.1Low112 Ų112110.7 Ų110.752%0.52355%0.55SS.*  trans-83.229.3175.9-68.5-178.6152.300114Q108 A114 G115Q108-E112 PolarHBondContact O-N 2.95Å; E112-A114 PolarHBondContact O-N 3.44Å; E112-G115 PolarHBondContact O-N 3.22Å
113K51.5Low64.2Low186 Ų186115.2 Ų115.281%0.80957%0.566SS**THydrogen-bonded Turntrans-60.5-10.5-177.3-121.9179.5179.3-175.30114.4K111K111-K113 PolarHBondContact O-N 3.42Å
114A42.7Very low66.3Low102 Ų102113.9 Ų113.984%0.84356%0.555SS**THydrogen-bonded Turntrans-117.718.4171.100000113.4E112E112-A114 PolarHBondContact O-N 3.44Å
115G49.6Very low68.1Low30 Ų30117.6 Ų117.631%0.30956%0.561SS.*SBendtrans-68.4136.1174.900000110.4E112 W117E112-G115 PolarHBondContact O-N 3.22Å; G115-W117 PolarHBondContact O-N 3.27Å; G115-W117 PolarHBondContact O-NE1 3.35Å
116K56.1Low69.7Low184 Ų184117.9 Ų117.980%0.858%0.575SS**  trans-60.996176.2-67.5174.9179177.10109.2E118K116-E118 HydrophobicContact CB-CG 4.3Å; K116-E118 PolarHBondContact O-N 3.27Å
117W73.5Confident71.1Confident170 Ų170116.9 Ų116.964%0.64457%0.569SS**  trans-72.576.1172.3-61.498.6000109.3K109 G115K109-W117 HydrophobicContact CD-CH2 4.14Å; K109-W117 HydrophobicContact CG-CH2 4.28Å; G115-W117 PolarHBondContact O-N 3.27Å; G115-W117 PolarHBondContact O-NE1 3.35Å
118E81.5Confident72.6Confident137 Ų137111.1 Ų111.164%0.6455%0.553SS**  trans-82131.3175.6-72.3-176.6-168.200110K116K116-E118 HydrophobicContact CB-CG 4.3Å; K116-E118 PolarHBondContact O-N 3.27Å
119V88.3Confident74.1Confident52 Ų52111.7 Ų111.732%0.31556%0.556SS.*  trans-69.3151.6167.5-66.30000109.4L121 P122 L259V119-L121 WeakPolarHBondContact CG2-O 3.17Å; V119-L121 PolarHBondContact O-N 2.98Å; V119-P122 WeakPolarHBondContact O-CD 3.48Å; V119-L259 HydrophobicContact CG1-CD1 4.11Å; V119-L259 HydrophobicContact CG1-CD2 4.4Å
120P90.1Very high75.7Confident76 Ų76113.9 Ų113.949%0.49458%0.576SS.*SBendtrans-52.1-32.7-178.7-29.434.5000115.1Q243 L259P120-Q243 VanDerWaalsContact CD-OE1 3.29Å; P120-L259 HydrophobicContact CG-CD2 4.03Å
121L90.9Very high77.5Confident46 Ų46109 Ų10924%0.24156%0.561CS.*  trans-119.487.1174.2-63.6174.4000109.9V119 V124 K216 Q243 T245V119-L121 WeakPolarHBondContact CG2-O 3.17Å; V119-L121 PolarHBondContact O-N 2.98Å; L121-V124 HydrophobicContact CB-CG2 4.15Å; L121-K216 HydrophobicContact CD1-CG 4.17Å; L121-Q243 PolarHBondContact O-NE2 3.39Å; L121-T245 HydrophobicContact CD1-CG2 4.34Å
122P88.6Confident79.2Confident93 Ų9399.7 Ų99.760%0.60452%0.521SS*.SBendtrans-73.6-37.4-176.327.3-32.9000112.2V119V119-P122 WeakPolarHBondContact O-CD 3.48Å
123K89.4Confident81.4Confident195 Ų19595 Ų9585%0.84850%0.499SS*.  trans-122.1126.1178.9-169.5174.4-177.4177.20109.7
124V91.1Very high83.5Confident41 Ų4192.3 Ų92.325%0.24849%0.488CS..  trans-121.5153.7175.2-176.20000109.1L121 A126 K216L121-V124 HydrophobicContact CB-CG2 4.15Å; V124-A126 PolarHBondContact O-N 2.81Å; V124-K216 HydrophobicContact CG1-CB 3.97Å; V124-K216 HydrophobicContact CG1-CD 4.33Å; V124-K216 HydrophobicContact CG1-CG 3.95Å; V124-K216 WeakPolarHBondContact CG1-O 3.36Å
125R90.2Very high86.1Confident186 Ų18690.8 Ų90.870%0.70247%0.468SS*.PPolyproline II helixtrans-52.3126.4171.8174.1176.6164.9174.3-6109.6E131R125-E131 IonicContact NH2-OE1 2.75Å; R125-E131 PolarHBondContact NH2-OE1 3.3Å
126A87.1Confident88.3Confident80 Ų8091.2 Ų91.266%0.66146%0.463SS*.PPolyproline II helixtrans-65.1135.6172.300000109.8V124V124-A126 PolarHBondContact O-N 2.81Å
127Q88Confident90.2Very high28 Ų2890.4 Ų90.413%0.13145%0.454CS..PPolyproline II helixtrans-96.3131.2175.2-62.9-166.8-2.900109.8V132 T215Q127-V132 HydrophobicContact CB-CG2 3.9Å; Q127-V132 VanDerWaalsContact OE1-CG2 3.3Å; Q127-T215 VanDerWaalsContact CD-CG2 3.49Å
128G89.6Confident91.1Very high33 Ų3383.9 Ų83.934%0.3443%0.433SS..PPolyproline II helixtrans-68.9146.9173.900000111T130 E131 V132G128-T130 PolarHBondContact O-N 2.97Å; G128-E131 WeakPolarHBondContact O-CB 3.47Å; G128-E131 PolarHBondContact O-N 3.49Å; G128-V132 PolarHBondContact O-N 2.85Å
129E90.4Very high91.7Very high136 Ų13679.7 Ų79.764%0.63643%0.427SS*.Hα-helixtrans-58.4-34.1177.7-65.3-167.4162.800112.7E131 V132 L133 Y208E129-E131 VanDerWaalsContact C-N 3.29Å; E129-E131 PolarHBondContact O-N 3.48Å; E129-V132 PolarHBondContact O-N 3.04Å; E129-L133 WeakPolarHBondContact O-CA 3.07Å; E129-L133 WeakPolarHBondContact O-CB 3.15Å; E129-L133 PolarHBondContact O-N 3.43Å; E129-Y208 WeakPolarHBondContact CA-OH 3.37Å
130T90.4Very high92.1Very high126 Ų12687.6 Ų87.677%0.77346%0.457SS*.Hα-helixtrans-65.9-29.5177.251.50000113.1G128G128-T130 PolarHBondContact O-N 2.97Å
131E91Very high92.3Very high81 Ų8193.9 Ų93.938%0.37947%0.471SS..Hα-helixtrans-74.8-33.7177.3-62.8-177.616400111.5R125 G128 E129 T151R125-E131 IonicContact NH2-OE1 2.75Å; R125-E131 PolarHBondContact NH2-OE1 3.3Å; G128-E131 WeakPolarHBondContact O-CB 3.47Å; G128-E131 PolarHBondContact O-N 3.49Å; E129-E131 VanDerWaalsContact C-N 3.29Å; E129-E131 PolarHBondContact O-N 3.48Å; E131-T151 PolarHBondContact O-OG1 3.44Å
132V93.3Very high92.4Very high0 Ų096.1 Ų96.10%048%0.481CS..Hα-helixtrans-90.7-36-176.1-176.60000112.3Q127 G128 E129 V150 T151 K152 Y208 V213Q127-V132 HydrophobicContact CB-CG2 3.9Å; Q127-V132 VanDerWaalsContact OE1-CG2 3.3Å; G128-V132 PolarHBondContact O-N 2.85Å; E129-V132 PolarHBondContact O-N 3.04Å; V132-V150 WeakPolarHBondContact O-CA 3.49Å; V132-T151 PolarHBondContact O-N 3.38Å; V132-T151 PolarHBondContact O-OG1 2.89Å; V132-K152 HydrophobicContact CB-CG 4.4Å; V132-K152 HydrophobicContact CG1-CG 4.1Å; V132-K152 HydrophobicContact CG2-CG 4.2Å; V132-Y208 HydrophobicContact CB-CE1 4.3Å; V132-Y208 HydrophobicContact CG1-CD1 4.29Å; V132-Y208 HydrophobicContact CG1-CE1 3.84Å; V132-Y208 HydrophobicContact CG1-CE2 4.41Å; V132-Y208 HydrophobicContact CG2-CE2 4.05Å; V132-V213 HydrophobicContact CG1-CG1 4.17Å
133L95.4Very high92.7Very high14 Ų1499.8 Ų99.87%0.07349%0.487CS..EExtended strand (participates in β ladder)trans-120.696.9-171.5-62.5177.4000111E129 R148 M149 V150 F170 Y208E129-L133 WeakPolarHBondContact O-CA 3.07Å; E129-L133 WeakPolarHBondContact O-CB 3.15Å; E129-L133 PolarHBondContact O-N 3.43Å; L133-R148 HydrophobicContact CB-CB 4.28Å; L133-R148 HydrophobicContact CD2-CB 4.36Å; L133-M149 CarbonylContact C-O 3.55Å; L133-M149 WeakPolarHBondContact CA-O 3.31Å; L133-V150 HydrophobicContact CD2-CG2 3.92Å; L133-F170 HydrophobicContact CD1-CE1 3.99Å; L133-F170 HydrophobicContact CD2-CD1 4.19Å; L133-F170 HydrophobicContact CD2-CE1 4.46Å; L133-Y208 HydrophobicContact CD1-CE1 4.43Å
134K96.3Very high93Very high129 Ų12997.3 Ų97.356%0.56148%0.476SS*.EExtended strand (participates in β ladder)trans-73.4133.1173.6-178.2178.4-1781770110.8I136 R148 M149 T151K134-I136 PolarHBondContact O-N 3.39Å; K134-R148 CarbonylContact O-C 3.56Å; K134-R148 WeakPolarHBondContact O-CA 3.27Å; K134-M149 HydrophobicContact CB-CB 4.3Å; K134-M149 PolarHBondContact N-O 3.3Å; K134-M149 PolarHBondContact O-N 3.27Å; K134-T151 HydrophobicContact CB-CG2 3.66Å
135V96.6Very high93.2Very high70 Ų7097.4 Ų97.442%0.42448%0.481SS..EExtended strand (participates in β ladder)trans-70.6127.2175.2179.70000110.4A145V135-A145 HydrophobicContact CG1-CB 3.78Å
136I95.8Very high93.3Very high39 Ų3993 Ų9320%0.246%0.464CS..EExtended strand (participates in β ladder)trans-104.2126168.3-57.5-175.4000109K134 T138 K147 M149 I171K134-I136 PolarHBondContact O-N 3.39Å; I136-T138 HydrophobicContact CG2-CG2 4.36Å; I136-K147 HydrophobicContact CB-CB 3.97Å; I136-K147 PolarHBondContact N-O 3.3Å; I136-K147 VanDerWaalsContact N-O 3.08Å; I136-M149 HydrophobicContact CD1-CB 3.9Å; I136-M149 HydrophobicContact CD1-CE 3.46Å; I136-M149 VanDerWaalsContact CD1-CE 3.46Å; I136-M149 HydrophobicContact CG1-CB 3.99Å; I136-M149 HydrophobicContact CG1-CE 4.17Å; I136-I171 HydrophobicContact CD1-CD1 3.43Å; I136-I171 VanDerWaalsContact CD1-CD1 3.43Å
137R96.1Very high93.8Very high166 Ų16690.4 Ų90.463%0.62644%0.438SS*.EExtended strand (participates in β ladder)trans-87.9147.2170.4-67.5178.8177.4-169.91.5110.1Q142 K144 A145R137-Q142 HydrophobicContact CB-CB 4.07Å; R137-Q142 WeakPolarHBondContact CB-O 3.19Å; R137-Q142 WeakPolarHBondContact CD-O 3.38Å; R137-Q142 PolarHBondContact O-OE1 3.41Å; R137-K144 CarbonylContact C-O 3.46Å; R137-K144 VanDerWaalsContact CA-O 3.3Å; R137-K144 WeakPolarHBondContact CA-O 3.43Å; R137-A145 HydrophobicContact CG-CB 4.2Å
138T93.8Very high94.2Very high33 Ų3392.4 Ų92.420%0.20245%0.445CS..EExtended strand (participates in β ladder)trans-135.8156.9-175.453.80000111.7I136 K144 W146 K147I136-T138 HydrophobicContact CG2-CG2 4.36Å; T138-K144 PolarHBondContact N-O 2.93Å; T138-K144 PolarHBondContact O-N 3.37Å; T138-K144 WeakPolarHBondContact OG1-CB 3.41Å; T138-K144 PolarHBondContact OG1-O 2.94Å; T138-K144 VanDerWaalsContact OG1-O 3.05Å; T138-W146 PolarHBondContact OG1-NE1 2.96Å; T138-K147 HydrophobicContact CG2-CD 3.97Å; T138-K147 HydrophobicContact CG2-CG 4.46Å
