A0A060W7Q2_ONCMY Loading...

Ankyrin repeat domain 9

AlphaFold DB , UniProt , Accession A0A060W7Q2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ankrd9, Length 290 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
1M37.5Very low39.1Very low226 Ų226151.3 Ų151.3100%1.11383%0.829SS**  0105.50-66.2-56.4-156.300107.2
2P38.1Very low39.4Very low125 Ų125158.3 Ų158.381%0.81283%0.834SS**  trans-75.7141.7-177.622.4-13.7000110.1D4P2-D4 PolarHBondContact O-N 3.31Å
3Y38.3Very low39.8Very low221 Ų221153.4 Ų153.487%0.86783%0.83SS**  trans-68122.8176.7-80-99.6000110L5Y3-L5 PolarHBondContact O-N 3.22Å; Y3-L5 VanDerWaalsContact O-N 3.11Å
4D37Very low40.5Very low157 Ų157152.1 Ų152.184%0.8482%0.823SS**  trans-65.8104.3170.8-89.2-39.6000110.2P2 A6P2-D4 PolarHBondContact O-N 3.31Å; D4-A6 PolarHBondContact O-N 3.3Å
5L40.9Very low41.3Very low150 Ų150152.1 Ų152.179%0.78581%0.808SS**  trans-84.921.6167.8-89.9158.7000112.3Y3 G7Y3-L5 PolarHBondContact O-N 3.22Å; Y3-L5 VanDerWaalsContact O-N 3.11Å; L5-G7 PolarHBondContact O-N 2.99Å; L5-G7 VanDerWaalsContact O-N 3.14Å
6A38.5Very low42.6Very low94 Ų94148.6 Ų148.678%0.77778%0.783SS**THydrogen-bonded Turntrans-85.228-173.100000114.3D4D4-A6 PolarHBondContact O-N 3.3Å
7G39.3Very low44.5Very low68 Ų68142.1 Ų142.170%0.70175%0.753SS**THydrogen-bonded Turntrans-131.84.8-173.300000116.8L5L5-G7 PolarHBondContact O-N 2.99Å; L5-G7 VanDerWaalsContact O-N 3.14Å
8V37.8Very low46.4Very low115 Ų115140.1 Ų140.170%0.69774%0.739SS**SBendtrans-116.30.8-173-173.20000113.6
9F39.2Very low48.2Very low194 Ų194141.7 Ų141.785%0.85174%0.739SS**SBendtrans-119.326.1-178.3-78.1-73.3000115.2
10D40.4Very low49.8Very low149 Ų149137.7 Ų137.780%0.79772%0.716SS**  trans-120.756.8176.7-148.611.2000112.7
11N43.2Very low51.3Low165 Ų165131.3 Ų131.388%0.88268%0.683SS**  trans-146.834.7177.1-108.9-14000113.2
12R42.1Very low53.5Low235 Ų235126 Ų12689%0.88766%0.656SS**  trans-128.417.8-177.7-84.7-170.2177.2-178.50.4116.1
13A45.3Very low55.7Low95 Ų95128 Ų12879%0.78565%0.647SS**SBendtrans-104.80.1-179.700000115.3
14D49.9Very low58Low136 Ų136118.1 Ų118.173%0.72761%0.61SS**  trans-102.9-2.3-170.1-1330.6000114.9K16D14-K16 PolarHBondContact O-N 2.75Å
15Y52.7Low60.4Low151 Ų151112 Ų11259%0.59258%0.579SS**THydrogen-bonded Turntrans-71.8-18.7-176.7110.9-99.1000113.5V49Y15-V49 HydrophobicContact CE2-CG2 4Å
16K62Low62.7Low96 Ų96110.4 Ų110.442%0.41757%0.566SS.*THydrogen-bonded Turntrans-115.957.7178.4-63.9-177.8-179.5-171.50110D14 W52 A58D14-K16 PolarHBondContact O-N 2.75Å; K16-W52 WeakPolarHBondContact O-CZ3 3.1Å; K16-A58 HydrophobicContact CB-CB 3.91Å; K16-A58 HydrophobicContact CD-CB 4.07Å; K16-A58 HydrophobicContact CG-CB 3.98Å
17S75Confident65.2Low39 Ų39107.8 Ų107.827%0.27355%0.545SS..  trans-90.8150.4168.965.90000110.5K19 Q20 C21S17-K19 VanDerWaalsContact C-N 3.25Å; S17-K19 PolarHBondContact O-N 3.25Å; S17-Q20 PolarHBondContact O-N 3.27Å; S17-Q20 VanDerWaalsContact O-N 3.12Å; S17-Q20 WeakPolarHBondContact OG-CB 3.43Å; S17-Q20 PolarHBondContact OG-N 3.37Å; S17-C21 PolarHBondContact O-N 3.41Å; S17-C21 VanDerWaalsContact O-N 3.07Å; S17-C21 PolarHBondContact O-SG 2.72Å
18E78.1Confident67.8Low105 Ų105104.6 Ų104.649%0.49151%0.511SS..Hα-helixtrans-55.2-41.9176.9-173-172.7168.700111.7Q20 C21 Q22 W52E18-Q20 VanDerWaalsContact C-N 3.34Å; E18-Q20 PolarHBondContact O-N 3.35Å; E18-C21 WeakPolarHBondContact O-CB 3.19Å; E18-C21 PolarHBondContact O-N 3.05Å; E18-Q22 WeakPolarHBondContact O-CG 3.26Å; E18-Q22 PolarHBondContact O-N 3.17Å; E18-Q22 PolarHBondContact OE1-NE2 3.31Å; E18-W52 HydrophobicContact CB-CD2 4.16Å; E18-W52 HydrophobicContact CB-CE3 4.45Å; E18-W52 HydrophobicContact CB-CG 4.27Å; E18-W52 HydrophobicContact CG-CB 4.16Å; E18-W52 HydrophobicContact CG-CD2 4.41Å; E18-W52 HydrophobicContact CG-CG 4Å
19K80.8Confident70.4Confident172 Ų172102.6 Ų102.675%0.74849%0.492SS*.Hα-helixtrans-61.3-40.6177.2-70.2-177.7-179.3176.40112.7S17 Q22 R23S17-K19 VanDerWaalsContact C-N 3.25Å; S17-K19 PolarHBondContact O-N 3.25Å; K19-Q22 PolarHBondContact O-N 2.97Å; K19-R23 PolarHBondContact O-N 3.2Å; K19-R23 VanDerWaalsContact O-N 3.14Å
20Q80.2Confident73.1Confident61 Ų6196.9 Ų96.929%0.28547%0.468SS..Hα-helixtrans-66.7-41.3177.3-17962.821.500110.9S17 E18 R23 T24S17-Q20 PolarHBondContact O-N 3.27Å; S17-Q20 VanDerWaalsContact O-N 3.12Å; S17-Q20 WeakPolarHBondContact OG-CB 3.43Å; S17-Q20 PolarHBondContact OG-N 3.37Å; E18-Q20 VanDerWaalsContact C-N 3.34Å; E18-Q20 PolarHBondContact O-N 3.35Å; Q20-R23 WeakPolarHBondContact O-CB 3.36Å; Q20-R23 PolarHBondContact O-N 3.37Å; Q20-R23 VanDerWaalsContact OE1-CZ 3.23Å; Q20-T24 PolarHBondContact O-N 2.82Å; Q20-T24 PolarHBondContact O-OG1 3.05Å; Q20-T24 VanDerWaalsContact O-OG1 3.07Å
21C82.1Confident75.8Confident3 Ų390 Ų902%0.0243%0.432CS..Hα-helixtrans-60.9-45175.6-60.90000111.4S17 E18 R23 T24 S25 F50 W52S17-C21 PolarHBondContact O-N 3.41Å; S17-C21 VanDerWaalsContact O-N 3.07Å; S17-C21 PolarHBondContact O-SG 2.72Å; E18-C21 WeakPolarHBondContact O-CB 3.19Å; E18-C21 PolarHBondContact O-N 3.05Å; C21-R23 VanDerWaalsContact C-N 3.27Å; C21-R23 PolarHBondContact O-N 3.37Å; C21-T24 WeakPolarHBondContact CA-OG1 3.35Å; C21-T24 PolarHBondContact O-N 2.89Å; C21-T24 PolarHBondContact O-OG1 3.04Å; C21-S25 WeakPolarHBondContact O-CB 3.05Å; C21-S25 PolarHBondContact O-N 2.93Å; C21-F50 CarbonylContact C-O 3.58Å; C21-F50 VanDerWaalsContact C-O 3.31Å; C21-F50 WeakPolarHBondContact CB-O 3.44Å; C21-W52 HydrophobicContact CB-CB 4.49Å
22Q82.3Confident78.4Confident114 Ų11482.2 Ų82.253%0.53339%0.39SS..Hα-helixtrans-57.8-41.1175.3-71173.82.700112E18 K19 F26E18-Q22 WeakPolarHBondContact O-CG 3.26Å; E18-Q22 PolarHBondContact O-N 3.17Å; E18-Q22 PolarHBondContact OE1-NE2 3.31Å; K19-Q22 PolarHBondContact O-N 2.97Å; Q22-F26 WeakPolarHBondContact O-CB 3.34Å; Q22-F26 PolarHBondContact O-N 3.31Å
23R85.4Confident81Confident168 Ų16876 Ų7663%0.63437%0.366SS*.Hα-helixtrans-67.3-47.2179.8-166.418077.7-176.27.4112.5K19 Q20 C21 F26 A27K19-R23 PolarHBondContact O-N 3.2Å; K19-R23 VanDerWaalsContact O-N 3.14Å; Q20-R23 WeakPolarHBondContact O-CB 3.36Å; Q20-R23 PolarHBondContact O-N 3.37Å; Q20-R23 VanDerWaalsContact OE1-CZ 3.23Å; C21-R23 VanDerWaalsContact C-N 3.27Å; C21-R23 PolarHBondContact O-N 3.37Å; R23-F26 PolarHBondContact O-N 3.31Å; R23-A27 WeakPolarHBondContact O-CB 3.26Å; R23-A27 PolarHBondContact O-N 2.77Å
24T86.4Confident83.5Confident13 Ų1375.1 Ų75.18%0.0835%0.349CS..Hα-helixtrans-68-40.7178.548.80000111.1Q20 C21 F26 A27 F28 V49 F50Q20-T24 PolarHBondContact O-N 2.82Å; Q20-T24 PolarHBondContact O-OG1 3.05Å; Q20-T24 VanDerWaalsContact O-OG1 3.07Å; C21-T24 WeakPolarHBondContact CA-OG1 3.35Å; C21-T24 PolarHBondContact O-N 2.89Å; C21-T24 PolarHBondContact O-OG1 3.04Å; T24-F26 VanDerWaalsContact C-N 3.33Å; T24-F26 PolarHBondContact O-N 3.06Å; T24-A27 WeakPolarHBondContact O-CB 3.34Å; T24-A27 PolarHBondContact O-N 3.35Å; T24-A27 VanDerWaalsContact O-N 3.15Å; T24-F28 PolarHBondContact O-N 2.83Å; T24-V49 WeakPolarHBondContact CB-O 3.4Å; T24-V49 PolarHBondContact OG1-O 3.28Å; T24-F50 VanDerWaalsContact C-CD1 3.46Å; T24-F50 WeakPolarHBondContact O-CD1 3.47Å; T24-F50 WeakPolarHBondContact O-CE1 3.34Å
25S87.3Confident85.8Confident28 Ų2873.1 Ų73.120%0.19634%0.338CS..Hα-helixtrans-55.8-48.3173.6175.40000111.6C21 A27 F28 Y29 F50C21-S25 WeakPolarHBondContact O-CB 3.05Å; C21-S25 PolarHBondContact O-N 2.93Å; S25-A27 VanDerWaalsContact C-N 3.35Å; S25-A27 PolarHBondContact O-N 3.05Å; S25-F28 PolarHBondContact O-N 3.22Å; S25-Y29 WeakPolarHBondContact O-CB 3.45Å; S25-Y29 PolarHBondContact O-N 3.46Å; S25-F50 VanDerWaalsContact CB-O 3.31Å; S25-F50 WeakPolarHBondContact CB-O 3.46Å
26F89.1Confident87.9Confident118 Ų11869.2 Ų69.252%0.51833%0.326SS..Hα-helixtrans-63.4-40.1176.7-176-101.9000112.4Q22 R23 T24 Y29 Q30Q22-F26 WeakPolarHBondContact O-CB 3.34Å; Q22-F26 PolarHBondContact O-N 3.31Å; R23-F26 PolarHBondContact O-N 3.31Å; T24-F26 VanDerWaalsContact C-N 3.33Å; T24-F26 PolarHBondContact O-N 3.06Å; F26-Y29 HydrophobicContact CD2-CD1 4.49Å; F26-Y29 HydrophobicContact CE2-CD1 4.49Å; F26-Y29 PolarHBondContact O-N 3.38Å; F26-Q30 WeakPolarHBondContact O-CB 3Å; F26-Q30 PolarHBondContact O-N 3.03Å
27A92Very high89.7Confident39 Ų3967.5 Ų67.532%0.32233%0.325SS..Hα-helixtrans-62.1-44.1176.700000112.1R23 T24 S25 Q30 A31 M44R23-A27 WeakPolarHBondContact O-CB 3.26Å; R23-A27 PolarHBondContact O-N 2.77Å; T24-A27 WeakPolarHBondContact O-CB 3.34Å; T24-A27 PolarHBondContact O-N 3.35Å; T24-A27 VanDerWaalsContact O-N 3.15Å; S25-A27 VanDerWaalsContact C-N 3.35Å; S25-A27 PolarHBondContact O-N 3.05Å; A27-Q30 PolarHBondContact O-N 3.32Å; A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 3.27Å; A27-M44 HydrophobicContact CB-CE 4.34Å
28F93.1Very high90.8Very high0 Ų067 Ų670%032%0.321CS..Hα-helixtrans-66.5-45.2175.8179.5-107.4000112.5T24 S25 Q30 A31 V32 L41 M44 R45 F50 F61 A66 Y69 Y78T24-F28 PolarHBondContact O-N 2.83Å; S25-F28 PolarHBondContact O-N 3.22Å; F28-Q30 VanDerWaalsContact C-N 3.27Å; F28-Q30 PolarHBondContact O-N 3.11Å; F28-A31 WeakPolarHBondContact O-CB 3.24Å; F28-A31 PolarHBondContact O-N 3.28Å; F28-A31 VanDerWaalsContact O-N 3.15Å; F28-V32 HydrophobicContact CD1-CG2 4.33Å; F28-V32 HydrophobicContact CD2-CG2 4.43Å; F28-V32 HydrophobicContact CE1-CG2 3.98Å; F28-V32 HydrophobicContact CE2-CG2 4.04Å; F28-V32 HydrophobicContact CZ-CG2 3.82Å; F28-V32 WeakPolarHBondContact O-CG2 3.45Å; F28-V32 PolarHBondContact O-N 2.98Å; F28-L41 HydrophobicContact CE2-CB 4.35Å; F28-L41 HydrophobicContact CE2-CD2 4.46Å; F28-L41 WeakPolarHBondContact CE2-O 3.49Å; F28-M44 HydrophobicContact CB-CE 4.31Å; F28-M44 HydrophobicContact CD2-CB 4.01Å; F28-R45 HydrophobicContact CE2-CB 3.88Å; F28-R45 HydrophobicContact CE2-CG 4.36Å; F28-R45 HydrophobicContact CZ-CB 4.08Å; F28-R45 HydrophobicContact CZ-CG 4.07Å; F28-F50 HydrophobicContact CB-CD1 3.89Å; F28-F50 HydrophobicContact CB-CE1 3.39Å; F28-F50 HydrophobicContact CB-CZ 3.98Å; F28-F50 HydrophobicContact CD2-CZ 4.26Å; F28-F50 HydrophobicContact CG-CE1 4.07Å; F28-F50 HydrophobicContact CG-CZ 4.2Å; F28-F61 HydrophobicContact CB-CD2 4.47Å; F28-F61 HydrophobicContact CB-CE2 4.03Å; F28-F61 AromaticContact CD1-CD2 3.24Å; F28-F61 HydrophobicContact CD1-CD2 3.24Å; F28-F61 AromaticContact CD1-CE2 3.27Å; F28-F61 HydrophobicContact CD1-CE2 3.27Å; F28-F61 HydrophobicContact CD1-CG 4.27Å; F28-F61 HydrophobicContact CD1-CZ 4.33Å; F28-F61 HydrophobicContact CE1-CB 4.47Å; F28-F61 AromaticContact CE1-CD2 3.52Å; F28-F61 HydrophobicContact CE1-CD2 3.52Å; F28-F61 AromaticContact CE1-CE2 3.99Å; F28-F61 HydrophobicContact CE1-CE2 3.99Å; F28-F61 HydrophobicContact CE1-CG 4.18Å; F28-F61 AromaticContact CG-CD2 3.96Å; F28-F61 HydrophobicContact CG-CD2 3.96Å; F28-F61 AromaticContact CG-CE2 3.94Å; F28-F61 HydrophobicContact CG-CE2 3.94Å; F28-F61 HydrophobicContact CZ-CD2 4.46Å; F28-A66 HydrophobicContact CE1-CB 4.14Å; F28-A66 HydrophobicContact CZ-CB 3.91Å; F28-Y69 HydrophobicContact CD1-CD2 4.06Å; F28-Y69 HydrophobicContact CD1-CE2 4.22Å; F28-Y69 AromaticContact CE1-CD2 3.91Å; F28-Y69 HydrophobicContact CE1-CD2 3.91Å; F28-Y69 HydrophobicContact CE1-CE2 4.4Å; F28-Y78 HydrophobicContact CZ-CE1 4.15Å
29Y92.6Very high91.6Very high73 Ų7371 Ų7129%0.28633%0.331SS..Hα-helixtrans-53.1-48.1173168.1-96000111.2S25 F26 V32 R33 Y69 H73S25-Y29 WeakPolarHBondContact O-CB 3.45Å; S25-Y29 PolarHBondContact O-N 3.46Å; F26-Y29 HydrophobicContact CD2-CD1 4.49Å; F26-Y29 HydrophobicContact CE2-CD1 4.49Å; F26-Y29 PolarHBondContact O-N 3.38Å; Y29-V32 PolarHBondContact O-N 2.71Å; Y29-R33 WeakPolarHBondContact O-CB 3.36Å; Y29-R33 PolarHBondContact O-N 3.39Å; Y29-Y69 AromaticContact CD2-CD1 3.82Å; Y29-Y69 HydrophobicContact CD2-CD1 3.82Å; Y29-Y69 AromaticContact CD2-CE1 3.68Å; Y29-Y69 HydrophobicContact CD2-CE1 3.68Å; Y29-Y69 HydrophobicContact CD2-CG 4.47Å; Y29-Y69 HydrophobicContact CE2-CD1 4.32Å; Y29-Y69 HydrophobicContact CE2-CE1 4.32Å; Y29-H73 AromaticContact CD2-NE2 3.98Å; Y29-H73 AromaticContact CE2-CE1 3.94Å; Y29-H73 AromaticContact CE2-NE2 3.11Å; Y29-H73 WeakPolarHBondContact CE2-NE2 3.42Å; Y29-H73 AromaticContact CZ-CE1 3.86Å; Y29-H73 AromaticContact CZ-NE2 3.47Å; Y29-H73 PolarHBondContact OH-CE1 3.49Å; Y29-H73 PolarHBondContact OH-NE2 3.02Å
30Q95.6Very high92.4Very high74 Ų7464.2 Ų64.235%0.34630%0.304SS..Hα-helixtrans-61.9-44.3177.8179.8171.9-36.300111.5F26 A27 F28 V32 R33 D34F26-Q30 WeakPolarHBondContact O-CB 3Å; F26-Q30 PolarHBondContact O-N 3.03Å; A27-Q30 PolarHBondContact O-N 3.32Å; F28-Q30 VanDerWaalsContact C-N 3.27Å; F28-Q30 PolarHBondContact O-N 3.11Å; Q30-V32 VanDerWaalsContact C-N 3.34Å; Q30-V32 PolarHBondContact O-N 3.41Å; Q30-R33 PolarHBondContact O-N 3.22Å; Q30-D34 VanDerWaalsContact CG-OD2 3.22Å; Q30-D34 WeakPolarHBondContact CG-OD2 3.23Å; Q30-D34 PolarHBondContact NE2-OD2 3.28Å; Q30-D34 VanDerWaalsContact O-CB 3.27Å; Q30-D34 WeakPolarHBondContact O-CB 3.46Å; Q30-D34 PolarHBondContact O-N 3.18Å
31A96.9Very high93.2Very high6 Ų661.3 Ų61.35%0.0529%0.291CS..Hα-helixtrans-60.1-41.7177.600000112.8A27 F28 L35 L36 L41 M44A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 3.27Å; F28-A31 WeakPolarHBondContact O-CB 3.24Å; F28-A31 PolarHBondContact O-N 3.28Å; F28-A31 VanDerWaalsContact O-N 3.15Å; A31-L35 PolarHBondContact O-N 3.34Å; A31-L36 HydrophobicContact CB-CD1 3.76Å; A31-L36 HydrophobicContact CB-CG 4.23Å; A31-L36 PolarHBondContact O-N 3.17Å; A31-L36 VanDerWaalsContact O-N 3.09Å; A31-L41 HydrophobicContact CB-CD2 3.63Å; A31-M44 HydrophobicContact CB-CE 3.9Å; A31-M44 HydrophobicContact CB-SD 3.67Å
32V97.1Very high93.8Very high0 Ų061.9 Ų61.90%029%0.293CS..Hα-helixtrans-67.1-45.1175.8178.40000110.7F28 Y29 Q30 D34 L35 L41 Y78F28-V32 HydrophobicContact CD1-CG2 4.33Å; F28-V32 HydrophobicContact CD2-CG2 4.43Å; F28-V32 HydrophobicContact CE1-CG2 3.98Å; F28-V32 HydrophobicContact CE2-CG2 4.04Å; F28-V32 HydrophobicContact CZ-CG2 3.82Å; F28-V32 WeakPolarHBondContact O-CG2 3.45Å; F28-V32 PolarHBondContact O-N 2.98Å; Y29-V32 PolarHBondContact O-N 2.71Å; Q30-V32 VanDerWaalsContact C-N 3.34Å; Q30-V32 PolarHBondContact O-N 3.41Å; V32-D34 VanDerWaalsContact C-N 3.31Å; V32-D34 PolarHBondContact O-N 3.11Å; V32-L35 PolarHBondContact O-N 2.85Å; V32-L35 VanDerWaalsContact O-N 3.12Å; V32-L41 HydrophobicContact CG2-CD1 4.3Å; V32-L41 HydrophobicContact CG2-CD2 3.91Å; V32-Y78 HydrophobicContact CG1-CD1 4.48Å; V32-Y78 HydrophobicContact CG2-CD1 4.38Å; V32-Y78 HydrophobicContact CG2-CE1 4.11Å
33R96.8Very high94.4Very high104 Ų10460.6 Ų60.639%0.39229%0.29SS..Hα-helixtrans-60-40.8177.1-178.9-164.873.2-175.60.7112.2Y29 Q30 L35Y29-R33 WeakPolarHBondContact O-CB 3.36Å; Y29-R33 PolarHBondContact O-N 3.39Å; Q30-R33 PolarHBondContact O-N 3.22Å; R33-L35 PolarHBondContact O-N 3.42Å
34D97.9Very high94.7Very high77 Ų7754 Ų5441%0.41227%0.267SS..THydrogen-bonded Turntrans-81.67.8-179.1-60.3-7.9000111.8Q30 V32 L36Q30-D34 VanDerWaalsContact CG-OD2 3.22Å; Q30-D34 WeakPolarHBondContact CG-OD2 3.23Å; Q30-D34 PolarHBondContact NE2-OD2 3.28Å; Q30-D34 VanDerWaalsContact O-CB 3.27Å; Q30-D34 WeakPolarHBondContact O-CB 3.46Å; Q30-D34 PolarHBondContact O-N 3.18Å; V32-D34 VanDerWaalsContact C-N 3.31Å; V32-D34 PolarHBondContact O-N 3.11Å; D34-L36 VanDerWaalsContact C-N 3.34Å; D34-L36 PolarHBondContact O-N 3.45Å
35L97.9Very high95Very high95 Ų9554.1 Ų54.150%0.49727%0.266SS..THydrogen-bonded Turntrans57.937.7173.6-55179.2000114.5A31 V32 R33 H75A31-L35 PolarHBondContact O-N 3.34Å; V32-L35 PolarHBondContact O-N 2.85Å; V32-L35 VanDerWaalsContact O-N 3.12Å; R33-L35 PolarHBondContact O-N 3.42Å; L35-H75 HydrophobicContact CD2-CB 3.64Å
36L98.3Very high95.1Very high68 Ų6856.6 Ų56.636%0.35628%0.28SS..  trans-59.8155.9177.8-63.8-166.4000112.2A31 D34 V40 L41 H75A31-L36 HydrophobicContact CB-CD1 3.76Å; A31-L36 HydrophobicContact CB-CG 4.23Å; A31-L36 PolarHBondContact O-N 3.17Å; A31-L36 VanDerWaalsContact O-N 3.09Å; D34-L36 VanDerWaalsContact C-N 3.34Å; D34-L36 PolarHBondContact O-N 3.45Å; L36-V40 HydrophobicContact CD1-CG1 4.06Å; L36-L41 HydrophobicContact CB-CD2 4.11Å; L36-L41 HydrophobicContact CB-CG 4.41Å; L36-L41 WeakPolarHBondContact O-CD1 3.44Å; L36-H75 PolarHBondContact O-NE2 3.39Å
37P98.3Very high94.7Very high61 Ų6157.5 Ų57.540%0.39629%0.287SS..  trans-57.7146.1-179.9-25.935.3000113W39 V40 L41P37-W39 HydrophobicContact CB-CG 4.44Å; P37-W39 PolarHBondContact O-N 2.88Å; P37-W39 VanDerWaalsContact O-N 3.11Å; P37-V40 HydrophobicContact CB-CG2 4.36Å; P37-V40 HydrophobicContact CG-CG2 4.47Å; P37-V40 WeakPolarHBondContact O-CB 3.4Å; P37-V40 PolarHBondContact O-N 2.9Å; P37-L41 PolarHBondContact O-N 3.39Å; P37-L41 VanDerWaalsContact O-N 3.17Å
38V98Very high93.7Very high28 Ų2859.1 Ų59.117%0.1729%0.288CS..Hα-helixtrans-50.9-40.6-177.2173.50000113.1V40 L41 E42 Q77 Y78 Y81V38-V40 PolarHBondContact O-N 3.43Å; V38-L41 PolarHBondContact O-N 3.48Å; V38-E42 HydrophobicContact CG1-CG 4.31Å; V38-E42 WeakPolarHBondContact O-CG 3.44Å; V38-E42 PolarHBondContact O-N 3.14Å; V38-Q77 HydrophobicContact CG2-CB 4.21Å; V38-Y78 HydrophobicContact CG1-CD2 4.16Å; V38-Y78 HydrophobicContact CG2-CD2 4.34Å; V38-Y81 HydrophobicContact CG1-CD1 3.63Å; V38-Y81 HydrophobicContact CG1-CD2 3.55Å; V38-Y81 HydrophobicContact CG1-CE1 4.15Å; V38-Y81 HydrophobicContact CG1-CE2 4.05Å; V38-Y81 HydrophobicContact CG1-CG 3.31Å
39W96.5Very high92.3Very high188 Ų18860.5 Ų60.571%0.71230%0.296SS*.Hα-helixtrans-66.2-36.3-179.465.1-95000112.6P37 D43P37-W39 HydrophobicContact CB-CG 4.44Å; P37-W39 PolarHBondContact O-N 2.88Å; P37-W39 VanDerWaalsContact O-N 3.11Å; W39-D43 VanDerWaalsContact O-CB 3.31Å; W39-D43 WeakPolarHBondContact O-CB 3.27Å; W39-D43 PolarHBondContact O-N 3.29Å
40V96.5Very high90.9Very high31 Ų3157 Ų5719%0.18828%0.283CS..Hα-helixtrans-65.4-46.1174.6-179.40000109.5L36 P37 V38 E42 D43 M44L36-V40 HydrophobicContact CD1-CG1 4.06Å; P37-V40 HydrophobicContact CB-CG2 4.36Å; P37-V40 HydrophobicContact CG-CG2 4.47Å; P37-V40 WeakPolarHBondContact O-CB 3.4Å; P37-V40 PolarHBondContact O-N 2.9Å; V38-V40 PolarHBondContact O-N 3.43Å; V40-E42 VanDerWaalsContact C-N 3.33Å; V40-E42 PolarHBondContact O-N 2.9Å; V40-D43 PolarHBondContact O-N 3.4Å; V40-M44 HydrophobicContact CG1-CG 4.46Å; V40-M44 HydrophobicContact CG1-SD 4.06Å; V40-M44 VanDerWaalsContact O-CG 3.27Å; V40-M44 WeakPolarHBondContact O-CG 3.4Å; V40-M44 PolarHBondContact O-N 3.5Å
41L96.8Very high89.6Confident0 Ų054.4 Ų54.40%027%0.271CS..Hα-helixtrans-62.9-40.9-179.2-62.3179.1000111.5F28 A31 V32 L36 P37 V38 R45 Y78F28-L41 HydrophobicContact CE2-CB 4.35Å; F28-L41 HydrophobicContact CE2-CD2 4.46Å; F28-L41 WeakPolarHBondContact CE2-O 3.49Å; A31-L41 HydrophobicContact CB-CD2 3.63Å; V32-L41 HydrophobicContact CG2-CD1 4.3Å; V32-L41 HydrophobicContact CG2-CD2 3.91Å; L36-L41 HydrophobicContact CB-CD2 4.11Å; L36-L41 HydrophobicContact CB-CG 4.41Å; L36-L41 WeakPolarHBondContact O-CD1 3.44Å; P37-L41 PolarHBondContact O-N 3.39Å; P37-L41 VanDerWaalsContact O-N 3.17Å; V38-L41 PolarHBondContact O-N 3.48Å; L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 PolarHBondContact O-N 3.25Å; L41-Y78 HydrophobicContact CB-CD2 4.39Å; L41-Y78 HydrophobicContact CB-CE1 4.1Å; L41-Y78 HydrophobicContact CB-CE2 3.98Å; L41-Y78 HydrophobicContact CD1-CD1 3.56Å; L41-Y78 HydrophobicContact CD1-CD2 4.14Å; L41-Y78 HydrophobicContact CD1-CE1 3.92Å; L41-Y78 HydrophobicContact CD1-CE2 4.46Å; L41-Y78 HydrophobicContact CD1-CG 3.69Å
42E95.8Very high88.2Confident15 Ų1558.8 Ų58.87%0.0729%0.286CS..Hα-helixtrans-73.2-34.6178.2-72.2-64.1102.600113.4V38 V40 R45 T46 Y78 Y81 Y86V38-E42 HydrophobicContact CG1-CG 4.31Å; V38-E42 WeakPolarHBondContact O-CG 3.44Å; V38-E42 PolarHBondContact O-N 3.14Å; V40-E42 VanDerWaalsContact C-N 3.33Å; V40-E42 PolarHBondContact O-N 2.9Å; E42-R45 PolarHBondContact O-N 3.46Å; E42-R45 IonicContact OE1-CZ 3.88Å; E42-R45 IonicContact OE1-NE 3.62Å; E42-R45 PolarHBondContact OE1-NE 3.39Å; E42-R45 IonicContact OE1-NH2 3.3Å; E42-R45 IonicContact OE2-CZ 2.82Å; E42-R45 IonicContact OE2-NE 3.16Å; E42-R45 PolarHBondContact OE2-NE 3.47Å; E42-R45 IonicContact OE2-NH2 2.62Å; E42-R45 PolarHBondContact OE2-NH2 3.05Å; E42-T46 WeakPolarHBondContact O-CB 3.35Å; E42-T46 WeakPolarHBondContact O-CG2 3.36Å; E42-T46 PolarHBondContact O-N 3.23Å; E42-T46 PolarHBondContact O-OG1 3.18Å; E42-Y78 HydrophobicContact CG-CE2 4Å; E42-Y78 WeakPolarHBondContact OE1-CE2 3.06Å; E42-Y78 VanDerWaalsContact OE1-CZ 3.3Å; E42-Y78 PolarHBondContact OE1-OH 3.39Å; E42-Y81 HydrophobicContact CG-CD1 4.11Å; E42-Y81 HydrophobicContact CG-CE1 3.38Å; E42-Y81 WeakPolarHBondContact OE2-CE1 3.45Å; E42-Y86 PolarHBondContact OE2-OH 2.98Å
43D93.8Very high87.1Confident87 Ų8759.8 Ų59.847%0.46529%0.29SS..Hα-helixtrans-59.8-52.3171.8-168.672.4000110W39 V40 R45 T46 M47W39-D43 VanDerWaalsContact O-CB 3.31Å; W39-D43 WeakPolarHBondContact O-CB 3.27Å; W39-D43 PolarHBondContact O-N 3.29Å; V40-D43 PolarHBondContact O-N 3.4Å; D43-R45 PolarHBondContact O-N 2.89Å; D43-T46 PolarHBondContact O-N 3.15Å; D43-T46 PolarHBondContact O-OG1 2.95Å; D43-M47 VanDerWaalsContact O-CB 3.25Å; D43-M47 WeakPolarHBondContact O-CB 2.95Å; D43-M47 WeakPolarHBondContact O-CG 3.48Å; D43-M47 PolarHBondContact O-N 3.44Å
44M92.6Very high85.7Confident30 Ų3061.4 Ų61.415%0.14831%0.307CS..Hα-helixtrans-54.4-57.4173.1-67.4176.177.100110.6A27 F28 A31 V40 T46 M47 E48 F50A27-M44 HydrophobicContact CB-CE 4.34Å; F28-M44 HydrophobicContact CB-CE 4.31Å; F28-M44 HydrophobicContact CD2-CB 4.01Å; A31-M44 HydrophobicContact CB-CE 3.9Å; A31-M44 HydrophobicContact CB-SD 3.67Å; V40-M44 HydrophobicContact CG1-CG 4.46Å; V40-M44 HydrophobicContact CG1-SD 4.06Å; V40-M44 VanDerWaalsContact O-CG 3.27Å; V40-M44 WeakPolarHBondContact O-CG 3.4Å; V40-M44 PolarHBondContact O-N 3.5Å; M44-T46 PolarHBondContact O-N 3.11Å; M44-T46 VanDerWaalsContact O-N 3.13Å; M44-M47 PolarHBondContact O-N 2.91Å; M44-E48 PolarHBondContact O-N 2.88Å; M44-F50 VanDerWaalsContact C-CZ 3.46Å; M44-F50 HydrophobicContact CB-CZ 4.26Å; M44-F50 WeakPolarHBondContact O-CE2 3.49Å; M44-F50 WeakPolarHBondContact O-CZ 3.43Å
45R92.5Very high84.5Confident14 Ų1462.1 Ų62.15%0.05331%0.311CS..Hα-helixtrans-56.3-34.9-173.2-165.1-175.359.470.55.7113.3F28 L41 E42 D43 F50 F61 A66 Y78 Y86F28-R45 HydrophobicContact CE2-CB 3.88Å; F28-R45 HydrophobicContact CE2-CG 4.36Å; F28-R45 HydrophobicContact CZ-CB 4.08Å; F28-R45 HydrophobicContact CZ-CG 4.07Å; L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 PolarHBondContact O-N 3.25Å; E42-R45 PolarHBondContact O-N 3.46Å; E42-R45 IonicContact OE1-CZ 3.88Å; E42-R45 IonicContact OE1-NE 3.62Å; E42-R45 PolarHBondContact OE1-NE 3.39Å; E42-R45 IonicContact OE1-NH2 3.3Å; E42-R45 IonicContact OE2-CZ 2.82Å; E42-R45 IonicContact OE2-NE 3.16Å; E42-R45 PolarHBondContact OE2-NE 3.47Å; E42-R45 IonicContact OE2-NH2 2.62Å; E42-R45 PolarHBondContact OE2-NH2 3.05Å; D43-R45 PolarHBondContact O-N 2.89Å; R45-F50 VanDerWaalsContact CA-CE2 3.47Å; R45-F61 HydrophobicContact CG-CB 3.94Å; R45-F61 WeakPolarHBondContact CG-O 3.46Å; R45-F61 PolarHBondContact NH1-O 3.41Å; R45-A66 HydrophobicContact CG-CB 4.42Å; R45-Y78 WeakPolarHBondContact CD-OH 3.43Å; R45-Y86 PolarHBondContact NH2-OH 3.09Å
