A0A087XZT7_POEFO Loading...

Transcriptional activator Myb

Transcriptional activator; DNA-binding protein that specifically recognize the sequence 5'-YAAC[GT]G-3'. Plays an important role in the control of proliferation and differentiation of hematopoietic progenitor cells.

AlphaFold DB , UniProt , Accession A0A087XZT7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 595 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M34.1Very low38.7Very low235 Ų235165.5 Ų165.5100%1.15882%0.818SS**  0143.80-67.9151.8169.100108.3
2T36.1Very low38.6Very low122 Ų122158.1 Ų158.175%0.74880%0.795SS**  cis172.3119.2-37.419.20000106.5
3R34.2Very low38.5Very low235 Ų235156.1 Ų156.189%0.88778%0.781SS**  trans71.599.7152.5-59.2-176.6176.2-151.1-1.2121.6
4R38.6Very low38.7Very low250 Ų250155.4 Ų155.494%0.94377%0.774SS**  65.3163.5110.7-90.1-150.2164.6-175.5-3.8121.7
5P62.8Low38.6Very low107 Ų107154.9 Ų154.970%0.69578%0.775SS**  trans-119.5-159.5-15446.6-35.6000113.7
6K41.3Very low38.8Very low199 Ų199156.6 Ų156.687%0.86578%0.78SS**  trans-137.9138.9161.4-71.5-167.9175.1-173.60113.3
7N40.4Very low39.1Very low153 Ų153158.1 Ų158.182%0.81878%0.784SS**  trans-112.7157.1153.4-73.112.9000108
8S33.2Very low39.1Very low114 Ų114159.9 Ų159.980%0.79779%0.79SS**  trans-158.3132154.8-153.90000107.2
9V39.5Very low39.3Very low117 Ų117157.6 Ų157.671%0.70979%0.786SS**  cis96.5119.616.6-176.60000114.5
10Y32.1Very low39Very low208 Ų208156.8 Ų156.882%0.81678%0.784SS**  trans70.5150.1167.3-120.2-124.9000117.9
11S33.2Very low39.2Very low80 Ų80154.9 Ų154.956%0.55978%0.781SS**  cis-141.4-178.921.6-1400000113.3E13S11-E13 WeakPolarHBondContact CB-OE1 3.42Å; S11-E13 PolarHBondContact OG-OE1 3.13Å
12S37.8Very low39.4Very low77 Ų77153.5 Ų153.554%0.53876%0.764SS.*  trans-89.4-135.5163.1-92.90000109.8E14S12-E14 WeakPolarHBondContact CB-OE1 3.27Å; S12-E14 WeakPolarHBondContact CB-OE2 3.38Å; S12-E14 PolarHBondContact OG-OE1 3.32Å; S12-E14 PolarHBondContact OG-OE2 2.67Å
13E36.7Very low39.6Very low132 Ų132155.4 Ų155.462%0.61777%0.765SS**  cis-156.7154.510.3-66.688.6-122.400110.4S11S11-E13 WeakPolarHBondContact CB-OE1 3.42Å; S11-E13 PolarHBondContact OG-OE1 3.13Å
14E42.4Very low39.9Very low146 Ų146152.5 Ų152.568%0.68276%0.761SS**  cis-163-15.6-39.4-138.376.1-59.900116.1S12S12-E14 WeakPolarHBondContact CB-OE1 3.27Å; S12-E14 WeakPolarHBondContact CB-OE2 3.38Å; S12-E14 PolarHBondContact OG-OE1 3.32Å; S12-E14 PolarHBondContact OG-OE2 2.67Å
15D36.2Very low39.7Very low148 Ų148147.7 Ų147.779%0.79175%0.754SS**  trans-52.5125.7-169.1-52.8-11.2000119.2
16E42.4Very low38.6Very low183 Ų183151.7 Ų151.786%0.85576%0.756SS**  64.9143.890.5-65.3-176.9176.300117.2
17E44.5Very low38.6Very low181 Ų181149.1 Ų149.185%0.84675%0.752SS**  cis-175.2132-16.7163.8-179-12800104.1
18E39.1Very low38.7Very low192 Ų192144.4 Ų144.490%0.89774%0.739SS**  trans-162.9149.4144.6-166.1150.6-142.900110.5
19T41.5Very low39.1Very low116 Ų116144 Ų14471%0.71273%0.732SS**  trans-103.6131.2176.5-660000110.4
20D33.3Very low39.3Very low141 Ų141146.1 Ų146.175%0.75474%0.739SS**  trans-143.1146.7149.3-151.4-7.7000112
21V43.3Very low39.8Very low116 Ų116140.3 Ų140.370%0.70373%0.734SS**  trans-110.1105.4-174.3175.10000108.6
22Y38.7Very low40.2Very low206 Ų206146.1 Ų146.181%0.80875%0.749SS**  trans-115102.2166-101-87.9000112.5
23E39.6Very low40.6Very low163 Ų163148.7 Ų148.776%0.76276%0.761SS**  trans-58.9130.8167.7-167164.4-135.800109.9
24H40.3Very low40.9Very low174 Ų174145 Ų14581%0.80676%0.758SS**  trans-142.5112.1170.8-117.250.5000109.5Y26H24-Y26 PolarHBondContact O-N 2.7Å
25D35.1Very low41.4Very low149 Ų149147.8 Ų147.880%0.79777%0.768SS**  trans-61.7104.4-175.8-63.4-69000111.3D27D25-D27 PolarHBondContact O-N 3.3Å
26Y39.6Very low42.2Very low191 Ų191148.7 Ų148.775%0.74976%0.76SS**  trans-75.485165.6-164.4-91.5000108.7H24 G28 T29H24-Y26 PolarHBondContact O-N 2.7Å; Y26-G28 PolarHBondContact O-N 3.03Å; Y26-T29 HydrophobicContact CE1-CG2 3.9Å
27D41.8Very low42.5Very low145 Ų145146.9 Ų146.978%0.77575%0.752SS**  trans-46.4130.2175.8179.926.9000110.2D25 T29D25-D27 PolarHBondContact O-N 3.3Å; D27-T29 PolarHBondContact O-N 3.18Å
28G43.3Very low43.1Very low53 Ų53141 Ų14155%0.54673%0.726SS.*  trans-65107.3-16200000110.6Y26 L30Y26-G28 PolarHBondContact O-N 3.03Å; G28-L30 PolarHBondContact O-N 2.9Å
29T41.3Very low43.8Very low105 Ų105134.8 Ų134.864%0.64471%0.713SS**  trans-66.377.3167.255.90000109.7Y26 D27 A31Y26-T29 HydrophobicContact CE1-CG2 3.9Å; D27-T29 PolarHBondContact O-N 3.18Å; T29-A31 VanDerWaalsContact C-N 3.29Å; T29-A31 PolarHBondContact O-N 2.69Å
30L42.6Very low44.6Very low163 Ų163137.4 Ų137.485%0.85371%0.714SS**  trans-54.197.4165.2-97.2167.6000106.8G28 K32G28-L30 PolarHBondContact O-N 2.9Å; L30-K32 PolarHBondContact O-N 2.74Å
31A43.9Very low46.8Very low86 Ų86134.7 Ų134.771%0.71170%0.703SS**  trans-56.5102.7178.700000107.5T29 V33T29-A31 VanDerWaalsContact C-N 3.29Å; T29-A31 PolarHBondContact O-N 2.69Å; A31-V33 PolarHBondContact O-N 3.49Å
32K39.8Very low48.9Very low201 Ų201139.7 Ų139.787%0.87471%0.709SS**  trans-47.8115.9-179.7-78.3177.9177.4170.60106.8L30 G34L30-K32 PolarHBondContact O-N 2.74Å; K32-G34 PolarHBondContact O-N 2.69Å
33V47.5Very low51.4Low131 Ų131131.8 Ų131.879%0.79468%0.678SS**  trans-68.782.4-173.2-1780000108.2A31 K35A31-V33 PolarHBondContact O-N 3.49Å; V33-K35 PolarHBondContact O-N 2.76Å
34G43Very low53.9Low54 Ų54126.6 Ų126.656%0.55766%0.657SS**  trans-54126.6174.300000106.9K32 R36K32-G34 PolarHBondContact O-N 2.69Å; G34-R36 VanDerWaalsContact C-N 3.27Å; G34-R36 PolarHBondContact O-N 3.1Å
35K52.6Low56.4Low205 Ų205126.5 Ų126.589%0.89165%0.65SS**  trans-59.992.9-175.5-68.1180178.9178.40108.5V33 H37V33-K35 PolarHBondContact O-N 2.76Å; K35-H37 PolarHBondContact O-N 3.29Å
36R52.8Low59.1Low167 Ų167125.3 Ų125.363%0.6364%0.64SS**  trans-51139.9-173.7-76.4-175.2-75164.2-13.5109G34 L38 N72G34-R36 VanDerWaalsContact C-N 3.27Å; G34-R36 PolarHBondContact O-N 3.1Å; R36-L38 HydrophobicContact CB-CD1 3.39Å; R36-L38 PolarHBondContact O-N 2.8Å; R36-N72 PolarHBondContact NH1-OD1 2.81Å
37H49.2Very low61.6Low146 Ų146117.9 Ų117.968%0.67661%0.612SS**  trans-77.345.7-167.8-140.192000113.4K35 G39K35-H37 PolarHBondContact O-N 3.29Å; H37-G39 PolarHBondContact O-N 3.4Å