139G94.2Very high94.5Very high50 Ų5093.8 Ų93.852%0.51544%0.443SS..SBendtrans89.9161-177.900000113.4R141 Q142G139-R141 VanDerWaalsContact C-N 3.25Å; G139-R141 PolarHBondContact O-N 3.44Å; G139-Q142 PolarHBondContact O-N 3.47Å; G139-Q142 PolarHBondContact O-NE2 2.94Å
140K95.1Very high94.7Very high217 Ų21787.3 Ų87.394%0.94341%0.413SS*.THydrogen-bonded Turntrans-53.8-40.2-177-174.3172.9-179.41760113
141R94.4Very high95Very high208 Ų20883.7 Ų83.779%0.78539%0.39SS*.THydrogen-bonded Turntrans-92.23177.8-63.8-177178.3176.2-3114.3G139 K143G139-R141 VanDerWaalsContact C-N 3.25Å; G139-R141 PolarHBondContact O-N 3.44Å; R141-K143 HydrophobicContact CB-CG 4.31Å; R141-K143 PolarHBondContact O-N 3Å
142Q94Very high95.1Very high94 Ų9481 Ų8144%0.43938%0.378SS..  trans55.326.6176.7-62-67.1-25.500115.6R137 G139R137-Q142 HydrophobicContact CB-CB 4.07Å; R137-Q142 WeakPolarHBondContact CB-O 3.19Å; R137-Q142 WeakPolarHBondContact CD-O 3.38Å; R137-Q142 PolarHBondContact O-OE1 3.41Å; G139-Q142 PolarHBondContact O-N 3.47Å; G139-Q142 PolarHBondContact O-NE2 2.94Å
143K95.1Very high95.3Very high170 Ų17081 Ų8174%0.73938%0.378SS*.  trans-81.1-17.3-178.3-69.8-170.9174.9-169.60114.2R141R141-K143 HydrophobicContact CB-CG 4.31Å; R141-K143 PolarHBondContact O-N 3Å
144K94.6Very high95.3Very high143 Ų14380.4 Ų80.462%0.62237%0.374SS*.EExtended strand (participates in β ladder)trans-99.6116.4-173.9-61.7-62.2-173.9-179.60110.9R137 T138R137-K144 CarbonylContact C-O 3.46Å; R137-K144 VanDerWaalsContact CA-O 3.3Å; R137-K144 WeakPolarHBondContact CA-O 3.43Å; T138-K144 PolarHBondContact N-O 2.93Å; T138-K144 PolarHBondContact O-N 3.37Å; T138-K144 WeakPolarHBondContact OG1-CB 3.41Å; T138-K144 PolarHBondContact OG1-O 2.94Å; T138-K144 VanDerWaalsContact OG1-O 3.05Å
145A94.9Very high95.3Very high42 Ų4275.3 Ų75.335%0.34735%0.352SS..EExtended strand (participates in β ladder)trans-118.635.2-17100000114.1V135 R137 R148V135-A145 HydrophobicContact CG1-CB 3.78Å; R137-A145 HydrophobicContact CG-CB 4.2Å; A145-R148 PolarHBondContact O-NH1 2.96Å
146W94.2Very high95.2Very high94 Ų9472.6 Ų72.636%0.35634%0.336SS..EExtended strand (participates in β ladder)trans-82-19-17462.1-83.6000114T138 K166 R169T138-W146 PolarHBondContact OG1-NE1 2.96Å; W146-K166 WeakPolarHBondContact CH2-O 3.28Å; W146-R169 HydrophobicContact CE3-CB 4.32Å; W146-R169 HydrophobicContact CE3-CG 4.23Å; W146-R169 HydrophobicContact CZ3-CB 4.18Å; W146-R169 WeakPolarHBondContact O-CG 3.34Å; W146-R169 PolarHBondContact O-NE 3.34Å
147K95.9Very high94.9Very high25 Ų2572.5 Ų72.511%0.10935%0.345CS..EExtended strand (participates in β ladder)trans-84.2148.5179.6-67.6-167.2174.4-165.90112.1I136 T138 P165 E168 R169 I171I136-K147 HydrophobicContact CB-CB 3.97Å; I136-K147 PolarHBondContact N-O 3.3Å; I136-K147 VanDerWaalsContact N-O 3.08Å; T138-K147 HydrophobicContact CG2-CD 3.97Å; T138-K147 HydrophobicContact CG2-CG 4.46Å; K147-P165 VanDerWaalsContact CE-O 3.3Å; K147-P165 WeakPolarHBondContact CE-O 3.48Å; K147-P165 PolarHBondContact NZ-O 2.83Å; K147-E168 WeakPolarHBondContact CE-O 3.41Å; K147-R169 WeakPolarHBondContact CA-O 3.41Å; K147-I171 HydrophobicContact CB-CD1 4.49Å; K147-I171 HydrophobicContact CD-CD1 3.99Å
148R96.5Very high94.6Very high70 Ų7071 Ų7126%0.26435%0.349SS..EExtended strand (participates in β ladder)trans-130.9126178.7-65.3-67.2-178.9-98.75.5109.4L133 K134 A145 R169 F170 I171L133-R148 HydrophobicContact CB-CB 4.28Å; L133-R148 HydrophobicContact CD2-CB 4.36Å; K134-R148 CarbonylContact O-C 3.56Å; K134-R148 WeakPolarHBondContact O-CA 3.27Å; A145-R148 PolarHBondContact O-NH1 2.96Å; R148-R169 PolarHBondContact N-O 3.08Å; R148-F170 HydrophobicContact CB-CD1 3.86Å; R148-F170 HydrophobicContact CB-CE1 4.12Å; R148-F170 HydrophobicContact CG-CE1 4.31Å; R148-F170 CarbonylContact O-C 3.58Å; R148-F170 WeakPolarHBondContact O-CA 3.41Å; R148-I171 PolarHBondContact O-N 2.99Å
149M96.1Very high94.4Very high62 Ų6273.1 Ų73.131%0.30538%0.378SS..EExtended strand (participates in β ladder)trans-96.4129.8173-167-179-73.300109.5L133 K134 I136 T151 I171L133-M149 CarbonylContact C-O 3.55Å; L133-M149 WeakPolarHBondContact CA-O 3.31Å; K134-M149 HydrophobicContact CB-CB 4.3Å; K134-M149 PolarHBondContact N-O 3.3Å; K134-M149 PolarHBondContact O-N 3.27Å; I136-M149 HydrophobicContact CD1-CB 3.9Å; I136-M149 HydrophobicContact CD1-CE 3.46Å; I136-M149 VanDerWaalsContact CD1-CE 3.46Å; I136-M149 HydrophobicContact CG1-CB 3.99Å; I136-M149 HydrophobicContact CG1-CE 4.17Å; M149-T151 PolarHBondContact O-N 3.01Å; M149-I171 HydrophobicContact CG-CG2 4.46Å
150V95.8Very high94.2Very high0 Ų073.8 Ų73.80%037%0.366CS..EExtended strand (participates in β ladder)trans-73123.1169.4-178.90000108.5V132 L133 K152 I171 R172 P173 V213V132-V150 WeakPolarHBondContact O-CA 3.49Å; L133-V150 HydrophobicContact CD2-CG2 3.92Å; V150-K152 HydrophobicContact CG1-CB 4.5Å; V150-K152 WeakPolarHBondContact CG1-O 3.41Å; V150-I171 PolarHBondContact N-O 3.45Å; V150-R172 HydrophobicContact CB-CG 4.46Å; V150-R172 HydrophobicContact CG2-CG 3.97Å; V150-P173 WeakPolarHBondContact O-CD 3.4Å; V150-V213 HydrophobicContact CG1-CG2 3.78Å; V150-V213 HydrophobicContact CG2-CG2 4.49Å
151T95.3Very high94Very high50 Ų5069.2 Ų69.231%0.30736%0.357SS..  trans-94.5-17.2178.453.40000113E131 V132 K134 M149 L176E131-T151 PolarHBondContact O-OG1 3.44Å; V132-T151 PolarHBondContact O-N 3.38Å; V132-T151 PolarHBondContact O-OG1 2.89Å; K134-T151 HydrophobicContact CB-CG2 3.66Å; M149-T151 PolarHBondContact O-N 3.01Å; T151-L176 VanDerWaalsContact O-CD1 3.25Å; T151-L176 WeakPolarHBondContact O-CD1 3.21Å
152K94.8Very high93.9Very high25 Ų2565.6 Ų65.611%0.10934%0.343CS..SBendtrans-88.9160.6178.6-58.7-61.8-177.2176.90111.3V132 V150 V213 T215 E249V132-K152 HydrophobicContact CB-CG 4.4Å; V132-K152 HydrophobicContact CG1-CG 4.1Å; V132-K152 HydrophobicContact CG2-CG 4.2Å; V150-K152 HydrophobicContact CG1-CB 4.5Å; V150-K152 WeakPolarHBondContact CG1-O 3.41Å; K152-V213 HydrophobicContact CB-CG1 3.79Å; K152-V213 HydrophobicContact CG-CG1 4.4Å; K152-T215 HydrophobicContact CB-CG2 4.49Å; K152-T215 HydrophobicContact CG-CG2 4.28Å; K152-E249 HydrophobicContact CD-CB 4.09Å; K152-E249 HydrophobicContact CD-CG 3.93Å; K152-E249 IonicContact NZ-OE1 3.63Å; K152-E249 PolarHBondContact NZ-OE1 3.46Å
153V95.8Very high93.8Very high1 Ų167.9 Ų67.91%0.00635%0.351CS..  trans-59.6140.8172.2176.20000109.5F178 I214 P248 I254V153-F178 HydrophobicContact CG1-CB 3.91Å; V153-F178 HydrophobicContact CG1-CD1 3.56Å; V153-F178 HydrophobicContact CG1-CD2 4.09Å; V153-F178 HydrophobicContact CG1-CE1 4.08Å; V153-F178 HydrophobicContact CG1-CG 3.58Å; V153-F178 HydrophobicContact CG2-CD1 4.43Å; V153-F178 HydrophobicContact CG2-CE1 4.13Å; V153-F178 HydrophobicContact CG2-CZ 4.3Å; V153-I214 PolarHBondContact O-N 3.42Å; V153-P248 HydrophobicContact CB-CB 3.92Å; V153-P248 HydrophobicContact CG1-CB 4.36Å; V153-P248 HydrophobicContact CG2-CB 3.7Å; V153-I254 HydrophobicContact CG1-CD1 3.9Å; V153-I254 HydrophobicContact CG1-CG1 4.2Å
154C95.4Very high93.9Very high0 Ų063.5 Ų63.50%034%0.341CS..BIsolated β-bridgetrans-135.2150.4178.662.90000111.6L176 R177 F178 G212C154-L176 PolarHBondContact N-O 3.23Å; C154-L176 PolarHBondContact SG-O 3.47Å; C154-R177 VanDerWaalsContact O-CA 3.3Å; C154-R177 WeakPolarHBondContact O-CA 3.25Å; C154-F178 PolarHBondContact O-N 3.1Å; C154-G212 CarbonylContact C-O 3.53Å; C154-G212 WeakPolarHBondContact CA-O 3.4Å; C154-G212 WeakPolarHBondContact CB-O 3.29Å
155F96.4Very high93.8Very high22 Ų2260.9 Ų60.910%0.09634%0.338CS..  trans-98.9140.1166.5174.2-100.6000109.6F178 I196 L197 V199 G212 I214F155-F178 WeakPolarHBondContact CD2-O 3.42Å; F155-I196 HydrophobicContact CB-CG2 4.4Å; F155-I196 HydrophobicContact CD1-CG2 4.21Å; F155-I196 HydrophobicContact CD2-CB 3.68Å; F155-I196 HydrophobicContact CD2-CD1 4.36Å; F155-I196 HydrophobicContact CD2-CG2 3.54Å; F155-I196 HydrophobicContact CE1-CG2 4.38Å; F155-I196 HydrophobicContact CE2-CB 3.7Å; F155-I196 HydrophobicContact CE2-CG2 3.76Å; F155-I196 WeakPolarHBondContact CE2-O 3.29Å; F155-I196 HydrophobicContact CG-CB 4.42Å; F155-I196 HydrophobicContact CG-CG2 3.78Å; F155-I196 HydrophobicContact CZ-CB 4.44Å; F155-I196 HydrophobicContact CZ-CG2 4.16Å; F155-I196 VanDerWaalsContact CZ-O 3.25Å; F155-I196 WeakPolarHBondContact CZ-O 3.37Å; F155-L197 WeakPolarHBondContact CE1-O 3.49Å; F155-L197 WeakPolarHBondContact CZ-O 3.37Å; F155-V199 HydrophobicContact CB-CG2 3.85Å; F155-V199 HydrophobicContact CD1-CG2 4.34Å; F155-V199 HydrophobicContact CG-CG2 4.47Å; F155-G212 PolarHBondContact N-O 3.26Å; F155-I214 HydrophobicContact CB-CD1 3.76Å; F155-I214 HydrophobicContact CB-CG1 4.44Å