46T89.3Confident83.2Confident81 Ų8159.2 Ų59.250%0.49730%0.304SS..Hα-helixtrans-96-24.5-174.559.40000114E42 D43 M44E42-T46 WeakPolarHBondContact O-CB 3.35Å; E42-T46 WeakPolarHBondContact O-CG2 3.36Å; E42-T46 PolarHBondContact O-N 3.23Å; E42-T46 PolarHBondContact O-OG1 3.18Å; D43-T46 PolarHBondContact O-N 3.15Å; D43-T46 PolarHBondContact O-OG1 2.95Å; M44-T46 PolarHBondContact O-N 3.11Å; M44-T46 VanDerWaalsContact O-N 3.13Å
47M81.2Confident82Confident137 Ų13763.1 Ų63.168%0.67531%0.314SS*.Hα-helixtrans-100.8-24.6-175.8-63.9-172.758.300114D43 M44D43-M47 VanDerWaalsContact O-CB 3.25Å; D43-M47 WeakPolarHBondContact O-CB 2.95Å; D43-M47 WeakPolarHBondContact O-CG 3.48Å; D43-M47 PolarHBondContact O-N 3.44Å; M44-M47 PolarHBondContact O-N 2.91Å
48E70.4Confident81Confident72 Ų7261 Ų6134%0.33630%0.302SS..SBendtrans-101.1150.4180-58.8-172.715800112.4M44 F50 T60M44-E48 PolarHBondContact O-N 2.88Å; E48-F50 HydrophobicContact CB-CE1 3.83Å; E48-F50 HydrophobicContact CB-CE2 3.81Å; E48-F50 HydrophobicContact CB-CZ 3.47Å; E48-F50 VanDerWaalsContact CB-CZ 3.47Å; E48-F50 HydrophobicContact CG-CZ 4.36Å; E48-F50 WeakPolarHBondContact O-CD2 3.48Å; E48-F50 WeakPolarHBondContact O-CE2 3.23Å; E48-F50 WeakPolarHBondContact OE2-CE1 3.32Å; E48-T60 WeakPolarHBondContact O-CG2 3.2Å
49V64.1Low80.2Confident29 Ų2961.3 Ų61.318%0.17630%0.304CS..  trans-96126174.6-170.80000108.4Y15 T24 A58 C59Y15-V49 HydrophobicContact CE2-CG2 4Å; T24-V49 WeakPolarHBondContact CB-O 3.4Å; T24-V49 PolarHBondContact OG1-O 3.28Å; V49-A58 HydrophobicContact CG1-CB 3.32Å; V49-C59 VanDerWaalsContact CG1-N 3.34Å
50F63.5Low79.7Confident1 Ų155.5 Ų55.50%0.00429%0.29CS..  trans-114.9-43.9-162.9-67.6-71.5000114.7C21 T24 S25 F28 M44 R45 E48 C59 F61C21-F50 CarbonylContact C-O 3.58Å; C21-F50 VanDerWaalsContact C-O 3.31Å; C21-F50 WeakPolarHBondContact CB-O 3.44Å; T24-F50 VanDerWaalsContact C-CD1 3.46Å; T24-F50 WeakPolarHBondContact O-CD1 3.47Å; T24-F50 WeakPolarHBondContact O-CE1 3.34Å; S25-F50 VanDerWaalsContact CB-O 3.31Å; S25-F50 WeakPolarHBondContact CB-O 3.46Å; F28-F50 HydrophobicContact CB-CD1 3.89Å; F28-F50 HydrophobicContact CB-CE1 3.39Å; F28-F50 HydrophobicContact CB-CZ 3.98Å; F28-F50 HydrophobicContact CD2-CZ 4.26Å; F28-F50 HydrophobicContact CG-CE1 4.07Å; F28-F50 HydrophobicContact CG-CZ 4.2Å; M44-F50 VanDerWaalsContact C-CZ 3.46Å; M44-F50 HydrophobicContact CB-CZ 4.26Å; M44-F50 WeakPolarHBondContact O-CE2 3.49Å; M44-F50 WeakPolarHBondContact O-CZ 3.43Å; R45-F50 VanDerWaalsContact CA-CE2 3.47Å; E48-F50 HydrophobicContact CB-CE1 3.83Å; E48-F50 HydrophobicContact CB-CE2 3.81Å; E48-F50 HydrophobicContact CB-CZ 3.47Å; E48-F50 VanDerWaalsContact CB-CZ 3.47Å; E48-F50 HydrophobicContact CG-CZ 4.36Å; E48-F50 WeakPolarHBondContact O-CD2 3.48Å; E48-F50 WeakPolarHBondContact O-CE2 3.23Å; E48-F50 WeakPolarHBondContact OE2-CE1 3.32Å; F50-C59 PolarHBondContact N-O 3.3Å; F50-F61 HydrophobicContact CB-CD1 4.44Å; F50-F61 HydrophobicContact CB-CD2 3.57Å; F50-F61 HydrophobicContact CB-CE1 4.17Å; F50-F61 HydrophobicContact CB-CE2 3.31Å; F50-F61 HydrophobicContact CB-CG 4.16Å; F50-F61 HydrophobicContact CB-CZ 3.66Å; F50-F61 AromaticContact CD1-CD2 3.89Å; F50-F61 HydrophobicContact CD1-CD2 3.89Å; F50-F61 AromaticContact CD1-CE2 3.53Å; F50-F61 HydrophobicContact CD1-CE2 3.53Å; F50-F61 HydrophobicContact CD1-CZ 4.49Å; F50-F61 AromaticContact CD2-CD2 3.52Å; F50-F61 HydrophobicContact CD2-CD2 3.52Å; F50-F61 HydrophobicContact CD2-CE2 4.01Å; F50-F61 HydrophobicContact CD2-CG 4.25Å; F50-F61 HydrophobicContact CE1-CD2 4.47Å; F50-F61 HydrophobicContact CE1-CE2 4.32Å; F50-F61 HydrophobicContact CE2-CD2 4.14Å; F50-F61 AromaticContact CG-CD2 3.35Å; F50-F61 HydrophobicContact CG-CD2 3.35Å; F50-F61 AromaticContact CG-CE2 3.32Å; F50-F61 HydrophobicContact CG-CE2 3.32Å; F50-F61 HydrophobicContact CG-CG 4.26Å; F50-F61 HydrophobicContact CG-CZ 4.18Å
51H66.6Low79.3Confident19 Ų1954.1 Ų54.19%0.08828%0.282CS..EExtended strand (participates in β ladder)trans-118.7139.1-171.964.7111000112.1E53 A58 C59 T60H51-E53 IonicContact CE1-OE1 2.65Å; H51-E53 PolarHBondContact CE1-OE1 3.37Å; H51-E53 IonicContact ND1-OE1 2.78Å; H51-E53 PolarHBondContact ND1-OE1 3.09Å; H51-A58 CarbonylContact O-C 3.57Å; H51-A58 WeakPolarHBondContact O-CA 3.41Å; H51-C59 PolarHBondContact CD2-O 2.99Å; H51-C59 WeakPolarHBondContact CE1-CB 3.39Å; H51-C59 PolarHBondContact N-O 3.39Å; H51-C59 WeakPolarHBondContact NE2-CB 3.41Å; H51-C59 PolarHBondContact O-N 3.42Å; H51-T60 PolarHBondContact NE2-O 3.38Å
52W68.7Low79.1Confident98 Ų9856.7 Ų56.737%0.37130%0.297SS..EExtended strand (participates in β ladder)trans-93.5111.1169.3-168.6-93.9000107.5K16 E18 C21 G56 A58K16-W52 WeakPolarHBondContact O-CZ3 3.1Å; E18-W52 HydrophobicContact CB-CD2 4.16Å; E18-W52 HydrophobicContact CB-CE3 4.45Å; E18-W52 HydrophobicContact CB-CG 4.27Å; E18-W52 HydrophobicContact CG-CB 4.16Å; E18-W52 HydrophobicContact CG-CD2 4.41Å; E18-W52 HydrophobicContact CG-CG 4Å; C21-W52 HydrophobicContact CB-CB 4.49Å; W52-G56 VanDerWaalsContact CH2-O 3.27Å; W52-G56 WeakPolarHBondContact CH2-O 3.34Å; W52-G56 WeakPolarHBondContact CZ2-O 3.46Å; W52-A58 HydrophobicContact CE3-CB 4.18Å; W52-A58 HydrophobicContact CZ3-CB 4.27Å
53E74.4Confident79.1Confident20 Ų2056.4 Ų56.49%0.09330%0.297CS..  trans-79158175.3-73.7-71.7161.200110.7H51 D55 G56 R57 S95H51-E53 IonicContact CE1-OE1 2.65Å; H51-E53 PolarHBondContact CE1-OE1 3.37Å; H51-E53 IonicContact ND1-OE1 2.78Å; H51-E53 PolarHBondContact ND1-OE1 3.09Å; E53-D55 VanDerWaalsContact CB-OD1 3.24Å; E53-D55 WeakPolarHBondContact CB-OD1 3.31Å; E53-D55 PolarHBondContact O-N 3.03Å; E53-G56 PolarHBondContact O-N 2.79Å; E53-R57 PolarHBondContact N-O 3.03Å; E53-S95 WeakPolarHBondContact OE1-CB 3.28Å; E53-S95 PolarHBondContact OE1-OG 2.96Å
54D67.1Low79.1Confident138 Ų13852.3 Ų52.374%0.73828%0.275SS*.THydrogen-bonded Turntrans-58.4-18.3-179.7-62.1-31.4000113.2G56D54-G56 VanDerWaalsContact C-N 3.29Å
55D71.4Confident79.2Confident93 Ų9351 Ų5150%0.49727%0.268SS..THydrogen-bonded Turntrans-876.4176.365.99000113.9E53 R57E53-D55 VanDerWaalsContact CB-OD1 3.24Å; E53-D55 WeakPolarHBondContact CB-OD1 3.31Å; E53-D55 PolarHBondContact O-N 3.03Å; D55-R57 VanDerWaalsContact CG-NE 3.34Å; D55-R57 VanDerWaalsContact OD1-CB 3.31Å; D55-R57 WeakPolarHBondContact OD1-CB 3.48Å; D55-R57 WeakPolarHBondContact OD1-CG 3.34Å; D55-R57 PolarHBondContact OD1-N 3.06Å; D55-R57 VanDerWaalsContact OD1-N 3.12Å; D55-R57 IonicContact OD1-NE 3.51Å; D55-R57 PolarHBondContact OD1-NE 3.21Å; D55-R57 IonicContact OD2-CZ 3.6Å; D55-R57 IonicContact OD2-NE 2.62Å; D55-R57 PolarHBondContact OD2-NE 2.96Å; D55-R57 IonicContact OD2-NH2 3.98Å; D55-R57 PolarHBondContact OD2-NH2 3.46Å
56G70.8Confident79.3Confident34 Ų3450.3 Ų50.335%0.35127%0.266SS..SBendtrans79.814177.700000114.2W52 E53 D54W52-G56 VanDerWaalsContact CH2-O 3.27Å; W52-G56 WeakPolarHBondContact CH2-O 3.34Å; W52-G56 WeakPolarHBondContact CZ2-O 3.46Å; E53-G56 PolarHBondContact O-N 2.79Å; D54-G56 VanDerWaalsContact C-N 3.29Å
57R74.2Confident79.7Confident150 Ų15046.5 Ų46.557%0.56624%0.242SC*.  trans-96.4136.1178.4-64.1-173-65158.7-0.2111.8E53 D55E53-R57 PolarHBondContact N-O 3.03Å; D55-R57 VanDerWaalsContact CG-NE 3.34Å; D55-R57 VanDerWaalsContact OD1-CB 3.31Å; D55-R57 WeakPolarHBondContact OD1-CB 3.48Å; D55-R57 WeakPolarHBondContact OD1-CG 3.34Å; D55-R57 PolarHBondContact OD1-N 3.06Å; D55-R57 VanDerWaalsContact OD1-N 3.12Å; D55-R57 IonicContact OD1-NE 3.51Å; D55-R57 PolarHBondContact OD1-NE 3.21Å; D55-R57 IonicContact OD2-CZ 3.6Å; D55-R57 IonicContact OD2-NE 2.62Å; D55-R57 PolarHBondContact OD2-NE 2.96Å; D55-R57 IonicContact OD2-NH2 3.98Å; D55-R57 PolarHBondContact OD2-NH2 3.46Å
58A77.9Confident80.4Confident17 Ų1740.6 Ų40.614%0.1421%0.214CC..EExtended strand (participates in β ladder)trans-88.9122.1170.900000109.3K16 V49 H51 W52K16-A58 HydrophobicContact CB-CB 3.91Å; K16-A58 HydrophobicContact CD-CB 4.07Å; K16-A58 HydrophobicContact CG-CB 3.98Å; V49-A58 HydrophobicContact CG1-CB 3.32Å; H51-A58 CarbonylContact O-C 3.57Å; H51-A58 WeakPolarHBondContact O-CA 3.41Å; W52-A58 HydrophobicContact CE3-CB 4.18Å; W52-A58 HydrophobicContact CZ3-CB 4.27Å
59C80Confident81.5Confident33 Ų3339.1 Ų39.122%0.22321%0.205CC..EExtended strand (participates in β ladder)trans-130.4158.3-168.5-68.40000112.5V49 F50 H51V49-C59 VanDerWaalsContact CG1-N 3.34Å; F50-C59 PolarHBondContact N-O 3.3Å; H51-C59 PolarHBondContact CD2-O 2.99Å; H51-C59 WeakPolarHBondContact CE1-CB 3.39Å; H51-C59 PolarHBondContact N-O 3.39Å; H51-C59 WeakPolarHBondContact NE2-CB 3.41Å; H51-C59 PolarHBondContact O-N 3.42Å
60T85.5Confident83.1Confident67 Ų6737.7 Ų37.741%0.41120%0.197SC..PPolyproline II helixtrans-93.8147177.859.20000110.9E48 H51 T62E48-T60 WeakPolarHBondContact O-CG2 3.2Å; H51-T60 PolarHBondContact NE2-O 3.38Å; T60-T62 PolarHBondContact O-N 2.93Å
61F89.3Confident84.7Confident2 Ų237.7 Ų37.71%0.00920%0.196CC..PPolyproline II helixtrans-60.1128.7175.8-69.2-57.6000112.2F28 R45 F50 E65 Y69 F98F28-F61 HydrophobicContact CB-CD2 4.47Å; F28-F61 HydrophobicContact CB-CE2 4.03Å; F28-F61 AromaticContact CD1-CD2 3.24Å; F28-F61 HydrophobicContact CD1-CD2 3.24Å; F28-F61 AromaticContact CD1-CE2 3.27Å; F28-F61 HydrophobicContact CD1-CE2 3.27Å; F28-F61 HydrophobicContact CD1-CG 4.27Å; F28-F61 HydrophobicContact CD1-CZ 4.33Å; F28-F61 HydrophobicContact CE1-CB 4.47Å; F28-F61 AromaticContact CE1-CD2 3.52Å; F28-F61 HydrophobicContact CE1-CD2 3.52Å; F28-F61 AromaticContact CE1-CE2 3.99Å; F28-F61 HydrophobicContact CE1-CE2 3.99Å; F28-F61 HydrophobicContact CE1-CG 4.18Å; F28-F61 AromaticContact CG-CD2 3.96Å; F28-F61 HydrophobicContact CG-CD2 3.96Å; F28-F61 AromaticContact CG-CE2 3.94Å; F28-F61 HydrophobicContact CG-CE2 3.94Å; F28-F61 HydrophobicContact CZ-CD2 4.46Å; R45-F61 HydrophobicContact CG-CB 3.94Å; R45-F61 WeakPolarHBondContact CG-O 3.46Å; R45-F61 PolarHBondContact NH1-O 3.41Å; F50-F61 HydrophobicContact CB-CD1 4.44Å; F50-F61 HydrophobicContact CB-CD2 3.57Å; F50-F61 HydrophobicContact CB-CE1 4.17Å; F50-F61 HydrophobicContact CB-CE2 3.31Å; F50-F61 HydrophobicContact CB-CG 4.16Å; F50-F61 HydrophobicContact CB-CZ 3.66Å; F50-F61 AromaticContact CD1-CD2 3.89Å; F50-F61 HydrophobicContact CD1-CD2 3.89Å; F50-F61 AromaticContact CD1-CE2 3.53Å; F50-F61 HydrophobicContact CD1-CE2 3.53Å; F50-F61 HydrophobicContact CD1-CZ 4.49Å; F50-F61 AromaticContact CD2-CD2 3.52Å; F50-F61 HydrophobicContact CD2-CD2 3.52Å; F50-F61 HydrophobicContact CD2-CE2 4.01Å; F50-F61 HydrophobicContact CD2-CG 4.25Å; F50-F61 HydrophobicContact CE1-CD2 4.47Å; F50-F61 HydrophobicContact CE1-CE2 4.32Å; F50-F61 HydrophobicContact CE2-CD2 4.14Å; F50-F61 AromaticContact CG-CD2 3.35Å; F50-F61 HydrophobicContact CG-CD2 3.35Å; F50-F61 AromaticContact CG-CE2 3.32Å; F50-F61 HydrophobicContact CG-CE2 3.32Å; F50-F61 HydrophobicContact CG-CG 4.26Å; F50-F61 HydrophobicContact CG-CZ 4.18Å; F61-E65 WeakPolarHBondContact CA-OE2 3.42Å; F61-E65 HydrophobicContact CB-CB 4.36Å; F61-E65 HydrophobicContact CD1-CB 4.03Å; F61-Y69 HydrophobicContact CE1-CE2 4.14Å; F61-Y69 HydrophobicContact CE2-CE2 4.26Å; F61-Y69 AromaticContact CZ-CE2 3.89Å; F61-Y69 HydrophobicContact CZ-CE2 3.89Å; F61-F98 AromaticContact CD1-CE2 3.85Å; F61-F98 HydrophobicContact CD1-CE2 3.85Å; F61-F98 AromaticContact CD1-CZ 3.71Å; F61-F98 HydrophobicContact CD1-CZ 3.71Å; F61-F98 AromaticContact CE1-CE2 3.61Å; F61-F98 HydrophobicContact CE1-CE2 3.61Å; F61-F98 AromaticContact CE1-CZ 3.35Å; F61-F98 HydrophobicContact CE1-CZ 3.35Å; F61-F98 HydrophobicContact CZ-CZ 4.34Å
62T92.4Very high86.1Confident53 Ų5338.6 Ų38.633%0.32520%0.203SC..PPolyproline II helixtrans-67.4159.917168.80000110.5T60 S64 E65 A66T60-T62 PolarHBondContact O-N 2.93Å; T62-S64 PolarHBondContact O-N 2.97Å; T62-E65 PolarHBondContact N-OE2 2.91Å; T62-E65 PolarHBondContact O-N 3.23Å; T62-E65 VanDerWaalsContact OG1-CG 3.28Å; T62-E65 WeakPolarHBondContact OG1-CG 3.33Å; T62-E65 PolarHBondContact OG1-N 3.15Å; T62-E65 PolarHBondContact OG1-OE1 2.85Å; T62-E65 PolarHBondContact OG1-OE2 3.26Å; T62-A66 PolarHBondContact O-N 2.98Å
63P95.4Very high87.4Confident10 Ų1035.8 Ų35.87%0.06519%0.194CC..Hα-helixtrans-55.1-35.8172.4-27.636.6000113.2F67 L82 Y86P63-F67 WeakPolarHBondContact O-CB 3.38Å; P63-F67 PolarHBondContact O-N 3.36Å; P63-L82 HydrophobicContact CB-CD2 4.38Å; P63-Y86 HydrophobicContact CB-CD1 4.29Å; P63-Y86 HydrophobicContact CB-CD2 3.74Å; P63-Y86 HydrophobicContact CB-CE2 4.31Å; P63-Y86 HydrophobicContact CB-CG 3.74Å; P63-Y86 HydrophobicContact CG-CD1 3.73Å; P63-Y86 HydrophobicContact CG-CD2 3.94Å; P63-Y86 HydrophobicContact CG-CE1 4Å; P63-Y86 HydrophobicContact CG-CE2 4.2Å; P63-Y86 HydrophobicContact CG-CG 3.72Å
64S94.9Very high88.5Confident1 Ų137.2 Ų37.21%0.00720%0.202CC..Hα-helixtrans-64.9-43.5176.1168.20000112.6T62 F67 L68 A90 E92 H108T62-S64 PolarHBondContact O-N 2.97Å; S64-F67 WeakPolarHBondContact O-CB 3.29Å; S64-F67 PolarHBondContact O-N 2.94Å; S64-L68 PolarHBondContact O-N 3.19Å; S64-A90 WeakPolarHBondContact CA-O 3.42Å; S64-E92 PolarHBondContact OG-O 2.88Å; S64-H108 PolarHBondContact OG-CE1 3.13Å; S64-H108 VanDerWaalsContact OG-CE1 3.22Å; S64-H108 PolarHBondContact OG-NE2 2.54Å
65E93.3Very high90Very high2 Ų231 Ų311%0.00917%0.169CC..Hα-helixtrans-67.9-44.4179.9-69.7156.6-169.700111.8F61 T62 F67 L68 Y69 P94 S95 F98F61-E65 WeakPolarHBondContact CA-OE2 3.42Å; F61-E65 HydrophobicContact CB-CB 4.36Å; F61-E65 HydrophobicContact CD1-CB 4.03Å; T62-E65 PolarHBondContact N-OE2 2.91Å; T62-E65 PolarHBondContact O-N 3.23Å; T62-E65 VanDerWaalsContact OG1-CG 3.28Å; T62-E65 WeakPolarHBondContact OG1-CG 3.33Å; T62-E65 PolarHBondContact OG1-N 3.15Å; T62-E65 PolarHBondContact OG1-OE1 2.85Å; T62-E65 PolarHBondContact OG1-OE2 3.26Å; E65-F67 PolarHBondContact O-N 3.38Å; E65-L68 WeakPolarHBondContact O-CB 3.13Å; E65-L68 PolarHBondContact O-N 2.77Å; E65-L68 VanDerWaalsContact O-N 3.16Å; E65-Y69 PolarHBondContact O-N 2.84Å; E65-P94 HydrophobicContact CG-CB 3.7Å; E65-S95 WeakPolarHBondContact OE1-CB 3.47Å; E65-S95 PolarHBondContact OE1-N 3.35Å; E65-S95 PolarHBondContact OE1-OG 3.27Å; E65-F98 HydrophobicContact CB-CD1 4.38Å; E65-F98 HydrophobicContact CB-CD2 4.25Å; E65-F98 HydrophobicContact CB-CE1 4.09Å; E65-F98 HydrophobicContact CB-CE2 3.95Å; E65-F98 HydrophobicContact CB-CG 4.46Å; E65-F98 HydrophobicContact CB-CZ 3.87Å; E65-F98 HydrophobicContact CG-CB 4.48Å; E65-F98 HydrophobicContact CG-CD1 4.21Å; E65-F98 HydrophobicContact CG-CD2 3.54Å; E65-F98 HydrophobicContact CG-CE1 4.33Å; E65-F98 HydrophobicContact CG-CE2 3.69Å; E65-F98 HydrophobicContact CG-CG 3.82Å; E65-F98 HydrophobicContact CG-CZ 4.09Å
66A95.4Very high91.3Very high0 Ų029.7 Ų29.70%016%0.16CC..Hα-helixtrans-60.9-37.3172.500000111.7F28 R45 T62 L68 Y69 A70 Y78 L82F28-A66 HydrophobicContact CE1-CB 4.14Å; F28-A66 HydrophobicContact CZ-CB 3.91Å; R45-A66 HydrophobicContact CG-CB 4.42Å; T62-A66 PolarHBondContact O-N 2.98Å; A66-L68 VanDerWaalsContact C-N 3.34Å; A66-L68 PolarHBondContact O-N 2.96Å; A66-Y69 PolarHBondContact O-N 3.12Å; A66-A70 PolarHBondContact O-N 3.31Å; A66-Y78 HydrophobicContact CB-CE1 4.09Å; A66-L82 HydrophobicContact CB-CD1 4.06Å
67F97.4Very high92.6Very high0 Ų034.5 Ų34.50%017%0.173CC..Hα-helixtrans-64.6-37.4176-177.1-119.2000111.9P63 S64 E65 Y69 A70 L71 A79 L82 L83 A90 L91 H108 I120 I124P63-F67 WeakPolarHBondContact O-CB 3.38Å; P63-F67 PolarHBondContact O-N 3.36Å; S64-F67 WeakPolarHBondContact O-CB 3.29Å; S64-F67 PolarHBondContact O-N 2.94Å; E65-F67 PolarHBondContact O-N 3.38Å; F67-Y69 PolarHBondContact O-N 3.39Å; F67-A70 WeakPolarHBondContact O-CB 3.3Å; F67-A70 PolarHBondContact O-N 2.97Å; F67-L71 HydrophobicContact CE1-CD1 3.83Å; F67-L71 HydrophobicContact CZ-CD1 3.81Å; F67-L71 WeakPolarHBondContact O-CB 3.26Å; F67-L71 PolarHBondContact O-N 3.37Å; F67-A79 HydrophobicContact CD2-CB 4.18Å; F67-A79 HydrophobicContact CE2-CB 3.68Å; F67-L82 HydrophobicContact CB-CD1 3.84Å; F67-L82 HydrophobicContact CD2-CB 4.34Å; F67-L82 HydrophobicContact CD2-CD1 4.28Å; F67-L83 HydrophobicContact CD2-CG 4.39Å; F67-L83 HydrophobicContact CE1-CD2 4.22Å; F67-L83 HydrophobicContact CE2-CD1 3.77Å; F67-L83 HydrophobicContact CE2-CD2 4.11Å; F67-L83 HydrophobicContact CE2-CG 3.75Å; F67-L83 HydrophobicContact CZ-CD1 3.82Å; F67-L83 HydrophobicContact CZ-CD2 3.89Å; F67-L83 HydrophobicContact CZ-CG 3.97Å; F67-A90 WeakPolarHBondContact CD1-O 3.39Å; F67-L91 HydrophobicContact CD1-CD2 4.03Å; F67-L91 HydrophobicContact CE1-CD2 3.6Å; F67-L91 HydrophobicContact CZ-CD2 4.44Å; F67-H108 AromaticContact CD1-CD2 3.47Å; F67-H108 VanDerWaalsContact CD1-CD2 3.47Å; F67-H108 WeakPolarHBondContact CD1-CD2 3.19Å; F67-H108 HydrophobicContact CE1-CB 4.34Å; F67-H108 AromaticContact CE1-CD2 3.89Å; F67-I120 HydrophobicContact CE2-CG2 3.96Å; F67-I120 HydrophobicContact CZ-CG2 3.78Å; F67-I124 HydrophobicContact CE1-CD1 3.78Å; F67-I124 HydrophobicContact CE1-CG1 3.78Å; F67-I124 HydrophobicContact CZ-CD1 3.76Å; F67-I124 HydrophobicContact CZ-CG1 3.51Å
68L94.8Very high93.8Very high14 Ų1427.4 Ų27.47%0.07315%0.146CC..Hα-helixtrans-61.1-41.4173.7-72.4172.8000112.6S64 E65 A66 L71 V72 P94 F98 P107 H108S64-L68 PolarHBondContact O-N 3.19Å; E65-L68 WeakPolarHBondContact O-CB 3.13Å; E65-L68 PolarHBondContact O-N 2.77Å; E65-L68 VanDerWaalsContact O-N 3.16Å; A66-L68 VanDerWaalsContact C-N 3.34Å; A66-L68 PolarHBondContact O-N 2.96Å; L68-L71 PolarHBondContact O-N 2.9Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.28Å; L68-P94 HydrophobicContact CD1-CB 4.14Å; L68-P94 HydrophobicContact CD1-CG 3.92Å; L68-F98 HydrophobicContact CD1-CB 4.5Å; L68-F98 HydrophobicContact CD1-CD1 4.16Å; L68-P107 HydrophobicContact CD1-CG 4.09Å; L68-P107 HydrophobicContact CD2-CG 4Å; L68-H108 VanDerWaalsContact CD2-CD2 3.47Å; L68-H108 WeakPolarHBondContact CD2-CD2 3.38Å
69Y95.3Very high94.8Very high40 Ų4026.6 Ų26.616%0.15714%0.14CC..Hα-helixtrans-65.6-44.2173.5-69.2-41.1000112.2F28 Y29 F61 E65 A66 F67 L71 V72 H73 F98F28-Y69 HydrophobicContact CD1-CD2 4.06Å; F28-Y69 HydrophobicContact CD1-CE2 4.22Å; F28-Y69 AromaticContact CE1-CD2 3.91Å; F28-Y69 HydrophobicContact CE1-CD2 3.91Å; F28-Y69 HydrophobicContact CE1-CE2 4.4Å; Y29-Y69 AromaticContact CD2-CD1 3.82Å; Y29-Y69 HydrophobicContact CD2-CD1 3.82Å; Y29-Y69 AromaticContact CD2-CE1 3.68Å; Y29-Y69 HydrophobicContact CD2-CE1 3.68Å; Y29-Y69 HydrophobicContact CD2-CG 4.47Å; Y29-Y69 HydrophobicContact CE2-CD1 4.32Å; Y29-Y69 HydrophobicContact CE2-CE1 4.32Å; F61-Y69 HydrophobicContact CE1-CE2 4.14Å; F61-Y69 HydrophobicContact CE2-CE2 4.26Å; F61-Y69 AromaticContact CZ-CE2 3.89Å; F61-Y69 HydrophobicContact CZ-CE2 3.89Å; E65-Y69 PolarHBondContact O-N 2.84Å; A66-Y69 PolarHBondContact O-N 3.12Å; F67-Y69 PolarHBondContact O-N 3.39Å; Y69-L71 PolarHBondContact O-N 2.94Å; Y69-V72 PolarHBondContact O-N 3.22Å; Y69-H73 PolarHBondContact O-CD2 2.84Å; Y69-H73 VanDerWaalsContact O-CD2 3.31Å; Y69-H73 PolarHBondContact O-N 2.89Å; Y69-F98 HydrophobicContact CE1-CE1 4.15Å; Y69-F98 HydrophobicContact CE2-CE1 4.08Å; Y69-F98 HydrophobicContact CE2-CZ 4.02Å; Y69-F98 AromaticContact CZ-CE1 3.73Å; Y69-F98 AromaticContact CZ-CZ 3.88Å
70A97.9Very high95.6Very high0 Ų030 Ų300%015%0.148CC..Hα-helixtrans-56.1-38.2175.100000111.2A66 F67 D74 H75 Y78 A79A66-A70 PolarHBondContact O-N 3.31Å; F67-A70 WeakPolarHBondContact O-CB 3.3Å; F67-A70 PolarHBondContact O-N 2.97Å; A70-D74 CarbonylContact O-C 3.51Å; A70-D74 WeakPolarHBondContact O-CA 3.24Å; A70-D74 PolarHBondContact O-N 3.37Å; A70-H75 HydrophobicContact CB-CB 4.18Å; A70-H75 PolarHBondContact O-N 3.41Å; A70-Y78 HydrophobicContact CB-CD1 3.88Å; A70-Y78 HydrophobicContact CB-CG 4.42Å; A70-A79 HydrophobicContact CB-CB 4.29Å
71L96.5Very high96.3Very high0 Ų030.4 Ų30.40%014%0.143CC..Hα-helixtrans-73.1-45.6-178.9-163.3133.6000112.5F67 L68 Y69 H73 D74 V111 A112 R117 I120 I124F67-L71 HydrophobicContact CE1-CD1 3.83Å; F67-L71 HydrophobicContact CZ-CD1 3.81Å; F67-L71 WeakPolarHBondContact O-CB 3.26Å; F67-L71 PolarHBondContact O-N 3.37Å; L68-L71 PolarHBondContact O-N 2.9Å; Y69-L71 PolarHBondContact O-N 2.94Å; L71-H73 VanDerWaalsContact C-N 3.26Å; L71-H73 PolarHBondContact O-N 3.4Å; L71-D74 PolarHBondContact O-N 3.49Å; L71-V111 VanDerWaalsContact CD2-C 3.47Å; L71-V111 HydrophobicContact CD2-CB 3.55Å; L71-V111 HydrophobicContact CD2-CG1 3.25Å; L71-A112 HydrophobicContact CD1-CB 4.05Å; L71-A112 HydrophobicContact CD2-CB 4.05Å; L71-A112 VanDerWaalsContact CD2-N 3.3Å; L71-A112 HydrophobicContact CG-CB 4.38Å; L71-R117 VanDerWaalsContact O-CG 3.29Å; L71-R117 WeakPolarHBondContact O-CG 3.44Å; L71-R117 PolarHBondContact O-NE 2.78Å; L71-I120 HydrophobicContact CD1-CG2 3.64Å; L71-I120 HydrophobicContact CG-CG2 4.17Å; L71-I124 HydrophobicContact CD1-CD1 3.6Å
72V95.3Very high96.7Very high39 Ų3930.3 Ų30.324%0.23614%0.142CC..Hα-helixtrans-58.4-41.3174.7171.40000110.8L68 Y69 V111 Y115 R117L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.28Å; Y69-V72 PolarHBondContact O-N 3.22Å; V72-V111 HydrophobicContact CG2-CG1 3.97Å; V72-Y115 HydrophobicContact CG1-CE2 4.44Å; V72-Y115 HydrophobicContact CG2-CD2 4.34Å; V72-Y115 HydrophobicContact CG2-CE2 3.93Å; V72-R117 PolarHBondContact O-NH2 3.07Å
73H97Very high96.9Very high39 Ų3928.1 Ų28.118%0.18113%0.128CC..THydrogen-bonded Turntrans-94.96.5-174.9-65.4-63000115.5Y29 Y69 L71 H75Y29-H73 AromaticContact CD2-NE2 3.98Å; Y29-H73 AromaticContact CE2-CE1 3.94Å; Y29-H73 AromaticContact CE2-NE2 3.11Å; Y29-H73 WeakPolarHBondContact CE2-NE2 3.42Å; Y29-H73 AromaticContact CZ-CE1 3.86Å; Y29-H73 AromaticContact CZ-NE2 3.47Å; Y29-H73 PolarHBondContact OH-CE1 3.49Å; Y29-H73 PolarHBondContact OH-NE2 3.02Å; Y69-H73 PolarHBondContact O-CD2 2.84Å; Y69-H73 VanDerWaalsContact O-CD2 3.31Å; Y69-H73 PolarHBondContact O-N 2.89Å; L71-H73 VanDerWaalsContact C-N 3.26Å; L71-H73 PolarHBondContact O-N 3.4Å; H73-H75 PolarHBondContact O-N 3.05Å
74D97.6Very high97Very high49 Ų4933.9 Ų33.926%0.26216%0.158SC..THydrogen-bonded Turntrans55.932.1-177.6-143.4-13.5000114.4A70 L71 Q76 R117A70-D74 CarbonylContact O-C 3.51Å; A70-D74 WeakPolarHBondContact O-CA 3.24Å; A70-D74 PolarHBondContact O-N 3.37Å; L71-D74 PolarHBondContact O-N 3.49Å; D74-Q76 PolarHBondContact O-N 2.87Å; D74-Q76 WeakPolarHBondContact OD1-CG 3.1Å; D74-Q76 PolarHBondContact OD1-NE2 2.93Å; D74-R117 VanDerWaalsContact CB-CZ 3.48Å; D74-R117 VanDerWaalsContact CG-CD 3.43Å; D74-R117 IonicContact OD2-CZ 3.65Å; D74-R117 IonicContact OD2-NE 3.6Å; D74-R117 IonicContact OD2-NH1 2.74Å; D74-R117 PolarHBondContact OD2-NH1 3.27Å
75H98.4Very high97.1Very high7 Ų741.4 Ų41.43%0.03219%0.187CC..  trans-76.575.8176.8-161.3-30.9000110L35 L36 A70 H73 Q77 Y78 A79L35-H75 HydrophobicContact CD2-CB 3.64Å; L36-H75 PolarHBondContact O-NE2 3.39Å; A70-H75 HydrophobicContact CB-CB 4.18Å; A70-H75 PolarHBondContact O-N 3.41Å; H73-H75 PolarHBondContact O-N 3.05Å; H75-Q77 PolarHBondContact O-N 3.5Å; H75-Y78 WeakPolarHBondContact ND1-CB 3.39Å; H75-Y78 PolarHBondContact ND1-N 3.47Å; H75-Y78 VanDerWaalsContact ND1-N 3.2Å; H75-Y78 PolarHBondContact O-N 3.19Å; H75-Y78 VanDerWaalsContact O-N 3.16Å; H75-A79 WeakPolarHBondContact O-CB 3.49Å; H75-A79 PolarHBondContact O-N 2.94Å