38L57.4Low64.1Low58 Ų58112.4 Ų112.430%0.30458%0.582SS.*THydrogen-bonded Turntrans-55.4-11.5-171.5-101.370.1000115.9R36 N72 Q77R36-L38 HydrophobicContact CB-CD1 3.39Å; R36-L38 PolarHBondContact O-N 2.8Å; L38-N72 HydrophobicContact CD1-CB 3.9Å; L38-N72 HydrophobicContact CG-CB 4.01Å; L38-Q77 PolarHBondContact O-NE2 3.12Å
39G53.6Low66.6Low61 Ų61113.7 Ų113.763%0.62957%0.574SS**THydrogen-bonded Turntrans-90.3-17.6-168.900000116.5H37H37-G39 PolarHBondContact O-N 3.4Å
40K58.3Low69Low170 Ų170113.7 Ų113.774%0.73957%0.565SS**  trans-131.3-8.7-160.9-69.2-177.5179.4174.60117.4R42K40-R42 PolarHBondContact O-N 3.36Å
41T78.3Confident71.4Confident84 Ų84105.9 Ų105.952%0.51553%0.525SS..PPolyproline II helixtrans-65.1124.1-179.6-46.70000111W43 R73T41-W43 PolarHBondContact O-N 3.44Å; T41-R73 PolarHBondContact O-NH1 2.9Å; T41-R73 PolarHBondContact O-NH2 2.88Å
42R87.5Confident73.8Confident222 Ų222106.1 Ų106.184%0.83851%0.509SS*.PPolyproline II helixtrans-54135.6170.2178.6177.8179.8-114.25.5109.2K40 T44 R73K40-R42 PolarHBondContact O-N 3.36Å; R42-T44 PolarHBondContact O-N 3.46Å; R42-R73 PolarHBondContact O-NH2 3.24Å
43W91.4Very high76.4Confident40 Ų40103.1 Ų103.115%0.15250%0.496CS..PPolyproline II helixtrans-59.2124.5174.1-78.285.6000110.2T41 E47 L51 R73 Q77 R81T41-W43 PolarHBondContact O-N 3.44Å; W43-E47 WeakPolarHBondContact CA-OE2 3.4Å; W43-E47 HydrophobicContact CE3-CB 3.77Å; W43-E47 HydrophobicContact CZ3-CB 4.05Å; W43-L51 HydrophobicContact CH2-CD2 3.72Å; W43-L51 HydrophobicContact CZ3-CB 4.4Å; W43-L51 HydrophobicContact CZ3-CD2 3.71Å; W43-R73 HydrophobicContact CH2-CB 4.37Å; W43-R73 HydrophobicContact CH2-CG 3.91Å; W43-R73 HydrophobicContact CZ2-CG 4.3Å; W43-R73 HydrophobicContact CZ3-CG 4.34Å; W43-Q77 HydrophobicContact CZ2-CB 4.2Å; W43-R81 VanDerWaalsContact CB-CZ 3.48Å; W43-R81 HydrophobicContact CD2-CB 4.29Å; W43-R81 HydrophobicContact CD2-CG 3.67Å; W43-R81 HydrophobicContact CE3-CG 3.84Å; W43-R81 HydrophobicContact CG-CG 4.26Å; W43-R81 HydrophobicContact CH2-CB 3.99Å; W43-R81 HydrophobicContact CH2-CG 4.07Å; W43-R81 HydrophobicContact CZ2-CB 3.59Å; W43-R81 HydrophobicContact CZ2-CG 3.88Å; W43-R81 HydrophobicContact CZ3-CB 4.47Å; W43-R81 HydrophobicContact CZ3-CG 4.04Å
44T92.4Very high78.5Confident53 Ų5397.6 Ų97.633%0.32546%0.463SS..PPolyproline II helixtrans-83.9168.5173890000110.8R42 E46 E47 D48R42-T44 PolarHBondContact O-N 3.46Å; T44-E46 VanDerWaalsContact C-N 3.3Å; T44-E46 WeakPolarHBondContact CB-OE2 3.48Å; T44-E46 PolarHBondContact OG1-N 3.35Å; T44-E46 PolarHBondContact OG1-OE2 3.46Å; T44-E47 HydrophobicContact CG2-CG 4.48Å; T44-E47 PolarHBondContact N-OE2 3.24Å; T44-E47 PolarHBondContact OG1-N 2.91Å; T44-D48 PolarHBondContact O-N 3.09Å; T44-D48 VanDerWaalsContact O-N 3.14Å
45R92.5Very high80.9Confident172 Ų17295.5 Ų95.565%0.64944%0.439SS*.Hα-helixtrans-69.2-34.6178.2175.2-179.7169.5-173.4-9.4111.1D48 E49R45-D48 PolarHBondContact O-N 3.35Å; R45-E49 HydrophobicContact CG-CG 4.45Å; R45-E49 IonicContact CZ-OE1 3.2Å; R45-E49 IonicContact NE-OE1 2.73Å; R45-E49 PolarHBondContact NE-OE1 3.38Å; R45-E49 IonicContact NH2-OE1 2.78Å; R45-E49 PolarHBondContact NH2-OE1 3.13Å; R45-E49 WeakPolarHBondContact O-CB 3.29Å; R45-E49 WeakPolarHBondContact O-CG 3.49Å; R45-E49 PolarHBondContact O-N 2.9Å
46E92.3Very high82.7Confident125 Ų12592 Ų9258%0.58443%0.426SS*.Hα-helixtrans-71.4-37.5-178.2-52.366.5-137.200110.2T44 K50T44-E46 VanDerWaalsContact C-N 3.3Å; T44-E46 WeakPolarHBondContact CB-OE2 3.48Å; T44-E46 PolarHBondContact OG1-N 3.35Å; T44-E46 PolarHBondContact OG1-OE2 3.46Å; E46-K50 VanDerWaalsContact O-CB 3.26Å; E46-K50 WeakPolarHBondContact O-CB 3.16Å; E46-K50 PolarHBondContact O-N 3.2Å
47E92.7Very high84.5Confident34 Ų3490.3 Ų90.316%0.15943%0.428CS..Hα-helixtrans-64.7-42.4169.4-67.5-179.7119.700112.2W43 T44 K50 L51 R73W43-E47 WeakPolarHBondContact CA-OE2 3.4Å; W43-E47 HydrophobicContact CE3-CB 3.77Å; W43-E47 HydrophobicContact CZ3-CB 4.05Å; T44-E47 HydrophobicContact CG2-CG 4.48Å; T44-E47 PolarHBondContact N-OE2 3.24Å; T44-E47 PolarHBondContact OG1-N 2.91Å; E47-K50 PolarHBondContact O-N 3.05Å; E47-L51 WeakPolarHBondContact O-CB 3.42Å; E47-L51 PolarHBondContact O-N 3.18Å; E47-R73 VanDerWaalsContact CD-NH2 3.25Å; E47-R73 IonicContact OE1-CZ 2.7Å; E47-R73 VanDerWaalsContact OE1-CZ 3.25Å; E47-R73 IonicContact OE1-NE 3.33Å; E47-R73 PolarHBondContact OE1-NE 2.86Å; E47-R73 IonicContact OE1-NH2 3.14Å; E47-R73 PolarHBondContact OE1-NH2 3.32Å; E47-R73 IonicContact OE2-CZ 3.39Å; E47-R73 IonicContact OE2-NE 2.61Å; E47-R73 IonicContact OE2-NH2 2.77Å; E47-R73 PolarHBondContact OE2-NH2 3.25Å
48D94.2Very high86.3Confident30 Ų3086.7 Ų86.716%0.1641%0.411CS..Hα-helixtrans-64.5-44.2176.4-79.7-11000112T44 R45 L51 K52 R81 L86T44-D48 PolarHBondContact O-N 3.09Å; T44-D48 VanDerWaalsContact O-N 3.14Å; R45-D48 PolarHBondContact O-N 3.35Å; D48-L51 PolarHBondContact O-N 3.04Å; D48-K52 PolarHBondContact O-N 3.03Å; D48-R81 VanDerWaalsContact CG-NH2 3.27Å; D48-R81 IonicContact OD1-CZ 3.66Å; D48-R81 VanDerWaalsContact OD1-CZ 3.28Å; D48-R81 IonicContact OD1-NE 3.5Å; D48-R81 PolarHBondContact OD1-NE 3.26Å; D48-R81 IonicContact OD1-NH2 3.6Å; D48-R81 PolarHBondContact OD1-NH2 3.07Å; D48-R81 VanDerWaalsContact OD1-NH2 3.09Å; D48-R81 IonicContact OD2-CZ 3.19Å; D48-R81 IonicContact OD2-NE 3.25Å; D48-R81 IonicContact OD2-NH2 2.72Å; D48-R81 PolarHBondContact OD2-NH2 2.97Å; D48-L86 HydrophobicContact CB-CD1 3.93Å; D48-L86 HydrophobicContact CB-CD2 3.95Å
49E94.4Very high87.8Confident80 Ų8085.6 Ų85.637%0.37442%0.415SS..Hα-helixtrans-67.5-37.5177.2-75.2-176-166.600111.9R45 K53R45-E49 HydrophobicContact CG-CG 4.45Å; R45-E49 IonicContact CZ-OE1 3.2Å; R45-E49 IonicContact NE-OE1 2.73Å; R45-E49 PolarHBondContact NE-OE1 3.38Å; R45-E49 IonicContact NH2-OE1 2.78Å; R45-E49 PolarHBondContact NH2-OE1 3.13Å; R45-E49 WeakPolarHBondContact O-CB 3.29Å; R45-E49 WeakPolarHBondContact O-CG 3.49Å; R45-E49 PolarHBondContact O-N 2.9Å; E49-K53 WeakPolarHBondContact O-CG 3.44Å; E49-K53 PolarHBondContact O-N 3.46Å; E49-K53 VanDerWaalsContact O-N 3.07Å
50K93Very high89.3Confident105 Ų10585.6 Ų85.646%0.45741%0.405SS..Hα-helixtrans-68.2-44.6173.3-169.5175.6-173-169.70111.4E46 E47 K52 K53 L54 L69 L70E46-K50 VanDerWaalsContact O-CB 3.26Å; E46-K50 WeakPolarHBondContact O-CB 3.16Å; E46-K50 PolarHBondContact O-N 3.2Å; E47-K50 PolarHBondContact O-N 3.05Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 2.84Å; K50-K53 PolarHBondContact O-N 3.45Å; K50-L54 HydrophobicContact CG-CD1 4.04Å; K50-L54 HydrophobicContact CG-CG 4.38Å; K50-L54 WeakPolarHBondContact O-CB 3.29Å; K50-L54 VanDerWaalsContact O-CG 3.27Å; K50-L54 WeakPolarHBondContact O-CG 3.44Å; K50-L54 PolarHBondContact O-N 3.39Å; K50-L69 VanDerWaalsContact CE-O 3.31Å; K50-L69 WeakPolarHBondContact CE-O 3.29Å; K50-L69 PolarHBondContact NZ-O 2.88Å; K50-L70 HydrophobicContact CB-CD2 4.07Å; K50-L70 HydrophobicContact CD-CD2 3.94Å; K50-L70 HydrophobicContact CG-CD2 3.99Å