156V94.3Very high93.8Very high13 Ų1366.8 Ų66.88%0.07936%0.356CS..  trans-137.7122.4-179.6177.30000105.8F160 R177V156-F160 HydrophobicContact CG1-CB 3.05Å; V156-F160 HydrophobicContact CG1-CD1 3.35Å; V156-F160 HydrophobicContact CG1-CD2 3.7Å; V156-F160 HydrophobicContact CG1-CE1 4.16Å; V156-F160 HydrophobicContact CG1-CE2 4.47Å; V156-F160 HydrophobicContact CG1-CG 3.05Å; V156-R177 HydrophobicContact CB-CG 4.45Å; V156-R177 HydrophobicContact CG2-CG 3.85Å
157G91.3Very high93.7Very high38 Ų3870.8 Ų70.839%0.39237%0.372SS..  trans-62160.8-178.900000112.7G159 F160G157-G159 PolarHBondContact O-N 2.92Å; G157-F160 VanDerWaalsContact O-CB 3.32Å; G157-F160 WeakPolarHBondContact O-CB 3.07Å; G157-F160 PolarHBondContact O-N 3.31Å; G157-F160 VanDerWaalsContact O-N 3.1Å
158D88Confident93.6Very high135 Ų13570.1 Ų70.172%0.72237%0.369SS*.THydrogen-bonded Turntrans-63.5-27.1-171.5-69.7-48.3000114F160 K179D158-F160 VanDerWaalsContact C-N 3.26Å; D158-F160 PolarHBondContact O-N 2.8Å; D158-K179 IonicContact OD1-NZ 2.77Å; D158-K179 PolarHBondContact OD1-NZ 3.01Å
159G89.9Confident93.5Very high77 Ų7773.3 Ų73.379%0.79438%0.382SS*.THydrogen-bonded Turntrans-81.412.8175.700000115.5G157 T161G157-G159 PolarHBondContact O-N 2.92Å; G159-T161 PolarHBondContact O-N 3.47Å
160F90.8Very high93.5Very high64 Ų6473.3 Ų73.328%0.28138%0.38SS..  trans-75.5116.2-174.2176.8-102.7000113.5V156 G157 D158 R162V156-F160 HydrophobicContact CG1-CB 3.05Å; V156-F160 HydrophobicContact CG1-CD1 3.35Å; V156-F160 HydrophobicContact CG1-CD2 3.7Å; V156-F160 HydrophobicContact CG1-CE1 4.16Å; V156-F160 HydrophobicContact CG1-CE2 4.47Å; V156-F160 HydrophobicContact CG1-CG 3.05Å; G157-F160 VanDerWaalsContact O-CB 3.32Å; G157-F160 WeakPolarHBondContact O-CB 3.07Å; G157-F160 PolarHBondContact O-N 3.31Å; G157-F160 VanDerWaalsContact O-N 3.1Å; D158-F160 VanDerWaalsContact C-N 3.26Å; D158-F160 PolarHBondContact O-N 2.8Å; F160-R162 HydrophobicContact CE1-CG 3.73Å; F160-R162 HydrophobicContact CZ-CG 4.14Å
161T90.8Very high93.5Very high120 Ų12074.4 Ų74.474%0.73639%0.385SS*.  trans-105.4136.8167.2-56.40000109.9G159G159-T161 PolarHBondContact O-N 3.47Å
162R91.8Very high93.5Very high132 Ų13273.8 Ų73.850%0.49838%0.378SS..PPolyproline II helixtrans-68.2137.3176.7-72.2-173.370.1-161.8-2.7110.2F160 E168F160-R162 HydrophobicContact CE1-CG 3.73Å; F160-R162 HydrophobicContact CZ-CG 4.14Å; R162-E168 IonicContact CZ-OE2 3.57Å; R162-E168 IonicContact NE-OE1 3.51Å; R162-E168 IonicContact NE-OE2 3.61Å; R162-E168 IonicContact NH2-OE1 3.71Å; R162-E168 IonicContact NH2-OE2 2.73Å; R162-E168 PolarHBondContact NH2-OE2 3.26Å
163K93.3Very high93.5Very high142 Ų14274.2 Ų74.262%0.61738%0.383SS*.PPolyproline II helixtrans-68.5151.9170.1-64.3-172.9179.4-172.90109.9E168K163-E168 HydrophobicContact CB-CB 4.35Å
164P95.9Very high93.3Very high79 Ų7981 Ų8151%0.51342%0.416SS..PPolyproline II helixtrans-53.9143.7174.6-24.732.6000111.4K166 Y167 E168P164-K166 PolarHBondContact O-N 3.04Å; P164-Y167 HydrophobicContact CB-CD2 4.06Å; P164-Y167 HydrophobicContact CG-CD2 4.24Å; P164-Y167 PolarHBondContact O-N 3.39Å; P164-E168 PolarHBondContact O-N 3.39Å; P164-E168 VanDerWaalsContact O-N 3.11Å
165P93.4Very high93.2Very high88 Ų8884.3 Ų84.357%0.57145%0.451SS*.THydrogen-bonded Turntrans-56.6-24.8-172.1-28.434.9000114.9K147K147-P165 VanDerWaalsContact CE-O 3.3Å; K147-P165 WeakPolarHBondContact CE-O 3.48Å; K147-P165 PolarHBondContact NZ-O 2.83Å
166K93.8Very high93.1Very high166 Ų16685.5 Ų85.572%0.72246%0.457SS*.THydrogen-bonded Turntrans-70.5-30.6177-174.963.6175.8-169.70113.1W146 P164W146-K166 WeakPolarHBondContact CH2-O 3.28Å; P164-K166 PolarHBondContact O-N 3.04Å
167Y93.5Very high93.2Very high178 Ų17887.6 Ų87.670%0.69846%0.464SS*.THydrogen-bonded Turntrans-103.2-12.2-177.6-56.3-69.9000113.2P164 R169P164-Y167 HydrophobicContact CB-CD2 4.06Å; P164-Y167 HydrophobicContact CG-CD2 4.24Å; P164-Y167 PolarHBondContact O-N 3.39Å; Y167-R169 PolarHBondContact O-N 3.24Å
168E93.8Very high93.3Very high10 Ų1088.1 Ų88.15%0.04746%0.456CS..  trans-78.1103.5176.4-168.3-179.9-153.300111.2K147 R162 K163 P164 I171K147-E168 WeakPolarHBondContact CE-O 3.41Å; R162-E168 IonicContact CZ-OE2 3.57Å; R162-E168 IonicContact NE-OE1 3.51Å; R162-E168 IonicContact NE-OE2 3.61Å; R162-E168 IonicContact NH2-OE1 3.71Å; R162-E168 IonicContact NH2-OE2 2.73Å; R162-E168 PolarHBondContact NH2-OE2 3.26Å; K163-E168 HydrophobicContact CB-CB 4.35Å; P164-E168 PolarHBondContact O-N 3.39Å; P164-E168 VanDerWaalsContact O-N 3.11Å; E168-I171 HydrophobicContact CG-CG1 4.01Å
169R94.6Very high93.7Very high138 Ų13887.5 Ų87.552%0.52145%0.446SS..  trans-86.3-47.7173.2-173.7176.5178.4-169.6-5.4112.6W146 K147 R148 Y167W146-R169 HydrophobicContact CE3-CB 4.32Å; W146-R169 HydrophobicContact CE3-CG 4.23Å; W146-R169 HydrophobicContact CZ3-CB 4.18Å; W146-R169 WeakPolarHBondContact O-CG 3.34Å; W146-R169 PolarHBondContact O-NE 3.34Å; K147-R169 WeakPolarHBondContact CA-O 3.41Å; R148-R169 PolarHBondContact N-O 3.08Å; Y167-R169 PolarHBondContact O-N 3.24Å
170F95.6Very high94Very high61 Ų6189.8 Ų89.827%0.26844%0.435SS..EExtended strand (participates in β ladder)trans-98.6113.5178.9-63.1-75.4000110L133 R148 L207 L211L133-F170 HydrophobicContact CD1-CE1 3.99Å; L133-F170 HydrophobicContact CD2-CD1 4.19Å; L133-F170 HydrophobicContact CD2-CE1 4.46Å; R148-F170 HydrophobicContact CB-CD1 3.86Å; R148-F170 HydrophobicContact CB-CE1 4.12Å; R148-F170 HydrophobicContact CG-CE1 4.31Å; R148-F170 CarbonylContact O-C 3.58Å; R148-F170 WeakPolarHBondContact O-CA 3.41Å; F170-L207 HydrophobicContact CZ-CD2 4.48Å; F170-L211 HydrophobicContact CB-CD2 3.87Å; F170-L211 HydrophobicContact CD1-CD1 4.11Å; F170-L211 HydrophobicContact CD2-CD2 4.26Å; F170-L211 HydrophobicContact CG-CD1 4.27Å; F170-L211 HydrophobicContact CG-CD2 4.05Å
171I95.6Very high94.3Very high23 Ų2386.8 Ų86.812%0.11842%0.421CS..EExtended strand (participates in β ladder)trans-98.6119.7-178.2-66.3158.9000108.7I136 K147 R148 M149 V150 E168 P173I136-I171 HydrophobicContact CD1-CD1 3.43Å; I136-I171 VanDerWaalsContact CD1-CD1 3.43Å; K147-I171 HydrophobicContact CB-CD1 4.49Å; K147-I171 HydrophobicContact CD-CD1 3.99Å; R148-I171 PolarHBondContact O-N 2.99Å; M149-I171 HydrophobicContact CG-CG2 4.46Å; V150-I171 PolarHBondContact N-O 3.45Å; E168-I171 HydrophobicContact CG-CG1 4.01Å; I171-P173 WeakPolarHBondContact O-CD 3.43Å
172R95.1Very high94.5Very high38 Ų3885 Ų8514%0.14340%0.404CS..  trans-103.399.8173.5-65.8-176-63-173.92.3108.8V150 R177 L211V150-R172 HydrophobicContact CB-CG 4.46Å; V150-R172 HydrophobicContact CG2-CG 3.97Å; R172-R177 VanDerWaalsContact O-CZ 3.26Å; R172-R177 PolarHBondContact O-NE 3.01Å; R172-R177 PolarHBondContact O-NH2 2.78Å; R172-L211 WeakPolarHBondContact CD-O 3.34Å; R172-L211 PolarHBondContact NH1-O 2.6Å
173P93.9Very high94.7Very high34 Ų3478.7 Ų78.722%0.22138%0.381CS..  trans-68143.9-172.728.3-34.3000111.6V150 I171 G175 L176 R177V150-P173 WeakPolarHBondContact O-CD 3.4Å; I171-P173 WeakPolarHBondContact O-CD 3.43Å; P173-G175 VanDerWaalsContact C-N 3.31Å; P173-G175 PolarHBondContact O-N 3.39Å; P173-L176 HydrophobicContact CG-CB 4.07Å; P173-L176 HydrophobicContact CG-CD1 3.65Å; P173-L176 HydrophobicContact CG-CG 3.89Å; P173-L176 PolarHBondContact O-N 2.81Å; P173-L176 VanDerWaalsContact O-N 3.1Å; P173-R177 WeakPolarHBondContact O-CG 3.36Å
174M93.2Very high94.7Very high143 Ų14374.2 Ų74.270%0.70437%0.366SS*.G310 helixtrans-60.7-36.2-175.2-73.2177.266.200113.6L176 R177M174-L176 PolarHBondContact O-N 3.14Å; M174-L176 VanDerWaalsContact O-N 3.15Å; M174-R177 WeakPolarHBondContact O-CB 3.31Å; M174-R177 PolarHBondContact O-N 2.87Å
175G92.6Very high94.4Very high70 Ų7070.9 Ų70.972%0.72234%0.343SS*.G310 helixtrans-64.9-15.6177.800000114.6P173P173-G175 VanDerWaalsContact C-N 3.31Å; P173-G175 PolarHBondContact O-N 3.39Å
176L95Very high94.1Very high46 Ų4669.8 Ų69.824%0.24134%0.336CS..G310 helixtrans-105.39.1175.9-60.1-177.7000112.5T151 C154 P173 M174T151-L176 VanDerWaalsContact O-CD1 3.25Å; T151-L176 WeakPolarHBondContact O-CD1 3.21Å; C154-L176 PolarHBondContact N-O 3.23Å; C154-L176 PolarHBondContact SG-O 3.47Å; P173-L176 HydrophobicContact CG-CB 4.07Å; P173-L176 HydrophobicContact CG-CD1 3.65Å; P173-L176 HydrophobicContact CG-CG 3.89Å; P173-L176 PolarHBondContact O-N 2.81Å; P173-L176 VanDerWaalsContact O-N 3.1Å; M174-L176 PolarHBondContact O-N 3.14Å; M174-L176 VanDerWaalsContact O-N 3.15Å