76Q98.4Very high97.2Very high67 Ų6743.6 Ų43.631%0.31320%0.195SC..Hα-helixtrans-60.9-32.5-172.3-64.1178.819.600113.2D74 R80 I120 M123D74-Q76 PolarHBondContact O-N 2.87Å; D74-Q76 WeakPolarHBondContact OD1-CG 3.1Å; D74-Q76 PolarHBondContact OD1-NE2 2.93Å; Q76-R80 VanDerWaalsContact O-CB 3.25Å; Q76-R80 WeakPolarHBondContact O-CB 3.39Å; Q76-R80 PolarHBondContact O-N 3.27Å; Q76-R80 PolarHBondContact O-NH1 3.06Å; Q76-I120 HydrophobicContact CG-CD1 4.28Å; Q76-I120 HydrophobicContact CG-CG1 4.06Å; Q76-M123 HydrophobicContact CB-CE 4.39Å
77Q98.4Very high97.1Very high135 Ų13544.9 Ų44.963%0.63120%0.204SC*.Hα-helixtrans-69.2-44.3178.2-63.7-178.242.900110.6V38 H75 R80 Y81V38-Q77 HydrophobicContact CG2-CB 4.21Å; H75-Q77 PolarHBondContact O-N 3.5Å; Q77-R80 PolarHBondContact O-N 3.47Å; Q77-Y81 WeakPolarHBondContact O-CB 3.42Å; Q77-Y81 PolarHBondContact O-N 3.15Å
78Y98.6Very high96.8Very high0 Ų047.1 Ų47.10%022%0.218CC..Hα-helixtrans-70.1-41.8178.2-167.7-145.7000112F28 V32 V38 L41 E42 R45 A66 A70 H75 R80 Y81 L82F28-Y78 HydrophobicContact CZ-CE1 4.15Å; V32-Y78 HydrophobicContact CG1-CD1 4.48Å; V32-Y78 HydrophobicContact CG2-CD1 4.38Å; V32-Y78 HydrophobicContact CG2-CE1 4.11Å; V38-Y78 HydrophobicContact CG1-CD2 4.16Å; V38-Y78 HydrophobicContact CG2-CD2 4.34Å; L41-Y78 HydrophobicContact CB-CD2 4.39Å; L41-Y78 HydrophobicContact CB-CE1 4.1Å; L41-Y78 HydrophobicContact CB-CE2 3.98Å; L41-Y78 HydrophobicContact CD1-CD1 3.56Å; L41-Y78 HydrophobicContact CD1-CD2 4.14Å; L41-Y78 HydrophobicContact CD1-CE1 3.92Å; L41-Y78 HydrophobicContact CD1-CE2 4.46Å; L41-Y78 HydrophobicContact CD1-CG 3.69Å; E42-Y78 HydrophobicContact CG-CE2 4Å; E42-Y78 WeakPolarHBondContact OE1-CE2 3.06Å; E42-Y78 VanDerWaalsContact OE1-CZ 3.3Å; E42-Y78 PolarHBondContact OE1-OH 3.39Å; R45-Y78 WeakPolarHBondContact CD-OH 3.43Å; A66-Y78 HydrophobicContact CB-CE1 4.09Å; A70-Y78 HydrophobicContact CB-CD1 3.88Å; A70-Y78 HydrophobicContact CB-CG 4.42Å; H75-Y78 WeakPolarHBondContact ND1-CB 3.39Å; H75-Y78 PolarHBondContact ND1-N 3.47Å; H75-Y78 VanDerWaalsContact ND1-N 3.2Å; H75-Y78 PolarHBondContact O-N 3.19Å; H75-Y78 VanDerWaalsContact O-N 3.16Å; Y78-R80 PolarHBondContact O-N 3.33Å; Y78-Y81 HydrophobicContact CD2-CD1 4.26Å; Y78-Y81 HydrophobicContact CE2-CD1 4.22Å; Y78-Y81 PolarHBondContact O-N 3.2Å; Y78-L82 HydrophobicContact CD1-CD1 4.05Å; Y78-L82 HydrophobicContact CD2-CD1 4.16Å; Y78-L82 HydrophobicContact CD2-CG 4.04Å; Y78-L82 HydrophobicContact CE1-CD1 3.87Å; Y78-L82 HydrophobicContact CE2-CD1 3.97Å; Y78-L82 HydrophobicContact CE2-CD2 3.91Å; Y78-L82 HydrophobicContact CE2-CG 3.83Å; Y78-L82 HydrophobicContact CG-CD1 4.18Å; Y78-L82 WeakPolarHBondContact O-CG 3.48Å; Y78-L82 PolarHBondContact O-N 3.2Å
79A98.4Very high96.7Very high0 Ų053.1 Ų53.10%024%0.239CC..Hα-helixtrans-53.2-50.2170.800000112.2F67 A70 H75 Y81 L82 L83 I120 M123F67-A79 HydrophobicContact CD2-CB 4.18Å; F67-A79 HydrophobicContact CE2-CB 3.68Å; A70-A79 HydrophobicContact CB-CB 4.29Å; H75-A79 WeakPolarHBondContact O-CB 3.49Å; H75-A79 PolarHBondContact O-N 2.94Å; A79-Y81 PolarHBondContact O-N 3.41Å; A79-L82 PolarHBondContact O-N 3.39Å; A79-L83 WeakPolarHBondContact O-CB 3.36Å; A79-L83 VanDerWaalsContact O-CG 3.31Å; A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.29Å; A79-I120 HydrophobicContact CB-CD1 4.03Å; A79-I120 HydrophobicContact CB-CG1 4.15Å; A79-I120 HydrophobicContact CB-CG2 4.01Å; A79-M123 HydrophobicContact CB-CE 4.08Å
80R98.4Very high96.8Very high104 Ų10451.2 Ų51.239%0.39223%0.232SC..Hα-helixtrans-61.3-44177.3-176.1176.8-66.299.70.7111.9Q76 Q77 Y78 N84 M123Q76-R80 VanDerWaalsContact O-CB 3.25Å; Q76-R80 WeakPolarHBondContact O-CB 3.39Å; Q76-R80 PolarHBondContact O-N 3.27Å; Q76-R80 PolarHBondContact O-NH1 3.06Å; Q77-R80 PolarHBondContact O-N 3.47Å; Y78-R80 PolarHBondContact O-N 3.33Å; R80-N84 VanDerWaalsContact O-CB 3.26Å; R80-N84 WeakPolarHBondContact O-CB 3.15Å; R80-N84 PolarHBondContact O-N 2.82Å; R80-M123 HydrophobicContact CB-SD 3.75Å; R80-M123 HydrophobicContact CG-SD 4.2Å
81Y98.5Very high96.6Very high77 Ų7751.3 Ų51.330%0.30223%0.233SC..Hα-helixtrans-59.9-49.6177.2170.8-90.7000111.2V38 E42 Q77 Y78 A79 L83 N84 R85 Y86V38-Y81 HydrophobicContact CG1-CD1 3.63Å; V38-Y81 HydrophobicContact CG1-CD2 3.55Å; V38-Y81 HydrophobicContact CG1-CE1 4.15Å; V38-Y81 HydrophobicContact CG1-CE2 4.05Å; V38-Y81 HydrophobicContact CG1-CG 3.31Å; E42-Y81 HydrophobicContact CG-CD1 4.11Å; E42-Y81 HydrophobicContact CG-CE1 3.38Å; E42-Y81 WeakPolarHBondContact OE2-CE1 3.45Å; Q77-Y81 WeakPolarHBondContact O-CB 3.42Å; Q77-Y81 PolarHBondContact O-N 3.15Å; Y78-Y81 HydrophobicContact CD2-CD1 4.26Å; Y78-Y81 HydrophobicContact CE2-CD1 4.22Å; Y78-Y81 PolarHBondContact O-N 3.2Å; A79-Y81 PolarHBondContact O-N 3.41Å; Y81-L83 PolarHBondContact O-N 2.83Å; Y81-N84 PolarHBondContact O-N 3.18Å; Y81-R85 HydrophobicContact CE1-CB 4.32Å; Y81-R85 HydrophobicContact CE1-CG 4.46Å; Y81-R85 HydrophobicContact CE2-CB 4.44Å; Y81-R85 WeakPolarHBondContact O-CB 3.44Å; Y81-R85 PolarHBondContact O-N 2.89Å; Y81-Y86 HydrophobicContact CE1-CE2 4.09Å
82L98.3Very high96.4Very high0 Ų055.9 Ų55.90%025%0.254CS..Hα-helixtrans-62.2-46.6-177.8-70.1169.9000111.4P63 A66 F67 Y78 A79 R85 Y86 A90P63-L82 HydrophobicContact CB-CD2 4.38Å; A66-L82 HydrophobicContact CB-CD1 4.06Å; F67-L82 HydrophobicContact CB-CD1 3.84Å; F67-L82 HydrophobicContact CD2-CB 4.34Å; F67-L82 HydrophobicContact CD2-CD1 4.28Å; Y78-L82 HydrophobicContact CD1-CD1 4.05Å; Y78-L82 HydrophobicContact CD2-CD1 4.16Å; Y78-L82 HydrophobicContact CD2-CG 4.04Å; Y78-L82 HydrophobicContact CE1-CD1 3.87Å; Y78-L82 HydrophobicContact CE2-CD1 3.97Å; Y78-L82 HydrophobicContact CE2-CD2 3.91Å; Y78-L82 HydrophobicContact CE2-CG 3.83Å; Y78-L82 HydrophobicContact CG-CD1 4.18Å; Y78-L82 WeakPolarHBondContact O-CG 3.48Å; Y78-L82 PolarHBondContact O-N 3.2Å; A79-L82 PolarHBondContact O-N 3.39Å; L82-R85 PolarHBondContact O-N 2.88Å; L82-Y86 HydrophobicContact CD2-CD2 3.92Å; L82-Y86 HydrophobicContact CD2-CE2 3.9Å; L82-Y86 WeakPolarHBondContact O-CB 3.4Å; L82-Y86 PolarHBondContact O-N 3.25Å; L82-A90 HydrophobicContact CB-CB 4.43Å
83L97.6Very high96.1Very high6 Ų657.7 Ų57.73%0.03126%0.261CS..Hα-helixtrans-63.6-43.8177.6-68.8170.5000112.1F67 A79 Y81 S87 A90 L91 M123 I124F67-L83 HydrophobicContact CD2-CG 4.39Å; F67-L83 HydrophobicContact CE1-CD2 4.22Å; F67-L83 HydrophobicContact CE2-CD1 3.77Å; F67-L83 HydrophobicContact CE2-CD2 4.11Å; F67-L83 HydrophobicContact CE2-CG 3.75Å; F67-L83 HydrophobicContact CZ-CD1 3.82Å; F67-L83 HydrophobicContact CZ-CD2 3.89Å; F67-L83 HydrophobicContact CZ-CG 3.97Å; A79-L83 WeakPolarHBondContact O-CB 3.36Å; A79-L83 VanDerWaalsContact O-CG 3.31Å; A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.29Å; Y81-L83 PolarHBondContact O-N 2.83Å; L83-S87 WeakPolarHBondContact O-CA 3.47Å; L83-S87 PolarHBondContact O-N 3.35Å; L83-A90 HydrophobicContact CD2-CB 4.17Å; L83-L91 HydrophobicContact CD2-CD1 4.37Å; L83-L91 HydrophobicContact CD2-CD2 3.76Å; L83-L91 HydrophobicContact CD2-CG 4.04Å; L83-M123 HydrophobicContact CD1-CB 3.55Å; L83-I124 HydrophobicContact CD1-CG1 4.38Å
84N96.9Very high95.7Very high131 Ų13156.2 Ų56.270%0.70126%0.255SS*.Hα-helixtrans-70.4-37.1179.9-72.5-7.4000112.6R80 Y81R80-N84 VanDerWaalsContact O-CB 3.26Å; R80-N84 WeakPolarHBondContact O-CB 3.15Å; R80-N84 PolarHBondContact O-N 2.82Å; Y81-N84 PolarHBondContact O-N 3.18Å
85R96.9Very high95.1Very high160 Ų16055.1 Ų55.160%0.60425%0.251SS*.Hα-helixtrans-81.5-36.8-174.4-176.763.1-179.9108.1-5.8112.7Y81 L82Y81-R85 HydrophobicContact CE1-CB 4.32Å; Y81-R85 HydrophobicContact CE1-CG 4.46Å; Y81-R85 HydrophobicContact CE2-CB 4.44Å; Y81-R85 WeakPolarHBondContact O-CB 3.44Å; Y81-R85 PolarHBondContact O-N 2.89Å; L82-R85 PolarHBondContact O-N 2.88Å
86Y95.6Very high94.2Very high48 Ų4861.8 Ų61.819%0.18828%0.276CS..Hα-helixtrans-115.3-13-171-60-73.7000113.7E42 R45 P63 Y81 L82 V88 R89E42-Y86 PolarHBondContact OE2-OH 2.98Å; R45-Y86 PolarHBondContact NH2-OH 3.09Å; P63-Y86 HydrophobicContact CB-CD1 4.29Å; P63-Y86 HydrophobicContact CB-CD2 3.74Å; P63-Y86 HydrophobicContact CB-CE2 4.31Å; P63-Y86 HydrophobicContact CB-CG 3.74Å; P63-Y86 HydrophobicContact CG-CD1 3.73Å; P63-Y86 HydrophobicContact CG-CD2 3.94Å; P63-Y86 HydrophobicContact CG-CE1 4Å; P63-Y86 HydrophobicContact CG-CE2 4.2Å; P63-Y86 HydrophobicContact CG-CG 3.72Å; Y81-Y86 HydrophobicContact CE1-CE2 4.09Å; L82-Y86 HydrophobicContact CD2-CD2 3.92Å; L82-Y86 HydrophobicContact CD2-CE2 3.9Å; L82-Y86 WeakPolarHBondContact O-CB 3.4Å; L82-Y86 PolarHBondContact O-N 3.25Å; Y86-V88 PolarHBondContact O-N 3Å; Y86-R89 WeakPolarHBondContact O-CB 3.3Å; Y86-R89 PolarHBondContact O-N 2.82Å
87S93.3Very high93.2Very high27 Ų2761.9 Ų61.919%0.18928%0.284CS..G310 helixtrans49-124.4176176.70000111.3L83 R89 A90 D130L83-S87 WeakPolarHBondContact O-CA 3.47Å; L83-S87 PolarHBondContact O-N 3.35Å; S87-R89 PolarHBondContact O-N 3.3Å; S87-R89 VanDerWaalsContact O-N 3.07Å; S87-A90 WeakPolarHBondContact O-CB 3.43Å; S87-A90 PolarHBondContact O-N 2.97Å; S87-D130 WeakPolarHBondContact CB-OD2 3.45Å; S87-D130 VanDerWaalsContact OG-CB 3.26Å; S87-D130 WeakPolarHBondContact OG-CB 3.26Å; S87-D130 VanDerWaalsContact OG-CG 3.3Å; S87-D130 PolarHBondContact OG-OD2 3.1Å
88V91.1Very high92.1Very high47 Ų4757.8 Ų57.829%0.28526%0.264SS..G310 helixtrans-48.8-36.5178.4-174.90000112.1Y86 A90 L91 E92 D130 F131Y86-V88 PolarHBondContact O-N 3Å; V88-A90 VanDerWaalsContact C-N 3.29Å; V88-A90 PolarHBondContact O-N 3.11Å; V88-L91 CarbonylContact O-C 3.31Å; V88-L91 WeakPolarHBondContact O-CA 3.49Å; V88-L91 PolarHBondContact O-N 3.49Å; V88-E92 PolarHBondContact O-N 2.79Å; V88-D130 HydrophobicContact CG2-CB 4.19Å; V88-F131 HydrophobicContact CB-CE2 4.11Å; V88-F131 HydrophobicContact CB-CZ 4.3Å; V88-F131 HydrophobicContact CG1-CE1 4.16Å; V88-F131 HydrophobicContact CG1-CE2 4.07Å; V88-F131 HydrophobicContact CG1-CZ 3.8Å; V88-F131 HydrophobicContact CG2-CD2 3.84Å; V88-F131 HydrophobicContact CG2-CE2 3.73Å; V88-F131 HydrophobicContact CG2-CZ 4.33Å
89R93.4Very high91Very high139 Ų13959.1 Ų59.153%0.52527%0.273SS..G310 helixtrans-67.7-25.1-179.3-59.9-178.664.2-171.2-1.4114Y86 S87 L91Y86-R89 WeakPolarHBondContact O-CB 3.3Å; Y86-R89 PolarHBondContact O-N 2.82Å; S87-R89 PolarHBondContact O-N 3.3Å; S87-R89 VanDerWaalsContact O-N 3.07Å; R89-L91 PolarHBondContact O-N 3.31Å
90A96.1Very high89.7Confident0 Ų062.2 Ų62.20%029%0.294CS..G310 helixtrans-73.9-11.9172.400000112.4S64 F67 L82 L83 S87 V88S64-A90 WeakPolarHBondContact CA-O 3.42Å; F67-A90 WeakPolarHBondContact CD1-O 3.39Å; L82-A90 HydrophobicContact CB-CB 4.43Å; L83-A90 HydrophobicContact CD2-CB 4.17Å; S87-A90 WeakPolarHBondContact O-CB 3.43Å; S87-A90 PolarHBondContact O-N 2.97Å; V88-A90 VanDerWaalsContact C-N 3.29Å; V88-A90 PolarHBondContact O-N 3.11Å
91L94.9Very high88.4Confident3 Ų358.9 Ų58.92%0.01629%0.286CS..SBendtrans-115.42.9-176.9-60.4-177.8000113.1F67 L83 V88 R89 H108 I124 S127 L128 F131 Y139F67-L91 HydrophobicContact CD1-CD2 4.03Å; F67-L91 HydrophobicContact CE1-CD2 3.6Å; F67-L91 HydrophobicContact CZ-CD2 4.44Å; L83-L91 HydrophobicContact CD2-CD1 4.37Å; L83-L91 HydrophobicContact CD2-CD2 3.76Å; L83-L91 HydrophobicContact CD2-CG 4.04Å; V88-L91 CarbonylContact O-C 3.31Å; V88-L91 WeakPolarHBondContact O-CA 3.49Å; V88-L91 PolarHBondContact O-N 3.49Å; R89-L91 PolarHBondContact O-N 3.31Å; L91-H108 HydrophobicContact CD2-CB 4.42Å; L91-H108 PolarHBondContact O-CE1 2.96Å; L91-I124 HydrophobicContact CD1-CG2 4.06Å; L91-I124 HydrophobicContact CD2-CG1 4.2Å; L91-I124 HydrophobicContact CD2-CG2 4.04Å; L91-S127 WeakPolarHBondContact CD1-OG 3.33Å; L91-L128 HydrophobicContact CD1-CD2 4Å; L91-F131 HydrophobicContact CB-CZ 4.12Å; L91-F131 HydrophobicContact CD1-CE2 3.95Å; L91-F131 HydrophobicContact CD1-CZ 3.96Å; L91-Y139 HydrophobicContact CB-CE2 3.99Å; L91-Y139 HydrophobicContact CD1-CE1 4.5Å; L91-Y139 WeakPolarHBondContact CD2-OH 3.22Å; L91-Y139 WeakPolarHBondContact O-CE2 3.08Å
92E92.2Very high86.7Confident95 Ų9562.5 Ų62.544%0.44431%0.306SS..SBendtrans-59162.7175.6-82.5173-178.400112.5S64 V88 P94 H108S64-E92 PolarHBondContact OG-O 2.88Å; V88-E92 PolarHBondContact O-N 2.79Å; E92-P94 WeakPolarHBondContact O-CD 3.33Å; E92-H108 PolarHBondContact O-CE1 2.69Å; E92-H108 VanDerWaalsContact O-CE1 3.29Å
93M89.1Confident84.9Confident78 Ų7867.1 Ų67.138%0.38434%0.344SS..PPolyproline II helixtrans-65.3124.8174.1-164.166.5179.500109.7C99 S104 T106M93-C99 HydrophobicContact CE-CB 4.49Å; M93-C99 VanDerWaalsContact CE-SG 3.59Å; M93-S104 WeakPolarHBondContact CE-O 3.25Å; M93-S104 WeakPolarHBondContact CE-OG 3.27Å; M93-T106 HydrophobicContact CB-CG2 4.32Å; M93-T106 VanDerWaalsContact SD-CA 3.59Å; M93-T106 HydrophobicContact SD-CG2 3.81Å; M93-T106 PolarHBondContact SD-N 3.22Å
94P88.1Confident83.4Confident8 Ų867.7 Ų67.75%0.05235%0.349CS..PPolyproline II helixtrans-73.2171.5-179.934.4-38.4000110.8E65 L68 E92 F98 C99 P107E65-P94 HydrophobicContact CG-CB 3.7Å; L68-P94 HydrophobicContact CD1-CB 4.14Å; L68-P94 HydrophobicContact CD1-CG 3.92Å; E92-P94 WeakPolarHBondContact O-CD 3.33Å; P94-F98 HydrophobicContact CB-CB 3.68Å; P94-F98 HydrophobicContact CB-CG 4.36Å; P94-F98 HydrophobicContact CG-CB 3.87Å; P94-C99 PolarHBondContact O-SG 2.84Å; P94-P107 HydrophobicContact CG-CG 4.33Å
95S84.7Confident82.3Confident26 Ų2663 Ų6318%0.18233%0.329CS..PPolyproline II helixtrans-64.7172.1-179.292.70000113.2E53 E65 S97 F98 C99E53-S95 WeakPolarHBondContact OE1-CB 3.28Å; E53-S95 PolarHBondContact OE1-OG 2.96Å; E65-S95 WeakPolarHBondContact OE1-CB 3.47Å; E65-S95 PolarHBondContact OE1-N 3.35Å; E65-S95 PolarHBondContact OE1-OG 3.27Å; S95-S97 PolarHBondContact O-N 3.33Å; S95-S97 PolarHBondContact OG-N 3.43Å; S95-F98 PolarHBondContact O-N 3Å; S95-C99 PolarHBondContact O-N 3.18Å; S95-C99 PolarHBondContact O-SG 3.2Å
96R78.8Confident81.5Confident147 Ų14756.5 Ų56.556%0.55531%0.306SS*.G310 helixtrans-58.6-33.7-179-68.5-177.6-179.61794.4112.4F98 C99 Q102R96-F98 PolarHBondContact O-N 3.43Å; R96-F98 VanDerWaalsContact O-N 3.17Å; R96-C99 PolarHBondContact O-N 3.35Å; R96-C99 VanDerWaalsContact O-N 3.09Å; R96-Q102 VanDerWaalsContact NH2-NE2 3.14Å
97S77.4Confident81.1Confident69 Ų6955.4 Ų55.448%0.48331%0.305SS..G310 helixtrans-62.4-21.8177-50.50000113.3S95S95-S97 PolarHBondContact O-N 3.33Å; S95-S97 PolarHBondContact OG-N 3.43Å
98F76.8Confident81.2Confident48 Ų4854.1 Ų54.121%0.21130%0.296CS..G310 helixtrans-104.2-0.8179.5-75.1-94.4000113.3F61 E65 L68 Y69 P94 S95 R96F61-F98 AromaticContact CD1-CE2 3.85Å; F61-F98 HydrophobicContact CD1-CE2 3.85Å; F61-F98 AromaticContact CD1-CZ 3.71Å; F61-F98 HydrophobicContact CD1-CZ 3.71Å; F61-F98 AromaticContact CE1-CE2 3.61Å; F61-F98 HydrophobicContact CE1-CE2 3.61Å; F61-F98 AromaticContact CE1-CZ 3.35Å; F61-F98 HydrophobicContact CE1-CZ 3.35Å; F61-F98 HydrophobicContact CZ-CZ 4.34Å; E65-F98 HydrophobicContact CB-CD1 4.38Å; E65-F98 HydrophobicContact CB-CD2 4.25Å; E65-F98 HydrophobicContact CB-CE1 4.09Å; E65-F98 HydrophobicContact CB-CE2 3.95Å; E65-F98 HydrophobicContact CB-CG 4.46Å; E65-F98 HydrophobicContact CB-CZ 3.87Å; E65-F98 HydrophobicContact CG-CB 4.48Å; E65-F98 HydrophobicContact CG-CD1 4.21Å; E65-F98 HydrophobicContact CG-CD2 3.54Å; E65-F98 HydrophobicContact CG-CE1 4.33Å; E65-F98 HydrophobicContact CG-CE2 3.69Å; E65-F98 HydrophobicContact CG-CG 3.82Å; E65-F98 HydrophobicContact CG-CZ 4.09Å; L68-F98 HydrophobicContact CD1-CB 4.5Å; L68-F98 HydrophobicContact CD1-CD1 4.16Å; Y69-F98 HydrophobicContact CE1-CE1 4.15Å; Y69-F98 HydrophobicContact CE2-CE1 4.08Å; Y69-F98 HydrophobicContact CE2-CZ 4.02Å; Y69-F98 AromaticContact CZ-CE1 3.73Å; Y69-F98 AromaticContact CZ-CZ 3.88Å; P94-F98 HydrophobicContact CB-CB 3.68Å; P94-F98 HydrophobicContact CB-CG 4.36Å; P94-F98 HydrophobicContact CG-CB 3.87Å; S95-F98 PolarHBondContact O-N 3Å; R96-F98 PolarHBondContact O-N 3.43Å; R96-F98 VanDerWaalsContact O-N 3.17Å
99C74.1Confident81.4Confident28 Ų2851.9 Ų51.919%0.18928%0.283CS..  trans-113.8139.3-178-61.60000110.6M93 P94 S95 R96 C101M93-C99 HydrophobicContact CE-CB 4.49Å; M93-C99 VanDerWaalsContact CE-SG 3.59Å; P94-C99 PolarHBondContact O-SG 2.84Å; S95-C99 PolarHBondContact O-N 3.18Å; S95-C99 PolarHBondContact O-SG 3.2Å; R96-C99 PolarHBondContact O-N 3.35Å; R96-C99 VanDerWaalsContact O-N 3.09Å; C99-C101 VanDerWaalsContact C-N 3.3Å; C99-C101 PolarHBondContact O-N 2.87Å
100C71.9Confident81.4Confident65 Ų6546 Ų4644%0.43926%0.262SS..SBendtrans-64.5-35.6169.9600000112.1C145 V148C100-C145 HydrophobicContact CB-CB 4.18Å; C100-C145 WeakPolarHBondContact CB-SG 3.5Å; C100-C145 WeakPolarHBondContact SG-CB 3.45Å; C100-C145 CovalentContact SG-SG 2Å; C100-C145 PolarHBondContact SG-SG 3.49Å; C100-V148 HydrophobicContact CB-CG2 4.15Å
101C70.9Confident81.3Confident35 Ų3547.1 Ų47.124%0.23627%0.269CS..  trans-165.6158.2-177.466.40000111.4C99 A103 S104 C145C99-C101 VanDerWaalsContact C-N 3.3Å; C99-C101 PolarHBondContact O-N 2.87Å; C101-A103 PolarHBondContact O-N 3.43Å; C101-S104 WeakPolarHBondContact O-CB 2.95Å; C101-S104 PolarHBondContact O-N 2.94Å; C101-S104 VanDerWaalsContact O-N 3.11Å; C101-S104 PolarHBondContact O-OG 3.01Å; C101-C145 VanDerWaalsContact SG-SG 3.66Å
102Q63Low81.4Confident152 Ų15247 Ų4771%0.7127%0.268SS*.THydrogen-bonded Turntrans-65.1-20.8-177.7-66.2175.613.400114.2R96 S104R96-Q102 VanDerWaalsContact NH2-NE2 3.14Å; Q102-S104 VanDerWaalsContact C-N 3.32Å
103A59.4Low81.6Confident98 Ų9842.4 Ų42.481%0.8125%0.247SC*.THydrogen-bonded Turntrans-89.23.7178.100000113.3C101C101-A103 PolarHBondContact O-N 3.43Å
104S66.8Low81.8Confident18 Ų1841.9 Ų41.913%0.12624%0.241CC..PPolyproline II helixtrans-75.1150.5176.760.40000111M93 C101 Q102M93-S104 WeakPolarHBondContact CE-O 3.25Å; M93-S104 WeakPolarHBondContact CE-OG 3.27Å; C101-S104 WeakPolarHBondContact O-CB 2.95Å; C101-S104 PolarHBondContact O-N 2.94Å; C101-S104 VanDerWaalsContact O-N 3.11Å; C101-S104 PolarHBondContact O-OG 3.01Å; Q102-S104 VanDerWaalsContact C-N 3.32Å
105A73.9Confident82.2Confident33 Ų3346.6 Ų46.627%0.27326%0.258SS..PPolyproline II helixtrans-89.5170.5168.100000110.5R143A105-R143 WeakPolarHBondContact CB-O 3.29Å
106T80.1Confident82.8Confident22 Ų2248.8 Ų48.814%0.13527%0.268CS..PPolyproline II helixtrans-56.8124.6-177.3550000111.3M93 H108 Y139M93-T106 HydrophobicContact CB-CG2 4.32Å; M93-T106 VanDerWaalsContact SD-CA 3.59Å; M93-T106 HydrophobicContact SD-CG2 3.81Å; M93-T106 PolarHBondContact SD-N 3.22Å; T106-H108 PolarHBondContact O-N 3.47Å; T106-Y139 HydrophobicContact CG2-CD2 4.49Å; T106-Y139 HydrophobicContact CG2-CE2 4.09Å; T106-Y139 WeakPolarHBondContact OG1-CE2 3.4Å
107P88.1Confident83.6Confident26 Ų2644.4 Ų44.417%0.16925%0.251CS..  trans-82.5-9.2-168.730.8-35000114.5L68 P94 L109 T110 V111L68-P107 HydrophobicContact CD1-CG 4.09Å; L68-P107 HydrophobicContact CD2-CG 4Å; P94-P107 HydrophobicContact CG-CG 4.33Å; P107-L109 PolarHBondContact O-N 2.86Å; P107-T110 PolarHBondContact O-N 3.38Å; P107-T110 VanDerWaalsContact O-N 3.13Å; P107-T110 PolarHBondContact O-OG1 3.23Å; P107-V111 HydrophobicContact CB-CG2 3.99Å; P107-V111 WeakPolarHBondContact O-CB 3.33Å; P107-V111 VanDerWaalsContact O-CG2 3.23Å; P107-V111 WeakPolarHBondContact O-CG2 3.23Å; P107-V111 PolarHBondContact O-N 3.14Å
108H94.1Very high84.5Confident0 Ų043.8 Ų43.80%024%0.242CC..Hα-helixtrans-53.3-47.5-168.9-51.9100.8000114.3S64 F67 L68 L91 E92 T106 V111 A112 I124 Y139S64-H108 PolarHBondContact OG-CE1 3.13Å; S64-H108 VanDerWaalsContact OG-CE1 3.22Å; S64-H108 PolarHBondContact OG-NE2 2.54Å; F67-H108 AromaticContact CD1-CD2 3.47Å; F67-H108 VanDerWaalsContact CD1-CD2 3.47Å; F67-H108 WeakPolarHBondContact CD1-CD2 3.19Å; F67-H108 HydrophobicContact CE1-CB 4.34Å; F67-H108 AromaticContact CE1-CD2 3.89Å; L68-H108 VanDerWaalsContact CD2-CD2 3.47Å; L68-H108 WeakPolarHBondContact CD2-CD2 3.38Å; L91-H108 HydrophobicContact CD2-CB 4.42Å; L91-H108 PolarHBondContact O-CE1 2.96Å; E92-H108 PolarHBondContact O-CE1 2.69Å; E92-H108 VanDerWaalsContact O-CE1 3.29Å; T106-H108 PolarHBondContact O-N 3.47Å; H108-V111 PolarHBondContact O-N 2.85Å; H108-A112 VanDerWaalsContact O-CB 3.3Å; H108-A112 WeakPolarHBondContact O-CB 3.39Å; H108-A112 PolarHBondContact O-N 2.95Å; H108-I124 HydrophobicContact CB-CD1 4.23Å; H108-Y139 WeakPolarHBondContact CB-OH 3.18Å; H108-Y139 PolarHBondContact ND1-OH 2.94Å
109L95.3Very high85.5Confident0 Ų044.5 Ų44.50%025%0.25CS..Hα-helixtrans-65.9-44.1179.6-66.9176.3000111.8P107 V111 A112 V113 L121 I124 L125 Y139 A154 L170P107-L109 PolarHBondContact O-N 2.86Å; L109-V111 PolarHBondContact O-N 3.22Å; L109-A112 PolarHBondContact O-N 3.39Å; L109-V113 WeakPolarHBondContact O-CB 3.4Å; L109-V113 VanDerWaalsContact O-CG2 3.23Å; L109-V113 WeakPolarHBondContact O-CG2 3.48Å; L109-V113 PolarHBondContact O-N 3.14Å; L109-L121 HydrophobicContact CD2-CD1 3.6Å; L109-I124 HydrophobicContact CD2-CG2 3.77Å; L109-L125 HydrophobicContact CD2-CD2 4.13Å; L109-Y139 HydrophobicContact CD1-CD1 3.91Å; L109-Y139 HydrophobicContact CD1-CE1 3.78Å; L109-Y139 HydrophobicContact CD2-CE1 4.32Å; L109-Y139 HydrophobicContact CG-CD1 4.44Å; L109-Y139 HydrophobicContact CG-CE1 3.79Å; L109-A154 HydrophobicContact CB-CB 3.74Å; L109-L170 HydrophobicContact CD2-CD2 4.33Å
110T94Very high86.7Confident16 Ų1643.1 Ų43.110%0.09824%0.241CC..Hα-helixtrans-66.7-38.6-179.856.70000111.4P107 R114 A154 L157P107-T110 PolarHBondContact O-N 3.38Å; P107-T110 VanDerWaalsContact O-N 3.13Å; P107-T110 PolarHBondContact O-OG1 3.23Å; T110-R114 VanDerWaalsContact O-CB 3.23Å; T110-R114 WeakPolarHBondContact O-CB 3.14Å; T110-R114 PolarHBondContact O-N 2.98Å; T110-A154 HydrophobicContact CG2-CB 4.42Å; T110-L157 HydrophobicContact CG2-CD1 3.98Å
111V93.8Very high87.9Confident22 Ų2240 Ų4013%0.13322%0.22CC..Hα-helixtrans-68.1-38.9175.8-176.60000110.5L71 V72 P107 H108 L109 V113 R114 Y115L71-V111 VanDerWaalsContact CD2-C 3.47Å; L71-V111 HydrophobicContact CD2-CB 3.55Å; L71-V111 HydrophobicContact CD2-CG1 3.25Å; V72-V111 HydrophobicContact CG2-CG1 3.97Å; P107-V111 HydrophobicContact CB-CG2 3.99Å; P107-V111 WeakPolarHBondContact O-CB 3.33Å; P107-V111 VanDerWaalsContact O-CG2 3.23Å; P107-V111 WeakPolarHBondContact O-CG2 3.23Å; P107-V111 PolarHBondContact O-N 3.14Å; H108-V111 PolarHBondContact O-N 2.85Å; L109-V111 PolarHBondContact O-N 3.22Å; V111-V113 PolarHBondContact O-N 3.29Å; V111-R114 PolarHBondContact O-N 3.3Å; V111-Y115 HydrophobicContact CG1-CD2 3.6Å; V111-Y115 HydrophobicContact CG1-CE2 3.75Å; V111-Y115 WeakPolarHBondContact O-CD2 3.09Å; V111-Y115 PolarHBondContact O-N 3.22Å
112A96.8Very high89.1Confident0 Ų043.6 Ų43.60%023%0.232CC..Hα-helixtrans-65.3-45.3179.400000110.2L71 H108 L109 R114 N116 R117 L121 I124L71-A112 HydrophobicContact CD1-CB 4.05Å; L71-A112 HydrophobicContact CD2-CB 4.05Å; L71-A112 VanDerWaalsContact CD2-N 3.3Å; L71-A112 HydrophobicContact CG-CB 4.38Å; H108-A112 VanDerWaalsContact O-CB 3.3Å; H108-A112 WeakPolarHBondContact O-CB 3.39Å; H108-A112 PolarHBondContact O-N 2.95Å; L109-A112 PolarHBondContact O-N 3.39Å; A112-R114 VanDerWaalsContact C-N 3.34Å; A112-R114 PolarHBondContact O-N 3.34Å; A112-N116 PolarHBondContact O-N 3.26Å; A112-R117 PolarHBondContact O-N 2.62Å; A112-L121 HydrophobicContact CB-CB 4.1Å; A112-L121 HydrophobicContact CB-CD1 4.19Å; A112-I124 HydrophobicContact CB-CD1 4.32Å