51L93.4Very high90.5Very high0 Ų085.6 Ų85.60%041%0.408CS..Hα-helixtrans-59.5-41.6174.8175.656.4000111.5W43 E47 D48 L54 V55 W63 I66 L70 C78 R81 L86W43-L51 HydrophobicContact CH2-CD2 3.72Å; W43-L51 HydrophobicContact CZ3-CB 4.4Å; W43-L51 HydrophobicContact CZ3-CD2 3.71Å; E47-L51 WeakPolarHBondContact O-CB 3.42Å; E47-L51 PolarHBondContact O-N 3.18Å; D48-L51 PolarHBondContact O-N 3.04Å; L51-L54 PolarHBondContact O-N 3.39Å; L51-V55 HydrophobicContact CD1-CG2 4.02Å; L51-V55 WeakPolarHBondContact O-CG2 3.44Å; L51-V55 PolarHBondContact O-N 3.48Å; L51-W63 HydrophobicContact CD1-CZ3 4.29Å; L51-I66 HydrophobicContact CD1-CG2 3.5Å; L51-I66 VanDerWaalsContact CD1-CG2 3.5Å; L51-L70 HydrophobicContact CB-CD1 3.92Å; L51-L70 HydrophobicContact CD1-CD1 3.76Å; L51-L70 HydrophobicContact CG-CD1 4.34Å; L51-C78 HydrophobicContact CD1-CB 3.92Å; L51-C78 HydrophobicContact CD2-CB 4.49Å; L51-R81 HydrophobicContact CD2-CB 3.75Å; L51-R81 HydrophobicContact CD2-CG 3.68Å; L51-L86 HydrophobicContact CB-CD1 4.22Å; L51-L86 HydrophobicContact CD2-CD1 3.73Å; L51-L86 HydrophobicContact CG-CD1 4.02Å
52K94.1Very high91Very high90 Ų9086.6 Ų86.639%0.39141%0.41SS..Hα-helixtrans-59.4-52.3173.8-170.7-168.5176.9-90.90111.4D48 K50 L54 V55 E56 W82D48-K52 PolarHBondContact O-N 3.03Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 2.84Å; K52-L54 VanDerWaalsContact C-N 3.27Å; K52-L54 PolarHBondContact O-N 2.91Å; K52-V55 PolarHBondContact O-N 3.46Å; K52-E56 IonicContact NZ-OE1 3.35Å; K52-E56 PolarHBondContact NZ-OE1 3.11Å; K52-E56 IonicContact NZ-OE2 2.72Å; K52-E56 PolarHBondContact NZ-OE2 2.7Å; K52-E56 VanDerWaalsContact O-CB 3.24Å; K52-E56 WeakPolarHBondContact O-CB 3.18Å; K52-E56 PolarHBondContact O-N 3.12Å; K52-W82 HydrophobicContact CB-CZ3 4.29Å; K52-W82 HydrophobicContact CG-CH2 4.37Å; K52-W82 HydrophobicContact CG-CZ3 4.07Å
53K92.9Very high91.3Very high138 Ų13877 Ų7760%0.637%0.373SS*.Hα-helixtrans-59.8-36.3179.7-73172.8-179.5175.60112.7E49 K50 E56 L57E49-K53 WeakPolarHBondContact O-CG 3.44Å; E49-K53 PolarHBondContact O-N 3.46Å; E49-K53 VanDerWaalsContact O-N 3.07Å; K50-K53 PolarHBondContact O-N 3.45Å; K53-E56 PolarHBondContact O-N 3.42Å; K53-L57 VanDerWaalsContact O-CB 3.31Å; K53-L57 WeakPolarHBondContact O-CB 3.34Å; K53-L57 PolarHBondContact O-N 2.84Å
54L92.6Very high91.3Very high16 Ų1682.7 Ų82.78%0.08440%0.399CS..Hα-helixtrans-70.3-39.9177.6-71.4172.2000112.6K50 L51 K52 E56 L57 H58 I66 L69 L70K50-L54 HydrophobicContact CG-CD1 4.04Å; K50-L54 HydrophobicContact CG-CG 4.38Å; K50-L54 WeakPolarHBondContact O-CB 3.29Å; K50-L54 VanDerWaalsContact O-CG 3.27Å; K50-L54 WeakPolarHBondContact O-CG 3.44Å; K50-L54 PolarHBondContact O-N 3.39Å; L51-L54 PolarHBondContact O-N 3.39Å; K52-L54 VanDerWaalsContact C-N 3.27Å; K52-L54 PolarHBondContact O-N 2.91Å; L54-E56 VanDerWaalsContact C-N 3.34Å; L54-L57 PolarHBondContact O-N 3.01Å; L54-H58 WeakPolarHBondContact O-CB 3.13Å; L54-H58 PolarHBondContact O-CD2 3.41Å; L54-H58 PolarHBondContact O-N 2.84Å; L54-I66 HydrophobicContact CB-CG1 4.41Å; L54-I66 HydrophobicContact CB-CG2 4.13Å; L54-I66 HydrophobicContact CD1-CG2 4.39Å; L54-L69 HydrophobicContact CD1-CB 3.76Å; L54-L69 HydrophobicContact CD2-CB 3.98Å; L54-L69 HydrophobicContact CD2-CD1 3.57Å; L54-L69 HydrophobicContact CD2-CG 4.39Å; L54-L70 HydrophobicContact CD1-CD1 4.01Å; L54-L70 HydrophobicContact CD1-CD2 4.31Å; L54-L70 HydrophobicContact CD1-CG 3.73Å
55V92.9Very high91.2Very high9 Ų983.5 Ų83.56%0.05540%0.401CS..Hα-helixtrans-71.2-31.6174.2176.80000111.7L51 K52 L57 G59 W63 I66 W82L51-V55 HydrophobicContact CD1-CG2 4.02Å; L51-V55 WeakPolarHBondContact O-CG2 3.44Å; L51-V55 PolarHBondContact O-N 3.48Å; K52-V55 PolarHBondContact O-N 3.46Å; V55-L57 VanDerWaalsContact C-N 3.31Å; V55-G59 WeakPolarHBondContact CA-O 3.38Å; V55-G59 CarbonylContact O-C 3.42Å; V55-G59 WeakPolarHBondContact O-CA 3.1Å; V55-G59 PolarHBondContact O-N 2.75Å; V55-W63 HydrophobicContact CG2-CH2 3.76Å; V55-W63 HydrophobicContact CG2-CZ3 3.74Å; V55-I66 HydrophobicContact CG2-CD1 3.96Å; V55-W82 HydrophobicContact CB-CD2 4.29Å; V55-W82 HydrophobicContact CB-CE3 4.17Å; V55-W82 HydrophobicContact CB-CH2 4.11Å; V55-W82 HydrophobicContact CB-CZ2 4.21Å; V55-W82 HydrophobicContact CB-CZ3 4.11Å; V55-W82 HydrophobicContact CG1-CD2 3.94Å; V55-W82 HydrophobicContact CG1-CE3 4.27Å; V55-W82 HydrophobicContact CG1-CH2 3.85Å; V55-W82 HydrophobicContact CG1-CZ2 3.46Å; V55-W82 VanDerWaalsContact CG1-CZ2 3.46Å; V55-W82 HydrophobicContact CG1-CZ3 4.25Å; V55-W82 HydrophobicContact CG2-CD2 4.05Å; V55-W82 HydrophobicContact CG2-CE3 4.02Å; V55-W82 HydrophobicContact CG2-CG 4.43Å; V55-W82 HydrophobicContact CG2-CZ3 4.43Å
56E91.8Very high91.1Very high133 Ų13375.3 Ų75.362%0.62137%0.37SS*.Hα-helixtrans-70.2-25.9174.8-167.8161.1-160.500112.3K52 K53 L54K52-E56 IonicContact NZ-OE1 3.35Å; K52-E56 PolarHBondContact NZ-OE1 3.11Å; K52-E56 IonicContact NZ-OE2 2.72Å; K52-E56 PolarHBondContact NZ-OE2 2.7Å; K52-E56 VanDerWaalsContact O-CB 3.24Å; K52-E56 WeakPolarHBondContact O-CB 3.18Å; K52-E56 PolarHBondContact O-N 3.12Å; K53-E56 PolarHBondContact O-N 3.42Å; L54-E56 VanDerWaalsContact C-N 3.34Å
57L90.3Very high91Very high130 Ų13070 Ų7068%0.68135%0.348SS*.Hα-helixtrans-95-38.7178.6-178.262.4000114.2K53 L54 V55K53-L57 VanDerWaalsContact O-CB 3.31Å; K53-L57 WeakPolarHBondContact O-CB 3.34Å; K53-L57 PolarHBondContact O-N 2.84Å; L54-L57 PolarHBondContact O-N 3.01Å; V55-L57 VanDerWaalsContact C-N 3.31Å
58H87.6Confident90.9Very high70 Ų7072.7 Ų72.732%0.32437%0.37SS..Hα-helixtrans-110.14.3-174-59-69.3000113.8L54 L65L54-H58 WeakPolarHBondContact O-CB 3.13Å; L54-H58 PolarHBondContact O-CD2 3.41Å; L54-H58 PolarHBondContact O-N 2.84Å; H58-L65 HydrophobicContact CB-CD2 4.48Å
59G87.3Confident90.6Very high36 Ų3674.4 Ų74.437%0.37138%0.379SS..THydrogen-bonded Turntrans69.5-171.2-170.800000112.9V55 I66V55-G59 WeakPolarHBondContact CA-O 3.38Å; V55-G59 CarbonylContact O-C 3.42Å; V55-G59 WeakPolarHBondContact O-CA 3.1Å; V55-G59 PolarHBondContact O-N 2.75Å; G59-I66 WeakPolarHBondContact O-CD1 3.46Å