177R94.7Very high93.6Very high58 Ų5866.5 Ų66.522%0.21932%0.323CS..BIsolated β-bridgetrans-93.3107.9179-64.8-179.5-162.2168.94.3110.5C154 V156 R172 P173 M174C154-R177 VanDerWaalsContact O-CA 3.3Å; C154-R177 WeakPolarHBondContact O-CA 3.25Å; V156-R177 HydrophobicContact CB-CG 4.45Å; V156-R177 HydrophobicContact CG2-CG 3.85Å; R172-R177 VanDerWaalsContact O-CZ 3.26Å; R172-R177 PolarHBondContact O-NE 3.01Å; R172-R177 PolarHBondContact O-NH2 2.78Å; P173-R177 WeakPolarHBondContact O-CG 3.36Å; M174-R177 WeakPolarHBondContact O-CB 3.31Å; M174-R177 PolarHBondContact O-N 2.87Å
178F95.1Very high93.1Very high48 Ų4859.5 Ų59.521%0.21130%0.298CS..  trans-104.4140.8-177.6-78.345.6000109.2V153 C154 F155 G252 I254V153-F178 HydrophobicContact CG1-CB 3.91Å; V153-F178 HydrophobicContact CG1-CD1 3.56Å; V153-F178 HydrophobicContact CG1-CD2 4.09Å; V153-F178 HydrophobicContact CG1-CE1 4.08Å; V153-F178 HydrophobicContact CG1-CG 3.58Å; V153-F178 HydrophobicContact CG2-CD1 4.43Å; V153-F178 HydrophobicContact CG2-CE1 4.13Å; V153-F178 HydrophobicContact CG2-CZ 4.3Å; C154-F178 PolarHBondContact O-N 3.1Å; F155-F178 WeakPolarHBondContact CD2-O 3.42Å; F178-G252 WeakPolarHBondContact CE2-O 3.39Å; F178-G252 WeakPolarHBondContact CZ-O 3.27Å; F178-I254 HydrophobicContact CB-CD1 3.51Å; F178-I254 HydrophobicContact CB-CG1 4.48Å; F178-I254 HydrophobicContact CD2-CD1 3.74Å; F178-I254 HydrophobicContact CD2-CG1 3.79Å; F178-I254 HydrophobicContact CE2-CG1 4.44Å; F178-I254 HydrophobicContact CG-CD1 3.95Å; F178-I254 HydrophobicContact CG-CG1 4.43Å
179K95.3Very high92.7Very high122 Ų12267.9 Ų67.953%0.5333%0.334SS..  trans-110.3-19.4179.2-65.5-166.7174.8-151.30113.9D158 P195 I196D158-K179 IonicContact OD1-NZ 2.77Å; D158-K179 PolarHBondContact OD1-NZ 3.01Å; K179-P195 WeakPolarHBondContact O-CA 3.49Å; K179-I196 PolarHBondContact O-N 2.98Å
180K95.6Very high92.3Very high126 Ų12662.8 Ų62.855%0.54832%0.321SS..EExtended strand (participates in β ladder)trans-125.8154.1-176.4-60.8-172.7178.1-171.20110.6L194K180-L194 CarbonylContact C-O 3.42Å; K180-L194 WeakPolarHBondContact CA-O 3.49Å
181A97.1Very high92Very high0 Ų064.6 Ų64.60%034%0.337CS..EExtended strand (participates in β ladder)trans-130.4146.3174.400000110.3V183 C193 L194 I196 I220 I254A181-V183 HydrophobicContact CB-CG2 4.02Å; A181-V183 PolarHBondContact O-N 2.72Å; A181-C193 CarbonylContact O-C 3.57Å; A181-L194 PolarHBondContact N-O 3.09Å; A181-L194 PolarHBondContact O-N 3.42Å; A181-I196 HydrophobicContact CB-CD1 4.08Å; A181-I196 HydrophobicContact CB-CG1 3.93Å; A181-I220 HydrophobicContact CB-CD1 3.89Å; A181-I254 HydrophobicContact CB-CB 4.07Å; A181-I254 HydrophobicContact CB-CG2 3.76Å
182H96.8Very high91.9Very high82 Ų8266.1 Ų66.138%0.3834%0.343SS..EExtended strand (participates in β ladder)trans-84.4105.9168.8-66-73.7000108.6F192 I254 N255 A256H182-F192 CarbonylContact C-O 3.52Å; H182-F192 WeakPolarHBondContact CA-O 3.19Å; H182-I254 PolarHBondContact N-O 3.14Å; H182-N255 CarbonylContact O-C 3.45Å; H182-N255 WeakPolarHBondContact O-CA 3.32Å; H182-A256 PolarHBondContact O-N 3.06Å
183V95.3Very high91.9Very high0 Ų067 Ų670%035%0.354CS..EExtended strand (participates in β ladder)trans-109.2120.2-171.2-179.60000109.6A181 T191 F192 L194 V222 A242 A256 L258A181-V183 HydrophobicContact CB-CG2 4.02Å; A181-V183 PolarHBondContact O-N 2.72Å; V183-T191 WeakPolarHBondContact O-CA 3.38Å; V183-F192 PolarHBondContact N-O 2.89Å; V183-F192 PolarHBondContact O-N 3.37Å; V183-L194 HydrophobicContact CB-CD1 3.97Å; V183-L194 HydrophobicContact CB-CG 4.4Å; V183-L194 HydrophobicContact CG1-CD1 4.21Å; V183-L194 HydrophobicContact CG2-CB 4.22Å; V183-L194 HydrophobicContact CG2-CD1 4.23Å; V183-L194 HydrophobicContact CG2-CG 4.48Å; V183-V222 HydrophobicContact CG1-CG2 4.46Å; V183-V222 HydrophobicContact CG2-CB 4.35Å; V183-V222 HydrophobicContact CG2-CG1 3.95Å; V183-V222 HydrophobicContact CG2-CG2 4.23Å; V183-A242 HydrophobicContact CG1-CB 4.23Å; V183-A256 CarbonylContact C-O 3.5Å; V183-A256 WeakPolarHBondContact CA-O 3.28Å; V183-A256 HydrophobicContact CG2-CB 4.4Å; V183-L258 HydrophobicContact CG1-CB 4.49Å; V183-L258 HydrophobicContact CG1-CD1 4.05Å; V183-L258 HydrophobicContact CG1-CD2 3.76Å; V183-L258 HydrophobicContact CG1-CG 3.41Å; V183-L258 VanDerWaalsContact CG1-CG 3.41Å
184T93.6Very high91.9Very high49 Ų4965.3 Ų65.330%0.30134%0.344SS..EExtended strand (participates in β ladder)trans-93.2132.2176.3-520000110.7A190 T191 A256 L258T184-A190 WeakPolarHBondContact CA-O 3.15Å; T184-T191 HydrophobicContact CG2-CG2 4.12Å; T184-T191 WeakPolarHBondContact OG1-CG2 3.1Å; T184-A256 PolarHBondContact N-O 3.42Å; T184-L258 PolarHBondContact O-N 3.16Å
185H88.4Confident92.1Very high8 Ų860.6 Ų60.64%0.03732%0.324CS..EExtended strand (participates in β ladder)trans-90.3117.3169-166.8-60.3000109.9E187 L188 K189 A190 F192 L258H185-E187 VanDerWaalsContact C-N 3.35Å; H185-E187 IonicContact CE1-OE2 3.77Å; H185-E187 PolarHBondContact ND1-N 3.3Å; H185-E187 PolarHBondContact O-N 3.23Å; H185-L188 HydrophobicContact CB-CB 4.19Å; H185-L188 HydrophobicContact CB-CD1 4.41Å; H185-L188 PolarHBondContact ND1-N 3.49Å; H185-L188 PolarHBondContact O-N 3.21Å; H185-K189 PolarHBondContact O-N 2.76Å; H185-A190 PolarHBondContact N-O 2.87Å; H185-F192 HydrophobicContact CB-CE2 4.46Å; H185-L258 HydrophobicContact CB-CD1 4.15Å
186P87.1Confident92.3Very high66 Ų6657.8 Ų57.843%0.42929%0.292SS..THydrogen-bonded Turntrans-56.2-42.9-176.2-27.834.9000114.4V257P186-V257 HydrophobicContact CG-CG1 3.6Å
187E84.8Confident92.3Very high97 Ų9758.6 Ų58.645%0.45330%0.297SS..THydrogen-bonded Turntrans-74.7-44.5-176.8-55.9176.3169.100113.2H185 K189H185-E187 VanDerWaalsContact C-N 3.35Å; H185-E187 IonicContact CE1-OE2 3.77Å; H185-E187 PolarHBondContact ND1-N 3.3Å; H185-E187 PolarHBondContact O-N 3.23Å; E187-K189 VanDerWaalsContact C-N 3.31Å; E187-K189 PolarHBondContact O-N 2.89Å
188L82.4Confident92.4Very high31 Ų3156.6 Ų56.616%0.16229%0.294CS..THydrogen-bonded Turntrans-78.1-15.3-179.4-60.9173.9000113.1Q96 H185 A190Q96-L188 HydrophobicContact CG-CD2 4.1Å; H185-L188 HydrophobicContact CB-CB 4.19Å; H185-L188 HydrophobicContact CB-CD1 4.41Å; H185-L188 PolarHBondContact ND1-N 3.49Å; H185-L188 PolarHBondContact O-N 3.21Å; L188-A190 HydrophobicContact CB-CB 4.34Å; L188-A190 PolarHBondContact O-N 3.45Å
189K85.2Confident92.4Very high185 Ų18555.5 Ų55.580%0.80429%0.291SS*.THydrogen-bonded Turntrans51.827.9-174.2-58.3178.6-177.5173.70113.6H185 E187H185-K189 PolarHBondContact O-N 2.76Å; E187-K189 VanDerWaalsContact C-N 3.31Å; E187-K189 PolarHBondContact O-N 2.89Å
190A85.3Confident92.5Very high31 Ų3155.5 Ų55.526%0.25629%0.291SS..EExtended strand (participates in β ladder)trans-111.4151.6178.500000110.6T184 H185 L188 F192T184-A190 WeakPolarHBondContact CA-O 3.15Å; H185-A190 PolarHBondContact N-O 2.87Å; L188-A190 HydrophobicContact CB-CB 4.34Å; L188-A190 PolarHBondContact O-N 3.45Å; A190-F192 HydrophobicContact CB-CE2 3.77Å; A190-F192 HydrophobicContact CB-CZ 3.83Å
191T90.7Very high92.4Very high99 Ų9956.1 Ų56.161%0.60729%0.294SS*.EExtended strand (participates in β ladder)trans-114.2139.1-179.360.30000110.5V183 T184V183-T191 WeakPolarHBondContact O-CA 3.38Å; T184-T191 HydrophobicContact CG2-CG2 4.12Å; T184-T191 WeakPolarHBondContact OG1-CG2 3.1Å
192F92.3Very high92.3Very high55 Ų5556.4 Ų56.424%0.24130%0.295CS..EExtended strand (participates in β ladder)trans-130.5140.8-176.1-57.6-87.4000110.1H182 V183 H185 A190 L194 L227H182-F192 CarbonylContact C-O 3.52Å; H182-F192 WeakPolarHBondContact CA-O 3.19Å; V183-F192 PolarHBondContact N-O 2.89Å; V183-F192 PolarHBondContact O-N 3.37Å; H185-F192 HydrophobicContact CB-CE2 4.46Å; A190-F192 HydrophobicContact CB-CE2 3.77Å; A190-F192 HydrophobicContact CB-CZ 3.83Å; F192-L194 HydrophobicContact CB-CD1 4.19Å; F192-L194 HydrophobicContact CB-CD2 3.82Å; F192-L194 HydrophobicContact CB-CG 3.76Å; F192-L194 PolarHBondContact O-N 3.37Å; F192-L227 HydrophobicContact CD1-CD2 3.7Å; F192-L227 HydrophobicContact CD2-CD2 3.55Å; F192-L227 HydrophobicContact CE1-CD2 3.56Å; F192-L227 HydrophobicContact CE2-CD2 3.4Å; F192-L227 VanDerWaalsContact CE2-CD2 3.4Å; F192-L227 HydrophobicContact CG-CD2 3.69Å; F192-L227 HydrophobicContact CZ-CD2 3.41Å; F192-L227 VanDerWaalsContact CZ-CD2 3.41Å
193C94.9Very high92.1Very high56 Ų5655.6 Ų55.638%0.37830%0.297SS..EExtended strand (participates in β ladder)trans-93.580.6178-171.30000109.9A181A181-C193 CarbonylContact O-C 3.57Å
194L94.8Very high91.9Very high0 Ų057.7 Ų57.70%031%0.312CS..EExtended strand (participates in β ladder)trans-93.1143.5-170.1-59.2178.8000111.6K180 A181 V183 F192 V222 N223 V224 E226K180-L194 CarbonylContact C-O 3.42Å; K180-L194 WeakPolarHBondContact CA-O 3.49Å; A181-L194 PolarHBondContact N-O 3.09Å; A181-L194 PolarHBondContact O-N 3.42Å; V183-L194 HydrophobicContact CB-CD1 3.97Å; V183-L194 HydrophobicContact CB-CG 4.4Å; V183-L194 HydrophobicContact CG1-CD1 4.21Å; V183-L194 HydrophobicContact CG2-CB 4.22Å; V183-L194 HydrophobicContact CG2-CD1 4.23Å; V183-L194 HydrophobicContact CG2-CG 4.48Å; F192-L194 HydrophobicContact CB-CD1 4.19Å; F192-L194 HydrophobicContact CB-CD2 3.82Å; F192-L194 HydrophobicContact CB-CG 3.76Å; F192-L194 PolarHBondContact O-N 3.37Å; L194-V222 HydrophobicContact CB-CB 4.36Å; L194-V222 HydrophobicContact CD1-CG2 4.39Å; L194-N223 WeakPolarHBondContact CB-O 3.16Å; L194-N223 WeakPolarHBondContact CD1-O 3.23Å; L194-N223 WeakPolarHBondContact CD2-O 3.35Å; L194-V224 HydrophobicContact CD1-CG1 4.01Å; L194-E226 HydrophobicContact CD2-CB 4.31Å