113V96.8Very high90.7Very high0 Ų037.6 Ų37.60%020%0.204CC..Hα-helixtrans-66.7-33.5175.8175.60000111.8L109 V111 L121 A154 L157 A158 R163 C166 L170L109-V113 WeakPolarHBondContact O-CB 3.4Å; L109-V113 VanDerWaalsContact O-CG2 3.23Å; L109-V113 WeakPolarHBondContact O-CG2 3.48Å; L109-V113 PolarHBondContact O-N 3.14Å; V111-V113 PolarHBondContact O-N 3.29Å; V113-L121 HydrophobicContact CG2-CD2 4.16Å; V113-A154 HydrophobicContact CG2-CB 4.15Å; V113-L157 HydrophobicContact CG1-CB 3.8Å; V113-A158 HydrophobicContact CG1-CB 3.92Å; V113-R163 VanDerWaalsContact O-CD 3.25Å; V113-R163 WeakPolarHBondContact O-CD 3.27Å; V113-R163 VanDerWaalsContact O-CZ 3.29Å; V113-R163 PolarHBondContact O-NH1 3.12Å; V113-C166 HydrophobicContact CG1-CB 4.37Å; V113-C166 HydrophobicContact CG2-CB 4.17Å; V113-L170 HydrophobicContact CG2-CD1 3.94Å
114R94.1Very high92.5Very high67 Ų6732.9 Ų32.925%0.25317%0.165SC..Hα-helixtrans-70.3-41177.1174.5-171.4-55-65.8-10.9113.3T110 V111 A112 E149 R163T110-R114 VanDerWaalsContact O-CB 3.23Å; T110-R114 WeakPolarHBondContact O-CB 3.14Å; T110-R114 PolarHBondContact O-N 2.98Å; V111-R114 PolarHBondContact O-N 3.3Å; A112-R114 VanDerWaalsContact C-N 3.34Å; A112-R114 PolarHBondContact O-N 3.34Å; R114-E149 IonicContact CZ-OE1 2.8Å; R114-E149 VanDerWaalsContact CZ-OE1 3.3Å; R114-E149 IonicContact CZ-OE2 2.77Å; R114-E149 IonicContact NH1-OE1 3.49Å; R114-E149 PolarHBondContact NH1-OE1 2.61Å; R114-E149 IonicContact NH1-OE2 2.79Å; R114-E149 IonicContact NH2-OE1 2.98Å; R114-E149 PolarHBondContact NH2-OE1 3.39Å; R114-E149 VanDerWaalsContact NH2-OE1 3.16Å; R114-E149 IonicContact NH2-OE2 3.15Å; R114-E149 PolarHBondContact NH2-OE2 3.35Å; R114-R163 PolarHBondContact O-NH1 3.46Å; R114-R163 PolarHBondContact O-NH2 3.2Å
115Y95.5Very high93.8Very high107 Ų10732.2 Ų32.242%0.4216%0.16SC..Hα-helixtrans-94.75.6-178.9-68.2-73.2000113.9V72 V111 R117V72-Y115 HydrophobicContact CG1-CE2 4.44Å; V72-Y115 HydrophobicContact CG2-CD2 4.34Å; V72-Y115 HydrophobicContact CG2-CE2 3.93Å; V111-Y115 HydrophobicContact CG1-CD2 3.6Å; V111-Y115 HydrophobicContact CG1-CE2 3.75Å; V111-Y115 WeakPolarHBondContact O-CD2 3.09Å; V111-Y115 PolarHBondContact O-N 3.22Å; Y115-R117 VanDerWaalsContact C-N 3.3Å; Y115-R117 PolarHBondContact O-N 3.16Å
116N96.4Very high94.6Very high71 Ų7134.2 Ų34.238%0.3817%0.166SC..THydrogen-bonded Turntrans61.937.1175.7-154.435.6000112.6A112 I118A112-N116 PolarHBondContact O-N 3.26Å; N116-I118 PolarHBondContact O-N 2.66Å
117R97.6Very high95.3Very high56 Ų5633.7 Ų33.721%0.21116%0.163CC..  trans-84.564-176.1-55.3-61.3-176.9-149.8-5110.1L71 V72 D74 A112 Y115 T119 I120 L121L71-R117 VanDerWaalsContact O-CG 3.29Å; L71-R117 WeakPolarHBondContact O-CG 3.44Å; L71-R117 PolarHBondContact O-NE 2.78Å; V72-R117 PolarHBondContact O-NH2 3.07Å; D74-R117 VanDerWaalsContact CB-CZ 3.48Å; D74-R117 VanDerWaalsContact CG-CD 3.43Å; D74-R117 IonicContact OD2-CZ 3.65Å; D74-R117 IonicContact OD2-NE 3.6Å; D74-R117 IonicContact OD2-NH1 2.74Å; D74-R117 PolarHBondContact OD2-NH1 3.27Å; A112-R117 PolarHBondContact O-N 2.62Å; Y115-R117 VanDerWaalsContact C-N 3.3Å; Y115-R117 PolarHBondContact O-N 3.16Å; R117-T119 VanDerWaalsContact C-N 3.31Å; R117-T119 PolarHBondContact O-N 2.82Å; R117-I120 HydrophobicContact CB-CB 4.06Å; R117-I120 HydrophobicContact CB-CD1 4.34Å; R117-I120 HydrophobicContact CB-CG1 4.39Å; R117-I120 PolarHBondContact O-N 3Å; R117-I120 VanDerWaalsContact O-N 3.1Å; R117-L121 WeakPolarHBondContact O-CB 3.45Å; R117-L121 PolarHBondContact O-N 2.65Å
118I95.7Very high95.4Very high55 Ų5532.6 Ų32.628%0.28216%0.156SC..Hα-helixtrans-54.8-46.2-172.6-62.1167.8000111.2N116 I120 L121 K122 E165 L169N116-I118 PolarHBondContact O-N 2.66Å; I118-I120 PolarHBondContact O-N 2.94Å; I118-L121 PolarHBondContact O-N 2.76Å; I118-K122 PolarHBondContact O-N 3.35Å; I118-E165 HydrophobicContact CD1-CB 3.74Å; I118-E165 HydrophobicContact CD1-CG 4.13Å; I118-E165 HydrophobicContact CG1-CB 4.28Å; I118-E165 HydrophobicContact CG2-CB 4.44Å; I118-L169 HydrophobicContact CG2-CD1 3.8Å
119T97.6Very high95.2Very high63 Ų6340.4 Ų40.439%0.38719%0.19SC..Hα-helixtrans-63.7-41.9179.4-53.10000111.9R117 K122 M123R117-T119 VanDerWaalsContact C-N 3.31Å; R117-T119 PolarHBondContact O-N 2.82Å; T119-K122 PolarHBondContact O-N 3.07Å; T119-M123 HydrophobicContact CG2-CE 4.38Å; T119-M123 WeakPolarHBondContact O-CG 3.02Å; T119-M123 PolarHBondContact O-N 3.21Å; T119-M123 VanDerWaalsContact O-N 3.1Å
120I98.3Very high95Very high0 Ų044.6 Ų44.60%021%0.212CC..Hα-helixtrans-71.8-39178-55.4178.6000111F67 L71 Q76 A79 R117 I118 K122 M123 I124F67-I120 HydrophobicContact CE2-CG2 3.96Å; F67-I120 HydrophobicContact CZ-CG2 3.78Å; L71-I120 HydrophobicContact CD1-CG2 3.64Å; L71-I120 HydrophobicContact CG-CG2 4.17Å; Q76-I120 HydrophobicContact CG-CD1 4.28Å; Q76-I120 HydrophobicContact CG-CG1 4.06Å; A79-I120 HydrophobicContact CB-CD1 4.03Å; A79-I120 HydrophobicContact CB-CG1 4.15Å; A79-I120 HydrophobicContact CB-CG2 4.01Å; R117-I120 HydrophobicContact CB-CB 4.06Å; R117-I120 HydrophobicContact CB-CD1 4.34Å; R117-I120 HydrophobicContact CB-CG1 4.39Å; R117-I120 PolarHBondContact O-N 3Å; R117-I120 VanDerWaalsContact O-N 3.1Å; I118-I120 PolarHBondContact O-N 2.94Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 3.08Å; I120-M123 HydrophobicContact CB-CE 4.06Å; I120-M123 HydrophobicContact CG1-CE 3.69Å; I120-M123 HydrophobicContact CG2-CE 4.36Å; I120-M123 WeakPolarHBondContact O-CB 3.43Å; I120-M123 PolarHBondContact O-N 3.19Å; I120-M123 VanDerWaalsContact O-N 3.12Å; I120-I124 HydrophobicContact CG2-CD1 4.38Å; I120-I124 WeakPolarHBondContact O-CG1 3.27Å; I120-I124 PolarHBondContact O-N 3.14Å
121L97.8Very high95Very high0 Ų045.1 Ų45.10%021%0.213CC..Hα-helixtrans-56.6-46.4173.2177.361.1000110.9L109 A112 V113 R117 I118 M123 I124 L125 C166 L169 L170L109-L121 HydrophobicContact CD2-CD1 3.6Å; A112-L121 HydrophobicContact CB-CB 4.1Å; A112-L121 HydrophobicContact CB-CD1 4.19Å; V113-L121 HydrophobicContact CG2-CD2 4.16Å; R117-L121 WeakPolarHBondContact O-CB 3.45Å; R117-L121 PolarHBondContact O-N 2.65Å; I118-L121 PolarHBondContact O-N 2.76Å; L121-M123 PolarHBondContact O-N 3.22Å; L121-I124 WeakPolarHBondContact O-CB 3.38Å; L121-I124 PolarHBondContact O-N 2.8Å; L121-L125 HydrophobicContact CD1-CD1 4.14Å; L121-L125 HydrophobicContact CD1-CG 4.26Å; L121-L125 HydrophobicContact CG-CD1 4.06Å; L121-L125 VanDerWaalsContact O-CG 3.3Å; L121-L125 WeakPolarHBondContact O-CG 3.41Å; L121-L125 PolarHBondContact O-N 3.42Å; L121-C166 HydrophobicContact CD2-CB 3.92Å; L121-L169 HydrophobicContact CD2-CB 4.42Å; L121-L169 HydrophobicContact CD2-CD1 4.25Å; L121-L169 HydrophobicContact CG-CD1 4.5Å; L121-L170 HydrophobicContact CD1-CD2 4.27Å
122K95.4Very high94.9Very high110 Ų11046.5 Ų46.548%0.47822%0.224SC..Hα-helixtrans-58.7-46.4174.1-175.6174.4179.5175.50111.5I118 T119 I120 I124 L125 D126 L169I118-K122 PolarHBondContact O-N 3.35Å; T119-K122 PolarHBondContact O-N 3.07Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 3.08Å; K122-I124 VanDerWaalsContact C-N 3.32Å; K122-I124 PolarHBondContact O-N 3.08Å; K122-L125 PolarHBondContact O-N 3.1Å; K122-D126 WeakPolarHBondContact O-CB 3.45Å; K122-D126 PolarHBondContact O-N 3.48Å; K122-L169 HydrophobicContact CB-CD1 4.45Å
123M97.1Very high94.5Very high25 Ų2552 Ų5212%0.12325%0.253CS..Hα-helixtrans-60.2-39.2176.4-67.4-174.5-69.900112.8Q76 A79 R80 L83 T119 I120 L121 S127Q76-M123 HydrophobicContact CB-CE 4.39Å; A79-M123 HydrophobicContact CB-CE 4.08Å; R80-M123 HydrophobicContact CB-SD 3.75Å; R80-M123 HydrophobicContact CG-SD 4.2Å; L83-M123 HydrophobicContact CD1-CB 3.55Å; T119-M123 HydrophobicContact CG2-CE 4.38Å; T119-M123 WeakPolarHBondContact O-CG 3.02Å; T119-M123 PolarHBondContact O-N 3.21Å; T119-M123 VanDerWaalsContact O-N 3.1Å; I120-M123 HydrophobicContact CB-CE 4.06Å; I120-M123 HydrophobicContact CG1-CE 3.69Å; I120-M123 HydrophobicContact CG2-CE 4.36Å; I120-M123 WeakPolarHBondContact O-CB 3.43Å; I120-M123 PolarHBondContact O-N 3.19Å; I120-M123 VanDerWaalsContact O-N 3.12Å; L121-M123 PolarHBondContact O-N 3.22Å; M123-S127 PolarHBondContact O-N 3.2Å; M123-S127 VanDerWaalsContact O-N 3.13Å
124I97.1Very high94.3Very high0 Ų056.2 Ų56.20%028%0.283CS..Hα-helixtrans-60-53173.6-66.9166.4000109.5F67 L71 L83 L91 H108 L109 A112 I120 L121 K122 D126 S127 L128 Y139F67-I124 HydrophobicContact CE1-CD1 3.78Å; F67-I124 HydrophobicContact CE1-CG1 3.78Å; F67-I124 HydrophobicContact CZ-CD1 3.76Å; F67-I124 HydrophobicContact CZ-CG1 3.51Å; L71-I124 HydrophobicContact CD1-CD1 3.6Å; L83-I124 HydrophobicContact CD1-CG1 4.38Å; L91-I124 HydrophobicContact CD1-CG2 4.06Å; L91-I124 HydrophobicContact CD2-CG1 4.2Å; L91-I124 HydrophobicContact CD2-CG2 4.04Å; H108-I124 HydrophobicContact CB-CD1 4.23Å; L109-I124 HydrophobicContact CD2-CG2 3.77Å; A112-I124 HydrophobicContact CB-CD1 4.32Å; I120-I124 HydrophobicContact CG2-CD1 4.38Å; I120-I124 WeakPolarHBondContact O-CG1 3.27Å; I120-I124 PolarHBondContact O-N 3.14Å; L121-I124 WeakPolarHBondContact O-CB 3.38Å; L121-I124 PolarHBondContact O-N 2.8Å; K122-I124 VanDerWaalsContact C-N 3.32Å; K122-I124 PolarHBondContact O-N 3.08Å; I124-D126 VanDerWaalsContact C-N 3.33Å; I124-D126 PolarHBondContact O-N 2.96Å; I124-S127 WeakPolarHBondContact O-CB 3.47Å; I124-S127 PolarHBondContact O-N 3.31Å; I124-S127 VanDerWaalsContact O-N 3.09Å; I124-S127 PolarHBondContact O-OG 3.49Å; I124-L128 WeakPolarHBondContact O-CG 3.35Å; I124-L128 PolarHBondContact O-N 3.35Å; I124-Y139 HydrophobicContact CG2-CE1 4.14Å
125L93.9Very high94.2Very high4 Ų458 Ų582%0.02129%0.294CS..Hα-helixtrans-62.7-37.9-176.4-66.4172.7000112.5L109 L121 K122 S127 L128 L169 L170 H173L109-L125 HydrophobicContact CD2-CD2 4.13Å; L121-L125 HydrophobicContact CD1-CD1 4.14Å; L121-L125 HydrophobicContact CD1-CG 4.26Å; L121-L125 HydrophobicContact CG-CD1 4.06Å; L121-L125 VanDerWaalsContact O-CG 3.3Å; L121-L125 WeakPolarHBondContact O-CG 3.41Å; L121-L125 PolarHBondContact O-N 3.42Å; K122-L125 PolarHBondContact O-N 3.1Å; L125-S127 VanDerWaalsContact C-N 3.29Å; L125-S127 PolarHBondContact O-N 3.24Å; L125-L128 HydrophobicContact CD2-CD1 3.93Å; L125-L128 WeakPolarHBondContact O-CB 3.33Å; L125-L128 PolarHBondContact O-N 3.11Å; L125-L169 HydrophobicContact CD1-CB 3.91Å; L125-L170 HydrophobicContact CD2-CD2 4.41Å; L125-H173 HydrophobicContact CB-CB 4.33Å; L125-H173 HydrophobicContact CD1-CB 4.25Å; L125-H173 HydrophobicContact CD2-CB 4.01Å; L125-H173 HydrophobicContact CG-CB 4.43Å
126D92.1Very high94Very high74 Ų7456.1 Ų56.140%0.39629%0.286SS..Hα-helixtrans-66.7-29.8175.2-69.2-18.5000112.4K122 I124 L128 K129 H173K122-D126 WeakPolarHBondContact O-CB 3.45Å; K122-D126 PolarHBondContact O-N 3.48Å; I124-D126 VanDerWaalsContact C-N 3.33Å; I124-D126 PolarHBondContact O-N 2.96Å; D126-L128 VanDerWaalsContact C-N 3.27Å; D126-L128 PolarHBondContact O-N 2.82Å; D126-K129 WeakPolarHBondContact O-CD 3.46Å; D126-K129 WeakPolarHBondContact O-CG 3.36Å; D126-H173 IonicContact OD1-CE1 3.64Å
127S93.8Very high93.8Very high11 Ų1156.6 Ų56.68%0.07729%0.292CS..Hα-helixtrans-75.2-14.2176.374.80000113.4L91 M123 I124 L125 K129 D130L91-S127 WeakPolarHBondContact CD1-OG 3.33Å; M123-S127 PolarHBondContact O-N 3.2Å; M123-S127 VanDerWaalsContact O-N 3.13Å; I124-S127 WeakPolarHBondContact O-CB 3.47Å; I124-S127 PolarHBondContact O-N 3.31Å; I124-S127 VanDerWaalsContact O-N 3.09Å; I124-S127 PolarHBondContact O-OG 3.49Å; L125-S127 VanDerWaalsContact C-N 3.29Å; L125-S127 PolarHBondContact O-N 3.24Å; S127-K129 PolarHBondContact O-N 3.28Å; S127-K129 VanDerWaalsContact O-N 3.14Å; S127-D130 PolarHBondContact O-N 3.12Å
128L91.3Very high93.6Very high4 Ų458 Ų582%0.02131%0.31CS..G310 helixtrans-70.1-8.3179.8-58.6-176.7000114L91 I124 L125 D126 D130 F131 R136 Y139 I140L91-L128 HydrophobicContact CD1-CD2 4Å; I124-L128 WeakPolarHBondContact O-CG 3.35Å; I124-L128 PolarHBondContact O-N 3.35Å; L125-L128 HydrophobicContact CD2-CD1 3.93Å; L125-L128 WeakPolarHBondContact O-CB 3.33Å; L125-L128 PolarHBondContact O-N 3.11Å; D126-L128 VanDerWaalsContact C-N 3.27Å; D126-L128 PolarHBondContact O-N 2.82Å; L128-D130 PolarHBondContact O-N 2.8Å; L128-F131 HydrophobicContact CB-CD2 4.49Å; L128-F131 HydrophobicContact CD2-CD2 3.89Å; L128-F131 HydrophobicContact CD2-CE1 4.39Å; L128-F131 HydrophobicContact CD2-CE2 3.69Å; L128-F131 HydrophobicContact CD2-CG 4.33Å; L128-F131 HydrophobicContact CD2-CZ 3.97Å; L128-F131 WeakPolarHBondContact O-CB 3.43Å; L128-F131 PolarHBondContact O-N 3.28Å; L128-F131 VanDerWaalsContact O-N 3.13Å; L128-R136 HydrophobicContact CB-CG 4.18Å; L128-R136 HydrophobicContact CD1-CG 4.36Å; L128-Y139 HydrophobicContact CD1-CD1 4.32Å; L128-Y139 HydrophobicContact CD2-CD1 3.78Å; L128-Y139 HydrophobicContact CD2-CE1 4.05Å; L128-Y139 HydrophobicContact CD2-CG 4.43Å; L128-I140 HydrophobicContact CD1-CD1 3.53Å; L128-I140 HydrophobicContact CD1-CG1 3.4Å
129K89.8Confident93.5Very high164 Ų16456.2 Ų56.271%0.71330%0.3SS*.G310 helixtrans-60.7-21.6169.769.7-172.5175.2-177.50113.2D126 S127 F131D126-K129 WeakPolarHBondContact O-CD 3.46Å; D126-K129 WeakPolarHBondContact O-CG 3.36Å; S127-K129 PolarHBondContact O-N 3.28Å; S127-K129 VanDerWaalsContact O-N 3.14Å; K129-F131 VanDerWaalsContact C-N 3.33Å
130D91.1Very high93.3Very high87 Ų8753.6 Ų53.647%0.46528%0.284SS..G310 helixtrans-85.7-6.7178.9-59.4-24.1000112.4S87 V88 S127 L128S87-D130 WeakPolarHBondContact CB-OD2 3.45Å; S87-D130 VanDerWaalsContact OG-CB 3.26Å; S87-D130 WeakPolarHBondContact OG-CB 3.26Å; S87-D130 VanDerWaalsContact OG-CG 3.3Å; S87-D130 PolarHBondContact OG-OD2 3.1Å; V88-D130 HydrophobicContact CG2-CB 4.19Å; S127-D130 PolarHBondContact O-N 3.12Å; L128-D130 PolarHBondContact O-N 2.8Å
131F92.3Very high93Very high28 Ų2855 Ų5512%0.12329%0.291CS..SBendtrans-88.2153.1178.1-74.1-123.2000110.9V88 L91 L128 K129 E135 R136 Y139V88-F131 HydrophobicContact CB-CE2 4.11Å; V88-F131 HydrophobicContact CB-CZ 4.3Å; V88-F131 HydrophobicContact CG1-CE1 4.16Å; V88-F131 HydrophobicContact CG1-CE2 4.07Å; V88-F131 HydrophobicContact CG1-CZ 3.8Å; V88-F131 HydrophobicContact CG2-CD2 3.84Å; V88-F131 HydrophobicContact CG2-CE2 3.73Å; V88-F131 HydrophobicContact CG2-CZ 4.33Å; L91-F131 HydrophobicContact CB-CZ 4.12Å; L91-F131 HydrophobicContact CD1-CE2 3.95Å; L91-F131 HydrophobicContact CD1-CZ 3.96Å; L128-F131 HydrophobicContact CB-CD2 4.49Å; L128-F131 HydrophobicContact CD2-CD2 3.89Å; L128-F131 HydrophobicContact CD2-CE1 4.39Å; L128-F131 HydrophobicContact CD2-CE2 3.69Å; L128-F131 HydrophobicContact CD2-CG 4.33Å; L128-F131 HydrophobicContact CD2-CZ 3.97Å; L128-F131 WeakPolarHBondContact O-CB 3.43Å; L128-F131 PolarHBondContact O-N 3.28Å; L128-F131 VanDerWaalsContact O-N 3.13Å; K129-F131 VanDerWaalsContact C-N 3.33Å; F131-E135 HydrophobicContact CB-CB 4.28Å; F131-E135 HydrophobicContact CD1-CB 3.77Å; F131-R136 HydrophobicContact CB-CB 4.11Å; F131-Y139 HydrophobicContact CE1-CD2 4.1Å; F131-Y139 HydrophobicContact CE1-CG 4.23Å; F131-Y139 HydrophobicContact CZ-CD2 4.47Å
132S92.9Very high92.6Very high50 Ų5055.8 Ų55.835%0.3530%0.296SS..  trans-65.9159.7162.670.50000111.1S134 E135 R136S132-S134 VanDerWaalsContact C-N 3.29Å; S132-S134 PolarHBondContact O-N 2.76Å; S132-S134 PolarHBondContact OG-OG 3.43Å; S132-E135 WeakPolarHBondContact CB-OE2 3.28Å; S132-E135 PolarHBondContact N-OE2 3.47Å; S132-E135 PolarHBondContact O-N 2.92Å; S132-E135 WeakPolarHBondContact OG-CG 3.38Å; S132-E135 PolarHBondContact OG-N 3.36Å; S132-E135 PolarHBondContact OG-OE2 3.25Å; S132-R136 WeakPolarHBondContact O-CB 3.3Å; S132-R136 PolarHBondContact O-N 3.02Å
133N88.9Confident92.2Very high115 Ų11556.5 Ų56.562%0.61530%0.296SS*.Hα-helixtrans-57.1-40.5-179.7-84.1-38.3000113.2R136 V137N133-R136 PolarHBondContact OD1-NH2 3.32Å; N133-V137 VanDerWaalsContact O-CG2 3.28Å; N133-V137 WeakPolarHBondContact O-CG2 3.36Å; N133-V137 PolarHBondContact O-N 3.03Å; N133-V137 VanDerWaalsContact O-N 3.09Å
134S91.6Very high91.4Very high89 Ų8956.1 Ų56.162%0.62230%0.299SS*.Hα-helixtrans-68.5-43.3178.746.30000112S132 V137 S138S132-S134 VanDerWaalsContact C-N 3.29Å; S132-S134 PolarHBondContact O-N 2.76Å; S132-S134 PolarHBondContact OG-OG 3.43Å; S134-V137 PolarHBondContact O-N 3.49Å; S134-S138 WeakPolarHBondContact O-CB 2.91Å; S134-S138 PolarHBondContact O-N 2.98Å
135E92.3Very high90.5Very high104 Ų10456.8 Ų56.849%0.48630%0.303SS..Hα-helixtrans-65.5-42.5177.7-65.7164.1139.100111F131 S132 V137 S138 Y139F131-E135 HydrophobicContact CB-CB 4.28Å; F131-E135 HydrophobicContact CD1-CB 3.77Å; S132-E135 WeakPolarHBondContact CB-OE2 3.28Å; S132-E135 PolarHBondContact N-OE2 3.47Å; S132-E135 PolarHBondContact O-N 2.92Å; S132-E135 WeakPolarHBondContact OG-CG 3.38Å; S132-E135 PolarHBondContact OG-N 3.36Å; S132-E135 PolarHBondContact OG-OE2 3.25Å; E135-V137 PolarHBondContact O-N 3.44Å; E135-S138 PolarHBondContact O-N 3.41Å; E135-Y139 WeakPolarHBondContact O-CB 3.48Å; E135-Y139 PolarHBondContact O-N 3.46Å
136R92.1Very high89.5Confident68 Ų6861.1 Ų61.126%0.25732%0.322SS..Hα-helixtrans-57.1-49.4174.8-179.8176.767158.6-4.6111.6L128 F131 S132 N133 S138 Y139 I140 E269L128-R136 HydrophobicContact CB-CG 4.18Å; L128-R136 HydrophobicContact CD1-CG 4.36Å; F131-R136 HydrophobicContact CB-CB 4.11Å; S132-R136 WeakPolarHBondContact O-CB 3.3Å; S132-R136 PolarHBondContact O-N 3.02Å; N133-R136 PolarHBondContact OD1-NH2 3.32Å; R136-S138 PolarHBondContact O-N 3Å; R136-Y139 PolarHBondContact O-N 2.82Å; R136-I140 HydrophobicContact CG-CD1 3.87Å; R136-I140 HydrophobicContact CG-CG1 4.49Å; R136-I140 WeakPolarHBondContact O-CG1 3.27Å; R136-I140 PolarHBondContact O-N 3.42Å; R136-E269 IonicContact NH1-OE1 2.7Å
137V91.5Very high88.7Confident82 Ų8264 Ų6450%0.49733%0.332SS..Hα-helixtrans-63-42.9179170.20000111N133 S134 E135 N141N133-V137 VanDerWaalsContact O-CG2 3.28Å; N133-V137 WeakPolarHBondContact O-CG2 3.36Å; N133-V137 PolarHBondContact O-N 3.03Å; N133-V137 VanDerWaalsContact O-N 3.09Å; S134-V137 PolarHBondContact O-N 3.49Å; E135-V137 PolarHBondContact O-N 3.44Å; V137-N141 VanDerWaalsContact O-CB 3.3Å; V137-N141 WeakPolarHBondContact O-CB 3.36Å; V137-N141 PolarHBondContact O-N 3.41Å; V137-N141 PolarHBondContact O-ND2 3.02Å
138S92.7Very high87.6Confident86 Ų8666.6 Ų66.660%0.60135%0.348SS*.Hα-helixtrans-62.3-45177-1740000111.8S134 E135 R136 S142S134-S138 WeakPolarHBondContact O-CB 2.91Å; S134-S138 PolarHBondContact O-N 2.98Å; E135-S138 PolarHBondContact O-N 3.41Å; R136-S138 PolarHBondContact O-N 3Å; S138-S142 PolarHBondContact O-N 2.92Å; S138-S142 VanDerWaalsContact O-N 3.11Å
139Y93.4Very high86.6Confident16 Ų1669.8 Ų69.86%0.06336%0.363CS..Hα-helixtrans-66.1-50.7-177.8-172.5-89.4000112.3L91 T106 H108 L109 I124 L128 F131 E135 R136 N141 S142L91-Y139 HydrophobicContact CB-CE2 3.99Å; L91-Y139 HydrophobicContact CD1-CE1 4.5Å; L91-Y139 WeakPolarHBondContact CD2-OH 3.22Å; L91-Y139 WeakPolarHBondContact O-CE2 3.08Å; T106-Y139 HydrophobicContact CG2-CD2 4.49Å; T106-Y139 HydrophobicContact CG2-CE2 4.09Å; T106-Y139 WeakPolarHBondContact OG1-CE2 3.4Å; H108-Y139 WeakPolarHBondContact CB-OH 3.18Å; H108-Y139 PolarHBondContact ND1-OH 2.94Å; L109-Y139 HydrophobicContact CD1-CD1 3.91Å; L109-Y139 HydrophobicContact CD1-CE1 3.78Å; L109-Y139 HydrophobicContact CD2-CE1 4.32Å; L109-Y139 HydrophobicContact CG-CD1 4.44Å; L109-Y139 HydrophobicContact CG-CE1 3.79Å; I124-Y139 HydrophobicContact CG2-CE1 4.14Å; L128-Y139 HydrophobicContact CD1-CD1 4.32Å; L128-Y139 HydrophobicContact CD2-CD1 3.78Å; L128-Y139 HydrophobicContact CD2-CE1 4.05Å; L128-Y139 HydrophobicContact CD2-CG 4.43Å; F131-Y139 HydrophobicContact CE1-CD2 4.1Å; F131-Y139 HydrophobicContact CE1-CG 4.23Å; F131-Y139 HydrophobicContact CZ-CD2 4.47Å; E135-Y139 WeakPolarHBondContact O-CB 3.48Å; E135-Y139 PolarHBondContact O-N 3.46Å; R136-Y139 PolarHBondContact O-N 2.82Å; Y139-N141 VanDerWaalsContact C-N 3.3Å; Y139-N141 PolarHBondContact O-N 3Å; Y139-S142 WeakPolarHBondContact O-CB 3.36Å; Y139-S142 PolarHBondContact O-N 3.43Å; Y139-S142 PolarHBondContact O-OG 3.26Å
140I93.6Very high85.9Confident9 Ų963.3 Ų63.35%0.04634%0.343CS..Hα-helixtrans-63.5-38.3-178.6-67.8177.9000111.5L128 R136 S142 H173 A175L128-I140 HydrophobicContact CD1-CD1 3.53Å; L128-I140 HydrophobicContact CD1-CG1 3.4Å; R136-I140 HydrophobicContact CG-CD1 3.87Å; R136-I140 HydrophobicContact CG-CG1 4.49Å; R136-I140 WeakPolarHBondContact O-CG1 3.27Å; R136-I140 PolarHBondContact O-N 3.42Å; I140-S142 VanDerWaalsContact C-N 3.28Å; I140-S142 PolarHBondContact O-N 3.31Å; I140-H173 HydrophobicContact CD1-CB 4.45Å; I140-H173 WeakPolarHBondContact CD1-O 3.37Å; I140-A175 VanDerWaalsContact CG2-CA 3.41Å; I140-A175 HydrophobicContact CG2-CB 3.36Å
141N93.3Very high85.4Confident29 Ų2959.3 Ų59.316%0.15532%0.322CS..THydrogen-bonded Turntrans-93.214.4-177.4-61.7-60.4000113.3V137 Y139 R143 C176 V179V137-N141 VanDerWaalsContact O-CB 3.3Å; V137-N141 WeakPolarHBondContact O-CB 3.36Å; V137-N141 PolarHBondContact O-N 3.41Å; V137-N141 PolarHBondContact O-ND2 3.02Å; Y139-N141 VanDerWaalsContact C-N 3.3Å; Y139-N141 PolarHBondContact O-N 3Å; N141-R143 PolarHBondContact O-N 3.34Å; N141-C176 VanDerWaalsContact OD1-CB 3.24Å; N141-C176 WeakPolarHBondContact OD1-CB 3.38Å; N141-C176 PolarHBondContact OD1-N 3.32Å; N141-V179 HydrophobicContact CB-CG1 3.99Å
142S89.6Confident85.4Confident16 Ų1659.7 Ų59.711%0.11232%0.323CS..PPolyproline II helixtrans-59.7136.3179.157.40000111.5S138 Y139 I140S138-S142 PolarHBondContact O-N 2.92Å; S138-S142 VanDerWaalsContact O-N 3.11Å; Y139-S142 WeakPolarHBondContact O-CB 3.36Å; Y139-S142 PolarHBondContact O-N 3.43Å; Y139-S142 PolarHBondContact O-OG 3.26Å; I140-S142 VanDerWaalsContact C-N 3.28Å; I140-S142 PolarHBondContact O-N 3.31Å
143R85.7Confident85.4Confident126 Ų12657.5 Ų57.548%0.47531%0.309SS..PPolyproline II helixtrans-84.3147.7177.3-65.2-176-177.8-163.8-7.4110.3A105 N141 T180A105-R143 WeakPolarHBondContact CB-O 3.29Å; N141-R143 PolarHBondContact O-N 3.34Å; R143-T180 PolarHBondContact NE-O 2.97Å; R143-T180 PolarHBondContact NH2-O 2.62Å; R143-T180 PolarHBondContact NH2-OG1 3.23Å; R143-T180 VanDerWaalsContact NH2-OG1 3.15Å
144G80Confident85.7Confident17 Ų1752.1 Ų52.118%0.17528%0.28CS..PPolyproline II helixtrans-64.8170.1173.400000112G151 K152G144-G151 PolarHBondContact N-O 3.49Å; G144-G151 WeakPolarHBondContact O-CA 3.23Å; G144-K152 VanDerWaalsContact CA-O 3.28Å; G144-K152 WeakPolarHBondContact CA-O 3.41Å; G144-K152 PolarHBondContact N-O 3.39Å
145C79.4Confident85.9Confident14 Ų1448.1 Ų48.110%0.09525%0.252CS..PPolyproline II helixtrans-62.6141.8171178.30000111.5C100 C101 H147 V148 G151C100-C145 HydrophobicContact CB-CB 4.18Å; C100-C145 WeakPolarHBondContact CB-SG 3.5Å; C100-C145 WeakPolarHBondContact SG-CB 3.45Å; C100-C145 CovalentContact SG-SG 2Å; C100-C145 PolarHBondContact SG-SG 3.49Å; C101-C145 VanDerWaalsContact SG-SG 3.66Å; C145-H147 PolarHBondContact O-N 2.96Å; C145-V148 HydrophobicContact CB-CB 4.03Å; C145-V148 HydrophobicContact CB-CG2 4.05Å; C145-V148 CarbonylContact O-C 3.52Å; C145-V148 PolarHBondContact O-N 3.5Å; C145-G151 VanDerWaalsContact O-CA 3.31Å; C145-G151 WeakPolarHBondContact O-CA 3.1Å; C145-G151 PolarHBondContact O-N 2.89Å