60S85.3Confident90.3Very high61 Ų6170.9 Ų70.943%0.42736%0.363SS..THydrogen-bonded Turntrans-109.228.2-174.658.20000113.8W63S60-W63 VanDerWaalsContact O-CZ2 3.25Å; S60-W63 WeakPolarHBondContact O-CZ2 3.39Å; S60-W63 PolarHBondContact O-NE1 2.82Å
61E83.8Confident89.7Confident170 Ų17069.5 Ų69.579%0.79437%0.371SS*.THydrogen-bonded Turntrans-111.4-54.8-172.2-62.6-179.3-170.100110.9W63E61-W63 VanDerWaalsContact C-N 3.31Å; E61-W63 PolarHBondContact O-N 3.37Å
62D89.5Confident89.2Confident104 Ų10472.8 Ų72.856%0.55639%0.389SS*.  trans-81.364.2-178.2-81-44.2000114.4K64 L65 I66D62-K64 PolarHBondContact O-N 2.7Å; D62-L65 HydrophobicContact CB-CB 4.11Å; D62-L65 WeakPolarHBondContact O-CB 3.48Å; D62-L65 PolarHBondContact O-N 3.37Å; D62-I66 PolarHBondContact O-N 3.26Å; D62-I66 VanDerWaalsContact O-N 3.12Å
63W92.3Very high88.9Confident21 Ų2169.4 Ų69.48%0.0837%0.373CS..Hα-helixtrans-55.9-26.1178.1-63.9101.2000114.4L51 V55 S60 E61 I66 A67 D75 C78 Q79 W82L51-W63 HydrophobicContact CD1-CZ3 4.29Å; V55-W63 HydrophobicContact CG2-CH2 3.76Å; V55-W63 HydrophobicContact CG2-CZ3 3.74Å; S60-W63 VanDerWaalsContact O-CZ2 3.25Å; S60-W63 WeakPolarHBondContact O-CZ2 3.39Å; S60-W63 PolarHBondContact O-NE1 2.82Å; E61-W63 VanDerWaalsContact C-N 3.31Å; E61-W63 PolarHBondContact O-N 3.37Å; W63-I66 HydrophobicContact CD2-CD1 4.41Å; W63-I66 HydrophobicContact CE3-CD1 3.9Å; W63-I66 HydrophobicContact CE3-CG2 4.41Å; W63-I66 HydrophobicContact CZ3-CD1 3.99Å; W63-I66 HydrophobicContact CZ3-CG2 4.49Å; W63-A67 VanDerWaalsContact O-CB 3.26Å; W63-A67 WeakPolarHBondContact O-CB 3.33Å; W63-A67 PolarHBondContact O-N 2.81Å; W63-D75 HydrophobicContact CB-CB 3.89Å; W63-D75 WeakPolarHBondContact O-CB 3.09Å; W63-C78 HydrophobicContact CE3-CB 4.04Å; W63-C78 HydrophobicContact CZ3-CB 4.4Å; W63-Q79 HydrophobicContact CD2-CB 3.57Å; W63-Q79 HydrophobicContact CD2-CG 4.02Å; W63-Q79 HydrophobicContact CE3-CB 3.93Å; W63-Q79 HydrophobicContact CG-CB 3.84Å; W63-Q79 HydrophobicContact CG-CG 4.25Å; W63-Q79 HydrophobicContact CZ2-CB 4.42Å; W63-Q79 HydrophobicContact CZ2-CG 4.24Å; W63-W82 HydrophobicContact CH2-CB 3.46Å; W63-W82 VanDerWaalsContact CH2-CB 3.46Å; W63-W82 AromaticContact CH2-CD1 3.6Å; W63-W82 HydrophobicContact CH2-CD2 4.46Å; W63-W82 AromaticContact CH2-CG 3.56Å; W63-W82 HydrophobicContact CH2-CG 3.56Å; W63-W82 HydrophobicContact CZ2-CB 4.39Å; W63-W82 HydrophobicContact CZ2-CG 4.39Å; W63-W82 HydrophobicContact CZ3-CB 3.93Å; W63-W82 HydrophobicContact CZ3-CG 4.39Å
64K91.9Very high88.9Confident159 Ų15965.4 Ų65.469%0.69136%0.36SS*.Hα-helixtrans-69.5-39.4175.7-66.7176.2-178.31730112.5D62 S68 D75D62-K64 PolarHBondContact O-N 2.7Å; K64-S68 PolarHBondContact O-N 3.09Å; K64-D75 HydrophobicContact CG-CB 4.23Å
65L89.9Confident88.9Confident71 Ų7167.1 Ų67.137%0.37237%0.37SS..Hα-helixtrans-69.6-43.7174.1178.261.1000110.7H58 D62 A67 S68 L69H58-L65 HydrophobicContact CB-CD2 4.48Å; D62-L65 HydrophobicContact CB-CB 4.11Å; D62-L65 WeakPolarHBondContact O-CB 3.48Å; D62-L65 PolarHBondContact O-N 3.37Å; L65-A67 VanDerWaalsContact C-N 3.25Å; L65-A67 PolarHBondContact O-N 3.41Å; L65-S68 PolarHBondContact O-N 3.41Å; L65-S68 PolarHBondContact O-OG 3.26Å; L65-L69 HydrophobicContact CD1-CD1 4.21Å; L65-L69 HydrophobicContact CG-CD1 4.28Å; L65-L69 WeakPolarHBondContact O-CG 3.45Å; L65-L69 PolarHBondContact O-N 3.11Å
66I90.8Very high88.8Confident0 Ų070.2 Ų70.20%039%0.388CS..Hα-helixtrans-60.8-37.6176.8-65.4161.5000111L51 L54 V55 G59 D62 W63 L70 C78L51-I66 HydrophobicContact CD1-CG2 3.5Å; L51-I66 VanDerWaalsContact CD1-CG2 3.5Å; L54-I66 HydrophobicContact CB-CG1 4.41Å; L54-I66 HydrophobicContact CB-CG2 4.13Å; L54-I66 HydrophobicContact CD1-CG2 4.39Å; V55-I66 HydrophobicContact CG2-CD1 3.96Å; G59-I66 WeakPolarHBondContact O-CD1 3.46Å; D62-I66 PolarHBondContact O-N 3.26Å; D62-I66 VanDerWaalsContact O-N 3.12Å; W63-I66 HydrophobicContact CD2-CD1 4.41Å; W63-I66 HydrophobicContact CE3-CD1 3.9Å; W63-I66 HydrophobicContact CE3-CG2 4.41Å; W63-I66 HydrophobicContact CZ3-CD1 3.99Å; W63-I66 HydrophobicContact CZ3-CG2 4.49Å; I66-L70 HydrophobicContact CG2-CD1 3.96Å; I66-L70 WeakPolarHBondContact O-CD1 3.37Å; I66-L70 WeakPolarHBondContact O-CG 3.22Å; I66-L70 PolarHBondContact O-N 2.8Å; I66-C78 HydrophobicContact CG2-CB 4.29Å
67A91.6Very high88.8Confident13 Ų1366.1 Ų66.111%0.10737%0.369CS..Hα-helixtrans-73.4-37.9176.200000114W63 L65 L69 L70 D75W63-A67 VanDerWaalsContact O-CB 3.26Å; W63-A67 WeakPolarHBondContact O-CB 3.33Å; W63-A67 PolarHBondContact O-N 2.81Å; L65-A67 VanDerWaalsContact C-N 3.25Å; L65-A67 PolarHBondContact O-N 3.41Å; A67-L69 PolarHBondContact O-N 3.46Å; A67-L70 CarbonylContact O-C 3.47Å; A67-L70 PolarHBondContact O-N 2.75Å; A67-L70 VanDerWaalsContact O-O 3.1Å; A67-D75 HydrophobicContact CB-CB 4.12Å; A67-D75 VanDerWaalsContact CB-N 3.31Å
68S90.2Very high89Confident90 Ų9060 Ų6063%0.62934%0.337SS*.Hα-helixtrans-62.4-29.9175.571.60000112K64 L65K64-S68 PolarHBondContact O-N 3.09Å; L65-S68 PolarHBondContact O-N 3.41Å; L65-S68 PolarHBondContact O-OG 3.26Å
69L88.4Confident89.2Confident66 Ų6659.5 Ų59.535%0.34634%0.335SS..THydrogen-bonded Turntrans-82.2-9.7174.5-61.9170000113.6K50 L54 L65 A67K50-L69 VanDerWaalsContact CE-O 3.31Å; K50-L69 WeakPolarHBondContact CE-O 3.29Å; K50-L69 PolarHBondContact NZ-O 2.88Å; L54-L69 HydrophobicContact CD1-CB 3.76Å; L54-L69 HydrophobicContact CD2-CB 3.98Å; L54-L69 HydrophobicContact CD2-CD1 3.57Å; L54-L69 HydrophobicContact CD2-CG 4.39Å; L65-L69 HydrophobicContact CD1-CD1 4.21Å; L65-L69 HydrophobicContact CG-CD1 4.28Å; L65-L69 WeakPolarHBondContact O-CG 3.45Å; L65-L69 PolarHBondContact O-N 3.11Å; A67-L69 PolarHBondContact O-N 3.46Å
70L87.1Confident89.5Confident7 Ų761.4 Ų61.44%0.03733%0.334CS..SBendtrans-112.292.7177.6-77.6164.1000111.4K50 L51 L54 I66 A67 N72 R73 C78K50-L70 HydrophobicContact CB-CD2 4.07Å; K50-L70 HydrophobicContact CD-CD2 3.94Å; K50-L70 HydrophobicContact CG-CD2 3.99Å; L51-L70 HydrophobicContact CB-CD1 3.92Å; L51-L70 HydrophobicContact CD1-CD1 3.76Å; L51-L70 HydrophobicContact CG-CD1 4.34Å; L54-L70 HydrophobicContact CD1-CD1 4.01Å; L54-L70 HydrophobicContact CD1-CD2 4.31Å; L54-L70 HydrophobicContact CD1-CG 3.73Å; I66-L70 HydrophobicContact CG2-CD1 3.96Å; I66-L70 WeakPolarHBondContact O-CD1 3.37Å; I66-L70 WeakPolarHBondContact O-CG 3.22Å; I66-L70 PolarHBondContact O-N 2.8Å; A67-L70 CarbonylContact O-C 3.47Å; A67-L70 PolarHBondContact O-N 2.75Å; A67-L70 VanDerWaalsContact O-O 3.1Å; L70-N72 PolarHBondContact O-N 2.88Å; L70-R73 HydrophobicContact CB-CB 4.07Å; L70-R73 HydrophobicContact CB-CG 4.36Å; L70-R73 PolarHBondContact O-N 3.34Å; L70-C78 WeakPolarHBondContact CD1-SG 3.49Å