195P96.8Very high91.8Very high44 Ų4456.9 Ų56.929%0.28631%0.308SS..EExtended strand (participates in β ladder)trans-71.7140.7173.826.2-26.2000111K179 N223K179-P195 WeakPolarHBondContact O-CA 3.49Å; P195-N223 HydrophobicContact CG-CB 3.74Å; P195-N223 PolarHBondContact O-N 2.89Å
196I96.9Very high92Very high10 Ų1061.5 Ų61.55%0.05134%0.339CS..EExtended strand (participates in β ladder)trans-80.5129.9176-57.8169.9000107.8F155 K179 A181 I214 I220 I254F155-I196 HydrophobicContact CB-CG2 4.4Å; F155-I196 HydrophobicContact CD1-CG2 4.21Å; F155-I196 HydrophobicContact CD2-CB 3.68Å; F155-I196 HydrophobicContact CD2-CD1 4.36Å; F155-I196 HydrophobicContact CD2-CG2 3.54Å; F155-I196 HydrophobicContact CE1-CG2 4.38Å; F155-I196 HydrophobicContact CE2-CB 3.7Å; F155-I196 HydrophobicContact CE2-CG2 3.76Å; F155-I196 WeakPolarHBondContact CE2-O 3.29Å; F155-I196 HydrophobicContact CG-CB 4.42Å; F155-I196 HydrophobicContact CG-CG2 3.78Å; F155-I196 HydrophobicContact CZ-CB 4.44Å; F155-I196 HydrophobicContact CZ-CG2 4.16Å; F155-I196 VanDerWaalsContact CZ-O 3.25Å; F155-I196 WeakPolarHBondContact CZ-O 3.37Å; K179-I196 PolarHBondContact O-N 2.98Å; A181-I196 HydrophobicContact CB-CD1 4.08Å; A181-I196 HydrophobicContact CB-CG1 3.93Å; I196-I214 HydrophobicContact CD1-CD1 4.02Å; I196-I220 HydrophobicContact CD1-CD1 4.48Å; I196-I220 HydrophobicContact CG1-CD1 4.32Å; I196-I220 HydrophobicContact CG2-CB 4.49Å; I196-I254 HydrophobicContact CD1-CD1 3.75Å
197L95.4Very high92.4Very high64 Ų6461.6 Ų61.634%0.33534%0.336SS..EExtended strand (participates in β ladder)trans-90.8-39.4174.7-64171.1000110.8F155 E221 N223 W238F155-L197 WeakPolarHBondContact CE1-O 3.49Å; F155-L197 WeakPolarHBondContact CZ-O 3.37Å; L197-E221 HydrophobicContact CB-CB 4.3Å; L197-E221 HydrophobicContact CB-CG 4.17Å; L197-E221 HydrophobicContact CD1-CG 4.09Å; L197-E221 PolarHBondContact N-O 3.17Å; L197-N223 HydrophobicContact CD1-CB 4.16Å; L197-N223 HydrophobicContact CD2-CB 4.18Å; L197-N223 HydrophobicContact CG-CB 4.14Å; L197-W238 HydrophobicContact CD1-CE3 3.8Å; L197-W238 HydrophobicContact CD1-CZ3 3.5Å; L197-W238 VanDerWaalsContact CD1-CZ3 3.5Å; L197-W238 HydrophobicContact CD2-CZ3 4.09Å; L197-W238 HydrophobicContact CG-CZ3 4.41Å
198G96.3Very high92.8Very high16 Ų1657.2 Ų57.217%0.16532%0.315CS..EExtended strand (participates in β ladder)trans-170168.4-177.300000113.9I220 E221G198-I220 WeakPolarHBondContact O-CA 3.34Å; G198-E221 PolarHBondContact N-O 3.12Å; G198-E221 PolarHBondContact O-N 3.38Å
199V96.8Very high93.5Very high24 Ų2457.3 Ų57.315%0.14532%0.317CS..EExtended strand (participates in β ladder)trans-103.4117.3170.4-1800000107.6F155 T209 I214 T218 I220F155-V199 HydrophobicContact CB-CG2 3.85Å; F155-V199 HydrophobicContact CD1-CG2 4.34Å; F155-V199 HydrophobicContact CG-CG2 4.47Å; V199-T209 HydrophobicContact CG1-CG2 4.35Å; V199-I214 HydrophobicContact CG2-CD1 4.22Å; V199-I214 HydrophobicContact CG2-CG1 3.94Å; V199-T218 HydrophobicContact CG1-CG2 3.57Å; V199-I220 HydrophobicContact CG2-CG2 4.3Å
200K95.6Very high93.9Very high123 Ų12354.2 Ų54.254%0.53531%0.314SS..EExtended strand (participates in β ladder)trans-90-42.9-175.6-174.859.2173.9177.80112.6T209 V219 Y241K200-T209 WeakPolarHBondContact O-CG2 3.29Å; K200-V219 HydrophobicContact CB-CG1 4.36Å; K200-V219 PolarHBondContact N-O 3.03Å; K200-Y241 HydrophobicContact CB-CD1 4.24Å; K200-Y241 HydrophobicContact CB-CE1 3.85Å; K200-Y241 HydrophobicContact CD-CE1 4.21Å; K200-Y241 HydrophobicContact CG-CD1 4.38Å; K200-Y241 HydrophobicContact CG-CE1 3.68Å
201K94.7Very high94.3Very high138 Ų13853.7 Ų53.760%0.631%0.306SS*.EExtended strand (participates in β ladder)trans-153.4121.9-178.1-170.5168.6-177.31760111.6T218 V219K201-T218 WeakPolarHBondContact O-CA 3.32Å; K201-V219 HydrophobicContact CB-CB 4.28Å; K201-V219 PolarHBondContact N-O 3.24Å; K201-V219 VanDerWaalsContact N-O 3.15Å; K201-V219 PolarHBondContact O-N 2.98Å
202N94.3Very high94.5Very high6 Ų649.2 Ų49.23%0.03228%0.28CS..  trans-94.1130.7164.7-170.2-59.8000109.3S204 T209 V213 T215 T218N202-S204 VanDerWaalsContact C-N 3.3Å; N202-S204 PolarHBondContact O-N 3.05Å; N202-S204 PolarHBondContact OD1-N 2.93Å; N202-T209 PolarHBondContact N-OG1 3.11Å; N202-V213 PolarHBondContact ND2-O 3.11Å; N202-T215 PolarHBondContact ND2-OG1 2.96Å; N202-T218 PolarHBondContact ND2-OG1 2.88Å
203P92.6Very high94.7Very high66 Ų6646.6 Ų46.643%0.42927%0.268SS..SBendtrans-69.4-22.2-176.327.5-35.9000114.2
204S91.2Very high94.8Very high44 Ų4444 Ų4431%0.30825%0.25SS..SBendtrans-85.3-39.3-176.6-62.60000113.5N202N202-S204 VanDerWaalsContact C-N 3.3Å; N202-S204 PolarHBondContact O-N 3.05Å; N202-S204 PolarHBondContact OD1-N 2.93Å
205S90.8Very high94.8Very high31 Ų3144 Ų4422%0.21725%0.251CS..  trans-160.2142.8-179.3179.30000112.8L207 Y208 T209S205-L207 PolarHBondContact O-N 2.94Å; S205-L207 WeakPolarHBondContact OG-CB 3.43Å; S205-L207 PolarHBondContact OG-N 3.02Å; S205-Y208 WeakPolarHBondContact O-CB 3.26Å; S205-Y208 PolarHBondContact O-N 3.47Å; S205-T209 PolarHBondContact O-N 3.41Å
206P93.9Very high94.8Very high105 Ų10545.2 Ų45.268%0.68225%0.252SS*.Hα-helixtrans-57.8-33.4168.1-23.834.3000113.1Y208 T209 T210P206-Y208 PolarHBondContact O-N 3.42Å; P206-T209 WeakPolarHBondContact O-CA 3.45Å; P206-T209 VanDerWaalsContact O-CB 3.24Å; P206-T209 WeakPolarHBondContact O-CB 3.39Å; P206-T209 PolarHBondContact O-N 3.49Å; P206-T210 PolarHBondContact O-N 3.07Å; P206-T210 VanDerWaalsContact O-N 3.1Å; P206-T210 PolarHBondContact O-OG1 3.45Å
207L93.9Very high94.7Very high69 Ų6945 Ų4536%0.36125%0.251SS..Hα-helixtrans-58.2-40.2176.9177.564.6000111.6F170 S205 T209 T210 L211F170-L207 HydrophobicContact CZ-CD2 4.48Å; S205-L207 PolarHBondContact O-N 2.94Å; S205-L207 WeakPolarHBondContact OG-CB 3.43Å; S205-L207 PolarHBondContact OG-N 3.02Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 2.97Å; L207-T210 PolarHBondContact O-N 2.76Å; L207-L211 HydrophobicContact CD1-CD1 4.4Å; L207-L211 HydrophobicContact CD1-CG 4.46Å; L207-L211 HydrophobicContact CG-CD1 4.16Å; L207-L211 WeakPolarHBondContact O-CG 3.4Å; L207-L211 PolarHBondContact O-N 3.21Å
208Y95.1Very high94.7Very high5 Ų541.9 Ų41.92%0.0224%0.235CC..Hα-helixtrans-68.5-30.6177.9-63.7-16.9000112.2E129 V132 L133 S205 P206 G212 V213E129-Y208 WeakPolarHBondContact CA-OH 3.37Å; V132-Y208 HydrophobicContact CB-CE1 4.3Å; V132-Y208 HydrophobicContact CG1-CD1 4.29Å; V132-Y208 HydrophobicContact CG1-CE1 3.84Å; V132-Y208 HydrophobicContact CG1-CE2 4.41Å; V132-Y208 HydrophobicContact CG2-CE2 4.05Å; L133-Y208 HydrophobicContact CD1-CE1 4.43Å; S205-Y208 WeakPolarHBondContact O-CB 3.26Å; S205-Y208 PolarHBondContact O-N 3.47Å; P206-Y208 PolarHBondContact O-N 3.42Å; Y208-G212 PolarHBondContact O-N 2.89Å; Y208-V213 HydrophobicContact CG-CB 4.5Å; Y208-V213 PolarHBondContact O-N 3.25Å
209T95.4Very high94.7Very high33 Ų3342.2 Ų42.220%0.20223%0.234CC..Hα-helixtrans-63.8-48171.7-50.60000110.2V199 K200 N202 S205 P206 L207 L211 G212V199-T209 HydrophobicContact CG1-CG2 4.35Å; K200-T209 WeakPolarHBondContact O-CG2 3.29Å; N202-T209 PolarHBondContact N-OG1 3.11Å; S205-T209 PolarHBondContact O-N 3.41Å; P206-T209 WeakPolarHBondContact O-CA 3.45Å; P206-T209 VanDerWaalsContact O-CB 3.24Å; P206-T209 WeakPolarHBondContact O-CB 3.39Å; P206-T209 PolarHBondContact O-N 3.49Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 2.97Å; T209-L211 PolarHBondContact O-N 3.34Å; T209-G212 PolarHBondContact O-N 3.3Å
210T94Very high94.7Very high120 Ų12041 Ų4174%0.73623%0.227SC*.Hα-helixtrans-64.3-38.7177.8-51.20000112.8P206 L207 G212P206-T210 PolarHBondContact O-N 3.07Å; P206-T210 VanDerWaalsContact O-N 3.1Å; P206-T210 PolarHBondContact O-OG1 3.45Å; L207-T210 PolarHBondContact O-N 2.76Å; T210-G212 PolarHBondContact O-N 3.24Å
211L94.4Very high94.8Very high20 Ų2038 Ų3811%0.10522%0.215CC..Hα-helixtrans-72.9-10.5174.4-69.1176.9000112.8F170 R172 L207 T209 V213F170-L211 HydrophobicContact CB-CD2 3.87Å; F170-L211 HydrophobicContact CD1-CD1 4.11Å; F170-L211 HydrophobicContact CD2-CD2 4.26Å; F170-L211 HydrophobicContact CG-CD1 4.27Å; F170-L211 HydrophobicContact CG-CD2 4.05Å; R172-L211 WeakPolarHBondContact CD-O 3.34Å; R172-L211 PolarHBondContact NH1-O 2.6Å; L207-L211 HydrophobicContact CD1-CD1 4.4Å; L207-L211 HydrophobicContact CD1-CG 4.46Å; L207-L211 HydrophobicContact CG-CD1 4.16Å; L207-L211 WeakPolarHBondContact O-CG 3.4Å; L207-L211 PolarHBondContact O-N 3.21Å; T209-L211 PolarHBondContact O-N 3.34Å; L211-V213 VanDerWaalsContact C-N 3.31Å; L211-V213 HydrophobicContact CB-CG2 3.93Å