146F72.8Confident86.1Confident94 Ų9443.3 Ų43.341%0.41223%0.229SC..THydrogen-bonded Turntrans-57.4-49.8175.7169.5-137.9000113.6V148 R182F146-V148 PolarHBondContact O-N 3.31Å; F146-V148 VanDerWaalsContact O-N 3.16Å; F146-R182 VanDerWaalsContact CD1-NH1 3.35Å; F146-R182 VanDerWaalsContact CD2-NE 3.32Å
147H75.5Confident86.3Confident134 Ų13440.1 Ų40.162%0.6222%0.217SC*.THydrogen-bonded Turntrans-71.4-9.1-174.1-59-70.5000112.4C145C145-H147 PolarHBondContact O-N 2.96Å
148V69.9Low86.5Confident67 Ų6736.2 Ų36.241%0.40619%0.193SC..THydrogen-bonded Turntrans-118108.5-179.6-174.40000108.1C100 C145 F146 G150 G151C100-V148 HydrophobicContact CB-CG2 4.15Å; C145-V148 HydrophobicContact CB-CB 4.03Å; C145-V148 HydrophobicContact CB-CG2 4.05Å; C145-V148 CarbonylContact O-C 3.52Å; C145-V148 PolarHBondContact O-N 3.5Å; F146-V148 PolarHBondContact O-N 3.31Å; F146-V148 VanDerWaalsContact O-N 3.16Å; V148-G150 VanDerWaalsContact C-N 3.3Å; V148-G150 PolarHBondContact O-N 2.91Å; V148-G151 PolarHBondContact O-N 3.49Å
149E69.4Low86.7Confident71 Ų7132.1 Ų32.133%0.33217%0.165SC..G310 helixtrans59.133.6171.8-56.6-178153.300115.7R114 G151 K152 L157R114-E149 IonicContact CZ-OE1 2.8Å; R114-E149 VanDerWaalsContact CZ-OE1 3.3Å; R114-E149 IonicContact CZ-OE2 2.77Å; R114-E149 IonicContact NH1-OE1 3.49Å; R114-E149 PolarHBondContact NH1-OE1 2.61Å; R114-E149 IonicContact NH1-OE2 2.79Å; R114-E149 IonicContact NH2-OE1 2.98Å; R114-E149 PolarHBondContact NH2-OE1 3.39Å; R114-E149 VanDerWaalsContact NH2-OE1 3.16Å; R114-E149 IonicContact NH2-OE2 3.15Å; R114-E149 PolarHBondContact NH2-OE2 3.35Å; E149-G151 VanDerWaalsContact C-N 3.26Å; E149-G151 PolarHBondContact O-N 3.3Å; E149-K152 WeakPolarHBondContact O-CD 3.12Å; E149-K152 WeakPolarHBondContact O-CG 3.38Å; E149-K152 PolarHBondContact O-N 3.11Å; E149-L157 WeakPolarHBondContact OE2-CD2 3.49Å
150G75.6Confident86.7Confident28 Ų2833.5 Ų33.529%0.28917%0.172SC..G310 helixtrans69.321171.900000114.4V148 K152 R182V148-G150 VanDerWaalsContact C-N 3.3Å; V148-G150 PolarHBondContact O-N 2.91Å; G150-K152 VanDerWaalsContact C-N 3.35Å; G150-R182 WeakPolarHBondContact O-CB 3.3Å
151G82Confident86.8Confident2 Ų236.2 Ų36.22%0.02119%0.186CC..G310 helixtrans7817.8179.600000114.5G144 C145 V148 E149 G153G144-G151 PolarHBondContact N-O 3.49Å; G144-G151 WeakPolarHBondContact O-CA 3.23Å; C145-G151 VanDerWaalsContact O-CA 3.31Å; C145-G151 WeakPolarHBondContact O-CA 3.1Å; C145-G151 PolarHBondContact O-N 2.89Å; V148-G151 PolarHBondContact O-N 3.49Å; E149-G151 VanDerWaalsContact C-N 3.26Å; E149-G151 PolarHBondContact O-N 3.3Å; G151-G153 PolarHBondContact O-N 3.39Å
152K90.4Very high86.8Confident37 Ų3735.8 Ų35.816%0.16118%0.184CC..  trans-60123.8177.9-76176.9-165.2-178.50111.8G144 E149 G150 H156 L157 E160 D181G144-K152 VanDerWaalsContact CA-O 3.28Å; G144-K152 WeakPolarHBondContact CA-O 3.41Å; G144-K152 PolarHBondContact N-O 3.39Å; E149-K152 WeakPolarHBondContact O-CD 3.12Å; E149-K152 WeakPolarHBondContact O-CG 3.38Å; E149-K152 PolarHBondContact O-N 3.11Å; G150-K152 VanDerWaalsContact C-N 3.35Å; K152-H156 HydrophobicContact CB-CB 3.75Å; K152-H156 HydrophobicContact CD-CB 4.29Å; K152-H156 HydrophobicContact CG-CB 3.81Å; K152-L157 HydrophobicContact CB-CD2 3.97Å; K152-L157 HydrophobicContact CB-CG 4.23Å; K152-L157 HydrophobicContact CD-CD2 4.25Å; K152-E160 WeakPolarHBondContact CD-OE2 3.45Å; K152-E160 WeakPolarHBondContact CE-OE2 3.2Å; K152-E160 IonicContact NZ-OE1 3.37Å; K152-E160 PolarHBondContact NZ-OE1 2.87Å; K152-E160 IonicContact NZ-OE2 2.85Å; K152-E160 PolarHBondContact NZ-OE2 3.07Å; K152-D181 HydrophobicContact CG-CB 4.3Å
153G93.3Very high87.1Confident4 Ų437.3 Ų37.34%0.04119%0.188CC..  trans-77.3178.717000000112.5G151 L155 H156 L157G151-G153 PolarHBondContact O-N 3.39Å; G153-L155 PolarHBondContact O-N 3.3Å; G153-H156 PolarHBondContact N-ND1 3.1Å; G153-H156 WeakPolarHBondContact O-CB 3.28Å; G153-H156 PolarHBondContact O-N 3.5Å; G153-H156 VanDerWaalsContact O-N 3.11Å; G153-L157 PolarHBondContact O-N 3.26Å; G153-L157 VanDerWaalsContact O-N 3.14Å
154A95.5Very high87.4Confident2 Ų231.5 Ų31.52%0.01717%0.167CC..Hα-helixtrans-58.7-41-174.800000113.6L109 T110 V113 H156 L157 A158 L170L109-A154 HydrophobicContact CB-CB 3.74Å; T110-A154 HydrophobicContact CG2-CB 4.42Å; V113-A154 HydrophobicContact CG2-CB 4.15Å; A154-H156 PolarHBondContact O-N 2.62Å; A154-L157 PolarHBondContact O-N 2.92Å; A154-A158 PolarHBondContact O-N 3.02Å; A154-L170 HydrophobicContact CB-CD1 3.79Å; A154-L170 HydrophobicContact CB-CD2 4.09Å
155L96.3Very high88Confident5 Ų534.8 Ų34.83%0.02618%0.177CC..Hα-helixtrans-63.9-39176.3-79178.6000113.1G153 L157 A158 C159 L167 L170 L171 A175 C176 V179 P187G153-L155 PolarHBondContact O-N 3.3Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L155-A158 PolarHBondContact O-N 3.26Å; L155-C159 PolarHBondContact O-N 3.31Å; L155-C159 VanDerWaalsContact O-N 3.14Å; L155-C159 PolarHBondContact O-SG 3.26Å; L155-L167 HydrophobicContact CD2-CD1 3.58Å; L155-L170 HydrophobicContact CD2-CB 3.6Å; L155-L170 HydrophobicContact CD2-CD1 4Å; L155-L170 HydrophobicContact CD2-CG 4.47Å; L155-L170 HydrophobicContact CG-CB 4.31Å; L155-L170 HydrophobicContact CG-CD1 4.36Å; L155-L171 HydrophobicContact CD1-CD2 4.23Å; L155-L171 HydrophobicContact CD2-CD2 3.93Å; L155-L171 HydrophobicContact CD2-CG 3.95Å; L155-A175 HydrophobicContact CD1-CB 3.54Å; L155-A175 HydrophobicContact CD2-CB 4.06Å; L155-A175 HydrophobicContact CG-CB 3.82Å; L155-C176 WeakPolarHBondContact CD1-O 3.11Å; L155-V179 HydrophobicContact CD1-CG2 4.15Å; L155-P187 HydrophobicContact CB-CB 4.2Å; L155-P187 HydrophobicContact CB-CG 3.66Å; L155-P187 HydrophobicContact CD1-CG 4.34Å
156H96.4Very high88.8Confident3 Ų334.1 Ų34.11%0.01417%0.173CC..Hα-helixtrans-63-44.7177-6389.4000110.3K152 G153 A154 C159 E160 V179 D181 N185K152-H156 HydrophobicContact CB-CB 3.75Å; K152-H156 HydrophobicContact CD-CB 4.29Å; K152-H156 HydrophobicContact CG-CB 3.81Å; G153-H156 PolarHBondContact N-ND1 3.1Å; G153-H156 WeakPolarHBondContact O-CB 3.28Å; G153-H156 PolarHBondContact O-N 3.5Å; G153-H156 VanDerWaalsContact O-N 3.11Å; A154-H156 PolarHBondContact O-N 2.62Å; H156-C159 PolarHBondContact O-N 3.47Å; H156-E160 WeakPolarHBondContact O-CB 3.35Å; H156-E160 PolarHBondContact O-N 3.18Å; H156-V179 PolarHBondContact CE1-O 3.43Å; H156-V179 VanDerWaalsContact CE1-O 3.31Å; H156-V179 PolarHBondContact NE2-O 3.31Å; H156-D181 PolarHBondContact NE2-N 2.86Å; H156-N185 PolarHBondContact NE2-O 3.37Å
157L95.7Very high89.9Confident0 Ų029.7 Ų29.70%015%0.153CC..Hα-helixtrans-66.5-37.5178.1-64.2178.7000112.7T110 V113 E149 K152 G153 A154 L155 C159 E160 L161T110-L157 HydrophobicContact CG2-CD1 3.98Å; V113-L157 HydrophobicContact CG1-CB 3.8Å; E149-L157 WeakPolarHBondContact OE2-CD2 3.49Å; K152-L157 HydrophobicContact CB-CD2 3.97Å; K152-L157 HydrophobicContact CB-CG 4.23Å; K152-L157 HydrophobicContact CD-CD2 4.25Å; G153-L157 PolarHBondContact O-N 3.26Å; G153-L157 VanDerWaalsContact O-N 3.14Å; A154-L157 PolarHBondContact O-N 2.92Å; L155-L157 VanDerWaalsContact C-N 3.34Å; L157-C159 PolarHBondContact O-N 3.23Å; L157-E160 PolarHBondContact O-N 2.91Å; L157-L161 VanDerWaalsContact O-CB 3.26Å; L157-L161 WeakPolarHBondContact O-CB 2.95Å; L157-L161 WeakPolarHBondContact O-CG 3.19Å; L157-L161 PolarHBondContact O-N 3.46Å
158A96.8Very high90.6Very high0 Ų023.7 Ų23.70%013%0.126CC..Hα-helixtrans-62.1-36.5175.300000111.4V113 A154 L155 V162 R163 C166 L167 L170V113-A158 HydrophobicContact CG1-CB 3.92Å; A154-A158 PolarHBondContact O-N 3.02Å; L155-A158 PolarHBondContact O-N 3.26Å; A158-V162 PolarHBondContact O-N 2.89Å; A158-R163 PolarHBondContact O-N 3.31Å; A158-C166 HydrophobicContact CB-CB 4.26Å; A158-L167 HydrophobicContact CB-CB 3.97Å; A158-L167 HydrophobicContact CB-CD1 4.37Å; A158-L170 HydrophobicContact CB-CD1 4.37Å
159C96.2Very high91.7Very high0 Ų021.4 Ų21.40%011%0.111CC..Hα-helixtrans-74.7-45175.7-670000112.7L155 H156 L157 V162 P187 C190 L191L155-C159 PolarHBondContact O-N 3.31Å; L155-C159 VanDerWaalsContact O-N 3.14Å; L155-C159 PolarHBondContact O-SG 3.26Å; H156-C159 PolarHBondContact O-N 3.47Å; L157-C159 PolarHBondContact O-N 3.23Å; C159-V162 PolarHBondContact O-N 3.24Å; C159-P187 WeakPolarHBondContact CB-O 3.17Å; C159-C190 HydrophobicContact CB-CB 4.26Å; C159-L191 HydrophobicContact CB-CB 4.05Å
160E94.4Very high92.9Very high46 Ų4618 Ų1822%0.21510%0.095CC..Hα-helixtrans-64.3-41.7-179.5176.6166.3-141.400112.4K152 H156 L157 V162K152-E160 WeakPolarHBondContact CD-OE2 3.45Å; K152-E160 WeakPolarHBondContact CE-OE2 3.2Å; K152-E160 IonicContact NZ-OE1 3.37Å; K152-E160 PolarHBondContact NZ-OE1 2.87Å; K152-E160 IonicContact NZ-OE2 2.85Å; K152-E160 PolarHBondContact NZ-OE2 3.07Å; H156-E160 WeakPolarHBondContact O-CB 3.35Å; H156-E160 PolarHBondContact O-N 3.18Å; L157-E160 PolarHBondContact O-N 2.91Å; E160-V162 VanDerWaalsContact C-N 3.3Å
161L94.3Very high93.7Very high66 Ų6616.9 Ų16.935%0.3468%0.082SC..THydrogen-bonded Turntrans-88.62.9179.5-57.3174.2000112.8L157 R163L157-L161 VanDerWaalsContact O-CB 3.26Å; L157-L161 WeakPolarHBondContact O-CB 2.95Å; L157-L161 WeakPolarHBondContact O-CG 3.19Å; L157-L161 PolarHBondContact O-N 3.46Å; L161-R163 HydrophobicContact CB-CG 4.05Å
162V94.6Very high94Very high19 Ų1917.3 Ų17.312%0.1159%0.087CC..THydrogen-bonded Turntrans52.157.4178.9-1640000112.4A158 C159 E160 P164 R204 K205A158-V162 PolarHBondContact O-N 2.89Å; C159-V162 PolarHBondContact O-N 3.24Å; E160-V162 VanDerWaalsContact C-N 3.3Å; V162-P164 WeakPolarHBondContact O-CD 3.44Å; V162-R204 HydrophobicContact CG1-CB 3.58Å; V162-K205 HydrophobicContact CB-CG 4.47Å; V162-K205 HydrophobicContact CG1-CB 4.38Å; V162-K205 HydrophobicContact CG1-CG 3.61Å; V162-K205 HydrophobicContact CG2-CG 3.91Å
163R95.2Very high93.9Very high48 Ų4817.4 Ų17.418%0.1819%0.088CC..  trans-111.583.8-177.3-63.5-177.9-174.6-164.72.5111V113 R114 A158 L161 E165 C166 L167V113-R163 VanDerWaalsContact O-CD 3.25Å; V113-R163 WeakPolarHBondContact O-CD 3.27Å; V113-R163 VanDerWaalsContact O-CZ 3.29Å; V113-R163 PolarHBondContact O-NH1 3.12Å; R114-R163 PolarHBondContact O-NH1 3.46Å; R114-R163 PolarHBondContact O-NH2 3.2Å; A158-R163 PolarHBondContact O-N 3.31Å; L161-R163 HydrophobicContact CB-CG 4.05Å; R163-E165 VanDerWaalsContact C-N 3.3Å; R163-E165 PolarHBondContact O-N 2.96Å; R163-C166 HydrophobicContact CB-CB 3.96Å; R163-C166 PolarHBondContact O-N 3.11Å; R163-L167 WeakPolarHBondContact O-CB 3.28Å; R163-L167 PolarHBondContact O-N 3.03Å
164P92.2Very high93.7Very high5 Ų519.6 Ų19.63%0.03211%0.11CC..Hα-helixtrans-61.6-37.4-173.821-29.4000112.6V162 L167 I168 R204 V207 Y211V162-P164 WeakPolarHBondContact O-CD 3.44Å; P164-L167 PolarHBondContact O-N 2.88Å; P164-I168 WeakPolarHBondContact O-CG2 3.5Å; P164-I168 PolarHBondContact O-N 3.01Å; P164-R204 HydrophobicContact CG-CB 4.26Å; P164-R204 HydrophobicContact CG-CG 4.12Å; P164-V207 HydrophobicContact CB-CB 4.39Å; P164-V207 HydrophobicContact CB-CG1 3.72Å; P164-Y211 HydrophobicContact CB-CD2 4.42Å; P164-Y211 HydrophobicContact CB-CE2 3.9Å
165E92.2Very high93.6Very high86 Ų8619.7 Ų19.740%0.40211%0.111SC..Hα-helixtrans-65.1-44.3179.8-61.377.9-170.800111.5I118 R163 I168 L169I118-E165 HydrophobicContact CD1-CB 3.74Å; I118-E165 HydrophobicContact CD1-CG 4.13Å; I118-E165 HydrophobicContact CG1-CB 4.28Å; I118-E165 HydrophobicContact CG2-CB 4.44Å; R163-E165 VanDerWaalsContact C-N 3.3Å; R163-E165 PolarHBondContact O-N 2.96Å; E165-I168 WeakPolarHBondContact O-CG2 3.5Å; E165-L169 WeakPolarHBondContact O-CB 3.49Å; E165-L169 VanDerWaalsContact O-CG 3.26Å; E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.47Å; E165-L169 VanDerWaalsContact O-N 3.11Å
166C96Very high93.4Very high0 Ų021.7 Ų21.70%013%0.125CC..Hα-helixtrans-64.3-42.3173.7-68.80000111.6V113 L121 A158 R163 L169 L170V113-C166 HydrophobicContact CG1-CB 4.37Å; V113-C166 HydrophobicContact CG2-CB 4.17Å; L121-C166 HydrophobicContact CD2-CB 3.92Å; A158-C166 HydrophobicContact CB-CB 4.26Å; R163-C166 HydrophobicContact CB-CB 3.96Å; R163-C166 PolarHBondContact O-N 3.11Å; C166-L169 PolarHBondContact O-N 3.45Å; C166-L170 VanDerWaalsContact O-CG 3.27Å; C166-L170 WeakPolarHBondContact O-CG 3.19Å; C166-L170 PolarHBondContact O-N 2.95Å
167L95.4Very high93.4Very high0 Ų022.1 Ų22.10%013%0.128CC..Hα-helixtrans-60.9-49.1-179.117859.3000111.1L155 A158 R163 P164 L170 L171 C208 Y211 L212L155-L167 HydrophobicContact CD2-CD1 3.58Å; A158-L167 HydrophobicContact CB-CB 3.97Å; A158-L167 HydrophobicContact CB-CD1 4.37Å; R163-L167 WeakPolarHBondContact O-CB 3.28Å; R163-L167 PolarHBondContact O-N 3.03Å; P164-L167 PolarHBondContact O-N 2.88Å; L167-L170 PolarHBondContact O-N 3.17Å; L167-L171 HydrophobicContact CD1-CD1 3.83Å; L167-L171 HydrophobicContact CD1-CG 4.13Å; L167-L171 HydrophobicContact CG-CD1 3.89Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.2Å; L167-C208 HydrophobicContact CD2-CB 3.59Å; L167-Y211 HydrophobicContact CD2-CD2 4.4Å; L167-L212 HydrophobicContact CD1-CD2 4.24Å; L167-L212 HydrophobicContact CD2-CG 4.34Å
168I91.5Very high93.4Very high8 Ų825.3 Ų25.34%0.04114%0.141CC..Hα-helixtrans-71.8-32.6-177.4-163.553.5000112.5P164 E165 G172 Y211 F215 L281P164-I168 WeakPolarHBondContact O-CG2 3.5Å; P164-I168 PolarHBondContact O-N 3.01Å; E165-I168 WeakPolarHBondContact O-CG2 3.5Å; I168-G172 WeakPolarHBondContact O-CA 3.25Å; I168-G172 PolarHBondContact O-N 3.16Å; I168-Y211 HydrophobicContact CB-CD1 4.49Å; I168-Y211 HydrophobicContact CB-CD2 3.86Å; I168-Y211 HydrophobicContact CB-CE1 4.36Å; I168-Y211 HydrophobicContact CB-CE2 3.7Å; I168-Y211 HydrophobicContact CB-CG 4.26Å; I168-Y211 HydrophobicContact CD1-CD1 3.61Å; I168-Y211 HydrophobicContact CD1-CD2 4.35Å; I168-Y211 HydrophobicContact CD1-CE1 3.92Å; I168-Y211 HydrophobicContact CD1-CG 3.86Å; I168-Y211 HydrophobicContact CG1-CD1 4.11Å; I168-Y211 HydrophobicContact CG1-CD2 4.37Å; I168-Y211 HydrophobicContact CG1-CE1 3.94Å; I168-Y211 HydrophobicContact CG1-CE2 4.2Å; I168-Y211 HydrophobicContact CG1-CG 4.33Å; I168-Y211 HydrophobicContact CG2-CE2 4.14Å; I168-F215 HydrophobicContact CD1-CD2 4.43Å; I168-F215 HydrophobicContact CD1-CE2 3.5Å; I168-F215 HydrophobicContact CD1-CZ 4.04Å; I168-L281 HydrophobicContact CB-CD2 4.25Å; I168-L281 HydrophobicContact CG1-CD2 3.68Å; I168-L281 HydrophobicContact CG1-CG 4.29Å; I168-L281 HydrophobicContact CG2-CD2 3.83Å
169L91.4Very high93.2Very high20 Ų2026.6 Ų26.611%0.10515%0.148CC..Hα-helixtrans-61.3-48.3170.5-76.9173.2000110.9I118 L121 K122 L125 E165 C166 G172 H173 L281I118-L169 HydrophobicContact CG2-CD1 3.8Å; L121-L169 HydrophobicContact CD2-CB 4.42Å; L121-L169 HydrophobicContact CD2-CD1 4.25Å; L121-L169 HydrophobicContact CG-CD1 4.5Å; K122-L169 HydrophobicContact CB-CD1 4.45Å; L125-L169 HydrophobicContact CD1-CB 3.91Å; E165-L169 WeakPolarHBondContact O-CB 3.49Å; E165-L169 VanDerWaalsContact O-CG 3.26Å; E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.47Å; E165-L169 VanDerWaalsContact O-N 3.11Å; C166-L169 PolarHBondContact O-N 3.45Å; L169-G172 PolarHBondContact O-N 3.13Å; L169-H173 PolarHBondContact O-CD2 2.86Å; L169-H173 PolarHBondContact O-N 3.12Å; L169-L281 HydrophobicContact CD2-CD2 4.43Å
170L94.9Very high93Very high0 Ų028.6 Ų28.60%016%0.161CC..Hα-helixtrans-61.6-50.4178.8-70.5167.1000111.9L109 V113 L121 L125 A154 L155 A158 C166 L167 G172 H173 G174 A175L109-L170 HydrophobicContact CD2-CD2 4.33Å; V113-L170 HydrophobicContact CG2-CD1 3.94Å; L121-L170 HydrophobicContact CD1-CD2 4.27Å; L125-L170 HydrophobicContact CD2-CD2 4.41Å; A154-L170 HydrophobicContact CB-CD1 3.79Å; A154-L170 HydrophobicContact CB-CD2 4.09Å; L155-L170 HydrophobicContact CD2-CB 3.6Å; L155-L170 HydrophobicContact CD2-CD1 4Å; L155-L170 HydrophobicContact CD2-CG 4.47Å; L155-L170 HydrophobicContact CG-CB 4.31Å; L155-L170 HydrophobicContact CG-CD1 4.36Å; A158-L170 HydrophobicContact CB-CD1 4.37Å; C166-L170 VanDerWaalsContact O-CG 3.27Å; C166-L170 WeakPolarHBondContact O-CG 3.19Å; C166-L170 PolarHBondContact O-N 2.95Å; L167-L170 PolarHBondContact O-N 3.17Å; L170-G172 VanDerWaalsContact C-N 3.34Å; L170-G172 PolarHBondContact O-N 3.48Å; L170-H173 PolarHBondContact O-N 3.17Å; L170-G174 PolarHBondContact O-N 3.41Å; L170-A175 VanDerWaalsContact C-CB 3.49Å; L170-A175 HydrophobicContact CB-CB 3.98Å; L170-A175 WeakPolarHBondContact O-CB 3.48Å; L170-A175 PolarHBondContact O-N 2.97Å
171L92.9Very high92.9Very high3 Ų326.6 Ų26.62%0.01615%0.151CC..Hα-helixtrans-62-43.4178.9-70172.2000111.6L155 L167 H173 G174 P177 L212 F215L155-L171 HydrophobicContact CD1-CD2 4.23Å; L155-L171 HydrophobicContact CD2-CD2 3.93Å; L155-L171 HydrophobicContact CD2-CG 3.95Å; L167-L171 HydrophobicContact CD1-CD1 3.83Å; L167-L171 HydrophobicContact CD1-CG 4.13Å; L167-L171 HydrophobicContact CG-CD1 3.89Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.2Å; L171-H173 PolarHBondContact O-N 3.37Å; L171-G174 PolarHBondContact O-N 3.24Å; L171-P177 HydrophobicContact CD2-CB 4.01Å; L171-L212 HydrophobicContact CD1-CD2 4.44Å; L171-F215 HydrophobicContact CB-CD1 3.86Å; L171-F215 HydrophobicContact CB-CD2 3.96Å; L171-F215 HydrophobicContact CB-CE1 3.93Å; L171-F215 HydrophobicContact CB-CE2 4.04Å; L171-F215 HydrophobicContact CB-CG 3.87Å; L171-F215 HydrophobicContact CB-CZ 4.01Å; L171-F215 HydrophobicContact CD1-CB 4.21Å; L171-F215 HydrophobicContact CD1-CD2 3.86Å; L171-F215 HydrophobicContact CD1-CE2 4.45Å; L171-F215 HydrophobicContact CD1-CG 4.07Å; L171-F215 HydrophobicContact CD2-CB 3.98Å; L171-F215 HydrophobicContact CD2-CG 4.2Å; L171-F215 HydrophobicContact CG-CB 4.48Å; L171-F215 HydrophobicContact CG-CD2 4.41Å; L171-F215 HydrophobicContact CG-CG 4.27Å; L171-F215 WeakPolarHBondContact O-CE1 3.27Å
172G87.5Confident92.5Very high11 Ų1130.3 Ų30.311%0.11316%0.161CC..Hα-helixtrans-59.9-33.1177.200000112.8I168 L169 L170 G174 V268I168-G172 WeakPolarHBondContact O-CA 3.25Å; I168-G172 PolarHBondContact O-N 3.16Å; L169-G172 PolarHBondContact O-N 3.13Å; L170-G172 VanDerWaalsContact C-N 3.34Å; L170-G172 PolarHBondContact O-N 3.48Å; G172-G174 VanDerWaalsContact C-N 3.32Å; G172-V268 VanDerWaalsContact O-CG1 3.28Å; G172-V268 WeakPolarHBondContact O-CG1 3.44Å; G172-V268 WeakPolarHBondContact O-CG2 3.36Å
173H88.8Confident92.2Very high40 Ų4034.9 Ų34.919%0.18518%0.184CC..THydrogen-bonded Turntrans-9014.9175-76-99.7000114.1L125 D126 I140 L169 L170 L171L125-H173 HydrophobicContact CB-CB 4.33Å; L125-H173 HydrophobicContact CD1-CB 4.25Å; L125-H173 HydrophobicContact CD2-CB 4.01Å; L125-H173 HydrophobicContact CG-CB 4.43Å; D126-H173 IonicContact OD1-CE1 3.64Å; I140-H173 HydrophobicContact CD1-CB 4.45Å; I140-H173 WeakPolarHBondContact CD1-O 3.37Å; L169-H173 PolarHBondContact O-CD2 2.86Å; L169-H173 PolarHBondContact O-N 3.12Å; L170-H173 PolarHBondContact O-N 3.17Å; L171-H173 PolarHBondContact O-N 3.37Å
174G89.1Confident92.1Very high49 Ų4933.5 Ų33.551%0.50519%0.186SC..THydrogen-bonded Turntrans90.219.1171.900000115.2L170 L171 G172 C176L170-G174 PolarHBondContact O-N 3.41Å; L171-G174 PolarHBondContact O-N 3.24Å; G172-G174 VanDerWaalsContact C-N 3.32Å; G174-C176 PolarHBondContact O-N 3.39Å
175A93.3Very high92.1Very high4 Ų434.7 Ų34.73%0.03319%0.191CC..  trans-62132.5169.700000110.7I140 L155 L170 P177I140-A175 VanDerWaalsContact CG2-CA 3.41Å; I140-A175 HydrophobicContact CG2-CB 3.36Å; L155-A175 HydrophobicContact CD1-CB 3.54Å; L155-A175 HydrophobicContact CD2-CB 4.06Å; L155-A175 HydrophobicContact CG-CB 3.82Å; L170-A175 VanDerWaalsContact C-CB 3.49Å; L170-A175 HydrophobicContact CB-CB 3.98Å; L170-A175 WeakPolarHBondContact O-CB 3.48Å; L170-A175 PolarHBondContact O-N 2.97Å; A175-P177 WeakPolarHBondContact O-CD 3.48Å
176C93.7Very high92.3Very high47 Ų4730.9 Ų30.932%0.31817%0.174SC..  trans-72.5119.3-178.6-179.40000109.8N141 L155 G174 Y178 V179N141-C176 VanDerWaalsContact OD1-CB 3.24Å; N141-C176 WeakPolarHBondContact OD1-CB 3.38Å; N141-C176 PolarHBondContact OD1-N 3.32Å; L155-C176 WeakPolarHBondContact CD1-O 3.11Å; G174-C176 PolarHBondContact O-N 3.39Å; C176-Y178 PolarHBondContact O-N 3.21Å; C176-Y178 VanDerWaalsContact O-N 3.1Å; C176-Y178 PolarHBondContact SG-N 3.44Å; C176-V179 HydrophobicContact CB-CG2 4.44Å; C176-V179 WeakPolarHBondContact O-CG2 3.45Å; C176-V179 PolarHBondContact O-N 2.85Å
177P94.8Very high92.4Very high12 Ų1230.9 Ų30.98%0.07817%0.174CC..THydrogen-bonded Turntrans-73.2-4.5179.530.9-35.2000113.1L171 A175 F215 M216L171-P177 HydrophobicContact CD2-CB 4.01Å; A175-P177 WeakPolarHBondContact O-CD 3.48Å; P177-F215 HydrophobicContact CG-CB 4.4Å; P177-F215 WeakPolarHBondContact CG-O 3.33Å; P177-M216 HydrophobicContact CB-CG 3.59Å; P177-M216 HydrophobicContact CB-SD 4.34Å; P177-M216 HydrophobicContact CG-CG 3.8Å
178Y95.6Very high92.5Very high68 Ų6831 Ų3127%0.26718%0.175SC..THydrogen-bonded Turntrans-1043-178.8-54.9-74000113.9C176 T180 M216 P217 K218 H220C176-Y178 PolarHBondContact O-N 3.21Å; C176-Y178 VanDerWaalsContact O-N 3.1Å; C176-Y178 PolarHBondContact SG-N 3.44Å; Y178-T180 PolarHBondContact O-N 2.86Å; Y178-M216 HydrophobicContact CD1-CE 3.77Å; Y178-M216 HydrophobicContact CE1-CB 4.38Å; Y178-M216 HydrophobicContact CE1-CE 3.46Å; Y178-M216 VanDerWaalsContact CE1-CE 3.46Å; Y178-M216 HydrophobicContact CE1-CG 4.16Å; Y178-M216 WeakPolarHBondContact OH-CA 3.41Å; Y178-P217 VanDerWaalsContact OH-CD 3.28Å; Y178-P217 WeakPolarHBondContact OH-CD 3.31Å; Y178-K218 WeakPolarHBondContact CE1-O 3.4Å; Y178-K218 VanDerWaalsContact CZ-O 3.31Å; Y178-K218 PolarHBondContact OH-N 3.36Å; Y178-K218 VanDerWaalsContact OH-N 3.13Å; Y178-K218 PolarHBondContact OH-O 3.09Å; Y178-H220 HydrophobicContact CD1-CB 4.47Å; Y178-H220 HydrophobicContact CE1-CB 4.44Å
179V93.6Very high92.7Very high26 Ų2630.6 Ų30.616%0.15817%0.173CC..  trans-57.7138.9173-106.10000109.4N141 L155 H156 C176 P187N141-V179 HydrophobicContact CB-CG1 3.99Å; L155-V179 HydrophobicContact CD1-CG2 4.15Å; H156-V179 PolarHBondContact CE1-O 3.43Å; H156-V179 VanDerWaalsContact CE1-O 3.31Å; H156-V179 PolarHBondContact NE2-O 3.31Å; C176-V179 HydrophobicContact CB-CG2 4.44Å; C176-V179 WeakPolarHBondContact O-CG2 3.45Å; C176-V179 PolarHBondContact O-N 2.85Å; V179-P187 WeakPolarHBondContact O-CD 3.48Å
180T92.5Very high92.9Very high43 Ų4330.1 Ų30.126%0.26417%0.171SC..  trans-106.7144.3176.553.90000111.6R143 Y178 N185 T186R143-T180 PolarHBondContact NE-O 2.97Å; R143-T180 PolarHBondContact NH2-O 2.62Å; R143-T180 PolarHBondContact NH2-OG1 3.23Å; R143-T180 VanDerWaalsContact NH2-OG1 3.15Å; Y178-T180 PolarHBondContact O-N 2.86Å; T180-N185 CarbonylContact C-O 3.56Å; T180-N185 VanDerWaalsContact CA-O 3.27Å; T180-N185 WeakPolarHBondContact CA-O 3.47Å; T180-T186 HydrophobicContact CG2-CG2 4.12Å
181D90.4Very high93Very high3 Ų330.1 Ų30.12%0.01617%0.171CC..  trans-73.2-170.2164.4739.8000111.1K152 H156 D183 G184 N185K152-D181 HydrophobicContact CG-CB 4.3Å; H156-D181 PolarHBondContact NE2-N 2.86Å; D181-D183 VanDerWaalsContact C-N 3.34Å; D181-D183 WeakPolarHBondContact OD1-CA 3.38Å; D181-D183 PolarHBondContact OD1-N 2.94Å; D181-G184 PolarHBondContact O-N 3.15Å; D181-G184 PolarHBondContact OD1-N 3.39Å; D181-N185 PolarHBondContact N-O 3.42Å; D181-N185 WeakPolarHBondContact OD1-CB 3.48Å; D181-N185 PolarHBondContact OD1-N 2.9Å