71A81.1Confident89.9Confident75 Ų7561 Ų6162%0.6232%0.323SS*.THydrogen-bonded Turntrans-50.7124-179.300000112.7R73A71-R73 VanDerWaalsContact C-N 3.35Å
72N82.9Confident90.3Very high70 Ų7054 Ų5437%0.37429%0.29SS..THydrogen-bonded Turntrans68.419.2-179.2-40.8-70.2000115.9R36 L38 L70R36-N72 PolarHBondContact NH1-OD1 2.81Å; L38-N72 HydrophobicContact CD1-CB 3.9Å; L38-N72 HydrophobicContact CG-CB 4.01Å; L70-N72 PolarHBondContact O-N 2.88Å
73R87.9Confident90.4Very high19 Ų1953.3 Ų53.37%0.07228%0.283CS..  trans-114.5148.9169.1-59.5-60.8179.3-179.81.2111.6T41 R42 W43 E47 L70 A71T41-R73 PolarHBondContact O-NH1 2.9Å; T41-R73 PolarHBondContact O-NH2 2.88Å; R42-R73 PolarHBondContact O-NH2 3.24Å; W43-R73 HydrophobicContact CH2-CB 4.37Å; W43-R73 HydrophobicContact CH2-CG 3.91Å; W43-R73 HydrophobicContact CZ2-CG 4.3Å; W43-R73 HydrophobicContact CZ3-CG 4.34Å; E47-R73 VanDerWaalsContact CD-NH2 3.25Å; E47-R73 IonicContact OE1-CZ 2.7Å; E47-R73 VanDerWaalsContact OE1-CZ 3.25Å; E47-R73 IonicContact OE1-NE 3.33Å; E47-R73 PolarHBondContact OE1-NE 2.86Å; E47-R73 IonicContact OE1-NH2 3.14Å; E47-R73 PolarHBondContact OE1-NH2 3.32Å; E47-R73 IonicContact OE2-CZ 3.39Å; E47-R73 IonicContact OE2-NE 2.61Å; E47-R73 IonicContact OE2-NH2 2.77Å; E47-R73 PolarHBondContact OE2-NH2 3.25Å; L70-R73 HydrophobicContact CB-CB 4.07Å; L70-R73 HydrophobicContact CB-CG 4.36Å; L70-R73 PolarHBondContact O-N 3.34Å; A71-R73 VanDerWaalsContact C-N 3.35Å
74T92Very high90.2Very high53 Ų5357.6 Ų57.633%0.32530%0.302SS..  trans-96.4158.5172.668.70000111.7V76 Q77 C78T74-V76 VanDerWaalsContact C-N 3.32Å; T74-V76 PolarHBondContact O-N 3.03Å; T74-Q77 VanDerWaalsContact N-OE1 3.1Å; T74-Q77 WeakPolarHBondContact O-CA 3.16Å; T74-Q77 WeakPolarHBondContact O-CB 3.15Å; T74-Q77 PolarHBondContact O-N 3.4Å; T74-Q77 VanDerWaalsContact OG1-CG 3.28Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.41Å; T74-Q77 PolarHBondContact OG1-N 2.75Å; T74-C78 PolarHBondContact O-N 3.11Å; T74-C78 PolarHBondContact O-SG 3.32Å; T74-C78 VanDerWaalsContact O-SG 3.35Å
75D92.3Very high90Very high52 Ų5252.5 Ų52.528%0.27828%0.284SS..Hα-helixtrans-51.6-48.2173.957.4-16.8000112.3W63 K64 A67 Q77 C78 Q79W63-D75 HydrophobicContact CB-CB 3.89Å; W63-D75 WeakPolarHBondContact O-CB 3.09Å; K64-D75 HydrophobicContact CG-CB 4.23Å; A67-D75 HydrophobicContact CB-CB 4.12Å; A67-D75 VanDerWaalsContact CB-N 3.31Å; D75-Q77 VanDerWaalsContact C-N 3.33Å; D75-Q77 PolarHBondContact O-N 3Å; D75-C78 PolarHBondContact O-N 2.81Å; D75-Q79 WeakPolarHBondContact O-CB 3.44Å; D75-Q79 PolarHBondContact O-N 2.8Å
76V91.8Very high90Very high74 Ų7450.7 Ų50.745%0.44828%0.275SS..Hα-helixtrans-64-35.2176178.70000112.2T74 H80T74-V76 VanDerWaalsContact C-N 3.32Å; T74-V76 PolarHBondContact O-N 3.03Å; V76-H80 VanDerWaalsContact O-CB 3.23Å; V76-H80 WeakPolarHBondContact O-CB 3.4Å; V76-H80 PolarHBondContact O-N 3.46Å; V76-H80 PolarHBondContact O-ND1 2.97Å
77Q92.2Very high89.9Confident48 Ų4851.8 Ų51.822%0.22428%0.281CS..Hα-helixtrans-67.8-44.9174-75.3173.1-7.400111.3L38 W43 T74 D75 H80 R81L38-Q77 PolarHBondContact O-NE2 3.12Å; W43-Q77 HydrophobicContact CZ2-CB 4.2Å; T74-Q77 VanDerWaalsContact N-OE1 3.1Å; T74-Q77 WeakPolarHBondContact O-CA 3.16Å; T74-Q77 WeakPolarHBondContact O-CB 3.15Å; T74-Q77 PolarHBondContact O-N 3.4Å; T74-Q77 VanDerWaalsContact OG1-CG 3.28Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.41Å; T74-Q77 PolarHBondContact OG1-N 2.75Å; D75-Q77 VanDerWaalsContact C-N 3.33Å; D75-Q77 PolarHBondContact O-N 3Å; Q77-H80 PolarHBondContact O-N 2.87Å; Q77-R81 VanDerWaalsContact O-CB 3.31Å; Q77-R81 WeakPolarHBondContact O-CB 3.36Å; Q77-R81 PolarHBondContact O-N 3.45Å
78C93.1Very high89.6Confident0 Ų056 Ų560%031%0.307CS..Hα-helixtrans-63.6-48.2178.4-66.90000111.8L51 W63 I66 L70 T74 D75 H80 R81 W82L51-C78 HydrophobicContact CD1-CB 3.92Å; L51-C78 HydrophobicContact CD2-CB 4.49Å; W63-C78 HydrophobicContact CE3-CB 4.04Å; W63-C78 HydrophobicContact CZ3-CB 4.4Å; I66-C78 HydrophobicContact CG2-CB 4.29Å; L70-C78 WeakPolarHBondContact CD1-SG 3.49Å; T74-C78 PolarHBondContact O-N 3.11Å; T74-C78 PolarHBondContact O-SG 3.32Å; T74-C78 VanDerWaalsContact O-SG 3.35Å; D75-C78 PolarHBondContact O-N 2.81Å; C78-H80 PolarHBondContact O-N 3.36Å; C78-R81 PolarHBondContact O-N 3.22Å; C78-W82 PolarHBondContact O-N 3.44Å
79Q93.1Very high89.4Confident60 Ų6058.5 Ų58.528%0.2831%0.309SS..Hα-helixtrans-56.9-49.6175.5-177-177.385.800111.3W63 D75 R81 W82 Q83W63-Q79 HydrophobicContact CD2-CB 3.57Å; W63-Q79 HydrophobicContact CD2-CG 4.02Å; W63-Q79 HydrophobicContact CE3-CB 3.93Å; W63-Q79 HydrophobicContact CG-CB 3.84Å; W63-Q79 HydrophobicContact CG-CG 4.25Å; W63-Q79 HydrophobicContact CZ2-CB 4.42Å; W63-Q79 HydrophobicContact CZ2-CG 4.24Å; D75-Q79 WeakPolarHBondContact O-CB 3.44Å; D75-Q79 PolarHBondContact O-N 2.8Å; Q79-R81 VanDerWaalsContact C-N 3.34Å; Q79-R81 PolarHBondContact O-N 3.22Å; Q79-W82 PolarHBondContact O-N 2.92Å; Q79-Q83 HydrophobicContact CG-CG 4.3Å; Q79-Q83 WeakPolarHBondContact O-CB 3.39Å; Q79-Q83 WeakPolarHBondContact O-CG 3.34Å; Q79-Q83 PolarHBondContact O-N 3.35Å
80H92.4Very high89.4Confident77 Ų7756.6 Ų56.636%0.35630%0.299SS..Hα-helixtrans-63.6-37.1177.7-78.2159.6000113.2V76 Q77 C78 K84V76-H80 VanDerWaalsContact O-CB 3.23Å; V76-H80 WeakPolarHBondContact O-CB 3.4Å; V76-H80 PolarHBondContact O-N 3.46Å; V76-H80 PolarHBondContact O-ND1 2.97Å; Q77-H80 PolarHBondContact O-N 2.87Å; C78-H80 PolarHBondContact O-N 3.36Å; H80-K84 HydrophobicContact CB-CD 4.45Å; H80-K84 PolarHBondContact CD2-NZ 3.23Å; H80-K84 PolarHBondContact NE2-NZ 3.23Å; H80-K84 VanDerWaalsContact O-CB 3.24Å; H80-K84 WeakPolarHBondContact O-CB 3.19Å; H80-K84 WeakPolarHBondContact O-CG 3.29Å; H80-K84 PolarHBondContact O-N 3.03Å; H80-K84 VanDerWaalsContact O-N 3.15Å