212G95.4Very high94.9Very high5 Ų531.5 Ų31.55%0.05219%0.186CC..THydrogen-bonded Turntrans69.426.4-176.600000113.1C154 F155 Y208 T209 T210 I214C154-G212 CarbonylContact C-O 3.53Å; C154-G212 WeakPolarHBondContact CA-O 3.4Å; C154-G212 WeakPolarHBondContact CB-O 3.29Å; F155-G212 PolarHBondContact N-O 3.26Å; Y208-G212 PolarHBondContact O-N 2.89Å; T209-G212 PolarHBondContact O-N 3.3Å; T210-G212 PolarHBondContact O-N 3.24Å; G212-I214 PolarHBondContact O-N 3.12Å
213V96.3Very high94.9Very high0 Ų032.9 Ų32.90%019%0.194CC..BIsolated β-bridgetrans-71.4128178.5175.60000109.6V132 V150 K152 N202 Y208 L211 T215V132-V213 HydrophobicContact CG1-CG1 4.17Å; V150-V213 HydrophobicContact CG1-CG2 3.78Å; V150-V213 HydrophobicContact CG2-CG2 4.49Å; K152-V213 HydrophobicContact CB-CG1 3.79Å; K152-V213 HydrophobicContact CG-CG1 4.4Å; N202-V213 PolarHBondContact ND2-O 3.11Å; Y208-V213 HydrophobicContact CG-CB 4.5Å; Y208-V213 PolarHBondContact O-N 3.25Å; L211-V213 VanDerWaalsContact C-N 3.31Å; L211-V213 HydrophobicContact CB-CG2 3.93Å; V213-T215 HydrophobicContact CG1-CG2 3.92Å
214I96.1Very high94.9Very high0 Ų029.8 Ų29.80%017%0.173CC..  trans-108.3111.8-178.5-59.3-178.3000108.6V153 F155 I196 V199 G212 I220 V244 P248 I254V153-I214 PolarHBondContact O-N 3.42Å; F155-I214 HydrophobicContact CB-CD1 3.76Å; F155-I214 HydrophobicContact CB-CG1 4.44Å; I196-I214 HydrophobicContact CD1-CD1 4.02Å; V199-I214 HydrophobicContact CG2-CD1 4.22Å; V199-I214 HydrophobicContact CG2-CG1 3.94Å; G212-I214 PolarHBondContact O-N 3.12Å; I214-I220 HydrophobicContact CD1-CG2 4.21Å; I214-I220 HydrophobicContact CG1-CG2 4.44Å; I214-V244 HydrophobicContact CG2-CB 4.46Å; I214-V244 HydrophobicContact CG2-CG1 4.28Å; I214-V244 HydrophobicContact CG2-CG2 3.78Å; I214-P248 HydrophobicContact CG2-CG 4.23Å; I214-I254 HydrophobicContact CD1-CD1 3.74Å; I214-I254 HydrophobicContact CG2-CD1 4.4Å; I214-I254 HydrophobicContact CG2-CG2 4.34Å
215T95.4Very high94.8Very high1 Ų130.6 Ų30.61%0.00618%0.179CC..  trans-123.6169.9175.754.80000109.7Q127 K152 N202 V213 G217 T218Q127-T215 VanDerWaalsContact CD-CG2 3.49Å; K152-T215 HydrophobicContact CB-CG2 4.49Å; K152-T215 HydrophobicContact CG-CG2 4.28Å; N202-T215 PolarHBondContact ND2-OG1 2.96Å; V213-T215 HydrophobicContact CG1-CG2 3.92Å; T215-G217 PolarHBondContact O-N 3.45Å; T215-T218 PolarHBondContact N-OG1 3.24Å; T215-T218 WeakPolarHBondContact O-CB 3.36Å; T215-T218 PolarHBondContact O-N 3.37Å; T215-T218 PolarHBondContact O-OG1 3.11Å; T215-T218 PolarHBondContact OG1-OG1 3.44Å
216K95.4Very high94.5Very high70 Ų7035.5 Ų35.530%0.30420%0.198SC..THydrogen-bonded Turntrans-51.5133.5173.2-174.3169.6179.6170.60111.1L121 V124 T218 T245 N246 N247L121-K216 HydrophobicContact CD1-CG 4.17Å; V124-K216 HydrophobicContact CG1-CB 3.97Å; V124-K216 HydrophobicContact CG1-CD 4.33Å; V124-K216 HydrophobicContact CG1-CG 3.95Å; V124-K216 WeakPolarHBondContact CG1-O 3.36Å; K216-T218 VanDerWaalsContact C-N 3.29Å; K216-T218 PolarHBondContact O-N 3.14Å; K216-T245 WeakPolarHBondContact CD-O 3.41Å; K216-T245 WeakPolarHBondContact CE-O 3.44Å; K216-N246 WeakPolarHBondContact CA-O 3.29Å; K216-N246 VanDerWaalsContact CB-O 3.3Å; K216-N246 WeakPolarHBondContact CB-O 3.38Å; K216-N247 WeakPolarHBondContact CB-OD1 3.13Å
217G95Very high94Very high4 Ų431.3 Ų31.34%0.04117%0.17CC..THydrogen-bonded Turntrans81.2-2.5-177.500000115.5T215 V219 Q243 V244T215-G217 PolarHBondContact O-N 3.45Å; G217-V219 PolarHBondContact O-N 3.48Å; G217-Q243 PolarHBondContact O-NE2 2.86Å; G217-V244 WeakPolarHBondContact CA-O 3.46Å; G217-V244 PolarHBondContact N-O 2.88Å
218T96.1Very high93.5Very high0 Ų030.4 Ų30.40%018%0.178CC..  trans-63.3131.3174.4-58.20000109.9V199 K201 N202 T215 K216 I220 V244V199-T218 HydrophobicContact CG1-CG2 3.57Å; K201-T218 WeakPolarHBondContact O-CA 3.32Å; N202-T218 PolarHBondContact ND2-OG1 2.88Å; T215-T218 PolarHBondContact N-OG1 3.24Å; T215-T218 WeakPolarHBondContact O-CB 3.36Å; T215-T218 PolarHBondContact O-N 3.37Å; T215-T218 PolarHBondContact O-OG1 3.11Å; T215-T218 PolarHBondContact OG1-OG1 3.44Å; K216-T218 VanDerWaalsContact C-N 3.29Å; K216-T218 PolarHBondContact O-N 3.14Å; T218-I220 HydrophobicContact CG2-CG2 4.07Å; T218-V244 PolarHBondContact O-N 3.45Å
219V96.8Very high93Very high22 Ų2231.7 Ų31.713%0.13319%0.185CC..EExtended strand (participates in β ladder)trans-89.2118.1172.7-1760000108.3K200 K201 G217 Y241 A242 L259K200-V219 HydrophobicContact CB-CG1 4.36Å; K200-V219 PolarHBondContact N-O 3.03Å; K201-V219 HydrophobicContact CB-CB 4.28Å; K201-V219 PolarHBondContact N-O 3.24Å; K201-V219 VanDerWaalsContact N-O 3.15Å; K201-V219 PolarHBondContact O-N 2.98Å; G217-V219 PolarHBondContact O-N 3.48Å; V219-Y241 HydrophobicContact CG1-CD1 4.12Å; V219-Y241 HydrophobicContact CG1-CG 4.23Å; V219-A242 WeakPolarHBondContact CA-O 3.23Å; V219-L259 HydrophobicContact CG1-CD1 4.21Å
220I97.3Very high92.4Very high0 Ų034 Ų340%020%0.199CC..EExtended strand (participates in β ladder)trans-112.1152.417858.3172.2000109.7A181 I196 G198 V199 I214 T218 V222 Y241 A242 V244 I254 A256A181-I220 HydrophobicContact CB-CD1 3.89Å; I196-I220 HydrophobicContact CD1-CD1 4.48Å; I196-I220 HydrophobicContact CG1-CD1 4.32Å; I196-I220 HydrophobicContact CG2-CB 4.49Å; G198-I220 WeakPolarHBondContact O-CA 3.34Å; V199-I220 HydrophobicContact CG2-CG2 4.3Å; I214-I220 HydrophobicContact CD1-CG2 4.21Å; I214-I220 HydrophobicContact CG1-CG2 4.44Å; T218-I220 HydrophobicContact CG2-CG2 4.07Å; I220-V222 HydrophobicContact CD1-CG1 3.73Å; I220-V222 HydrophobicContact CG1-CG1 3.99Å; I220-Y241 CarbonylContact O-C 3.49Å; I220-Y241 WeakPolarHBondContact O-CA 3.47Å; I220-A242 HydrophobicContact CG1-CB 4.14Å; I220-A242 WeakPolarHBondContact CG1-O 3.34Å; I220-A242 PolarHBondContact N-O 2.98Å; I220-A242 PolarHBondContact O-N 3.12Å; I220-V244 HydrophobicContact CD1-CG2 4Å; I220-V244 HydrophobicContact CG1-CG2 4.26Å; I220-V244 HydrophobicContact CG2-CG2 4.26Å; I220-I254 HydrophobicContact CD1-CG2 4.34Å; I220-A256 HydrophobicContact CD1-CB 4.18Å
221E96.6Very high92.1Very high60 Ų6031.2 Ų31.228%0.2818%0.182SC..EExtended strand (participates in β ladder)trans-98.4126.9169.9-169.7173.6-175.600108L197 G198 Y241L197-E221 HydrophobicContact CB-CB 4.3Å; L197-E221 HydrophobicContact CB-CG 4.17Å; L197-E221 HydrophobicContact CD1-CG 4.09Å; L197-E221 PolarHBondContact N-O 3.17Å; G198-E221 PolarHBondContact N-O 3.12Å; G198-E221 PolarHBondContact O-N 3.38Å; E221-Y241 HydrophobicContact CB-CD1 4.23Å; E221-Y241 HydrophobicContact CB-CE1 4.25Å; E221-Y241 HydrophobicContact CG-CD1 4.47Å; E221-Y241 HydrophobicContact CG-CE1 4.36Å
222V96.8Very high91.5Very high0 Ų037.9 Ų37.90%021%0.212CC..EExtended strand (participates in β ladder)trans-122.8145.4-176.1-66.30000110.2V183 L194 I220 V224 G239 K240 A242 L258V183-V222 HydrophobicContact CG1-CG2 4.46Å; V183-V222 HydrophobicContact CG2-CB 4.35Å; V183-V222 HydrophobicContact CG2-CG1 3.95Å; V183-V222 HydrophobicContact CG2-CG2 4.23Å; L194-V222 HydrophobicContact CB-CB 4.36Å; L194-V222 HydrophobicContact CD1-CG2 4.39Å; I220-V222 HydrophobicContact CD1-CG1 3.73Å; I220-V222 HydrophobicContact CG1-CG1 3.99Å; V222-V224 HydrophobicContact CG2-CG1 4.23Å; V222-V224 PolarHBondContact O-N 3.46Å; V222-G239 WeakPolarHBondContact O-CA 3.44Å; V222-K240 WeakPolarHBondContact CG2-O 3.46Å; V222-K240 PolarHBondContact N-O 2.95Å; V222-K240 PolarHBondContact O-N 2.88Å; V222-A242 HydrophobicContact CG1-CB 4.38Å; V222-A242 HydrophobicContact CG2-CB 4Å; V222-L258 HydrophobicContact CG2-CD2 3.94Å
223N95.3Very high91Very high36 Ų3640.9 Ų40.919%0.19324%0.243CC..EExtended strand (participates in β ladder)trans-75.1120.7176.4-172.3-22000109.7L194 P195 L197 S225 W238L194-N223 WeakPolarHBondContact CB-O 3.16Å; L194-N223 WeakPolarHBondContact CD1-O 3.23Å; L194-N223 WeakPolarHBondContact CD2-O 3.35Å; P195-N223 HydrophobicContact CG-CB 3.74Å; P195-N223 PolarHBondContact O-N 2.89Å; L197-N223 HydrophobicContact CD1-CB 4.16Å; L197-N223 HydrophobicContact CD2-CB 4.18Å; L197-N223 HydrophobicContact CG-CB 4.14Å; N223-S225 VanDerWaalsContact OD1-CB 3.23Å; N223-S225 WeakPolarHBondContact OD1-CB 3.38Å; N223-S225 PolarHBondContact OD1-N 2.86Å; N223-S225 PolarHBondContact OD1-OG 3.38Å; N223-W238 CarbonylContact C-O 3.58Å; N223-W238 WeakPolarHBondContact CA-O 3.49Å; N223-W238 PolarHBondContact OD1-O 2.99Å