182R86.1Confident93.1Very high144 Ų14430 Ų3054%0.54317%0.17SC..THydrogen-bonded Turntrans-69.7-29.7179.4-82.6-166.1171.5-148.7-4.7114.4F146 G150 G184F146-R182 VanDerWaalsContact CD1-NH1 3.35Å; F146-R182 VanDerWaalsContact CD2-NE 3.32Å; G150-R182 WeakPolarHBondContact O-CB 3.3Å; R182-G184 PolarHBondContact O-N 3.35Å
183D89.6Confident93.4Very high115 Ų11531.1 Ų31.162%0.61517%0.174SC*.THydrogen-bonded Turntrans-79.9-0177.3-62.4-30.7000111D181 N185 Q222D181-D183 VanDerWaalsContact C-N 3.34Å; D181-D183 WeakPolarHBondContact OD1-CA 3.38Å; D181-D183 PolarHBondContact OD1-N 2.94Å; D183-N185 VanDerWaalsContact CB-ND2 3.33Å; D183-N185 WeakPolarHBondContact CB-ND2 3.3Å; D183-N185 PolarHBondContact O-N 3.3Å; D183-Q222 PolarHBondContact O-NE2 3.35Å
184G91.6Very high93.6Very high20 Ų2030.3 Ų30.321%0.20617%0.17CC..  trans76.411.7-177.200000112.7D181 R182 Q222D181-G184 PolarHBondContact O-N 3.15Å; D181-G184 PolarHBondContact OD1-N 3.39Å; R182-G184 PolarHBondContact O-N 3.35Å; G184-Q222 VanDerWaalsContact CA-NE2 3.28Å; G184-Q222 WeakPolarHBondContact O-CG 3.13Å; G184-Q222 PolarHBondContact O-NE2 3.23Å
185N94Very high93.8Very high29 Ų2928 Ų2816%0.15515%0.146CC..  trans-74138.1175.7-63.7-56.6000109.1H156 T180 D181 D183 D189H156-N185 PolarHBondContact NE2-O 3.37Å; T180-N185 CarbonylContact C-O 3.56Å; T180-N185 VanDerWaalsContact CA-O 3.27Å; T180-N185 WeakPolarHBondContact CA-O 3.47Å; D181-N185 PolarHBondContact N-O 3.42Å; D181-N185 WeakPolarHBondContact OD1-CB 3.48Å; D181-N185 PolarHBondContact OD1-N 2.9Å; D183-N185 VanDerWaalsContact CB-ND2 3.33Å; D183-N185 WeakPolarHBondContact CB-ND2 3.3Å; D183-N185 PolarHBondContact O-N 3.3Å; N185-D189 HydrophobicContact CB-CB 3.77Å
186T96.3Very high93.8Very high7 Ų734.2 Ų34.24%0.04317%0.169CC..  trans-82.8168167.363.80000110.8T180 L188 D189 C190 F221T180-T186 HydrophobicContact CG2-CG2 4.12Å; T186-L188 PolarHBondContact O-N 2.99Å; T186-L188 PolarHBondContact OG1-N 3.45Å; T186-D189 WeakPolarHBondContact CB-OD2 3.24Å; T186-D189 PolarHBondContact N-OD2 3.2Å; T186-D189 WeakPolarHBondContact O-CB 3.42Å; T186-D189 PolarHBondContact O-N 3.28Å; T186-D189 PolarHBondContact OG1-N 3.22Å; T186-D189 PolarHBondContact OG1-OD2 3.38Å; T186-C190 PolarHBondContact O-N 2.85Å; T186-F221 HydrophobicContact CG2-CB 4.48Å
187P97.1Very high93.5Very high0 Ų038.9 Ų38.90%018%0.18CC..Hα-helixtrans-53.5-36169.1-28.334.5000113L155 C159 V179 C190 L191 L212L155-P187 HydrophobicContact CB-CB 4.2Å; L155-P187 HydrophobicContact CB-CG 3.66Å; L155-P187 HydrophobicContact CD1-CG 4.34Å; C159-P187 WeakPolarHBondContact CB-O 3.17Å; V179-P187 WeakPolarHBondContact O-CD 3.48Å; P187-C190 WeakPolarHBondContact O-CB 3.42Å; P187-C190 PolarHBondContact O-N 2.86Å; P187-L191 PolarHBondContact O-N 3.25Å; P187-L212 HydrophobicContact CB-CD2 4.21Å
188L97.6Very high92.6Very high1 Ų141 Ų411%0.00520%0.203CC..Hα-helixtrans-64.4-40.2174.6-178.760.5000112.2T186 C190 L191 L192 L209 L212 M216 F221 L246T186-L188 PolarHBondContact O-N 2.99Å; T186-L188 PolarHBondContact OG1-N 3.45Å; L188-C190 VanDerWaalsContact C-N 3.35Å; L188-C190 PolarHBondContact O-N 3.28Å; L188-L191 PolarHBondContact O-N 3.43Å; L188-L192 HydrophobicContact CD1-CD1 4.25Å; L188-L192 HydrophobicContact CD1-CG 4.07Å; L188-L192 HydrophobicContact CG-CD1 4.04Å; L188-L192 HydrophobicContact CG-CG 4.31Å; L188-L192 WeakPolarHBondContact O-CB 3.36Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.13Å; L188-L209 HydrophobicContact CD1-CD1 3.62Å; L188-L212 HydrophobicContact CB-CD1 4.01Å; L188-L212 HydrophobicContact CD1-CB 4.42Å; L188-L212 HydrophobicContact CD1-CD1 3.88Å; L188-M216 HydrophobicContact CB-CE 4.42Å; L188-M216 HydrophobicContact CB-SD 4.06Å; L188-M216 HydrophobicContact CD2-CE 4.06Å; L188-M216 HydrophobicContact CD2-SD 3.92Å; L188-F221 HydrophobicContact CD2-CB 4.15Å; L188-F221 HydrophobicContact CD2-CD1 3.76Å; L188-F221 HydrophobicContact CD2-CD2 4.24Å; L188-F221 HydrophobicContact CD2-CE1 4.21Å; L188-F221 HydrophobicContact CD2-CG 3.8Å; L188-F221 HydrophobicContact CG-CG 4.41Å; L188-L246 HydrophobicContact CD2-CD2 3.89Å
189D96.7Very high91.2Very high0 Ų042.4 Ų42.40%021%0.212CC..Hα-helixtrans-62.9-41.5174.3-64.6-59.9000111.4N185 T186 L191 N193 Q222 M223N185-D189 HydrophobicContact CB-CB 3.77Å; T186-D189 WeakPolarHBondContact CB-OD2 3.24Å; T186-D189 PolarHBondContact N-OD2 3.2Å; T186-D189 WeakPolarHBondContact O-CB 3.42Å; T186-D189 PolarHBondContact O-N 3.28Å; T186-D189 PolarHBondContact OG1-N 3.22Å; T186-D189 PolarHBondContact OG1-OD2 3.38Å; D189-L191 PolarHBondContact O-N 2.92Å; D189-N193 WeakPolarHBondContact O-CB 3.34Å; D189-N193 PolarHBondContact O-N 3.42Å; D189-N193 PolarHBondContact O-ND2 3.5Å; D189-Q222 PolarHBondContact OD1-N 3.49Å; D189-Q222 PolarHBondContact OD2-N 3.48Å; D189-M223 HydrophobicContact CB-CG 4.2Å; D189-M223 HydrophobicContact CB-SD 4.25Å; D189-M223 WeakPolarHBondContact OD1-CB 3.21Å; D189-M223 VanDerWaalsContact OD1-CG 3.27Å; D189-M223 WeakPolarHBondContact OD1-CG 3.36Å; D189-M223 PolarHBondContact OD1-N 2.76Å
190C95Very high90.2Very high10 Ų1046.4 Ų46.47%0.06824%0.239CC..Hα-helixtrans-59.9-46.1173.5-70.10000111.6C159 T186 P187 L188 N193 Q194C159-C190 HydrophobicContact CB-CB 4.26Å; T186-C190 PolarHBondContact O-N 2.85Å; P187-C190 WeakPolarHBondContact O-CB 3.42Å; P187-C190 PolarHBondContact O-N 2.86Å; L188-C190 VanDerWaalsContact C-N 3.35Å; L188-C190 PolarHBondContact O-N 3.28Å; C190-N193 PolarHBondContact O-N 2.88Å; C190-Q194 WeakPolarHBondContact O-CG 3.36Å; C190-Q194 PolarHBondContact O-N 3.11Å; C190-Q194 VanDerWaalsContact O-N 3.09Å
191L96.3Very high89.8Confident0 Ų047.2 Ų47.20%024%0.242CC..Hα-helixtrans-65.1-46-180-176.563.9000112.4C159 P187 L188 D189 N193 Q194 I195 K205 C208 L209 L212C159-L191 HydrophobicContact CB-CB 4.05Å; P187-L191 PolarHBondContact O-N 3.25Å; L188-L191 PolarHBondContact O-N 3.43Å; D189-L191 PolarHBondContact O-N 2.92Å; L191-N193 VanDerWaalsContact C-N 3.27Å; L191-N193 PolarHBondContact O-N 2.86Å; L191-Q194 WeakPolarHBondContact O-CA 3.46Å; L191-Q194 WeakPolarHBondContact O-CB 3.23Å; L191-Q194 PolarHBondContact O-N 3.48Å; L191-I195 HydrophobicContact CD1-CD1 4.49Å; L191-I195 HydrophobicContact CG-CD1 4.03Å; L191-I195 WeakPolarHBondContact O-CG1 3.41Å; L191-I195 PolarHBondContact O-N 3.19Å; L191-K205 HydrophobicContact CD1-CB 4.34Å; L191-K205 HydrophobicContact CD1-CG 4.46Å; L191-C208 HydrophobicContact CD1-CB 3.96Å; L191-C208 HydrophobicContact CD2-CB 3.75Å; L191-L209 VanDerWaalsContact CD2-CA 3.42Å; L191-L209 HydrophobicContact CD2-CB 3.79Å; L191-L209 HydrophobicContact CD2-CD1 4.31Å; L191-L209 VanDerWaalsContact CD2-N 3.25Å; L191-L212 HydrophobicContact CB-CD1 4.23Å; L191-L212 HydrophobicContact CD2-CD1 3.75Å
192L95.6Very high89.7Confident0 Ų050 Ų500%026%0.255CS..Hα-helixtrans-62.5-36.5178.8-71176000111.3L188 I195 R196 F221 M223 W234 I238 L246L188-L192 HydrophobicContact CD1-CD1 4.25Å; L188-L192 HydrophobicContact CD1-CG 4.07Å; L188-L192 HydrophobicContact CG-CD1 4.04Å; L188-L192 HydrophobicContact CG-CG 4.31Å; L188-L192 WeakPolarHBondContact O-CB 3.36Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 3.13Å; L192-I195 PolarHBondContact O-N 3.24Å; L192-R196 WeakPolarHBondContact O-CB 3.32Å; L192-R196 PolarHBondContact O-N 3.16Å; L192-F221 HydrophobicContact CD1-CD2 3.92Å; L192-F221 HydrophobicContact CD1-CE2 3.61Å; L192-F221 HydrophobicContact CD1-CZ 4.48Å; L192-M223 HydrophobicContact CB-CE 3.75Å; L192-M223 HydrophobicContact CB-SD 3.62Å; L192-M223 HydrophobicContact CD1-CB 4.15Å; L192-W234 HydrophobicContact CB-CH2 4.05Å; L192-W234 HydrophobicContact CB-CZ3 4.18Å; L192-W234 HydrophobicContact CD2-CE3 4.47Å; L192-W234 HydrophobicContact CD2-CZ3 3.86Å; L192-W234 WeakPolarHBondContact O-CH2 3.3Å; L192-I238 HydrophobicContact CD2-CG2 4.26Å; L192-L246 HydrophobicContact CD2-CD1 4.39Å
193N93.4Very high89.8Confident36 Ų3652 Ų5219%0.19326%0.262CS..Hα-helixtrans-63-40.5171.5-79.5-49.1000112.4D189 C190 L191 R196 R197 M223D189-N193 WeakPolarHBondContact O-CB 3.34Å; D189-N193 PolarHBondContact O-N 3.42Å; D189-N193 PolarHBondContact O-ND2 3.5Å; C190-N193 PolarHBondContact O-N 2.88Å; L191-N193 VanDerWaalsContact C-N 3.27Å; L191-N193 PolarHBondContact O-N 2.86Å; N193-R196 PolarHBondContact O-N 3.27Å; N193-R197 WeakPolarHBondContact O-CG 3.19Å; N193-R197 PolarHBondContact O-N 2Å; N193-R197 VanDerWaalsContact O-N 3.11Å; N193-M223 HydrophobicContact CB-SD 4.35Å; N193-M223 PolarHBondContact ND2-SD 2.94Å; N193-M223 VanDerWaalsContact ND2-SD 3.39Å; N193-M223 WeakPolarHBondContact OD1-CE 3.47Å; N193-M223 PolarHBondContact OD1-SD 3.47Å
194Q92.8Very high89.9Confident23 Ų2352.3 Ų52.311%0.10726%0.255CS..Hα-helixtrans-66.1-38.7174.9-71.3-62.1-22.300112.9C190 L191 R197 K205C190-Q194 WeakPolarHBondContact O-CG 3.36Å; C190-Q194 PolarHBondContact O-N 3.11Å; C190-Q194 VanDerWaalsContact O-N 3.09Å; L191-Q194 WeakPolarHBondContact O-CA 3.46Å; L191-Q194 WeakPolarHBondContact O-CB 3.23Å; L191-Q194 PolarHBondContact O-N 3.48Å; Q194-R197 PolarHBondContact O-N 3.04Å; Q194-K205 PolarHBondContact O-NZ 3.25Å
195I93.8Very high89.9Confident0 Ų051.4 Ų51.40%025%0.245CC..Hα-helixtrans-63.6-47.5174.5-70.3170.3000110.1L191 L192 R197 G198 M202 K205 L209 L237 I238L191-I195 HydrophobicContact CD1-CD1 4.49Å; L191-I195 HydrophobicContact CG-CD1 4.03Å; L191-I195 WeakPolarHBondContact O-CG1 3.41Å; L191-I195 PolarHBondContact O-N 3.19Å; L192-I195 PolarHBondContact O-N 3.24Å; I195-R197 VanDerWaalsContact C-N 3.26Å; I195-R197 PolarHBondContact O-N 3.15Å; I195-G198 PolarHBondContact O-N 3.45Å; I195-M202 HydrophobicContact CG2-CE 4.16Å; I195-M202 HydrophobicContact CG2-SD 4.49Å; I195-K205 HydrophobicContact CD1-CB 4.21Å; I195-K205 HydrophobicContact CG1-CB 3.8Å; I195-K205 HydrophobicContact CG1-CD 3.81Å; I195-K205 HydrophobicContact CG1-CG 4.23Å; I195-L209 HydrophobicContact CD1-CD2 4.41Å; I195-L237 HydrophobicContact CG2-CB 3.85Å; I195-L237 HydrophobicContact CG2-CD1 4.44Å; I195-I238 HydrophobicContact CD1-CG2 3.91Å; I195-I238 HydrophobicContact CG2-CG2 3.91Å
196R92.4Very high89.8Confident135 Ų13552.2 Ų52.251%0.50925%0.248SC..Hα-helixtrans-60.4-33.3179.1-168.6-172.968.479.3-1.4113.4L192 N193 G198 W234L192-R196 WeakPolarHBondContact O-CB 3.32Å; L192-R196 PolarHBondContact O-N 3.16Å; N193-R196 PolarHBondContact O-N 3.27Å; R196-G198 PolarHBondContact O-N 3.48Å; R196-W234 HydrophobicContact CB-CH2 3.88Å; R196-W234 HydrophobicContact CB-CZ2 4.39Å; R196-W234 HydrophobicContact CG-CH2 4.35Å; R196-W234 HydrophobicContact CG-CZ2 4.37Å
197R88.4Confident89.5Confident145 Ų14553.8 Ų53.855%0.54726%0.258SS..THydrogen-bonded Turntrans-68.8-14.5177.9-74.5173.4-177.6178.10.7113.2N193 Q194 I195 E199N193-R197 WeakPolarHBondContact O-CG 3.19Å; N193-R197 PolarHBondContact O-N 2Å; N193-R197 VanDerWaalsContact O-N 3.11Å; Q194-R197 PolarHBondContact O-N 3.04Å; I195-R197 VanDerWaalsContact C-N 3.26Å; I195-R197 PolarHBondContact O-N 3.15Å; R197-E199 VanDerWaalsContact C-N 3.25Å; R197-E199 HydrophobicContact CB-CG 4.07Å; R197-E199 PolarHBondContact O-N 2.98Å
198G74.8Confident89.3Confident55 Ų5553.8 Ų53.857%0.56726%0.258SS*.THydrogen-bonded Turntrans7214.9176.700000114.9I195 R196I195-G198 PolarHBondContact O-N 3.45Å; R196-G198 PolarHBondContact O-N 3.48Å
199E67.2Low89.2Confident99 Ų9953.9 Ų53.946%0.46326%0.258SS..  trans-58.1157.2178.5-63.8-68157.700112R197 K205R197-E199 VanDerWaalsContact C-N 3.25Å; R197-E199 HydrophobicContact CB-CG 4.07Å; R197-E199 PolarHBondContact O-N 2.98Å; E199-K205 PolarHBondContact O-NZ 2.91Å
200P72.9Confident89Confident109 Ų10954 Ų5471%0.70826%0.26SS*.SBendtrans-54.3162.6177.622.5-33.7000112.9
201D83.3Confident88.8Confident61 Ų6154.7 Ų54.733%0.32626%0.261SS..  trans72.646.9177.2-152-9.6000116.4R203 R204 K205D201-R203 PolarHBondContact O-N 2.85Å; D201-R203 VanDerWaalsContact O-N 3.17Å; D201-R204 PolarHBondContact O-N 3.49Å; D201-R204 WeakPolarHBondContact OD1-CB 2.86Å; D201-R204 VanDerWaalsContact OD1-CG 3.26Å; D201-R204 WeakPolarHBondContact OD1-CG 3.31Å; D201-R204 PolarHBondContact OD1-N 3.31Å; D201-R204 WeakPolarHBondContact OD2-CD 3.41Å; D201-R204 VanDerWaalsContact OD2-CG 3.24Å; D201-R204 WeakPolarHBondContact OD2-CG 3.31Å; D201-R204 IonicContact OD2-CZ 3.35Å; D201-R204 IonicContact OD2-NE 3.39Å; D201-R204 PolarHBondContact OD2-NE 3.2Å; D201-R204 IonicContact OD2-NH1 2.71Å; D201-R204 PolarHBondContact OD2-NH1 2.95Å; D201-K205 WeakPolarHBondContact O-CG 3.12Å; D201-K205 PolarHBondContact O-N 2.88Å; D201-K205 VanDerWaalsContact O-N 3.17Å
202M88.4Confident88.7Confident61 Ų6154.7 Ų54.730%0.326%0.261SS..Hα-helixtrans-54.7-32171.9-74.8-66.2-93.100112.5I195 K205 H206 L237I195-M202 HydrophobicContact CG2-CE 4.16Å; I195-M202 HydrophobicContact CG2-SD 4.49Å; M202-K205 PolarHBondContact O-N 3.36Å; M202-K205 HydrophobicContact SD-CD 3.83Å; M202-H206 PolarHBondContact O-N 2.87Å; M202-H206 PolarHBondContact O-ND1 3.44Å; M202-L237 HydrophobicContact CE-CD2 4.02Å; M202-L237 WeakPolarHBondContact CE-O 3.41Å
203R88.9Confident88.6Confident185 Ų18555 Ų5570%0.69826%0.262SS*.Hα-helixtrans-60.2-52.2177.1-174.4-179.6178.5-174.40.6111.5D201 K205 H206 V207D201-R203 PolarHBondContact O-N 2.85Å; D201-R203 VanDerWaalsContact O-N 3.17Å; R203-K205 VanDerWaalsContact C-N 3.3Å; R203-K205 PolarHBondContact O-N 3.2Å; R203-H206 PolarHBondContact O-N 3.13Å; R203-V207 WeakPolarHBondContact O-CG2 3.46Å; R203-V207 PolarHBondContact O-N 3.35Å; R203-V207 VanDerWaalsContact O-N 3.11Å
204R90.6Very high88.4Confident123 Ų12353.2 Ų53.246%0.46425%0.253SS..Hα-helixtrans-65-34.4177.5-71.5-168.4-173.7130.6-11.6112.3V162 P164 D201 H206 V207 C208V162-R204 HydrophobicContact CG1-CB 3.58Å; P164-R204 HydrophobicContact CG-CB 4.26Å; P164-R204 HydrophobicContact CG-CG 4.12Å; D201-R204 PolarHBondContact O-N 3.49Å; D201-R204 WeakPolarHBondContact OD1-CB 2.86Å; D201-R204 VanDerWaalsContact OD1-CG 3.26Å; D201-R204 WeakPolarHBondContact OD1-CG 3.31Å; D201-R204 PolarHBondContact OD1-N 3.31Å; D201-R204 WeakPolarHBondContact OD2-CD 3.41Å; D201-R204 VanDerWaalsContact OD2-CG 3.24Å; D201-R204 WeakPolarHBondContact OD2-CG 3.31Å; D201-R204 IonicContact OD2-CZ 3.35Å; D201-R204 IonicContact OD2-NE 3.39Å; D201-R204 PolarHBondContact OD2-NE 3.2Å; D201-R204 IonicContact OD2-NH1 2.71Å; D201-R204 PolarHBondContact OD2-NH1 2.95Å; R204-H206 VanDerWaalsContact C-N 3.34Å; R204-H206 PolarHBondContact O-N 3.47Å; R204-V207 WeakPolarHBondContact O-CB 3.26Å; R204-V207 PolarHBondContact O-N 2.59Å; R204-C208 PolarHBondContact O-N 3.37Å; R204-C208 PolarHBondContact O-SG 3.48Å; R204-C208 VanDerWaalsContact O-SG 3.39Å
205K92.6Very high88.3Confident0 Ų053.5 Ų53.50%025%0.254CS..Hα-helixtrans-60.5-42.5174.6-65.7174.6-176.5174.80112.3V162 L191 Q194 I195 E199 D201 M202 R203 V207 C208 L209V162-K205 HydrophobicContact CB-CG 4.47Å; V162-K205 HydrophobicContact CG1-CB 4.38Å; V162-K205 HydrophobicContact CG1-CG 3.61Å; V162-K205 HydrophobicContact CG2-CG 3.91Å; L191-K205 HydrophobicContact CD1-CB 4.34Å; L191-K205 HydrophobicContact CD1-CG 4.46Å; Q194-K205 PolarHBondContact O-NZ 3.25Å; I195-K205 HydrophobicContact CD1-CB 4.21Å; I195-K205 HydrophobicContact CG1-CB 3.8Å; I195-K205 HydrophobicContact CG1-CD 3.81Å; I195-K205 HydrophobicContact CG1-CG 4.23Å; E199-K205 PolarHBondContact O-NZ 2.91Å; D201-K205 WeakPolarHBondContact O-CG 3.12Å; D201-K205 PolarHBondContact O-N 2.88Å; D201-K205 VanDerWaalsContact O-N 3.17Å; M202-K205 PolarHBondContact O-N 3.36Å; M202-K205 HydrophobicContact SD-CD 3.83Å; R203-K205 VanDerWaalsContact C-N 3.3Å; R203-K205 PolarHBondContact O-N 3.2Å; K205-V207 VanDerWaalsContact C-N 3.34Å; K205-C208 PolarHBondContact O-N 3.14Å; K205-L209 WeakPolarHBondContact O-CB 3.14Å; K205-L209 PolarHBondContact O-N 3.09Å
206H91.4Very high88.3Confident46 Ų4653.5 Ų53.521%0.21325%0.254CS..Hα-helixtrans-66.1-36.3175.2-74.190.1000112.3M202 R203 R204 L209 G210 L237M202-H206 PolarHBondContact O-N 2.87Å; M202-H206 PolarHBondContact O-ND1 3.44Å; R203-H206 PolarHBondContact O-N 3.13Å; R204-H206 VanDerWaalsContact C-N 3.34Å; R204-H206 PolarHBondContact O-N 3.47Å; H206-L209 PolarHBondContact O-N 3.4Å; H206-G210 PolarHBondContact O-N 2.97Å; H206-L237 PolarHBondContact CE1-O 2.83Å; H206-L237 PolarHBondContact NE2-O 2.95Å
207V90.6Very high88.1Confident40 Ų4049.5 Ų49.524%0.24225%0.246CC..Hα-helixtrans-61.8-49.3172.4174.20000110.5P164 R203 R204 K205 L209 G210 Y211P164-V207 HydrophobicContact CB-CB 4.39Å; P164-V207 HydrophobicContact CB-CG1 3.72Å; R203-V207 WeakPolarHBondContact O-CG2 3.46Å; R203-V207 PolarHBondContact O-N 3.35Å; R203-V207 VanDerWaalsContact O-N 3.11Å; R204-V207 WeakPolarHBondContact O-CB 3.26Å; R204-V207 PolarHBondContact O-N 2.59Å; K205-V207 VanDerWaalsContact C-N 3.34Å; V207-L209 VanDerWaalsContact C-N 3.31Å; V207-L209 PolarHBondContact O-N 3Å; V207-G210 WeakPolarHBondContact O-CA 3.15Å; V207-G210 PolarHBondContact O-N 3.49Å; V207-G210 VanDerWaalsContact O-N 3.12Å; V207-Y211 HydrophobicContact CG1-CD2 4.04Å; V207-Y211 HydrophobicContact CG1-CE2 3.43Å; V207-Y211 VanDerWaalsContact CG1-CE2 3.43Å; V207-Y211 PolarHBondContact O-N 3.38Å
208C93.6Very high88.2Confident0 Ų049.3 Ų49.30%025%0.249CC..Hα-helixtrans-59.3-42.5176.2-68.20000112.3L167 L191 R204 K205 G210 Y211 L212L167-C208 HydrophobicContact CD2-CB 3.59Å; L191-C208 HydrophobicContact CD1-CB 3.96Å; L191-C208 HydrophobicContact CD2-CB 3.75Å; R204-C208 PolarHBondContact O-N 3.37Å; R204-C208 PolarHBondContact O-SG 3.48Å; R204-C208 VanDerWaalsContact O-SG 3.39Å; K205-C208 PolarHBondContact O-N 3.14Å; C208-G210 PolarHBondContact O-N 3.16Å; C208-Y211 PolarHBondContact O-N 3.04Å; C208-L212 WeakPolarHBondContact O-CG 3.5Å; C208-L212 PolarHBondContact O-N 2.97Å
209L94.8Very high89Confident4 Ų448 Ų482%0.02123%0.228CC..Hα-helixtrans-59.9-41.8177.6179.357.8000110.2L188 L191 I195 K205 H206 V207 L212 I213 I238 A242 L246L188-L209 HydrophobicContact CD1-CD1 3.62Å; L191-L209 VanDerWaalsContact CD2-CA 3.42Å; L191-L209 HydrophobicContact CD2-CB 3.79Å; L191-L209 HydrophobicContact CD2-CD1 4.31Å; L191-L209 VanDerWaalsContact CD2-N 3.25Å; I195-L209 HydrophobicContact CD1-CD2 4.41Å; K205-L209 WeakPolarHBondContact O-CB 3.14Å; K205-L209 PolarHBondContact O-N 3.09Å; H206-L209 PolarHBondContact O-N 3.4Å; V207-L209 VanDerWaalsContact C-N 3.31Å; V207-L209 PolarHBondContact O-N 3Å; L209-L212 PolarHBondContact O-N 3.22Å; L209-I213 HydrophobicContact CD1-CD1 4.15Å; L209-I213 HydrophobicContact CD1-CG1 4.45Å; L209-I213 HydrophobicContact CG-CD1 3.91Å; L209-I213 WeakPolarHBondContact O-CG1 3.38Å; L209-I213 PolarHBondContact O-N 2.94Å; L209-I238 HydrophobicContact CD2-CB 3.8Å; L209-I238 HydrophobicContact CD2-CG2 3.75Å; L209-A242 HydrophobicContact CD2-CB 4.2Å; L209-L246 HydrophobicContact CD1-CD1 4.19Å
210G91.6Very high90.1Very high3 Ų349.2 Ų49.23%0.03123%0.233CC..Hα-helixtrans-61.7-45.3176.300000114.8H206 V207 C208 I213 L214H206-G210 PolarHBondContact O-N 2.97Å; V207-G210 WeakPolarHBondContact O-CA 3.15Å; V207-G210 PolarHBondContact O-N 3.49Å; V207-G210 VanDerWaalsContact O-N 3.12Å; C208-G210 PolarHBondContact O-N 3.16Å; G210-I213 PolarHBondContact O-N 3.21Å; G210-L214 WeakPolarHBondContact O-CB 3.41Å; G210-L214 PolarHBondContact O-N 2.9Å
211Y92.1Very high91.2Very high24 Ų2445 Ų459%0.09420%0.204CC..Hα-helixtrans-61.7-43.9173.2-64-36000111.6P164 L167 I168 V207 C208 I213 L214 F215 F283P164-Y211 HydrophobicContact CB-CD2 4.42Å; P164-Y211 HydrophobicContact CB-CE2 3.9Å; L167-Y211 HydrophobicContact CD2-CD2 4.4Å; I168-Y211 HydrophobicContact CB-CD1 4.49Å; I168-Y211 HydrophobicContact CB-CD2 3.86Å; I168-Y211 HydrophobicContact CB-CE1 4.36Å; I168-Y211 HydrophobicContact CB-CE2 3.7Å; I168-Y211 HydrophobicContact CB-CG 4.26Å; I168-Y211 HydrophobicContact CD1-CD1 3.61Å; I168-Y211 HydrophobicContact CD1-CD2 4.35Å; I168-Y211 HydrophobicContact CD1-CE1 3.92Å; I168-Y211 HydrophobicContact CD1-CG 3.86Å; I168-Y211 HydrophobicContact CG1-CD1 4.11Å; I168-Y211 HydrophobicContact CG1-CD2 4.37Å; I168-Y211 HydrophobicContact CG1-CE1 3.94Å; I168-Y211 HydrophobicContact CG1-CE2 4.2Å; I168-Y211 HydrophobicContact CG1-CG 4.33Å; I168-Y211 HydrophobicContact CG2-CE2 4.14Å; V207-Y211 HydrophobicContact CG1-CD2 4.04Å; V207-Y211 HydrophobicContact CG1-CE2 3.43Å; V207-Y211 VanDerWaalsContact CG1-CE2 3.43Å; V207-Y211 PolarHBondContact O-N 3.38Å; C208-Y211 PolarHBondContact O-N 3.04Å; Y211-I213 PolarHBondContact O-N 3.19Å; Y211-L214 WeakPolarHBondContact O-CB 3.42Å; Y211-L214 PolarHBondContact O-N 3.29Å; Y211-F215 VanDerWaalsContact O-CD2 3.28Å; Y211-F215 WeakPolarHBondContact O-CD2 3.21Å; Y211-F215 PolarHBondContact O-N 3.24Å; Y211-F283 HydrophobicContact CE1-CB 4.44Å
212L94.6Very high91.6Very high0 Ų047.7 Ų47.70%021%0.214CC..Hα-helixtrans-61.8-43.9176.5-69.1174.3000112L167 L171 P187 L188 L191 C208 L209 L214 F215 M216L167-L212 HydrophobicContact CD1-CD2 4.24Å; L167-L212 HydrophobicContact CD2-CG 4.34Å; L171-L212 HydrophobicContact CD1-CD2 4.44Å; P187-L212 HydrophobicContact CB-CD2 4.21Å; L188-L212 HydrophobicContact CB-CD1 4.01Å; L188-L212 HydrophobicContact CD1-CB 4.42Å; L188-L212 HydrophobicContact CD1-CD1 3.88Å; L191-L212 HydrophobicContact CB-CD1 4.23Å; L191-L212 HydrophobicContact CD2-CD1 3.75Å; C208-L212 WeakPolarHBondContact O-CG 3.5Å; C208-L212 PolarHBondContact O-N 2.97Å; L209-L212 PolarHBondContact O-N 3.22Å; L212-L214 VanDerWaalsContact C-N 3.28Å; L212-L214 PolarHBondContact O-N 3.41Å; L212-F215 PolarHBondContact O-N 2.89Å; L212-M216 HydrophobicContact CB-SD 4.3Å; L212-M216 WeakPolarHBondContact O-CB 3.15Å; L212-M216 WeakPolarHBondContact O-CG 3.34Å; L212-M216 PolarHBondContact O-N 2.68Å
213I92.9Very high91.8Very high5 Ų544.9 Ų44.93%0.02620%0.2CC..Hα-helixtrans-58.6-42.9175.4-73.1164.5000111L209 G210 Y211 F215 M216 F219 A242 W245 L246 V256 Q260L209-I213 HydrophobicContact CD1-CD1 4.15Å; L209-I213 HydrophobicContact CD1-CG1 4.45Å; L209-I213 HydrophobicContact CG-CD1 3.91Å; L209-I213 WeakPolarHBondContact O-CG1 3.38Å; L209-I213 PolarHBondContact O-N 2.94Å; G210-I213 PolarHBondContact O-N 3.21Å; Y211-I213 PolarHBondContact O-N 3.19Å; I213-F215 VanDerWaalsContact C-N 3.32Å; I213-F215 PolarHBondContact O-N 3.22Å; I213-M216 PolarHBondContact O-N 3.24Å; I213-F219 HydrophobicContact CB-CE1 4.46Å; I213-F219 HydrophobicContact CG1-CE1 4.18Å; I213-F219 HydrophobicContact CG1-CZ 4.43Å; I213-F219 HydrophobicContact CG2-CE1 4.44Å; I213-F219 HydrophobicContact CG2-CZ 4.17Å; I213-A242 HydrophobicContact CD1-CB 4.19Å; I213-W245 HydrophobicContact CD1-CE3 4.22Å; I213-W245 HydrophobicContact CG2-CE3 3.91Å; I213-W245 HydrophobicContact CG2-CZ3 4.12Å; I213-L246 HydrophobicContact CG1-CD2 4.37Å; I213-V256 HydrophobicContact CG2-CG1 4.22Å; I213-Q260 PolarHBondContact O-NE2 2.92Å