81R93Very high89.4Confident53 Ų5359.3 Ų59.320%0.231%0.312CS..Hα-helixtrans-66.9-41.7176.5-175.663.5172.5-177.1-2.6111.2W43 D48 L51 Q77 C78 Q79 V85 L86W43-R81 VanDerWaalsContact CB-CZ 3.48Å; W43-R81 HydrophobicContact CD2-CB 4.29Å; W43-R81 HydrophobicContact CD2-CG 3.67Å; W43-R81 HydrophobicContact CE3-CG 3.84Å; W43-R81 HydrophobicContact CG-CG 4.26Å; W43-R81 HydrophobicContact CH2-CB 3.99Å; W43-R81 HydrophobicContact CH2-CG 4.07Å; W43-R81 HydrophobicContact CZ2-CB 3.59Å; W43-R81 HydrophobicContact CZ2-CG 3.88Å; W43-R81 HydrophobicContact CZ3-CB 4.47Å; W43-R81 HydrophobicContact CZ3-CG 4.04Å; D48-R81 VanDerWaalsContact CG-NH2 3.27Å; D48-R81 IonicContact OD1-CZ 3.66Å; D48-R81 VanDerWaalsContact OD1-CZ 3.28Å; D48-R81 IonicContact OD1-NE 3.5Å; D48-R81 PolarHBondContact OD1-NE 3.26Å; D48-R81 IonicContact OD1-NH2 3.6Å; D48-R81 PolarHBondContact OD1-NH2 3.07Å; D48-R81 VanDerWaalsContact OD1-NH2 3.09Å; D48-R81 IonicContact OD2-CZ 3.19Å; D48-R81 IonicContact OD2-NE 3.25Å; D48-R81 IonicContact OD2-NH2 2.72Å; D48-R81 PolarHBondContact OD2-NH2 2.97Å; L51-R81 HydrophobicContact CD2-CB 3.75Å; L51-R81 HydrophobicContact CD2-CG 3.68Å; Q77-R81 VanDerWaalsContact O-CB 3.31Å; Q77-R81 WeakPolarHBondContact O-CB 3.36Å; Q77-R81 PolarHBondContact O-N 3.45Å; C78-R81 PolarHBondContact O-N 3.22Å; Q79-R81 VanDerWaalsContact C-N 3.34Å; Q79-R81 PolarHBondContact O-N 3.22Å; R81-V85 WeakPolarHBondContact O-CA 3.47Å; R81-V85 WeakPolarHBondContact O-CB 3.44Å; R81-V85 PolarHBondContact O-N 2.73Å; R81-V85 VanDerWaalsContact O-N 3.08Å; R81-L86 HydrophobicContact CG-CD1 3.91Å; R81-L86 HydrophobicContact CG-CG 4.17Å; R81-L86 PolarHBondContact O-N 3.27Å; R81-L86 VanDerWaalsContact O-N 3.1Å
82W93.1Very high89.7Confident23 Ų2362.6 Ų62.69%0.08731%0.313CS..Iπ-helixtrans-61.2-64.5173.6-174.1-108.9000111.7K52 V55 W63 C78 Q79 K84 V85 L86 N87 P88K52-W82 HydrophobicContact CB-CZ3 4.29Å; K52-W82 HydrophobicContact CG-CH2 4.37Å; K52-W82 HydrophobicContact CG-CZ3 4.07Å; V55-W82 HydrophobicContact CB-CD2 4.29Å; V55-W82 HydrophobicContact CB-CE3 4.17Å; V55-W82 HydrophobicContact CB-CH2 4.11Å; V55-W82 HydrophobicContact CB-CZ2 4.21Å; V55-W82 HydrophobicContact CB-CZ3 4.11Å; V55-W82 HydrophobicContact CG1-CD2 3.94Å; V55-W82 HydrophobicContact CG1-CE3 4.27Å; V55-W82 HydrophobicContact CG1-CH2 3.85Å; V55-W82 HydrophobicContact CG1-CZ2 3.46Å; V55-W82 VanDerWaalsContact CG1-CZ2 3.46Å; V55-W82 HydrophobicContact CG1-CZ3 4.25Å; V55-W82 HydrophobicContact CG2-CD2 4.05Å; V55-W82 HydrophobicContact CG2-CE3 4.02Å; V55-W82 HydrophobicContact CG2-CG 4.43Å; V55-W82 HydrophobicContact CG2-CZ3 4.43Å; W63-W82 HydrophobicContact CH2-CB 3.46Å; W63-W82 VanDerWaalsContact CH2-CB 3.46Å; W63-W82 AromaticContact CH2-CD1 3.6Å; W63-W82 HydrophobicContact CH2-CD2 4.46Å; W63-W82 AromaticContact CH2-CG 3.56Å; W63-W82 HydrophobicContact CH2-CG 3.56Å; W63-W82 HydrophobicContact CZ2-CB 4.39Å; W63-W82 HydrophobicContact CZ2-CG 4.39Å; W63-W82 HydrophobicContact CZ3-CB 3.93Å; W63-W82 HydrophobicContact CZ3-CG 4.39Å; C78-W82 PolarHBondContact O-N 3.44Å; Q79-W82 PolarHBondContact O-N 2.92Å; W82-K84 PolarHBondContact O-N 3.15Å; W82-K84 VanDerWaalsContact O-N 3.1Å; W82-V85 PolarHBondContact O-N 3.06Å; W82-L86 HydrophobicContact CE3-CB 3.64Å; W82-L86 HydrophobicContact CZ3-CB 3.98Å; W82-L86 PolarHBondContact O-N 3.04Å; W82-L86 VanDerWaalsContact O-N 3.09Å; W82-N87 HydrophobicContact CD2-CB 4.24Å; W82-N87 HydrophobicContact CG-CB 4.37Å; W82-N87 HydrophobicContact CZ2-CB 4.33Å; W82-N87 WeakPolarHBondContact O-CB 3.34Å; W82-N87 PolarHBondContact O-N 2.97Å; W82-P88 VanDerWaalsContact CZ2-CD 3.49Å
83Q90.8Very high89.9Confident89 Ų8961 Ų6142%0.41631%0.313SS..Iπ-helixtrans-57.7-29.4-173.9-70.8174.7-10.800114.4Q79Q79-Q83 HydrophobicContact CG-CG 4.3Å; Q79-Q83 WeakPolarHBondContact O-CB 3.39Å; Q79-Q83 WeakPolarHBondContact O-CG 3.34Å; Q79-Q83 PolarHBondContact O-N 3.35Å
84K89.2Confident90.2Very high110 Ų11065.9 Ų65.948%0.47835%0.347SS..Iπ-helixtrans-109.8-10.3-171.8-57.2168.5-176.1169.20113.8H80 W82 I126H80-K84 HydrophobicContact CB-CD 4.45Å; H80-K84 PolarHBondContact CD2-NZ 3.23Å; H80-K84 PolarHBondContact NE2-NZ 3.23Å; H80-K84 VanDerWaalsContact O-CB 3.24Å; H80-K84 WeakPolarHBondContact O-CB 3.19Å; H80-K84 WeakPolarHBondContact O-CG 3.29Å; H80-K84 PolarHBondContact O-N 3.03Å; H80-K84 VanDerWaalsContact O-N 3.15Å; W82-K84 PolarHBondContact O-N 3.15Å; W82-K84 VanDerWaalsContact O-N 3.1Å; K84-I126 WeakPolarHBondContact O-CD1 3.33Å
85V88.2Confident90.3Very high53 Ų5365.7 Ų65.732%0.32134%0.34SS..Iπ-helixtrans-142.4-43.6-174.1-166.20000114.2R81 W82 K92R81-V85 WeakPolarHBondContact O-CA 3.47Å; R81-V85 WeakPolarHBondContact O-CB 3.44Å; R81-V85 PolarHBondContact O-N 2.73Å; R81-V85 VanDerWaalsContact O-N 3.08Å; W82-V85 PolarHBondContact O-N 3.06Å; V85-K92 WeakPolarHBondContact O-CE 3.45Å; V85-K92 PolarHBondContact O-NZ 2.94Å
86L89.8Confident90.5Very high32 Ų3266.2 Ų66.217%0.16835%0.346CS..Iπ-helixtrans-103.2-24.4-168-58.6-178.7000116D48 L51 R81 W82D48-L86 HydrophobicContact CB-CD1 3.93Å; D48-L86 HydrophobicContact CB-CD2 3.95Å; L51-L86 HydrophobicContact CB-CD1 4.22Å; L51-L86 HydrophobicContact CD2-CD1 3.73Å; L51-L86 HydrophobicContact CG-CD1 4.02Å; R81-L86 HydrophobicContact CG-CD1 3.91Å; R81-L86 HydrophobicContact CG-CG 4.17Å; R81-L86 PolarHBondContact O-N 3.27Å; R81-L86 VanDerWaalsContact O-N 3.1Å; W82-L86 HydrophobicContact CE3-CB 3.64Å; W82-L86 HydrophobicContact CZ3-CB 3.98Å; W82-L86 PolarHBondContact O-N 3.04Å; W82-L86 VanDerWaalsContact O-N 3.09Å
87N87.5Confident90.7Very high24 Ų2471 Ų7113%0.12836%0.36CS..  trans-51.6124.4180175.7-0.4000110.5W82 E89 L90W82-N87 HydrophobicContact CD2-CB 4.24Å; W82-N87 HydrophobicContact CG-CB 4.37Å; W82-N87 HydrophobicContact CZ2-CB 4.33Å; W82-N87 WeakPolarHBondContact O-CB 3.34Å; W82-N87 PolarHBondContact O-N 2.97Å; N87-E89 PolarHBondContact ND2-OE2 2.79Å; N87-E89 PolarHBondContact O-N 3.49Å; N87-E89 WeakPolarHBondContact OD1-CB 3.17Å; N87-E89 WeakPolarHBondContact OD1-CG 3.42Å; N87-E89 PolarHBondContact OD1-N 3.05Å; N87-E89 PolarHBondContact OD1-OE2 3.42Å; N87-L90 HydrophobicContact CB-CD1 4.05Å; N87-L90 HydrophobicContact CB-CG 4.03Å; N87-L90 VanDerWaalsContact O-CB 3.3Å; N87-L90 WeakPolarHBondContact O-CB 3.32Å; N87-L90 WeakPolarHBondContact O-CG 3.41Å; N87-L90 PolarHBondContact O-N 3.2Å
88P86.5Confident90.8Very high101 Ų10174.2 Ų74.266%0.65638%0.375SS*.THydrogen-bonded Turntrans-62.9-19.8-178.925.8-36000114.1W82 L90W82-P88 VanDerWaalsContact CZ2-CD 3.49Å; P88-L90 PolarHBondContact O-N 3.48Å