224V92.3Very high90.5Very high0 Ų043.4 Ų43.40%027%0.269CS..  trans-110.816.6-178.6-67.90000113.2L194 V222 E226 L227 L229 I237 W238 K240 L258L194-V224 HydrophobicContact CD1-CG1 4.01Å; V222-V224 HydrophobicContact CG2-CG1 4.23Å; V222-V224 PolarHBondContact O-N 3.46Å; V224-E226 PolarHBondContact O-N 3.49Å; V224-L227 HydrophobicContact CB-CB 4.5Å; V224-L227 HydrophobicContact CB-CD1 4.01Å; V224-L227 HydrophobicContact CB-CG 4.35Å; V224-L227 HydrophobicContact CG1-CD1 3.89Å; V224-L227 WeakPolarHBondContact O-CB 3.46Å; V224-L227 PolarHBondContact O-N 2.91Å; V224-L229 HydrophobicContact CB-CD1 4.49Å; V224-L229 HydrophobicContact CG2-CD1 4.43Å; V224-I237 HydrophobicContact CG2-CG2 3.9Å; V224-W238 PolarHBondContact N-O 2.93Å; V224-K240 HydrophobicContact CG1-CB 3.77Å; V224-K240 HydrophobicContact CG2-CB 3.91Å; V224-L258 HydrophobicContact CG1-CD2 4.07Å
225S89.1Confident90.1Very high61 Ų6151.1 Ų51.143%0.42730%0.303SS..G310 helixtrans-53.2-38.5176.750.40000112.9N223 L227 G228N223-S225 VanDerWaalsContact OD1-CB 3.23Å; N223-S225 WeakPolarHBondContact OD1-CB 3.38Å; N223-S225 PolarHBondContact OD1-N 2.86Å; N223-S225 PolarHBondContact OD1-OG 3.38Å; S225-L227 PolarHBondContact O-N 3.28Å; S225-G228 PolarHBondContact O-N 2.96Å
226E83.9Confident89.7Confident134 Ų13455.6 Ų55.663%0.62633%0.33SS*.G310 helixtrans-63.4-21.9176.7-65-179.2-173.600113.7L194 V224L194-E226 HydrophobicContact CD2-CB 4.31Å; V224-E226 PolarHBondContact O-N 3.49Å
227L83.3Confident89.4Confident17 Ų1754.8 Ų54.89%0.08933%0.328CS..G310 helixtrans-82.7-13.7179.8-60.9-177.2000113.3F192 V224 S225 L229 L258F192-L227 HydrophobicContact CD1-CD2 3.7Å; F192-L227 HydrophobicContact CD2-CD2 3.55Å; F192-L227 HydrophobicContact CE1-CD2 3.56Å; F192-L227 HydrophobicContact CE2-CD2 3.4Å; F192-L227 VanDerWaalsContact CE2-CD2 3.4Å; F192-L227 HydrophobicContact CG-CD2 3.69Å; F192-L227 HydrophobicContact CZ-CD2 3.41Å; F192-L227 VanDerWaalsContact CZ-CD2 3.41Å; V224-L227 HydrophobicContact CB-CB 4.5Å; V224-L227 HydrophobicContact CB-CD1 4.01Å; V224-L227 HydrophobicContact CB-CG 4.35Å; V224-L227 HydrophobicContact CG1-CD1 3.89Å; V224-L227 WeakPolarHBondContact O-CB 3.46Å; V224-L227 PolarHBondContact O-N 2.91Å; S225-L227 PolarHBondContact O-N 3.28Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 HydrophobicContact CB-CD1 4.36Å; L227-L229 HydrophobicContact CB-CG 3.92Å; L227-L229 HydrophobicContact CD1-CD1 4.27Å; L227-L229 PolarHBondContact O-N 3.15Å; L227-L258 HydrophobicContact CD1-CD1 3.76Å
228G83.7Confident89.3Confident50 Ų5062 Ų6252%0.51535%0.354SS..THydrogen-bonded Turntrans59.634.6-178.600000113.3S225S225-G228 PolarHBondContact O-N 2.96Å
229L83.8Confident89.2Confident33 Ų3363 Ų6317%0.17337%0.365CS..  trans-72.7129.2179.2-65.9177.5000110V224 L227 I237 K240V224-L229 HydrophobicContact CB-CD1 4.49Å; V224-L229 HydrophobicContact CG2-CD1 4.43Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 HydrophobicContact CB-CD1 4.36Å; L227-L229 HydrophobicContact CB-CG 3.92Å; L227-L229 HydrophobicContact CD1-CD1 4.27Å; L227-L229 PolarHBondContact O-N 3.15Å; L229-I237 HydrophobicContact CB-CB 4.13Å; L229-I237 HydrophobicContact CB-CD1 4.23Å; L229-I237 PolarHBondContact O-N 2.93Å; L229-K240 HydrophobicContact CD1-CD 4.19Å
230V84.7Confident89.1Confident82 Ų8264 Ų6450%0.49737%0.368SS..BIsolated β-bridgetrans-124.4138.4-179.1-168.90000109.5G234V230-G234 WeakPolarHBondContact CG1-O 3.48Å
231T86.2Confident89Confident61 Ų6168.7 Ų68.737%0.37439%0.386SS..  trans-70.7163.6171.159.80000110.9G233 G234 K235 I237T231-G233 PolarHBondContact O-N 3.41Å; T231-G234 PolarHBondContact O-N 3.31Å; T231-K235 PolarHBondContact N-O 2.98Å; T231-K235 WeakPolarHBondContact OG1-CB 3.49Å; T231-K235 PolarHBondContact OG1-N 2.97Å; T231-K235 PolarHBondContact OG1-O 3.18Å; T231-K235 VanDerWaalsContact OG1-O 3.06Å; T231-I237 HydrophobicContact CG2-CD1 3.84Å; T231-I237 HydrophobicContact CG2-CG1 3.74Å
232Q81.6Confident89.1Confident159 Ų15965.8 Ų65.874%0.74337%0.372SS*.THydrogen-bonded Turntrans-57.6-23.9174.7-64.2-171.9-52.400113.3G234Q232-G234 VanDerWaalsContact C-N 3.32Å
233G85.6Confident89.1Confident68 Ų6866 Ų6670%0.70137%0.373SS*.THydrogen-bonded Turntrans-8916.7176.300000114.6T231 K235T231-G233 PolarHBondContact O-N 3.41Å; G233-K235 PolarHBondContact O-N 2.95Å; G233-K235 VanDerWaalsContact O-N 3.15Å
234G85.6Confident89.2Confident53 Ų5364.3 Ų64.355%0.54636%0.364SS..SBendtrans76.1-2.9175.600000115.5V230 T231 Q232V230-G234 WeakPolarHBondContact CG1-O 3.48Å; T231-G234 PolarHBondContact O-N 3.31Å; Q232-G234 VanDerWaalsContact C-N 3.32Å
235K87.8Confident89.3Confident162 Ų16266.5 Ų66.570%0.70438%0.378SS*.PPolyproline II helixtrans-75.9130.1176.4-60.5-176.1-179.9-177.90110.6T231 G233T231-K235 PolarHBondContact N-O 2.98Å; T231-K235 WeakPolarHBondContact OG1-CB 3.49Å; T231-K235 PolarHBondContact OG1-N 2.97Å; T231-K235 PolarHBondContact OG1-O 3.18Å; T231-K235 VanDerWaalsContact OG1-O 3.06Å; G233-K235 PolarHBondContact O-N 2.95Å; G233-K235 VanDerWaalsContact O-N 3.15Å
236V87.6Confident89.6Confident96 Ų9664.4 Ų64.458%0.58236%0.362SS*.BIsolated β-bridgetrans-71.6131176.4179.40000110.1
237I89.6Confident90.1Very high52 Ų5260.7 Ų60.727%0.26735%0.346SS..PPolyproline II helixtrans-90119.9174.1-58.3167.8000107.3V224 L229 T231 G239V224-I237 HydrophobicContact CG2-CG2 3.9Å; L229-I237 HydrophobicContact CB-CB 4.13Å; L229-I237 HydrophobicContact CB-CD1 4.23Å; L229-I237 PolarHBondContact O-N 2.93Å; T231-I237 HydrophobicContact CG2-CD1 3.84Å; T231-I237 HydrophobicContact CG2-CG1 3.74Å; I237-G239 VanDerWaalsContact CG2-O 3.31Å; I237-G239 WeakPolarHBondContact CG2-O 3.14Å
238W91.4Very high90.7Very high156 Ų15659.9 Ų59.959%0.59134%0.342SS*.  trans-109.4-15.1178.363.5-88.5000112.8L197 N223 V224L197-W238 HydrophobicContact CD1-CE3 3.8Å; L197-W238 HydrophobicContact CD1-CZ3 3.5Å; L197-W238 VanDerWaalsContact CD1-CZ3 3.5Å; L197-W238 HydrophobicContact CD2-CZ3 4.09Å; L197-W238 HydrophobicContact CG-CZ3 4.41Å; N223-W238 CarbonylContact C-O 3.58Å; N223-W238 WeakPolarHBondContact CA-O 3.49Å; N223-W238 PolarHBondContact OD1-O 2.99Å; V224-W238 PolarHBondContact N-O 2.93Å
239G94.1Very high90.9Very high22 Ų2259.9 Ų59.923%0.22733%0.329CS..EExtended strand (participates in β ladder)trans-127.2134.3177.500000111.7V222 I237V222-G239 WeakPolarHBondContact O-CA 3.44Å; I237-G239 VanDerWaalsContact CG2-O 3.31Å; I237-G239 WeakPolarHBondContact CG2-O 3.14Å
240K94.8Very high91.3Very high42 Ų4264.3 Ų64.318%0.18335%0.352CS..EExtended strand (participates in β ladder)trans-142.6152.6173.7-163.9160.3-179.7167.70110.6V222 V224 L229 L258 L259V222-K240 WeakPolarHBondContact CG2-O 3.46Å; V222-K240 PolarHBondContact N-O 2.95Å; V222-K240 PolarHBondContact O-N 2.88Å; V224-K240 HydrophobicContact CG1-CB 3.77Å; V224-K240 HydrophobicContact CG2-CB 3.91Å; L229-K240 HydrophobicContact CD1-CD 4.19Å; K240-L258 HydrophobicContact CB-CD2 4.09Å; K240-L258 HydrophobicContact CD-CD2 4.24Å; K240-L258 HydrophobicContact CG-CD2 4.09Å; K240-L259 WeakPolarHBondContact CE-O 3.33Å
241Y96.4Very high91.6Very high98 Ų9864.9 Ų64.938%0.38435%0.353SS..EExtended strand (participates in β ladder)trans-79.9140175.7-62.9-56.4000111.3K200 V219 I220 E221 L259K200-Y241 HydrophobicContact CB-CD1 4.24Å; K200-Y241 HydrophobicContact CB-CE1 3.85Å; K200-Y241 HydrophobicContact CD-CE1 4.21Å; K200-Y241 HydrophobicContact CG-CD1 4.38Å; K200-Y241 HydrophobicContact CG-CE1 3.68Å; V219-Y241 HydrophobicContact CG1-CD1 4.12Å; V219-Y241 HydrophobicContact CG1-CG 4.23Å; I220-Y241 CarbonylContact O-C 3.49Å; I220-Y241 WeakPolarHBondContact O-CA 3.47Å; E221-Y241 HydrophobicContact CB-CD1 4.23Å; E221-Y241 HydrophobicContact CB-CE1 4.25Å; E221-Y241 HydrophobicContact CG-CD1 4.47Å; E221-Y241 HydrophobicContact CG-CE1 4.36Å; Y241-L259 PolarHBondContact O-N 3.26Å
242A96.8Very high91.9Very high0 Ų064.1 Ų64.10%036%0.357CS..EExtended strand (participates in β ladder)trans-131.2146.6171.600000109.5V183 V219 I220 V222 A256 V257 L258V183-A242 HydrophobicContact CG1-CB 4.23Å; V219-A242 WeakPolarHBondContact CA-O 3.23Å; I220-A242 HydrophobicContact CG1-CB 4.14Å; I220-A242 WeakPolarHBondContact CG1-O 3.34Å; I220-A242 PolarHBondContact N-O 2.98Å; I220-A242 PolarHBondContact O-N 3.12Å; V222-A242 HydrophobicContact CG1-CB 4.38Å; V222-A242 HydrophobicContact CG2-CB 4Å; A242-A256 HydrophobicContact CB-CB 3.96Å; A242-V257 CarbonylContact C-O 3.55Å; A242-V257 WeakPolarHBondContact CA-O 3.33Å; A242-V257 WeakPolarHBondContact CB-O 3.46Å; A242-L258 HydrophobicContact CB-CD2 4.27Å
243Q96.8Very high92.5Very high4 Ų458.9 Ų58.92%0.01934%0.337CS..EExtended strand (participates in β ladder)trans-105.5127.5175.8-171.7176.339.800110.3P120 L121 G217 A256 V257 L259P120-Q243 VanDerWaalsContact CD-OE1 3.29Å; L121-Q243 PolarHBondContact O-NE2 3.39Å; G217-Q243 PolarHBondContact O-NE2 2.86Å; Q243-A256 CarbonylContact O-C 3.57Å; Q243-A256 WeakPolarHBondContact O-CA 3.43Å; Q243-A256 WeakPolarHBondContact O-CB 3.39Å; Q243-V257 PolarHBondContact N-O 3.46Å; Q243-V257 PolarHBondContact O-N 2.85Å; Q243-L259 HydrophobicContact CB-CD2 4.01Å; Q243-L259 HydrophobicContact CB-CG 4.49Å