214L89.3Confident91.9Very high0 Ų039.3 Ų39.30%018%0.181CC..Hα-helixtrans-63.7-36.4178.6174.660.2000112.4G210 Y211 L212 M259 Q260 P280 F283G210-L214 WeakPolarHBondContact O-CB 3.41Å; G210-L214 PolarHBondContact O-N 2.9Å; Y211-L214 WeakPolarHBondContact O-CB 3.42Å; Y211-L214 PolarHBondContact O-N 3.29Å; L212-L214 VanDerWaalsContact C-N 3.28Å; L212-L214 PolarHBondContact O-N 3.41Å; L214-M259 HydrophobicContact CD1-CB 3.43Å; L214-M259 VanDerWaalsContact CD1-CB 3.43Å; L214-M259 HydrophobicContact CD1-CG 4.46Å; L214-Q260 WeakPolarHBondContact O-CG 3.46Å; L214-P280 HydrophobicContact CD2-CB 4.03Å; L214-F283 HydrophobicContact CB-CD1 4.44Å; L214-F283 HydrophobicContact CB-CE1 4.31Å; L214-F283 HydrophobicContact CD2-CB 4.35Å; L214-F283 HydrophobicContact CD2-CD1 3.71Å; L214-F283 HydrophobicContact CD2-CE1 4.21Å; L214-F283 HydrophobicContact CD2-CG 4.19Å
215F91.1Very high91.8Very high29 Ų2935.1 Ų35.113%0.12718%0.176CC..Hα-helixtrans-95-7.8-177.9-75.5-97.7000113.7I168 L171 P177 Y211 L212 I213 P217 T263 P280I168-F215 HydrophobicContact CD1-CD2 4.43Å; I168-F215 HydrophobicContact CD1-CE2 3.5Å; I168-F215 HydrophobicContact CD1-CZ 4.04Å; L171-F215 HydrophobicContact CB-CD1 3.86Å; L171-F215 HydrophobicContact CB-CD2 3.96Å; L171-F215 HydrophobicContact CB-CE1 3.93Å; L171-F215 HydrophobicContact CB-CE2 4.04Å; L171-F215 HydrophobicContact CB-CG 3.87Å; L171-F215 HydrophobicContact CB-CZ 4.01Å; L171-F215 HydrophobicContact CD1-CB 4.21Å; L171-F215 HydrophobicContact CD1-CD2 3.86Å; L171-F215 HydrophobicContact CD1-CE2 4.45Å; L171-F215 HydrophobicContact CD1-CG 4.07Å; L171-F215 HydrophobicContact CD2-CB 3.98Å; L171-F215 HydrophobicContact CD2-CG 4.2Å; L171-F215 HydrophobicContact CG-CB 4.48Å; L171-F215 HydrophobicContact CG-CD2 4.41Å; L171-F215 HydrophobicContact CG-CG 4.27Å; L171-F215 WeakPolarHBondContact O-CE1 3.27Å; P177-F215 HydrophobicContact CG-CB 4.4Å; P177-F215 WeakPolarHBondContact CG-O 3.33Å; Y211-F215 VanDerWaalsContact O-CD2 3.28Å; Y211-F215 WeakPolarHBondContact O-CD2 3.21Å; Y211-F215 PolarHBondContact O-N 3.24Å; L212-F215 PolarHBondContact O-N 2.89Å; I213-F215 VanDerWaalsContact C-N 3.32Å; I213-F215 PolarHBondContact O-N 3.22Å; F215-P217 WeakPolarHBondContact O-CD 3.43Å; F215-T263 HydrophobicContact CE1-CG2 4.12Å; F215-T263 HydrophobicContact CZ-CG2 4.18Å; F215-P280 HydrophobicContact CE2-CB 3.9Å; F215-P280 HydrophobicContact CZ-CB 3.65Å; F215-P280 HydrophobicContact CZ-CG 4.32Å
216M92.3Very high91.7Very high0 Ų041.2 Ų41.20%020%0.203CC..  trans-10587.7177.6-67.3178.380.400111.7P177 Y178 L188 L212 I213 K218 F219 Q260P177-M216 HydrophobicContact CB-CG 3.59Å; P177-M216 HydrophobicContact CB-SD 4.34Å; P177-M216 HydrophobicContact CG-CG 3.8Å; Y178-M216 HydrophobicContact CD1-CE 3.77Å; Y178-M216 HydrophobicContact CE1-CB 4.38Å; Y178-M216 HydrophobicContact CE1-CE 3.46Å; Y178-M216 VanDerWaalsContact CE1-CE 3.46Å; Y178-M216 HydrophobicContact CE1-CG 4.16Å; Y178-M216 WeakPolarHBondContact OH-CA 3.41Å; L188-M216 HydrophobicContact CB-CE 4.42Å; L188-M216 HydrophobicContact CB-SD 4.06Å; L188-M216 HydrophobicContact CD2-CE 4.06Å; L188-M216 HydrophobicContact CD2-SD 3.92Å; L212-M216 HydrophobicContact CB-SD 4.3Å; L212-M216 WeakPolarHBondContact O-CB 3.15Å; L212-M216 WeakPolarHBondContact O-CG 3.34Å; L212-M216 PolarHBondContact O-N 2.68Å; I213-M216 PolarHBondContact O-N 3.24Å; M216-K218 PolarHBondContact O-N 2.97Å; M216-F219 HydrophobicContact CB-CD1 4.11Å; M216-F219 HydrophobicContact CB-CE1 4.15Å; M216-F219 WeakPolarHBondContact O-CE1 3.38Å; M216-Q260 PolarHBondContact O-NE2 3.28Å
217P88.5Confident91.6Very high51 Ų5139 Ų3933%0.33119%0.193SC..SBendtrans-61.9-26.9177.428.3-40000113.6Y178 F215 Q264Y178-P217 VanDerWaalsContact OH-CD 3.28Å; Y178-P217 WeakPolarHBondContact OH-CD 3.31Å; F215-P217 WeakPolarHBondContact O-CD 3.43Å; P217-Q264 VanDerWaalsContact CG-NE2 3.32Å
218K91Very high91.6Very high140 Ų14041.9 Ų41.961%0.60920%0.203SC*.SBendtrans-124.1134.5172.8-64.1-175.9179.2-178.80109Y178 M216 H220Y178-K218 WeakPolarHBondContact CE1-O 3.4Å; Y178-K218 VanDerWaalsContact CZ-O 3.31Å; Y178-K218 PolarHBondContact OH-N 3.36Å; Y178-K218 VanDerWaalsContact OH-N 3.13Å; Y178-K218 PolarHBondContact OH-O 3.09Å; M216-K218 PolarHBondContact O-N 2.97Å; K218-H220 PolarHBondContact O-N 2.8Å
219F91.5Very high91.6Very high29 Ų2949.8 Ų49.813%0.12724%0.238CC..  trans-89.494.2179.6-56.3-57.3000110.8I213 M216 F221 W245 L246 P252I213-F219 HydrophobicContact CB-CE1 4.46Å; I213-F219 HydrophobicContact CG1-CE1 4.18Å; I213-F219 HydrophobicContact CG1-CZ 4.43Å; I213-F219 HydrophobicContact CG2-CE1 4.44Å; I213-F219 HydrophobicContact CG2-CZ 4.17Å; M216-F219 HydrophobicContact CB-CD1 4.11Å; M216-F219 HydrophobicContact CB-CE1 4.15Å; M216-F219 WeakPolarHBondContact O-CE1 3.38Å; F219-F221 HydrophobicContact CB-CD1 4.12Å; F219-F221 HydrophobicContact CB-CE1 3.92Å; F219-W245 WeakPolarHBondContact CD2-O 3.49Å; F219-W245 HydrophobicContact CE2-CB 3.96Å; F219-W245 VanDerWaalsContact CE2-O 3.29Å; F219-W245 WeakPolarHBondContact CE2-O 3.39Å; F219-W245 HydrophobicContact CZ-CB 4.34Å; F219-L246 HydrophobicContact CB-CD2 4.49Å; F219-L246 HydrophobicContact CD1-CD2 3.64Å; F219-L246 HydrophobicContact CD2-CD2 4.37Å; F219-L246 HydrophobicContact CE1-CD2 3.9Å; F219-L246 HydrophobicContact CG-CD2 3.91Å; F219-L246 HydrophobicContact CZ-CD2 4.36Å; F219-P252 HydrophobicContact CE2-CG 4.01Å; F219-P252 HydrophobicContact CZ-CG 4Å
220H90.8Very high91.5Very high123 Ų12353.9 Ų53.957%0.56926%0.259SS*.  trans-114.1109.1171.4-56.2143.3000108.9Y178 K218Y178-H220 HydrophobicContact CD1-CB 4.47Å; Y178-H220 HydrophobicContact CE1-CB 4.44Å; K218-H220 PolarHBondContact O-N 2.8Å
221F94.7Very high91.5Very high22 Ų2256.6 Ų56.610%0.09628%0.276CS..  trans-159.2154.3-177.665.6-79.2000109.6T186 L188 L192 F219 M223 K224 L246T186-F221 HydrophobicContact CG2-CB 4.48Å; L188-F221 HydrophobicContact CD2-CB 4.15Å; L188-F221 HydrophobicContact CD2-CD1 3.76Å; L188-F221 HydrophobicContact CD2-CD2 4.24Å; L188-F221 HydrophobicContact CD2-CE1 4.21Å; L188-F221 HydrophobicContact CD2-CG 3.8Å; L188-F221 HydrophobicContact CG-CG 4.41Å; L192-F221 HydrophobicContact CD1-CD2 3.92Å; L192-F221 HydrophobicContact CD1-CE2 3.61Å; L192-F221 HydrophobicContact CD1-CZ 4.48Å; F219-F221 HydrophobicContact CB-CD1 4.12Å; F219-F221 HydrophobicContact CB-CE1 3.92Å; F221-M223 HydrophobicContact CD2-CB 3.94Å; F221-M223 HydrophobicContact CE2-CB 4.05Å; F221-K224 HydrophobicContact CD2-CB 4.39Å; F221-K224 HydrophobicContact CE1-CB 4.04Å; F221-K224 HydrophobicContact CE1-CD 4.5Å; F221-K224 HydrophobicContact CE1-CG 4.34Å; F221-K224 VanDerWaalsContact CE2-CA 3.49Å; F221-K224 HydrophobicContact CE2-CB 3.88Å; F221-K224 HydrophobicContact CZ-CB 3.68Å; F221-K224 HydrophobicContact CZ-CG 4.07Å; F221-L246 HydrophobicContact CE1-CB 4.44Å; F221-L246 HydrophobicContact CE1-CD2 4.35Å; F221-L246 HydrophobicContact CZ-CB 4.17Å
222Q93.1Very high91.6Very high116 Ų11657.8 Ų57.854%0.54230%0.296SS..THydrogen-bonded Turntrans-72.9-32.5-172.9-71.8-15517.600114D183 G184 D189 K224D183-Q222 PolarHBondContact O-NE2 3.35Å; G184-Q222 VanDerWaalsContact CA-NE2 3.28Å; G184-Q222 WeakPolarHBondContact O-CG 3.13Å; G184-Q222 PolarHBondContact O-NE2 3.23Å; D189-Q222 PolarHBondContact OD1-N 3.49Å; D189-Q222 PolarHBondContact OD2-N 3.48Å; Q222-K224 PolarHBondContact O-N 3.42Å; Q222-K224 VanDerWaalsContact O-N 3.15Å
223M91Very high91.5Very high3 Ų362.3 Ų62.32%0.01532%0.32CS..THydrogen-bonded Turntrans-73.6-2.9-173.5-71.7-174.666.900114.1D189 L192 N193 F221 G225 K226 L227 W234D189-M223 HydrophobicContact CB-CG 4.2Å; D189-M223 HydrophobicContact CB-SD 4.25Å; D189-M223 WeakPolarHBondContact OD1-CB 3.21Å; D189-M223 VanDerWaalsContact OD1-CG 3.27Å; D189-M223 WeakPolarHBondContact OD1-CG 3.36Å; D189-M223 PolarHBondContact OD1-N 2.76Å; L192-M223 HydrophobicContact CB-CE 3.75Å; L192-M223 HydrophobicContact CB-SD 3.62Å; L192-M223 HydrophobicContact CD1-CB 4.15Å; N193-M223 HydrophobicContact CB-SD 4.35Å; N193-M223 PolarHBondContact ND2-SD 2.94Å; N193-M223 VanDerWaalsContact ND2-SD 3.39Å; N193-M223 WeakPolarHBondContact OD1-CE 3.47Å; N193-M223 PolarHBondContact OD1-SD 3.47Å; F221-M223 HydrophobicContact CD2-CB 3.94Å; F221-M223 HydrophobicContact CE2-CB 4.05Å; M223-G225 VanDerWaalsContact C-N 3.34Å; M223-G225 PolarHBondContact O-N 3.28Å; M223-K226 WeakPolarHBondContact O-CA 3.44Å; M223-K226 WeakPolarHBondContact O-CB 3.18Å; M223-K226 PolarHBondContact O-N 2.99Å; M223-L227 PolarHBondContact O-N 3.15Å; M223-W234 HydrophobicContact CE-CH2 3.68Å; M223-W234 HydrophobicContact CE-CZ2 3.85Å
224K91.3Very high91.6Very high68 Ų6862.3 Ų62.330%0.29632%0.32SS..Hα-helixtrans-53.1-47.7-176.6-172.1173179.6175.80112.7F221 Q222 K226 L227 E228 S247F221-K224 HydrophobicContact CD2-CB 4.39Å; F221-K224 HydrophobicContact CE1-CB 4.04Å; F221-K224 HydrophobicContact CE1-CD 4.5Å; F221-K224 HydrophobicContact CE1-CG 4.34Å; F221-K224 VanDerWaalsContact CE2-CA 3.49Å; F221-K224 HydrophobicContact CE2-CB 3.88Å; F221-K224 HydrophobicContact CZ-CB 3.68Å; F221-K224 HydrophobicContact CZ-CG 4.07Å; Q222-K224 PolarHBondContact O-N 3.42Å; Q222-K224 VanDerWaalsContact O-N 3.15Å; K224-K226 VanDerWaalsContact C-N 3.29Å; K224-K226 PolarHBondContact O-N 3.47Å; K224-L227 WeakPolarHBondContact O-CB 3.47Å; K224-L227 PolarHBondContact O-N 3.48Å; K224-L227 VanDerWaalsContact O-N 3.09Å; K224-E228 WeakPolarHBondContact CE-OE1 3.47Å; K224-E228 WeakPolarHBondContact O-CG 3.21Å; K224-E228 PolarHBondContact O-N 3.36Å; K224-S247 VanDerWaalsContact CE-O 3.24Å; K224-S247 WeakPolarHBondContact CE-O 3.45Å; K224-S247 PolarHBondContact NZ-O 3.28Å
225G89.3Confident91.8Very high35 Ų3565.3 Ų65.336%0.36133%0.334SS..Hα-helixtrans-66.6-25.5177.900000114.3M223 K229M223-G225 VanDerWaalsContact C-N 3.34Å; M223-G225 PolarHBondContact O-N 3.28Å; G225-K229 WeakPolarHBondContact O-CD 3.44Å; G225-K229 VanDerWaalsContact O-CG 3.23Å; G225-K229 WeakPolarHBondContact O-CG 3.35Å; G225-K229 PolarHBondContact O-N 2.92Å
226K89.4Confident91.8Very high128 Ų12867.2 Ų67.256%0.55736%0.361SS*.Hα-helixtrans-77-31173.3-67.3177.7-178.7169.90111.7M223 K224 W234M223-K226 WeakPolarHBondContact O-CA 3.44Å; M223-K226 WeakPolarHBondContact O-CB 3.18Å; M223-K226 PolarHBondContact O-N 2.99Å; K224-K226 VanDerWaalsContact C-N 3.29Å; K224-K226 PolarHBondContact O-N 3.47Å; K226-W234 PolarHBondContact O-NE1 3.02Å
227L89.7Confident91.8Very high0 Ų068.8 Ų68.80%037%0.37CS..Hα-helixtrans-67.5-47176.3-172.4150.3000110.5M223 K224 K229 N230 W234 I238 F243 L246 S247M223-L227 PolarHBondContact O-N 3.15Å; K224-L227 WeakPolarHBondContact O-CB 3.47Å; K224-L227 PolarHBondContact O-N 3.48Å; K224-L227 VanDerWaalsContact O-N 3.09Å; L227-K229 VanDerWaalsContact C-N 3.33Å; L227-K229 PolarHBondContact O-N 2.84Å; L227-N230 PolarHBondContact O-N 3.42Å; L227-W234 VanDerWaalsContact CA-CD1 3.49Å; L227-W234 HydrophobicContact CB-CG 4.47Å; L227-W234 HydrophobicContact CG-CB 4.21Å; L227-W234 HydrophobicContact CG-CD2 4.3Å; L227-W234 HydrophobicContact CG-CG 3.98Å; L227-I238 HydrophobicContact CD1-CD1 4.12Å; L227-F243 HydrophobicContact CD2-CD2 3.46Å; L227-F243 VanDerWaalsContact CD2-CD2 3.46Å; L227-F243 HydrophobicContact CD2-CE2 3.26Å; L227-F243 HydrophobicContact CD2-CG 4.47Å; L227-F243 HydrophobicContact CD2-CZ 4.14Å; L227-F243 HydrophobicContact CG-CD2 4.01Å; L227-F243 HydrophobicContact CG-CE2 3.97Å; L227-L246 HydrophobicContact CD1-CB 4.1Å; L227-L246 HydrophobicContact CD1-CD1 4.21Å; L227-S247 WeakPolarHBondContact CD2-OG 3.26Å
228E90.8Very high92Very high99 Ų9966.7 Ų66.746%0.46336%0.356SS..Hα-helixtrans-65.8-30.1178.3-69168.5176.500113.8K224 N230K224-E228 WeakPolarHBondContact CE-OE1 3.47Å; K224-E228 WeakPolarHBondContact O-CG 3.21Å; K224-E228 PolarHBondContact O-N 3.36Å; E228-N230 VanDerWaalsContact C-N 3.34Å; E228-N230 PolarHBondContact O-N 3.49Å
229K93.6Very high92Very high167 Ų16761.4 Ų61.473%0.72634%0.341SS*.Hα-helixtrans-70.8-24.6179.4-78.6174.4-175.2-173.60114.4G225 L227G225-K229 WeakPolarHBondContact O-CD 3.44Å; G225-K229 VanDerWaalsContact O-CG 3.23Å; G225-K229 WeakPolarHBondContact O-CG 3.35Å; G225-K229 PolarHBondContact O-N 2.92Å; L227-K229 VanDerWaalsContact C-N 3.33Å; L227-K229 PolarHBondContact O-N 2.84Å
230N92.4Very high92Very high89 Ų8964.1 Ų64.148%0.47635%0.354SS..  trans-133.962.9-174.9-63-78.8000111.3L227 E228 G232 L233 W234L227-N230 PolarHBondContact O-N 3.42Å; E228-N230 VanDerWaalsContact C-N 3.34Å; E228-N230 PolarHBondContact O-N 3.49Å; N230-G232 PolarHBondContact O-N 2.99Å; N230-L233 HydrophobicContact CB-CB 4.15Å; N230-L233 HydrophobicContact CB-CD2 4.44Å; N230-L233 PolarHBondContact O-N 3.38Å; N230-W234 VanDerWaalsContact O-CD1 3.23Å; N230-W234 PolarHBondContact O-N 3.14Å
231P92.8Very high92Very high60 Ų6062.9 Ų62.939%0.3935%0.349SS..Hα-helixtrans-57.3-49.2-170.522.1-33.1000112.6L233 W234 Q235 F243P231-L233 VanDerWaalsContact C-N 3.31Å; P231-L233 PolarHBondContact O-N 3.19Å; P231-W234 PolarHBondContact O-N 3.3Å; P231-W234 VanDerWaalsContact O-N 3.11Å; P231-Q235 WeakPolarHBondContact O-CB 3.49Å; P231-Q235 VanDerWaalsContact O-CG 3.26Å; P231-Q235 WeakPolarHBondContact O-CG 3.37Å; P231-Q235 PolarHBondContact O-N 2.97Å; P231-F243 HydrophobicContact CB-CE1 4.26Å; P231-F243 HydrophobicContact CB-CE2 4.17Å; P231-F243 HydrophobicContact CB-CZ 3.6Å
232G93.3Very high91.9Very high50 Ų5062.3 Ų62.352%0.51535%0.348SS..Hα-helixtrans-60.7-35.9-178.200000114.1N230 G236N230-G232 PolarHBondContact O-N 2.99Å; G232-G236 PolarHBondContact O-N 3.17Å
233L93.4Very high91.9Very high94 Ų9457.2 Ų57.249%0.49232%0.324SS..Hα-helixtrans-64.7-49174.8178.172.7000110.6N230 P231 G236 L237N230-L233 HydrophobicContact CB-CB 4.15Å; N230-L233 HydrophobicContact CB-CD2 4.44Å; N230-L233 PolarHBondContact O-N 3.38Å; P231-L233 VanDerWaalsContact C-N 3.31Å; P231-L233 PolarHBondContact O-N 3.19Å; L233-G236 PolarHBondContact O-N 3.31Å; L233-L237 HydrophobicContact CD1-CD1 4.18Å; L233-L237 HydrophobicContact CD2-CD1 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.96Å; L233-L237 WeakPolarHBondContact O-CG 3.36Å; L233-L237 PolarHBondContact O-N 3.09Å
234W93.8Very high92.1Very high5 Ų559.8 Ų59.82%0.01934%0.336CS..Hα-helixtrans-71.4-38.1-176.4-72.7105.5000112.4L192 R196 M223 K226 L227 N230 P231 G236 L237 I238 F243L192-W234 HydrophobicContact CB-CH2 4.05Å; L192-W234 HydrophobicContact CB-CZ3 4.18Å; L192-W234 HydrophobicContact CD2-CE3 4.47Å; L192-W234 HydrophobicContact CD2-CZ3 3.86Å; L192-W234 WeakPolarHBondContact O-CH2 3.3Å; R196-W234 HydrophobicContact CB-CH2 3.88Å; R196-W234 HydrophobicContact CB-CZ2 4.39Å; R196-W234 HydrophobicContact CG-CH2 4.35Å; R196-W234 HydrophobicContact CG-CZ2 4.37Å; M223-W234 HydrophobicContact CE-CH2 3.68Å; M223-W234 HydrophobicContact CE-CZ2 3.85Å; K226-W234 PolarHBondContact O-NE1 3.02Å; L227-W234 VanDerWaalsContact CA-CD1 3.49Å; L227-W234 HydrophobicContact CB-CG 4.47Å; L227-W234 HydrophobicContact CG-CB 4.21Å; L227-W234 HydrophobicContact CG-CD2 4.3Å; L227-W234 HydrophobicContact CG-CG 3.98Å; N230-W234 VanDerWaalsContact O-CD1 3.23Å; N230-W234 PolarHBondContact O-N 3.14Å; P231-W234 PolarHBondContact O-N 3.3Å; P231-W234 VanDerWaalsContact O-N 3.11Å; W234-G236 PolarHBondContact O-N 3.3Å; W234-L237 HydrophobicContact CE3-CD1 4.36Å; W234-L237 PolarHBondContact O-N 2.68Å; W234-I238 HydrophobicContact CE3-CG2 4.37Å; W234-I238 WeakPolarHBondContact O-CG1 3.21Å; W234-I238 PolarHBondContact O-N 3.43Å; W234-F243 HydrophobicContact CB-CD2 3.68Å; W234-F243 HydrophobicContact CB-CE2 4Å
235Q93.6Very high92.2Very high63 Ų6357.4 Ų57.429%0.29433%0.326SS..Hα-helixtrans-55.2-41.7171-71.9170.1-38.700111.4P231 G239 E240 F243P231-Q235 WeakPolarHBondContact O-CB 3.49Å; P231-Q235 VanDerWaalsContact O-CG 3.26Å; P231-Q235 WeakPolarHBondContact O-CG 3.37Å; P231-Q235 PolarHBondContact O-N 2.97Å; Q235-G239 CarbonylContact O-C 3.43Å; Q235-G239 WeakPolarHBondContact O-CA 3.47Å; Q235-G239 PolarHBondContact O-N 3.17Å; Q235-E240 WeakPolarHBondContact CG-OE2 3.18Å; Q235-E240 PolarHBondContact NE2-OE1 2.92Å; Q235-E240 PolarHBondContact NE2-OE2 3.48Å; Q235-F243 HydrophobicContact CG-CB 4.13Å; Q235-F243 HydrophobicContact CG-CD1 3.67Å; Q235-F243 HydrophobicContact CG-CD2 4.24Å; Q235-F243 HydrophobicContact CG-CE1 4.16Å; Q235-F243 HydrophobicContact CG-CG 3.74Å
236G91.3Very high92.5Very high69 Ų6955.8 Ų55.871%0.71131%0.309SS*.Hα-helixtrans-69.4-31.1175.100000114.6G232 L233 W234G232-G236 PolarHBondContact O-N 3.17Å; L233-G236 PolarHBondContact O-N 3.31Å; W234-G236 PolarHBondContact O-N 3.3Å
237L92.7Very high92.6Very high34 Ų3450.2 Ų50.218%0.17829%0.285CS..Hα-helixtrans-86.7-38.8-175.6-74.3176.2000114.6I195 M202 H206 L233 W234I195-L237 HydrophobicContact CG2-CB 3.85Å; I195-L237 HydrophobicContact CG2-CD1 4.44Å; M202-L237 HydrophobicContact CE-CD2 4.02Å; M202-L237 WeakPolarHBondContact CE-O 3.41Å; H206-L237 PolarHBondContact CE1-O 2.83Å; H206-L237 PolarHBondContact NE2-O 2.95Å; L233-L237 HydrophobicContact CD1-CD1 4.18Å; L233-L237 HydrophobicContact CD2-CD1 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.96Å; L233-L237 WeakPolarHBondContact O-CG 3.36Å; L233-L237 PolarHBondContact O-N 3.09Å; W234-L237 HydrophobicContact CE3-CD1 4.36Å; W234-L237 PolarHBondContact O-N 2.68Å
238I92.1Very high92.7Very high6 Ų652.7 Ų52.73%0.03131%0.311CS..Hα-helixtrans-116-5.8-175.558162.1000113.5L192 I195 L209 L227 W234 A242 F243 L246L192-I238 HydrophobicContact CD2-CG2 4.26Å; I195-I238 HydrophobicContact CD1-CG2 3.91Å; I195-I238 HydrophobicContact CG2-CG2 3.91Å; L209-I238 HydrophobicContact CD2-CB 3.8Å; L209-I238 HydrophobicContact CD2-CG2 3.75Å; L227-I238 HydrophobicContact CD1-CD1 4.12Å; W234-I238 HydrophobicContact CE3-CG2 4.37Å; W234-I238 WeakPolarHBondContact O-CG1 3.21Å; W234-I238 PolarHBondContact O-N 3.43Å; I238-A242 HydrophobicContact CB-CB 4.42Å; I238-A242 HydrophobicContact CD1-CB 4.3Å; I238-A242 WeakPolarHBondContact O-CB 3.5Å; I238-F243 HydrophobicContact CD1-CB 4.08Å; I238-F243 HydrophobicContact CG1-CB 4.32Å; I238-L246 HydrophobicContact CD1-CD1 3.85Å
239G91.6Very high92.8Very high30 Ų3054.1 Ų54.131%0.30932%0.322SS..  trans85.8152.7-175.100000113.1Q235 Q241 A242 F243Q235-G239 CarbonylContact O-C 3.43Å; Q235-G239 WeakPolarHBondContact O-CA 3.47Å; Q235-G239 PolarHBondContact O-N 3.17Å; G239-Q241 PolarHBondContact O-N 2.59Å; G239-A242 PolarHBondContact O-N 3.41Å; G239-F243 WeakPolarHBondContact O-CB 3.5Å; G239-F243 PolarHBondContact O-N 3.47Å
240E91.9Very high92.6Very high85 Ų8547.5 Ų47.540%0.39730%0.296SS..Hα-helixtrans-55.8-47.4-178-175.859.6-149.800112.3Q235 F243 Q244Q235-E240 WeakPolarHBondContact CG-OE2 3.18Å; Q235-E240 PolarHBondContact NE2-OE1 2.92Å; Q235-E240 PolarHBondContact NE2-OE2 3.48Å; E240-F243 WeakPolarHBondContact O-CB 3.39Å; E240-F243 PolarHBondContact O-N 3.11Å; E240-Q244 WeakPolarHBondContact O-CG 3.31Å; E240-Q244 PolarHBondContact O-N 3.21Å; E240-Q244 PolarHBondContact OE1-NE2 2.74Å
241Q90.8Very high92.6Very high97 Ų9747.8 Ų47.845%0.45330%0.303SS..Hα-helixtrans-64.6-47.3-174.5-169.664.569.900112.4G239 F243 Q244 W245G239-Q241 PolarHBondContact O-N 2.59Å; Q241-F243 VanDerWaalsContact C-N 3.31Å; Q241-F243 PolarHBondContact O-N 3.48Å; Q241-Q244 PolarHBondContact O-N 2.99Å; Q241-W245 HydrophobicContact CG-CD2 4.15Å; Q241-W245 HydrophobicContact CG-CE3 4.45Å; Q241-W245 HydrophobicContact CG-CH2 3.72Å; Q241-W245 HydrophobicContact CG-CZ2 3.35Å; Q241-W245 HydrophobicContact CG-CZ3 4.26Å; Q241-W245 VanDerWaalsContact NE2-CE2 3.25Å; Q241-W245 VanDerWaalsContact O-CG 3.26Å; Q241-W245 PolarHBondContact O-N 3.49Å; Q241-W245 VanDerWaalsContact O-N 3.14Å
242A91.6Very high92.5Very high11 Ų1145.7 Ų45.79%0.09129%0.289CS..Hα-helixtrans-66.5-37.4178.600000111.1L209 I213 I238 G239 W245 L246L209-A242 HydrophobicContact CD2-CB 4.2Å; I213-A242 HydrophobicContact CD1-CB 4.19Å; I238-A242 HydrophobicContact CB-CB 4.42Å; I238-A242 HydrophobicContact CD1-CB 4.3Å; I238-A242 WeakPolarHBondContact O-CB 3.5Å; G239-A242 PolarHBondContact O-N 3.41Å; A242-W245 PolarHBondContact O-N 2.8Å; A242-L246 WeakPolarHBondContact O-CB 3.13Å; A242-L246 VanDerWaalsContact O-CG 3.27Å; A242-L246 WeakPolarHBondContact O-CG 3.04Å; A242-L246 PolarHBondContact O-N 3.47Å
243F94.6Very high92.3Very high9 Ų945.8 Ų45.84%0.03928%0.282CS..Hα-helixtrans-58.4-52.7173.6174-94.9000111.4L227 P231 W234 Q235 I238 G239 E240 Q241 W245 L246 S247 L249L227-F243 HydrophobicContact CD2-CD2 3.46Å; L227-F243 VanDerWaalsContact CD2-CD2 3.46Å; L227-F243 HydrophobicContact CD2-CE2 3.26Å; L227-F243 HydrophobicContact CD2-CG 4.47Å; L227-F243 HydrophobicContact CD2-CZ 4.14Å; L227-F243 HydrophobicContact CG-CD2 4.01Å; L227-F243 HydrophobicContact CG-CE2 3.97Å; P231-F243 HydrophobicContact CB-CE1 4.26Å; P231-F243 HydrophobicContact CB-CE2 4.17Å; P231-F243 HydrophobicContact CB-CZ 3.6Å; W234-F243 HydrophobicContact CB-CD2 3.68Å; W234-F243 HydrophobicContact CB-CE2 4Å; Q235-F243 HydrophobicContact CG-CB 4.13Å; Q235-F243 HydrophobicContact CG-CD1 3.67Å; Q235-F243 HydrophobicContact CG-CD2 4.24Å; Q235-F243 HydrophobicContact CG-CE1 4.16Å; Q235-F243 HydrophobicContact CG-CG 3.74Å; I238-F243 HydrophobicContact CD1-CB 4.08Å; I238-F243 HydrophobicContact CG1-CB 4.32Å; G239-F243 WeakPolarHBondContact O-CB 3.5Å; G239-F243 PolarHBondContact O-N 3.47Å; E240-F243 WeakPolarHBondContact O-CB 3.39Å; E240-F243 PolarHBondContact O-N 3.11Å; Q241-F243 VanDerWaalsContact C-N 3.31Å; Q241-F243 PolarHBondContact O-N 3.48Å; F243-W245 VanDerWaalsContact C-N 3.28Å; F243-W245 PolarHBondContact O-N 3.21Å; F243-L246 PolarHBondContact O-N 2.74Å; F243-S247 WeakPolarHBondContact O-CB 3.41Å; F243-S247 PolarHBondContact O-N 3.07Å; F243-S247 PolarHBondContact O-OG 3.03Å; F243-L249 HydrophobicContact CE1-CD1 4Å
244Q93.6Very high92.1Very high56 Ų5648.2 Ų48.226%0.26230%0.295SS..Hα-helixtrans-58.7-40.1-179.6-68.81784.300112.6E240 Q241 G248 L249 S250E240-Q244 WeakPolarHBondContact O-CG 3.31Å; E240-Q244 PolarHBondContact O-N 3.21Å; E240-Q244 PolarHBondContact OE1-NE2 2.74Å; Q241-Q244 PolarHBondContact O-N 2.99Å; Q244-G248 PolarHBondContact O-N 3.45Å; Q244-G248 VanDerWaalsContact O-N 3.15Å; Q244-L249 HydrophobicContact CB-CB 4.35Å; Q244-L249 PolarHBondContact O-N 2.88Å; Q244-S250 VanDerWaalsContact CB-OG 3.23Å; Q244-S250 WeakPolarHBondContact CB-OG 3.38Å; Q244-S250 PolarHBondContact O-N 3.09Å; Q244-S250 PolarHBondContact OE1-OG 2.97Å
245W94.3Very high91.8Very high19 Ų1951.2 Ų51.27%0.07231%0.308CS..Hα-helixtrans-63.9-51176.1-65.4-16.5000112.3I213 F219 Q241 A242 F243 S247 G248 S250 P251 P252 V256 L285I213-W245 HydrophobicContact CD1-CE3 4.22Å; I213-W245 HydrophobicContact CG2-CE3 3.91Å; I213-W245 HydrophobicContact CG2-CZ3 4.12Å; F219-W245 WeakPolarHBondContact CD2-O 3.49Å; F219-W245 HydrophobicContact CE2-CB 3.96Å; F219-W245 VanDerWaalsContact CE2-O 3.29Å; F219-W245 WeakPolarHBondContact CE2-O 3.39Å; F219-W245 HydrophobicContact CZ-CB 4.34Å; Q241-W245 HydrophobicContact CG-CD2 4.15Å; Q241-W245 HydrophobicContact CG-CE3 4.45Å; Q241-W245 HydrophobicContact CG-CH2 3.72Å; Q241-W245 HydrophobicContact CG-CZ2 3.35Å; Q241-W245 HydrophobicContact CG-CZ3 4.26Å; Q241-W245 VanDerWaalsContact NE2-CE2 3.25Å; Q241-W245 VanDerWaalsContact O-CG 3.26Å; Q241-W245 PolarHBondContact O-N 3.49Å; Q241-W245 VanDerWaalsContact O-N 3.14Å; A242-W245 PolarHBondContact O-N 2.8Å; F243-W245 VanDerWaalsContact C-N 3.28Å; F243-W245 PolarHBondContact O-N 3.21Å; W245-S247 PolarHBondContact O-N 2.99Å; W245-G248 PolarHBondContact O-N 2.95Å; W245-S250 WeakPolarHBondContact CA-O 3.37Å; W245-P251 PolarHBondContact NE1-O 3.23Å; W245-P252 HydrophobicContact CD2-CB 4.49Å; W245-V256 HydrophobicContact CH2-CG2 4.39Å; W245-L285 HydrophobicContact CH2-CD2 4.38Å; W245-L285 HydrophobicContact CZ3-CD2 4.17Å