89E85.9Confident91Very high143 Ų14374.8 Ų74.867%0.66838%0.378SS*.THydrogen-bonded Turntrans-65.8-16.4173.1-59.7177.212600113.2N87 I91 G124N87-E89 PolarHBondContact ND2-OE2 2.79Å; N87-E89 PolarHBondContact O-N 3.49Å; N87-E89 WeakPolarHBondContact OD1-CB 3.17Å; N87-E89 WeakPolarHBondContact OD1-CG 3.42Å; N87-E89 PolarHBondContact OD1-N 3.05Å; N87-E89 PolarHBondContact OD1-OE2 3.42Å; E89-I91 PolarHBondContact O-N 3.27Å; E89-G124 WeakPolarHBondContact O-CA 3.43Å
90L87.4Confident91.1Very high25 Ų2572.9 Ų72.913%0.13137%0.37CS..SBendtrans-76.9112.2-175.5-62.8174.8000112.1N87 P88 K92 G124 I126N87-L90 HydrophobicContact CB-CD1 4.05Å; N87-L90 HydrophobicContact CB-CG 4.03Å; N87-L90 VanDerWaalsContact O-CB 3.3Å; N87-L90 WeakPolarHBondContact O-CB 3.32Å; N87-L90 WeakPolarHBondContact O-CG 3.41Å; N87-L90 PolarHBondContact O-N 3.2Å; P88-L90 PolarHBondContact O-N 3.48Å; L90-K92 PolarHBondContact O-N 2.95Å; L90-K92 VanDerWaalsContact O-N 3.07Å; L90-G124 CarbonylContact C-O 3.59Å; L90-G124 WeakPolarHBondContact CA-O 3.16Å; L90-I126 HydrophobicContact CD1-CD1 4.28Å; L90-I126 HydrophobicContact CD2-CD1 3.92Å; L90-I126 HydrophobicContact CD2-CG1 3.83Å
91I88.3Confident91.3Very high64 Ų6473.8 Ų73.833%0.32837%0.374SS..  trans-75.3103.9179.4-53.3-179.4000109.8E89 K123 G124 R125 Q129E89-I91 PolarHBondContact O-N 3.27Å; I91-K123 VanDerWaalsContact CD1-O 3.24Å; I91-K123 WeakPolarHBondContact CD1-O 3.18Å; I91-G124 PolarHBondContact N-O 3.35Å; I91-R125 VanDerWaalsContact CG2-CZ 3.41Å; I91-R125 PolarHBondContact O-NH1 2.87Å; I91-Q129 PolarHBondContact O-NE2 3.2Å; I91-Q129 VanDerWaalsContact O-NE2 3.11Å
92K85.6Confident91.5Very high144 Ų14475.6 Ų75.663%0.62638%0.381SS*.  trans-89.9-5.6175.5-66.8162-175.2167.90113.4V85 L90V85-K92 WeakPolarHBondContact O-CE 3.45Å; V85-K92 PolarHBondContact O-NZ 2.94Å; L90-K92 PolarHBondContact O-N 2.95Å; L90-K92 VanDerWaalsContact O-N 3.07Å
93G88.8Confident91.7Very high37 Ų3774.5 Ų74.538%0.38138%0.377SS..SBendtrans-77.7179.5-178.700000115R125G93-R125 PolarHBondContact O-NH1 3.08Å; G93-R125 PolarHBondContact O-NH2 3.29Å
94P92.8Very high92Very high121 Ų12172.9 Ų72.979%0.78637%0.371SS*.PPolyproline II helixtrans-59.1160.6174.528.8-36.5000111.6R125P94-R125 PolarHBondContact O-NH2 3.04Å
95W95.6Very high92.3Very high49 Ų4971.9 Ų71.919%0.18637%0.368CS..PPolyproline II helixtrans-80.8134.2176-75.182.1000111.1E99 V103 R125 Q129 R133W95-E99 WeakPolarHBondContact CA-OE2 3.43Å; W95-E99 HydrophobicContact CE3-CB 3.65Å; W95-E99 HydrophobicContact CZ3-CB 3.95Å; W95-V103 HydrophobicContact CH2-CG2 3.94Å; W95-V103 HydrophobicContact CZ3-CG2 3.56Å; W95-R125 HydrophobicContact CH2-CB 4.33Å; W95-R125 HydrophobicContact CH2-CG 4.13Å; W95-R125 HydrophobicContact CZ3-CG 4.37Å; W95-Q129 HydrophobicContact CZ2-CB 3.88Å; W95-R133 HydrophobicContact CD2-CB 4.21Å; W95-R133 HydrophobicContact CD2-CG 3.65Å; W95-R133 HydrophobicContact CE3-CG 4.02Å; W95-R133 HydrophobicContact CG-CG 4.02Å; W95-R133 HydrophobicContact CH2-CB 4.21Å; W95-R133 HydrophobicContact CH2-CG 4.41Å; W95-R133 HydrophobicContact CZ2-CB 3.66Å; W95-R133 HydrophobicContact CZ2-CG 4.03Å; W95-R133 HydrophobicContact CZ3-CG 4.4Å
96T95.8Very high92.7Very high64 Ų6470.2 Ų70.239%0.39336%0.357SS..PPolyproline II helixtrans-88.1162.9170.889.30000111.2E98 E99 D100T96-E98 WeakPolarHBondContact CB-OE2 3.48Å; T96-E98 PolarHBondContact O-N 3.19Å; T96-E98 PolarHBondContact OG1-N 3.13Å; T96-E98 PolarHBondContact OG1-OE2 3.48Å; T96-E99 PolarHBondContact N-OE2 2.98Å; T96-E99 PolarHBondContact O-N 2.94Å; T96-E99 PolarHBondContact OG1-N 2.81Å; T96-D100 PolarHBondContact O-N 3.41Å
97K95.4Very high93.1Very high173 Ų17369.1 Ų69.175%0.75235%0.351SS*.Hα-helixtrans-65.2-30.3179.6-66.4-179.2179.7178.30111.9D100 Q101K97-D100 PolarHBondContact O-N 3.06Å; K97-Q101 WeakPolarHBondContact O-CB 3.48Å; K97-Q101 PolarHBondContact O-N 3.35Å
98E95.5Very high93.5Very high116 Ų11675.8 Ų75.854%0.54238%0.382SS..Hα-helixtrans-79-23.7-178.3-49.468.2-141.600111.8T96 R102T96-E98 WeakPolarHBondContact CB-OE2 3.48Å; T96-E98 PolarHBondContact O-N 3.19Å; T96-E98 PolarHBondContact OG1-N 3.13Å; T96-E98 PolarHBondContact OG1-OE2 3.48Å; E98-R102 PolarHBondContact O-N 2.78Å; E98-R102 PolarHBondContact O-NE 3.14Å
99E95.6Very high94Very high12 Ų1278 Ų786%0.05638%0.381CS..Hα-helixtrans-78.3-45.4166.5-65-179.4113.700111.4W95 T96 Q101 R102 V103 R125W95-E99 WeakPolarHBondContact CA-OE2 3.43Å; W95-E99 HydrophobicContact CE3-CB 3.65Å; W95-E99 HydrophobicContact CZ3-CB 3.95Å; T96-E99 PolarHBondContact N-OE2 2.98Å; T96-E99 PolarHBondContact O-N 2.94Å; T96-E99 PolarHBondContact OG1-N 2.81Å; E99-Q101 PolarHBondContact O-N 3.01Å; E99-R102 PolarHBondContact O-N 2.9Å; E99-V103 WeakPolarHBondContact O-CG2 3.45Å; E99-V103 PolarHBondContact O-N 3.43Å; E99-R125 VanDerWaalsContact CD-NH2 3.34Å; E99-R125 WeakPolarHBondContact OE1-CG 3.27Å; E99-R125 IonicContact OE1-CZ 3.62Å; E99-R125 IonicContact OE1-NE 3.6Å; E99-R125 PolarHBondContact OE1-NE 3.34Å; E99-R125 IonicContact OE1-NH2 2.81Å; E99-R125 PolarHBondContact OE1-NH2 3.41Å; E99-R125 IonicContact OE2-CZ 3.38Å; E99-R125 IonicContact OE2-NE 3.75Å; E99-R125 IonicContact OE2-NH2 3.5Å; E99-R125 PolarHBondContact OE2-NH2 2.91Å
100D96.5Very high94.4Very high21 Ų2173.4 Ų73.411%0.11236%0.358CS..Hα-helixtrans-59.2-46.4177-78.3-23.4000111.5T96 K97 R102 V103 I104 R133 L138T96-D100 PolarHBondContact O-N 3.41Å; K97-D100 PolarHBondContact O-N 3.06Å; D100-R102 PolarHBondContact O-N 2.88Å; D100-V103 WeakPolarHBondContact O-CB 3.48Å; D100-V103 PolarHBondContact O-N 3.47Å; D100-V103 VanDerWaalsContact O-N 3.14Å; D100-I104 WeakPolarHBondContact O-CG1 3.3Å; D100-I104 PolarHBondContact O-N 3.48Å; D100-R133 WeakPolarHBondContact OD1-CG 3.44Å; D100-R133 IonicContact OD1-CZ 3.79Å; D100-R133 IonicContact OD1-NE 3.48Å; D100-R133 PolarHBondContact OD1-NE 3.29Å; D100-R133 IonicContact OD1-NH2 2.74Å; D100-R133 PolarHBondContact OD1-NH2 3.35Å; D100-R133 IonicContact OD2-CZ 3.78Å; D100-R133 IonicContact OD2-NE 3.54Å; D100-R133 IonicContact OD2-NH2 3.58Å; D100-R133 PolarHBondContact OD2-NH2 3.34Å; D100-L138 HydrophobicContact CB-CD1 4.04Å; D100-L138 HydrophobicContact CB-CD2 3.76Å
101Q97.1Very high94.8Very high96 Ų9673.7 Ų73.745%0.44937%0.367SS..Hα-helixtrans-59.3-45.8176.5179.357.728.100111.6K97 E99 V103 I104 E105K97-Q101 WeakPolarHBondContact O-CB 3.48Å; K97-Q101 PolarHBondContact O-N 3.35Å; E99-Q101 PolarHBondContact O-N 3.01Å; Q101-V103 PolarHBondContact O-N 3.31Å; Q101-I104 WeakPolarHBondContact O-CB 3.45Å; Q101-I104 PolarHBondContact O-N 3.14Å; Q101-I104 VanDerWaalsContact O-N 3.14Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.48Å; Q101-E105 PolarHBondContact NE2-OE1 2.78Å; Q101-E105 WeakPolarHBondContact O-CG 3.35Å; Q101-E105 PolarHBondContact O-N 3.5Å