244V97.3Very high93Very high0 Ų055.8 Ų55.80%031%0.305CS..EExtended strand (participates in β ladder)trans-70.7130177.8178.40000110.4I214 G217 T218 I220 P248 I254 N255 A256I214-V244 HydrophobicContact CG2-CB 4.46Å; I214-V244 HydrophobicContact CG2-CG1 4.28Å; I214-V244 HydrophobicContact CG2-CG2 3.78Å; G217-V244 WeakPolarHBondContact CA-O 3.46Å; G217-V244 PolarHBondContact N-O 2.88Å; T218-V244 PolarHBondContact O-N 3.45Å; I220-V244 HydrophobicContact CD1-CG2 4Å; I220-V244 HydrophobicContact CG1-CG2 4.26Å; I220-V244 HydrophobicContact CG2-CG2 4.26Å; V244-P248 HydrophobicContact CG1-CG 4.02Å; V244-I254 HydrophobicContact CG1-CG2 4.26Å; V244-I254 HydrophobicContact CG2-CG2 3.81Å; V244-N255 CarbonylContact C-O 3.56Å; V244-N255 WeakPolarHBondContact CA-O 3.4Å; V244-A256 HydrophobicContact CG2-CB 4.26Å
245T96Very high93.6Very high46 Ų4656.1 Ų56.128%0.28229%0.294SS..  trans-106-27.6-172.555.80000114L121 K216 N255 V257L121-T245 HydrophobicContact CD1-CG2 4.34Å; K216-T245 WeakPolarHBondContact CD-O 3.41Å; K216-T245 WeakPolarHBondContact CE-O 3.44Å; T245-N255 PolarHBondContact N-O 2.92Å; T245-N255 PolarHBondContact OG1-O 3.45Å; T245-V257 HydrophobicContact CG2-CB 4.22Å; T245-V257 HydrophobicContact CG2-CG2 3.59Å
246N95.5Very high94Very high18 Ų1848.5 Ų48.510%0.09626%0.261CS..SBendtrans-97.4-177.5179.276-44.2000112.6K216 P248 D251 C253 N255K216-N246 WeakPolarHBondContact CA-O 3.29Å; K216-N246 VanDerWaalsContact CB-O 3.3Å; K216-N246 WeakPolarHBondContact CB-O 3.38Å; N246-P248 WeakPolarHBondContact O-CD 3.36Å; N246-D251 PolarHBondContact ND2-OD2 3.37Å; N246-C253 PolarHBondContact ND2-O 3.39Å; N246-N255 HydrophobicContact CB-CB 4.26Å; N246-N255 PolarHBondContact OD1-N 3.27Å; N246-N255 PolarHBondContact OD1-O 3.45Å
247N94.4Very high94.4Very high56 Ų5645.5 Ų45.530%0.29924%0.243SC..  trans-104.795170-66.5-53.6000108.1K216 E249 N250K216-N247 WeakPolarHBondContact CB-OD1 3.13Å; N247-E249 VanDerWaalsContact C-OE2 3.26Å; N247-E249 PolarHBondContact O-N 2.98Å; N247-E249 VanDerWaalsContact O-N 3.07Å; N247-N250 PolarHBondContact O-N 3.02Å; N247-N250 VanDerWaalsContact O-N 3.09Å
248P94.5Very high94.6Very high0 Ų043.1 Ų43.10%023%0.231CC..Hα-helixtrans-59.7-26-169.3-2636.4000114.6V153 I214 V244 N246 N250 G252 C253 I254V153-P248 HydrophobicContact CB-CB 3.92Å; V153-P248 HydrophobicContact CG1-CB 4.36Å; V153-P248 HydrophobicContact CG2-CB 3.7Å; I214-P248 HydrophobicContact CG2-CG 4.23Å; V244-P248 HydrophobicContact CG1-CG 4.02Å; N246-P248 WeakPolarHBondContact O-CD 3.36Å; P248-N250 PolarHBondContact O-N 3.1Å; P248-G252 PolarHBondContact O-N 3.05Å; P248-C253 WeakPolarHBondContact CA-O 3.37Å; P248-I254 HydrophobicContact CB-CG1 3.99Å; P248-I254 HydrophobicContact CG-CG1 4.09Å
249E88.5Confident94.6Very high50 Ų5037.7 Ų37.723%0.23421%0.213CC..Hα-helixtrans-64.2-24.6178.565.5-89.5-147.500114.4K152 N247K152-E249 HydrophobicContact CD-CB 4.09Å; K152-E249 HydrophobicContact CD-CG 3.93Å; K152-E249 IonicContact NZ-OE1 3.63Å; K152-E249 PolarHBondContact NZ-OE1 3.46Å; N247-E249 VanDerWaalsContact C-OE2 3.26Å; N247-E249 PolarHBondContact O-N 2.98Å; N247-E249 VanDerWaalsContact O-N 3.07Å
250N91.9Very high94.1Very high125 Ų12540.5 Ų40.567%0.66823%0.226SC*.Hα-helixtrans-94.3-31.7-178.7-66.7-12.4000111.9N247 P248N247-N250 PolarHBondContact O-N 3.02Å; N247-N250 VanDerWaalsContact O-N 3.09Å; P248-N250 PolarHBondContact O-N 3.1Å
251D91Very high94Very high95 Ų9540.5 Ų40.551%0.50823%0.228SC..Hα-helixtrans-100.7-23-169.3-54.9-30.9000112.7N246 C253N246-D251 PolarHBondContact ND2-OD2 3.37Å; D251-C253 PolarHBondContact O-N 3.33Å
252G91.9Very high93.9Very high45 Ų4537.4 Ų37.446%0.46422%0.22SC..SBendtrans72.214.9-173.300000114F178 P248F178-G252 WeakPolarHBondContact CE2-O 3.39Å; F178-G252 WeakPolarHBondContact CZ-O 3.27Å; P248-G252 PolarHBondContact O-N 3.05Å
253C94.4Very high93.8Very high49 Ų4939.5 Ų39.533%0.33123%0.232SC..SBendtrans-135.1144.4178.6-69.60000110.1N246 P248 D251N246-C253 PolarHBondContact ND2-O 3.39Å; P248-C253 WeakPolarHBondContact CA-O 3.37Å; D251-C253 PolarHBondContact O-N 3.33Å
254I97Very high93.6Very high2 Ų241.6 Ų41.61%0.0124%0.244CC..  trans-99106.2170.4-61169.6000107.8V153 F178 A181 H182 I196 I214 I220 V244 P248V153-I254 HydrophobicContact CG1-CD1 3.9Å; V153-I254 HydrophobicContact CG1-CG1 4.2Å; F178-I254 HydrophobicContact CB-CD1 3.51Å; F178-I254 HydrophobicContact CB-CG1 4.48Å; F178-I254 HydrophobicContact CD2-CD1 3.74Å; F178-I254 HydrophobicContact CD2-CG1 3.79Å; F178-I254 HydrophobicContact CE2-CG1 4.44Å; F178-I254 HydrophobicContact CG-CD1 3.95Å; F178-I254 HydrophobicContact CG-CG1 4.43Å; A181-I254 HydrophobicContact CB-CB 4.07Å; A181-I254 HydrophobicContact CB-CG2 3.76Å; H182-I254 PolarHBondContact N-O 3.14Å; I196-I254 HydrophobicContact CD1-CD1 3.75Å; I214-I254 HydrophobicContact CD1-CD1 3.74Å; I214-I254 HydrophobicContact CG2-CD1 4.4Å; I214-I254 HydrophobicContact CG2-CG2 4.34Å; I220-I254 HydrophobicContact CD1-CG2 4.34Å; V244-I254 HydrophobicContact CG1-CG2 4.26Å; V244-I254 HydrophobicContact CG2-CG2 3.81Å; P248-I254 HydrophobicContact CB-CG1 3.99Å; P248-I254 HydrophobicContact CG-CG1 4.09Å
255N97.1Very high93.3Very high61 Ų6144.2 Ų44.233%0.32626%0.26SS..EExtended strand (participates in β ladder)trans-98.9127.3173.9-62.8-25.5000109H182 V244 T245 N246H182-N255 CarbonylContact O-C 3.45Å; H182-N255 WeakPolarHBondContact O-CA 3.32Å; V244-N255 CarbonylContact C-O 3.56Å; V244-N255 WeakPolarHBondContact CA-O 3.4Å; T245-N255 PolarHBondContact N-O 2.92Å; T245-N255 PolarHBondContact OG1-O 3.45Å; N246-N255 HydrophobicContact CB-CB 4.26Å; N246-N255 PolarHBondContact OD1-N 3.27Å; N246-N255 PolarHBondContact OD1-O 3.45Å
256A96.9Very high93.2Very high1 Ų144.1 Ų44.11%0.00826%0.258CS..EExtended strand (participates in β ladder)trans-137.1158.5-177.500000111.7H182 V183 T184 I220 A242 Q243 V244H182-A256 PolarHBondContact O-N 3.06Å; V183-A256 CarbonylContact C-O 3.5Å; V183-A256 WeakPolarHBondContact CA-O 3.28Å; V183-A256 HydrophobicContact CG2-CB 4.4Å; T184-A256 PolarHBondContact N-O 3.42Å; I220-A256 HydrophobicContact CD1-CB 4.18Å; A242-A256 HydrophobicContact CB-CB 3.96Å; Q243-A256 CarbonylContact O-C 3.57Å; Q243-A256 WeakPolarHBondContact O-CA 3.43Å; Q243-A256 WeakPolarHBondContact O-CB 3.39Å; V244-A256 HydrophobicContact CG2-CB 4.26Å
257V96.1Very high93Very high33 Ų3345.9 Ų45.920%0.227%0.27CS..EExtended strand (participates in β ladder)trans-117.1131.6176.1174.50000108.6P186 A242 Q243 T245P186-V257 HydrophobicContact CG-CG1 3.6Å; A242-V257 CarbonylContact C-O 3.55Å; A242-V257 WeakPolarHBondContact CA-O 3.33Å; A242-V257 WeakPolarHBondContact CB-O 3.46Å; Q243-V257 PolarHBondContact N-O 3.46Å; Q243-V257 PolarHBondContact O-N 2.85Å; T245-V257 HydrophobicContact CG2-CB 4.22Å; T245-V257 HydrophobicContact CG2-CG2 3.59Å
258L93.6Very high92.9Very high2 Ų245.2 Ų45.21%0.0127%0.267CS..EExtended strand (participates in β ladder)trans-62.6136.1175.2-78.7167.9000111.1V183 T184 H185 V222 V224 L227 K240 A242 V260V183-L258 HydrophobicContact CG1-CB 4.49Å; V183-L258 HydrophobicContact CG1-CD1 4.05Å; V183-L258 HydrophobicContact CG1-CD2 3.76Å; V183-L258 HydrophobicContact CG1-CG 3.41Å; V183-L258 VanDerWaalsContact CG1-CG 3.41Å; T184-L258 PolarHBondContact O-N 3.16Å; H185-L258 HydrophobicContact CB-CD1 4.15Å; V222-L258 HydrophobicContact CG2-CD2 3.94Å; V224-L258 HydrophobicContact CG1-CD2 4.07Å; L227-L258 HydrophobicContact CD1-CD1 3.76Å; K240-L258 HydrophobicContact CB-CD2 4.09Å; K240-L258 HydrophobicContact CD-CD2 4.24Å; K240-L258 HydrophobicContact CG-CD2 4.09Å; A242-L258 HydrophobicContact CB-CD2 4.27Å; L258-V260 HydrophobicContact CB-CG2 4.15Å; L258-V260 PolarHBondContact O-N 2.99Å
259L91.1Very high92.8Very high42 Ų4248.9 Ų48.922%0.2229%0.29CS..  trans-87.1105.8169.4-56-178000107.6V119 P120 V219 K240 Y241 Q243V119-L259 HydrophobicContact CG1-CD1 4.11Å; V119-L259 HydrophobicContact CG1-CD2 4.4Å; P120-L259 HydrophobicContact CG-CD2 4.03Å; V219-L259 HydrophobicContact CG1-CD1 4.21Å; K240-L259 WeakPolarHBondContact CE-O 3.33Å; Y241-L259 PolarHBondContact O-N 3.26Å; Q243-L259 HydrophobicContact CB-CD2 4.01Å; Q243-L259 HydrophobicContact CB-CG 4.49Å
260V83.6Confident93.1Very high82 Ų8248.8 Ų48.850%0.49730%0.295SS..  trans-97.90-172.7-179.40000113L258L258-V260 HydrophobicContact CB-CG2 4.15Å; L258-V260 PolarHBondContact O-N 2.99Å

Retrieved 260 of 260 residues in 45.8 ms (Link to these results)

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