246L94.3Very high91.5Very high1 Ų148.3 Ų48.31%0.00530%0.295CS..Hα-helixtrans-68.6-32.9-177-67.9179.1000113.1L188 L192 L209 I213 F219 F221 L227 I238 A242 F243 G248L188-L246 HydrophobicContact CD2-CD2 3.89Å; L192-L246 HydrophobicContact CD2-CD1 4.39Å; L209-L246 HydrophobicContact CD1-CD1 4.19Å; I213-L246 HydrophobicContact CG1-CD2 4.37Å; F219-L246 HydrophobicContact CB-CD2 4.49Å; F219-L246 HydrophobicContact CD1-CD2 3.64Å; F219-L246 HydrophobicContact CD2-CD2 4.37Å; F219-L246 HydrophobicContact CE1-CD2 3.9Å; F219-L246 HydrophobicContact CG-CD2 3.91Å; F219-L246 HydrophobicContact CZ-CD2 4.36Å; F221-L246 HydrophobicContact CE1-CB 4.44Å; F221-L246 HydrophobicContact CE1-CD2 4.35Å; F221-L246 HydrophobicContact CZ-CB 4.17Å; L227-L246 HydrophobicContact CD1-CB 4.1Å; L227-L246 HydrophobicContact CD1-CD1 4.21Å; I238-L246 HydrophobicContact CD1-CD1 3.85Å; A242-L246 WeakPolarHBondContact O-CB 3.13Å; A242-L246 VanDerWaalsContact O-CG 3.27Å; A242-L246 WeakPolarHBondContact O-CG 3.04Å; A242-L246 PolarHBondContact O-N 3.47Å; F243-L246 PolarHBondContact O-N 2.74Å; L246-G248 PolarHBondContact O-N 3.33Å
247S92.8Very high91.4Very high10 Ų1048.8 Ų48.87%0.0728%0.278CS..Hα-helixtrans-70-22.1170.8-65.70000112.6K224 L227 F243 W245 L249K224-S247 VanDerWaalsContact CE-O 3.24Å; K224-S247 WeakPolarHBondContact CE-O 3.45Å; K224-S247 PolarHBondContact NZ-O 3.28Å; L227-S247 WeakPolarHBondContact CD2-OG 3.26Å; F243-S247 WeakPolarHBondContact O-CB 3.41Å; F243-S247 PolarHBondContact O-N 3.07Å; F243-S247 PolarHBondContact O-OG 3.03Å; W245-S247 PolarHBondContact O-N 2.99Å; S247-L249 VanDerWaalsContact C-N 3.34Å
248G92Very high91.2Very high53 Ų5349.8 Ų49.855%0.54629%0.292SS..THydrogen-bonded Turntrans76.922.2-172.100000113.3Q244 W245 L246Q244-G248 PolarHBondContact O-N 3.45Å; Q244-G248 VanDerWaalsContact O-N 3.15Å; W245-G248 PolarHBondContact O-N 2.95Å; L246-G248 PolarHBondContact O-N 3.33Å
249L91.4Very high90.9Very high129 Ų12949.8 Ų49.868%0.67529%0.291SS*.SBendtrans-76.1-29.8173.4-65.1173.6000111.4F243 Q244 S247F243-L249 HydrophobicContact CE1-CD1 4Å; Q244-L249 HydrophobicContact CB-CB 4.35Å; Q244-L249 PolarHBondContact O-N 2.88Å; S247-L249 VanDerWaalsContact C-N 3.34Å
250S91.1Very high90.7Very high27 Ų2749 Ų4919%0.18928%0.279CS..SBendtrans-140.2148.6172.865.70000110.7Q244 W245Q244-S250 VanDerWaalsContact CB-OG 3.23Å; Q244-S250 WeakPolarHBondContact CB-OG 3.38Å; Q244-S250 PolarHBondContact O-N 3.09Å; Q244-S250 PolarHBondContact OE1-OG 2.97Å; W245-S250 WeakPolarHBondContact CA-O 3.37Å
251P91.1Very high90.5Very high95 Ų9551.3 Ų51.362%0.61729%0.288SS*.PPolyproline II helixtrans-71.7157.2172.131-34.8000110.9W245W245-P251 PolarHBondContact NE1-O 3.23Å
252P90.3Very high90.2Very high17 Ų1748.2 Ų48.211%0.1128%0.275CS..PPolyproline II helixtrans-53.1157167.9-24.834.8000112.3F219 W245 V256 Q257F219-P252 HydrophobicContact CE2-CG 4.01Å; F219-P252 HydrophobicContact CZ-CG 4Å; W245-P252 HydrophobicContact CD2-CB 4.49Å; P252-V256 HydrophobicContact CB-CB 3.92Å; P252-V256 HydrophobicContact CB-CG1 3.67Å; P252-Q257 HydrophobicContact CB-CG 4.25Å; P252-Q257 PolarHBondContact O-NE2 3.07Å
253S89.6Confident89.6Confident51 Ų5149.2 Ų49.236%0.35728%0.28SS..PPolyproline II helixtrans-58.6155177.767.70000112F255 V256 Q257S253-F255 PolarHBondContact O-N 3.13Å; S253-F255 VanDerWaalsContact O-N 3.15Å; S253-V256 PolarHBondContact O-N 2.99Å; S253-V256 WeakPolarHBondContact OG-CG2 3.4Å; S253-V256 PolarHBondContact OG-N 3.27Å; S253-Q257 WeakPolarHBondContact O-CG 3.25Å; S253-Q257 PolarHBondContact O-N 3.26Å
254L90.1Very high88.8Confident145 Ų14553.9 Ų53.976%0.75930%0.302SS*.Hα-helixtrans-53.2-38.1176.6179.964.5000111.5Q257 A258L254-Q257 PolarHBondContact O-N 3.41Å; L254-A258 VanDerWaalsContact O-CB 3.31Å; L254-A258 WeakPolarHBondContact O-CB 3.35Å; L254-A258 PolarHBondContact O-N 2.94Å
255F86Confident88.2Confident69 Ų6955.7 Ų55.730%0.30332%0.32SS..Hα-helixtrans-58.9-52173.9179.2-87.1000111.8S253 Q257 A258 M259 F283S253-F255 PolarHBondContact O-N 3.13Å; S253-F255 VanDerWaalsContact O-N 3.15Å; F255-Q257 VanDerWaalsContact C-N 3.3Å; F255-Q257 PolarHBondContact O-N 2.95Å; F255-A258 PolarHBondContact O-N 3.01Å; F255-M259 HydrophobicContact CD1-CG 4.02Å; F255-M259 HydrophobicContact CE1-CG 3.45Å; F255-M259 VanDerWaalsContact CE1-CG 3.45Å; F255-M259 HydrophobicContact CE2-CG 4.2Å; F255-M259 HydrophobicContact CZ-CG 3.58Å; F255-M259 HydrophobicContact CZ-SD 4.07Å; F255-M259 WeakPolarHBondContact O-CB 3.34Å; F255-M259 WeakPolarHBondContact O-CG 3.5Å; F255-M259 PolarHBondContact O-N 3.32Å; F255-F283 HydrophobicContact CD1-CE2 4.09Å; F255-F283 HydrophobicContact CD1-CZ 4.37Å; F255-F283 HydrophobicContact CE1-CD2 4.01Å; F255-F283 AromaticContact CE1-CE2 3.3Å; F255-F283 HydrophobicContact CE1-CE2 3.3Å; F255-F283 AromaticContact CE1-CZ 3.92Å; F255-F283 HydrophobicContact CE1-CZ 3.92Å; F255-F283 HydrophobicContact CZ-CD2 4.49Å; F255-F283 HydrophobicContact CZ-CE2 4.12Å
256V87.2Confident87.2Confident2 Ų257.3 Ų57.31%0.01233%0.33CS..Hα-helixtrans-61.5-40.9179.3171.80000110.9I213 W245 P252 S253 M259 Q260 F283I213-V256 HydrophobicContact CG2-CG1 4.22Å; W245-V256 HydrophobicContact CH2-CG2 4.39Å; P252-V256 HydrophobicContact CB-CB 3.92Å; P252-V256 HydrophobicContact CB-CG1 3.67Å; S253-V256 PolarHBondContact O-N 2.99Å; S253-V256 WeakPolarHBondContact OG-CG2 3.4Å; S253-V256 PolarHBondContact OG-N 3.27Å; V256-M259 PolarHBondContact O-N 2.84Å; V256-Q260 HydrophobicContact CG1-CG 4.43Å; V256-Q260 WeakPolarHBondContact O-CB 3.33Å; V256-Q260 VanDerWaalsContact O-CG 3.3Å; V256-Q260 WeakPolarHBondContact O-CG 3.28Å; V256-Q260 PolarHBondContact O-N 3.41Å; V256-F283 HydrophobicContact CG2-CZ 4.43Å
257Q90.3Very high86Confident79 Ų7960.1 Ų60.137%0.36935%0.348SS..Hα-helixtrans-64.7-41.7176.7-66.2-177.847.400112.4P252 S253 L254 F255 M259 Q260 K261P252-Q257 HydrophobicContact CB-CG 4.25Å; P252-Q257 PolarHBondContact O-NE2 3.07Å; S253-Q257 WeakPolarHBondContact O-CG 3.25Å; S253-Q257 PolarHBondContact O-N 3.26Å; L254-Q257 PolarHBondContact O-N 3.41Å; F255-Q257 VanDerWaalsContact C-N 3.3Å; F255-Q257 PolarHBondContact O-N 2.95Å; Q257-M259 VanDerWaalsContact C-N 3.35Å; Q257-Q260 WeakPolarHBondContact O-CB 3.46Å; Q257-Q260 PolarHBondContact O-N 3.48Å; Q257-K261 WeakPolarHBondContact O-CG 3.05Å; Q257-K261 PolarHBondContact O-N 3.19Å
258A88.7Confident84.6Confident55 Ų5561.6 Ų61.646%0.45536%0.357SS..Hα-helixtrans-63.5-42.6175.500000111.1L254 F255 K261 L262L254-A258 VanDerWaalsContact O-CB 3.31Å; L254-A258 WeakPolarHBondContact O-CB 3.35Å; L254-A258 PolarHBondContact O-N 2.94Å; F255-A258 PolarHBondContact O-N 3.01Å; A258-K261 WeakPolarHBondContact O-CB 3.13Å; A258-K261 PolarHBondContact O-N 3.01Å; A258-L262 WeakPolarHBondContact O-CB 3.33Å; A258-L262 PolarHBondContact O-N 2.61Å
259M85Confident83.2Confident5 Ų564.8 Ų64.83%0.02536%0.357CS..Hα-helixtrans-65-42175.9-72.6-53.9-61.500112.4L214 F255 V256 Q257 K261 L262 T263 L278 P280L214-M259 HydrophobicContact CD1-CB 3.43Å; L214-M259 VanDerWaalsContact CD1-CB 3.43Å; L214-M259 HydrophobicContact CD1-CG 4.46Å; F255-M259 HydrophobicContact CD1-CG 4.02Å; F255-M259 HydrophobicContact CE1-CG 3.45Å; F255-M259 VanDerWaalsContact CE1-CG 3.45Å; F255-M259 HydrophobicContact CE2-CG 4.2Å; F255-M259 HydrophobicContact CZ-CG 3.58Å; F255-M259 HydrophobicContact CZ-SD 4.07Å; F255-M259 WeakPolarHBondContact O-CB 3.34Å; F255-M259 WeakPolarHBondContact O-CG 3.5Å; F255-M259 PolarHBondContact O-N 3.32Å; V256-M259 PolarHBondContact O-N 2.84Å; Q257-M259 VanDerWaalsContact C-N 3.35Å; M259-K261 VanDerWaalsContact C-N 3.29Å; M259-K261 PolarHBondContact O-N 3.33Å; M259-L262 WeakPolarHBondContact O-CB 2.99Å; M259-L262 PolarHBondContact O-N 3.09Å; M259-T263 WeakPolarHBondContact O-CG2 3.05Å; M259-T263 PolarHBondContact O-N 3.34Å; M259-T263 PolarHBondContact O-OG1 2.85Å; M259-L278 WeakPolarHBondContact CE-O 3.19Å; M259-L278 HydrophobicContact SD-CD2 3.77Å; M259-P280 HydrophobicContact CE-CG 4.42Å
260Q87.9Confident81.9Confident13 Ų1364.2 Ų64.26%0.06135%0.351CS..Hα-helixtrans-56.4-43.9172.1-81.7169.1-4.500111.6I213 L214 M216 V256 Q257 T263 Q264I213-Q260 PolarHBondContact O-NE2 2.92Å; L214-Q260 WeakPolarHBondContact O-CG 3.46Å; M216-Q260 PolarHBondContact O-NE2 3.28Å; V256-Q260 HydrophobicContact CG1-CG 4.43Å; V256-Q260 WeakPolarHBondContact O-CB 3.33Å; V256-Q260 VanDerWaalsContact O-CG 3.3Å; V256-Q260 WeakPolarHBondContact O-CG 3.28Å; V256-Q260 PolarHBondContact O-N 3.41Å; Q257-Q260 WeakPolarHBondContact O-CB 3.46Å; Q257-Q260 PolarHBondContact O-N 3.48Å; Q260-T263 WeakPolarHBondContact CA-OG1 3.36Å; Q260-T263 PolarHBondContact O-N 2.94Å; Q260-T263 PolarHBondContact O-OG1 2.85Å; Q260-Q264 VanDerWaalsContact O-CG 3.3Å; Q260-Q264 WeakPolarHBondContact O-CG 3.47Å; Q260-Q264 PolarHBondContact O-N 3.4Å
261K87.8Confident80.5Confident135 Ų13563.9 Ų63.959%0.58735%0.347SS*.Hα-helixtrans-64.5-45.3176-71.7-66.5178.6-173.40111.8Q257 A258 M259 T263 Q264 S265Q257-K261 WeakPolarHBondContact O-CG 3.05Å; Q257-K261 PolarHBondContact O-N 3.19Å; A258-K261 WeakPolarHBondContact O-CB 3.13Å; A258-K261 PolarHBondContact O-N 3.01Å; M259-K261 VanDerWaalsContact C-N 3.29Å; M259-K261 PolarHBondContact O-N 3.33Å; K261-T263 VanDerWaalsContact C-N 3.35Å; K261-T263 PolarHBondContact O-N 2.98Å; K261-Q264 PolarHBondContact O-N 3.22Å; K261-Q264 VanDerWaalsContact O-N 3.14Å; K261-S265 WeakPolarHBondContact O-CB 3.11Å; K261-S265 PolarHBondContact O-N 3.07Å; K261-S265 PolarHBondContact O-OG 3.22Å; K261-S265 VanDerWaalsContact O-OG 3.11Å
262L84Confident79.1Confident32 Ų3265.3 Ų65.317%0.16835%0.35CS..Hα-helixtrans-56.4-49.1176.6-171.2154.9000111.1A258 M259 Q264 S265 I266 L271 L274A258-L262 WeakPolarHBondContact O-CB 3.33Å; A258-L262 PolarHBondContact O-N 2.61Å; M259-L262 WeakPolarHBondContact O-CB 2.99Å; M259-L262 PolarHBondContact O-N 3.09Å; L262-Q264 PolarHBondContact O-N 2.69Å; L262-S265 PolarHBondContact O-N 3.48Å; L262-I266 HydrophobicContact CD1-CD1 4.42Å; L262-I266 HydrophobicContact CD2-CD1 4.14Å; L262-I266 HydrophobicContact CG-CD1 3.77Å; L262-I266 HydrophobicContact CG-CG1 4.42Å; L262-I266 WeakPolarHBondContact O-CB 3.2Å; L262-I266 PolarHBondContact O-N 3.42Å; L262-L271 HydrophobicContact CD2-CD2 3.47Å; L262-L271 VanDerWaalsContact CD2-CD2 3.47Å; L262-L274 HydrophobicContact CD1-CD1 4.12Å; L262-L274 HydrophobicContact CD2-CD1 3.73Å; L262-L274 HydrophobicContact CG-CD1 4.44Å
263T79.1Confident77.7Confident32 Ų3269.7 Ų69.720%0.19638%0.378CS..Hα-helixtrans-64.1-23.3179.153.40000114.5F215 M259 Q260 K261 P280F215-T263 HydrophobicContact CE1-CG2 4.12Å; F215-T263 HydrophobicContact CZ-CG2 4.18Å; M259-T263 WeakPolarHBondContact O-CG2 3.05Å; M259-T263 PolarHBondContact O-N 3.34Å; M259-T263 PolarHBondContact O-OG1 2.85Å; Q260-T263 WeakPolarHBondContact CA-OG1 3.36Å; Q260-T263 PolarHBondContact O-N 2.94Å; Q260-T263 PolarHBondContact O-OG1 2.85Å; K261-T263 VanDerWaalsContact C-N 3.35Å; K261-T263 PolarHBondContact O-N 2.98Å; T263-P280 HydrophobicContact CG2-CB 4.22Å; T263-P280 HydrophobicContact CG2-CG 3.46Å; T263-P280 VanDerWaalsContact CG2-CG 3.46Å
264Q79.1Confident76.3Confident106 Ų10668.9 Ų68.950%0.49537%0.37SS..Hα-helixtrans-89.9-27.9178.2-73.116621.700112.7P217 Q260 K261 L262P217-Q264 VanDerWaalsContact CG-NE2 3.32Å; Q260-Q264 VanDerWaalsContact O-CG 3.3Å; Q260-Q264 WeakPolarHBondContact O-CG 3.47Å; Q260-Q264 PolarHBondContact O-N 3.4Å; K261-Q264 PolarHBondContact O-N 3.22Å; K261-Q264 VanDerWaalsContact O-N 3.14Å; L262-Q264 PolarHBondContact O-N 2.69Å
265S80.4Confident74.8Confident94 Ų9465 Ų6566%0.65735%0.353SS*.Hα-helixtrans-97.1-23.1-172.7-62.30000113.6K261 L262K261-S265 WeakPolarHBondContact O-CB 3.11Å; K261-S265 PolarHBondContact O-N 3.07Å; K261-S265 PolarHBondContact O-OG 3.22Å; K261-S265 VanDerWaalsContact O-OG 3.11Å; L262-S265 PolarHBondContact O-N 3.48Å
266I73.2Confident73.9Confident53 Ų5366.4 Ų66.427%0.27236%0.364SS..SBendtrans-110.5124.6-175.8-54.2-173000109.6L262 Q270 L271L262-I266 HydrophobicContact CD1-CD1 4.42Å; L262-I266 HydrophobicContact CD2-CD1 4.14Å; L262-I266 HydrophobicContact CG-CD1 3.77Å; L262-I266 HydrophobicContact CG-CG1 4.42Å; L262-I266 WeakPolarHBondContact O-CB 3.2Å; L262-I266 PolarHBondContact O-N 3.42Å; I266-Q270 HydrophobicContact CG2-CB 3.57Å; I266-L271 HydrophobicContact CB-CD2 4Å; I266-L271 HydrophobicContact CG2-CD2 3.84Å; I266-L271 HydrophobicContact CG2-CG 4.37Å
267P67.9Low72.6Confident60 Ų6072.9 Ų72.939%0.3939%0.392SS..  trans-57.6147.3170.1-19.230.2000111.1E269 Q270P267-E269 WeakPolarHBondContact CB-OE2 3.28Å; P267-E269 PolarHBondContact O-N 3.12Å; P267-E269 VanDerWaalsContact O-N 3.12Å; P267-Q270 WeakPolarHBondContact O-CA 3.4Å; P267-Q270 WeakPolarHBondContact O-CB 3.48Å; P267-Q270 PolarHBondContact O-N 3.31Å
268V63.8Low71.2Confident41 Ų4171.1 Ų71.125%0.24839%0.385CS..G310 helixtrans-55.8-36.1-176-170.50000111.6G172 Q270 L271G172-V268 VanDerWaalsContact O-CG1 3.28Å; G172-V268 WeakPolarHBondContact O-CG1 3.44Å; G172-V268 WeakPolarHBondContact O-CG2 3.36Å; V268-Q270 PolarHBondContact O-N 3.39Å; V268-L271 HydrophobicContact CG1-CD1 4.38Å; V268-L271 WeakPolarHBondContact O-CB 3.46Å; V268-L271 PolarHBondContact O-N 2.6Å; V268-L271 VanDerWaalsContact O-N 3.08Å
269E63.6Low70.1Confident120 Ų12070.6 Ų70.656%0.56137%0.372SS*.G310 helixtrans-67-16.6-180-52.979.9-171.800112.9R136 P267R136-E269 IonicContact NH1-OE1 2.7Å; P267-E269 WeakPolarHBondContact CB-OE2 3.28Å; P267-E269 PolarHBondContact O-N 3.12Å; P267-E269 VanDerWaalsContact O-N 3.12Å
270Q63.4Low68.8Low118 Ų11870.6 Ų70.655%0.55137%0.373SS*.G310 helixtrans-103.95.1177.8-62.9-179.23.900112.5I266 P267 V268 P273I266-Q270 HydrophobicContact CG2-CB 3.57Å; P267-Q270 WeakPolarHBondContact O-CA 3.4Å; P267-Q270 WeakPolarHBondContact O-CB 3.48Å; P267-Q270 PolarHBondContact O-N 3.31Å; V268-Q270 PolarHBondContact O-N 3.39Å; Q270-P273 WeakPolarHBondContact O-CD 3.14Å; Q270-P273 WeakPolarHBondContact O-CG 3.14Å
271L62.3Low67.3Low19 Ų1973.7 Ų73.710%0.09939%0.39CS..SBendtrans-85.3-22.1175.2-61.9175.3000113L262 I266 V268 P273 L274L262-L271 HydrophobicContact CD2-CD2 3.47Å; L262-L271 VanDerWaalsContact CD2-CD2 3.47Å; I266-L271 HydrophobicContact CB-CD2 4Å; I266-L271 HydrophobicContact CG2-CD2 3.84Å; I266-L271 HydrophobicContact CG2-CG 4.37Å; V268-L271 HydrophobicContact CG1-CD1 4.38Å; V268-L271 WeakPolarHBondContact O-CB 3.46Å; V268-L271 PolarHBondContact O-N 2.6Å; V268-L271 VanDerWaalsContact O-N 3.08Å; L271-P273 VanDerWaalsContact C-CD 3.44Å; L271-L274 HydrophobicContact CB-CD1 4.26Å; L271-L274 HydrophobicContact CD2-CD1 3.5Å; L271-L274 VanDerWaalsContact O-CB 3.3Å; L271-L274 WeakPolarHBondContact O-CB 3.22Å; L271-L274 PolarHBondContact O-N 3.39Å; L271-L274 VanDerWaalsContact O-N 3.08Å
272D60.3Low65.7Low125 Ų12571.5 Ų71.567%0.66838%0.384SS*.THydrogen-bonded Turntrans-52.9-40.9177-77.7-16.7000115.5L274 K279D272-L274 PolarHBondContact O-N 3.28Å; D272-K279 WeakPolarHBondContact O-CE 3.27Å; D272-K279 PolarHBondContact O-NZ 2.77Å
273P61.2Low64.2Low109 Ų10970.9 Ų70.971%0.70838%0.38SS*.THydrogen-bonded Turntrans-76.5-5178.430.3-36.6000114.2Q270 L271Q270-P273 WeakPolarHBondContact O-CD 3.14Å; Q270-P273 WeakPolarHBondContact O-CG 3.14Å; L271-P273 VanDerWaalsContact C-CD 3.44Å
274L60.3Low63Low34 Ų3477.3 Ų77.318%0.17840%0.401CS..SBendtrans-70.8147.3176.8-65.6171000110.5L262 L271 D272 L278 K279L262-L274 HydrophobicContact CD1-CD1 4.12Å; L262-L274 HydrophobicContact CD2-CD1 3.73Å; L262-L274 HydrophobicContact CG-CD1 4.44Å; L271-L274 HydrophobicContact CB-CD1 4.26Å; L271-L274 HydrophobicContact CD2-CD1 3.5Å; L271-L274 VanDerWaalsContact O-CB 3.3Å; L271-L274 WeakPolarHBondContact O-CB 3.22Å; L271-L274 PolarHBondContact O-N 3.39Å; L271-L274 VanDerWaalsContact O-N 3.08Å; D272-L274 PolarHBondContact O-N 3.28Å; L274-L278 HydrophobicContact CB-CB 4.16Å; L274-K279 HydrophobicContact CB-CG 4.44Å; L274-K279 WeakPolarHBondContact O-CE 3.24Å
275P59.7Low61.6Low64 Ų6474.7 Ų74.742%0.41639%0.39SS..  trans-53.3144.6164.8-24.532.8000111.3F277 L278 K279P275-F277 HydrophobicContact CB-CD1 3.53Å; P275-F277 HydrophobicContact CB-CE1 3.17Å; P275-F277 HydrophobicContact CB-CG 4.42Å; P275-F277 HydrophobicContact CB-CZ 3.83Å; P275-F277 HydrophobicContact CG-CE1 3.87Å; P275-F277 HydrophobicContact CG-CZ 4.11Å; P275-F277 PolarHBondContact O-N 3.03Å; P275-L278 HydrophobicContact CG-CD1 4.43Å; P275-L278 WeakPolarHBondContact O-CA 3.18Å; P275-L278 WeakPolarHBondContact O-CB 3.45Å; P275-L278 PolarHBondContact O-N 3.3Å; P275-K279 PolarHBondContact O-N 3.28Å
276D65.8Low60Low99 Ų9975.3 Ų75.353%0.52938%0.382SS..G310 helixtrans-55.8-33.1-174.2-60.9-27.5000113.1L278 K279 D282D276-L278 PolarHBondContact O-N 2.88Å; D276-K279 WeakPolarHBondContact O-CB 3.34Å; D276-K279 PolarHBondContact O-N 2.86Å; D276-K279 IonicContact OD1-NZ 3.55Å; D276-K279 PolarHBondContact OD1-NZ 2.93Å; D276-D282 WeakPolarHBondContact O-CB 3.44Å
277F60.7Low58.5Low138 Ų13879.3 Ų79.361%0.60540%0.4SS*.G310 helixtrans-68.1-16.9176.669.9-93.6000114.6P275P275-F277 HydrophobicContact CB-CD1 3.53Å; P275-F277 HydrophobicContact CB-CE1 3.17Å; P275-F277 HydrophobicContact CB-CG 4.42Å; P275-F277 HydrophobicContact CB-CZ 3.83Å; P275-F277 HydrophobicContact CG-CE1 3.87Å; P275-F277 HydrophobicContact CG-CZ 4.11Å; P275-F277 PolarHBondContact O-N 3.03Å
278L60.6Low57.1Low42 Ų4285 Ų8522%0.2242%0.415CS..G310 helixtrans-99.1-0.8171.5-63.2-178.9000112.1M259 L274 P275 D276 P280M259-L278 WeakPolarHBondContact CE-O 3.19Å; M259-L278 HydrophobicContact SD-CD2 3.77Å; L274-L278 HydrophobicContact CB-CB 4.16Å; P275-L278 HydrophobicContact CG-CD1 4.43Å; P275-L278 WeakPolarHBondContact O-CA 3.18Å; P275-L278 WeakPolarHBondContact O-CB 3.45Å; P275-L278 PolarHBondContact O-N 3.3Å; D276-L278 PolarHBondContact O-N 2.88Å; L278-P280 WeakPolarHBondContact O-CD 3.39Å
279K65.5Low55.5Low43 Ų4387.5 Ų87.519%0.18744%0.44CS..  trans-81121.4171.1-67.3-178.8-174.2157.50108.4D272 L274 P275 D276 L281 D282D272-K279 WeakPolarHBondContact O-CE 3.27Å; D272-K279 PolarHBondContact O-NZ 2.77Å; L274-K279 HydrophobicContact CB-CG 4.44Å; L274-K279 WeakPolarHBondContact O-CE 3.24Å; P275-K279 PolarHBondContact O-N 3.28Å; D276-K279 WeakPolarHBondContact O-CB 3.34Å; D276-K279 PolarHBondContact O-N 2.86Å; D276-K279 IonicContact OD1-NZ 3.55Å; D276-K279 PolarHBondContact OD1-NZ 2.93Å; K279-L281 PolarHBondContact O-N 2.98Å; K279-D282 PolarHBondContact O-N 3.37Å
280P58.8Low53.8Low5 Ų590.5 Ų90.53%0.03247%0.474CS..G310 helixtrans-54.6-29.7176.2-24.833.4000113L214 F215 M259 T263 L278 D282 F283L214-P280 HydrophobicContact CD2-CB 4.03Å; F215-P280 HydrophobicContact CE2-CB 3.9Å; F215-P280 HydrophobicContact CZ-CB 3.65Å; F215-P280 HydrophobicContact CZ-CG 4.32Å; M259-P280 HydrophobicContact CE-CG 4.42Å; T263-P280 HydrophobicContact CG2-CB 4.22Å; T263-P280 HydrophobicContact CG2-CG 3.46Å; T263-P280 VanDerWaalsContact CG2-CG 3.46Å; L278-P280 WeakPolarHBondContact O-CD 3.39Å; P280-D282 VanDerWaalsContact C-N 3.3Å; P280-D282 PolarHBondContact O-N 2.7Å; P280-F283 WeakPolarHBondContact O-CB 3.31Å; P280-F283 PolarHBondContact O-N 3.12Å
281L55.5Low53.4Low79 Ų7989.1 Ų89.141%0.41447%0.47SS..G310 helixtrans-65-27.5179.2-70.3160.1000113.7I168 L169 K279I168-L281 HydrophobicContact CB-CD2 4.25Å; I168-L281 HydrophobicContact CG1-CD2 3.68Å; I168-L281 HydrophobicContact CG1-CG 4.29Å; I168-L281 HydrophobicContact CG2-CD2 3.83Å; L169-L281 HydrophobicContact CD2-CD2 4.43Å; K279-L281 PolarHBondContact O-N 2.98Å
282D53.9Low52.9Low88 Ų8892.8 Ų92.847%0.47149%0.489SS..G310 helixtrans-105.14.9-176.2-62.7-51.7000113D276 K279 P280 R284D276-D282 WeakPolarHBondContact O-CB 3.44Å; K279-D282 PolarHBondContact O-N 3.37Å; P280-D282 VanDerWaalsContact C-N 3.3Å; P280-D282 PolarHBondContact O-N 2.7Å; D282-R284 PolarHBondContact O-N 3.14Å
283F54.2Low52.5Low19 Ų1991 Ų918%0.08348%0.479CS..  trans-67.5125.5-174.3-175.5-126.8000113Y211 L214 F255 V256 P280 L285Y211-F283 HydrophobicContact CE1-CB 4.44Å; L214-F283 HydrophobicContact CB-CD1 4.44Å; L214-F283 HydrophobicContact CB-CE1 4.31Å; L214-F283 HydrophobicContact CD2-CB 4.35Å; L214-F283 HydrophobicContact CD2-CD1 3.71Å; L214-F283 HydrophobicContact CD2-CE1 4.21Å; L214-F283 HydrophobicContact CD2-CG 4.19Å; F255-F283 HydrophobicContact CD1-CE2 4.09Å; F255-F283 HydrophobicContact CD1-CZ 4.37Å; F255-F283 HydrophobicContact CE1-CD2 4.01Å; F255-F283 AromaticContact CE1-CE2 3.3Å; F255-F283 HydrophobicContact CE1-CE2 3.3Å; F255-F283 AromaticContact CE1-CZ 3.92Å; F255-F283 HydrophobicContact CE1-CZ 3.92Å; F255-F283 HydrophobicContact CZ-CD2 4.49Å; F255-F283 HydrophobicContact CZ-CE2 4.12Å; V256-F283 HydrophobicContact CG2-CZ 4.43Å; P280-F283 WeakPolarHBondContact O-CB 3.31Å; P280-F283 PolarHBondContact O-N 3.12Å; F283-L285 HydrophobicContact CD1-CD1 4.08Å; F283-L285 HydrophobicContact CD1-CG 4.2Å; F283-L285 HydrophobicContact CE1-CD1 3.37Å; F283-L285 HydrophobicContact CE1-CD2 4.05Å; F283-L285 HydrophobicContact CE1-CG 3.33Å; F283-L285 HydrophobicContact CE2-CG 4.44Å; F283-L285 HydrophobicContact CZ-CD1 4.05Å; F283-L285 HydrophobicContact CZ-CD2 3.88Å; F283-L285 HydrophobicContact CZ-CG 3.47Å; F283-L285 VanDerWaalsContact CZ-CG 3.47Å
284R53.5Low51.9Low167 Ų16789.9 Ų89.963%0.6347%0.466SS*.  trans-122.2100.3173.8-63.1-169.5-176.5-172.53111.1D282 H286 Q287D282-R284 PolarHBondContact O-N 3.14Å; R284-H286 PolarHBondContact O-N 3.42Å; R284-Q287 PolarHBondContact O-N 3.11Å
285L49.6Very low51.4Low51 Ų5193.4 Ų93.427%0.26748%0.484SS..G310 helixtrans-59.9-15.2178.6-93.4141.9000115.9W245 F283 Q287W245-L285 HydrophobicContact CH2-CD2 4.38Å; W245-L285 HydrophobicContact CZ3-CD2 4.17Å; F283-L285 HydrophobicContact CD1-CD1 4.08Å; F283-L285 HydrophobicContact CD1-CG 4.2Å; F283-L285 HydrophobicContact CE1-CD1 3.37Å; F283-L285 HydrophobicContact CE1-CD2 4.05Å; F283-L285 HydrophobicContact CE1-CG 3.33Å; F283-L285 HydrophobicContact CE2-CG 4.44Å; F283-L285 HydrophobicContact CZ-CD1 4.05Å; F283-L285 HydrophobicContact CZ-CD2 3.88Å; F283-L285 HydrophobicContact CZ-CG 3.47Å; F283-L285 VanDerWaalsContact CZ-CG 3.47Å; L285-Q287 VanDerWaalsContact C-N 3.29Å; L285-Q287 PolarHBondContact O-N 3.48Å
286H46.8Very low50.9Low107 Ų10795.4 Ų95.450%0.49549%0.488SS..G310 helixtrans-81.2-1.1-178-62.7-60.7000114.5R284R284-H286 PolarHBondContact O-N 3.42Å
287Q41.9Very low49.8Very low137 Ų13795.1 Ų95.164%0.6449%0.485SS*.G310 helixtrans-86.2-3.1-176.8-77-175.7-19.700115.3R284 L285R284-Q287 PolarHBondContact O-N 3.11Å; L285-Q287 VanDerWaalsContact C-N 3.29Å; L285-Q287 PolarHBondContact O-N 3.48Å
288Y36.8Very low49Very low181 Ų18191.8 Ų91.871%0.7148%0.476SS*.G310 helixtrans-125.919.3-177.9-61.1-75.5000114.2
289A30.7Very low48Very low93 Ų9396 Ų9677%0.76950%0.498SS*.  trans-106.880168.600000109.1
290S28.9Very low46.4Very low182 Ų182100.8 Ų100.8100%1.27353%0.526SS*.  trans-134.20160.456.30000107.8

Retrieved 290 of 290 residues in 2324.1 ms (Link to these results)

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