102R96.2Very high95.1Very high91 Ų9172.7 Ų72.734%0.34337%0.369SS..Hα-helixtrans-64.1-37.2173.9-83.6-171.4-69.6158-9.6112.6E98 E99 D100 I104 E105 L106 H121 L122E98-R102 PolarHBondContact O-N 2.78Å; E98-R102 PolarHBondContact O-NE 3.14Å; E99-R102 PolarHBondContact O-N 2.9Å; D100-R102 PolarHBondContact O-N 2.88Å; R102-I104 VanDerWaalsContact C-N 3.29Å; R102-I104 PolarHBondContact O-N 3.45Å; R102-E105 PolarHBondContact O-N 2.85Å; R102-L106 HydrophobicContact CB-CD1 4.32Å; R102-L106 WeakPolarHBondContact O-CB 3.29Å; R102-L106 VanDerWaalsContact O-CD1 3.23Å; R102-L106 WeakPolarHBondContact O-CD1 3.18Å; R102-L106 WeakPolarHBondContact O-CG 3.47Å; R102-L106 PolarHBondContact O-N 3.26Å; R102-H121 PolarHBondContact NH1-O 3.4Å; R102-H121 VanDerWaalsContact NH1-O 3.09Å; R102-L122 HydrophobicContact CB-CD2 3.82Å
103V97Very high95.5Very high0 Ų075 Ų750%038%0.378CS..Hα-helixtrans-60.2-41.5172.7172.40000110.6W95 E99 D100 Q101 V107 L122 W134 L138W95-V103 HydrophobicContact CH2-CG2 3.94Å; W95-V103 HydrophobicContact CZ3-CG2 3.56Å; E99-V103 WeakPolarHBondContact O-CG2 3.45Å; E99-V103 PolarHBondContact O-N 3.43Å; D100-V103 WeakPolarHBondContact O-CB 3.48Å; D100-V103 PolarHBondContact O-N 3.47Å; D100-V103 VanDerWaalsContact O-N 3.14Å; Q101-V103 PolarHBondContact O-N 3.31Å; V103-V107 HydrophobicContact CG1-CG2 4.19Å; V103-V107 VanDerWaalsContact O-CB 3.29Å; V103-V107 WeakPolarHBondContact O-CB 3.48Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 2.82Å; V103-L122 HydrophobicContact CG2-CD1 3.62Å; V103-W134 HydrophobicContact CG1-CB 4.41Å; V103-W134 HydrophobicContact CG1-CE3 4.32Å; V103-L138 HydrophobicContact CB-CD1 3.77Å; V103-L138 HydrophobicContact CG1-CD1 3.69Å
104I96.6Very high95.8Very high54 Ų5479.8 Ų79.828%0.27739%0.385SS..Hα-helixtrans-62-53.1177.6-65.6159.6000110.8D100 Q101 R102 L106 V107 Q108 W134 L138D100-I104 WeakPolarHBondContact O-CG1 3.3Å; D100-I104 PolarHBondContact O-N 3.48Å; Q101-I104 WeakPolarHBondContact O-CB 3.45Å; Q101-I104 PolarHBondContact O-N 3.14Å; Q101-I104 VanDerWaalsContact O-N 3.14Å; R102-I104 VanDerWaalsContact C-N 3.29Å; R102-I104 PolarHBondContact O-N 3.45Å; I104-L106 PolarHBondContact O-N 2.96Å; I104-V107 PolarHBondContact O-N 2.89Å; I104-Q108 WeakPolarHBondContact O-CB 3.13Å; I104-Q108 PolarHBondContact O-N 3.38Å; I104-W134 HydrophobicContact CB-CZ3 4.4Å; I104-W134 HydrophobicContact CG1-CZ3 4.02Å; I104-L138 HydrophobicContact CD1-CB 4.48Å; I104-L138 HydrophobicContact CG1-CB 4.09Å; I104-L138 HydrophobicContact CG1-CD1 4.36Å
105E96.9Very high96Very high90 Ų9075.3 Ų75.342%0.42135%0.353SS..Hα-helixtrans-58.7-44178.7-69.5163.4-173.700112.5Q101 R102 Q108 K109Q101-E105 WeakPolarHBondContact CG-OE1 3.48Å; Q101-E105 PolarHBondContact NE2-OE1 2.78Å; Q101-E105 WeakPolarHBondContact O-CG 3.35Å; Q101-E105 PolarHBondContact O-N 3.5Å; R102-E105 PolarHBondContact O-N 2.85Å; E105-Q108 PolarHBondContact O-N 2.98Å; E105-K109 WeakPolarHBondContact O-CB 3.23Å; E105-K109 PolarHBondContact O-N 3.38Å
106L97.1Very high96Very high18 Ų1877.5 Ų77.59%0.09438%0.375CS..Hα-helixtrans-70.8-32.7179.9-66.7165.7000112R102 I104 Y110 I118 H121 L122R102-L106 HydrophobicContact CB-CD1 4.32Å; R102-L106 WeakPolarHBondContact O-CB 3.29Å; R102-L106 VanDerWaalsContact O-CD1 3.23Å; R102-L106 WeakPolarHBondContact O-CD1 3.18Å; R102-L106 WeakPolarHBondContact O-CG 3.47Å; R102-L106 PolarHBondContact O-N 3.26Å; I104-L106 PolarHBondContact O-N 2.96Å; L106-Y110 HydrophobicContact CB-CD2 4.41Å; L106-Y110 HydrophobicContact CD2-CD2 4.09Å; L106-Y110 HydrophobicContact CD2-CE2 3.7Å; L106-Y110 WeakPolarHBondContact O-CB 3.03Å; L106-Y110 WeakPolarHBondContact O-CD2 3.37Å; L106-Y110 PolarHBondContact O-N 2.85Å; L106-I118 HydrophobicContact CB-CB 4.41Å; L106-I118 HydrophobicContact CB-CG1 4.13Å; L106-I118 HydrophobicContact CB-CG2 3.89Å; L106-I118 HydrophobicContact CD1-CG2 4.14Å; L106-H121 HydrophobicContact CD1-CB 3.58Å; L106-H121 HydrophobicContact CD2-CB 3.65Å; L106-H121 HydrophobicContact CG-CB 4.29Å; L106-L122 HydrophobicContact CD1-CG 4.2Å
107V97.1Very high95.9Very high8 Ų877.1 Ų77.15%0.04837%0.373CS..Hα-helixtrans-72-37.4172169.80000111.2V103 I104 G111 A112 W115 I118 W134V103-V107 HydrophobicContact CG1-CG2 4.19Å; V103-V107 VanDerWaalsContact O-CB 3.29Å; V103-V107 WeakPolarHBondContact O-CB 3.48Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 2.82Å; I104-V107 PolarHBondContact O-N 2.89Å; V107-G111 CarbonylContact O-C 3.59Å; V107-G111 WeakPolarHBondContact O-CA 3.44Å; V107-G111 PolarHBondContact O-N 3Å; V107-A112 HydrophobicContact CG1-CB 3.87Å; V107-W115 HydrophobicContact CG2-CH2 3.7Å; V107-W115 HydrophobicContact CG2-CZ3 3.58Å; V107-I118 HydrophobicContact CG2-CD1 3.75Å; V107-W134 HydrophobicContact CB-CD2 4.31Å; V107-W134 HydrophobicContact CB-CE3 4Å; V107-W134 HydrophobicContact CB-CH2 4.3Å; V107-W134 HydrophobicContact CB-CZ3 4Å; V107-W134 HydrophobicContact CG1-CD2 3.91Å; V107-W134 HydrophobicContact CG1-CE3 3.99Å; V107-W134 HydrophobicContact CG1-CH2 3.74Å; V107-W134 HydrophobicContact CG1-CZ2 3.64Å; V107-W134 HydrophobicContact CG1-CZ3 3.91Å; V107-W134 HydrophobicContact CG2-CD2 4.04Å; V107-W134 HydrophobicContact CG2-CE3 3.91Å; V107-W134 HydrophobicContact CG2-CG 4.41Å; V107-W134 HydrophobicContact CG2-CZ3 4.42Å
108Q96.2Very high96Very high165 Ų16568.9 Ų68.977%0.77134%0.337SS*.Hα-helixtrans-64.3-42.3173.4-172.5176.80.700111.4I104 E105I104-Q108 WeakPolarHBondContact O-CB 3.13Å; I104-Q108 PolarHBondContact O-N 3.38Å; E105-Q108 PolarHBondContact O-N 2.98Å
109K96.2Very high95.9Very high146 Ų14664 Ų6464%0.63532%0.317SS*.Hα-helixtrans-73.9-42.8179.7-172.6-178.7-178.5-169.50113.9E105E105-K109 WeakPolarHBondContact O-CB 3.23Å; E105-K109 PolarHBondContact O-N 3.38Å
110Y95.3Very high95.8Very high47 Ų4772.2 Ų72.218%0.18435%0.352CS..Hα-helixtrans-107.8-9.7-172.1-60.5-62.4000114.7L106 R114 I118 H121L106-Y110 HydrophobicContact CB-CD2 4.41Å; L106-Y110 HydrophobicContact CD2-CD2 4.09Å; L106-Y110 HydrophobicContact CD2-CE2 3.7Å; L106-Y110 WeakPolarHBondContact O-CB 3.03Å; L106-Y110 WeakPolarHBondContact O-CD2 3.37Å; L106-Y110 PolarHBondContact O-N 2.85Å; Y110-R114 VanDerWaalsContact O-CZ 3.3Å; Y110-R114 PolarHBondContact O-NE 2.94Å; Y110-R114 PolarHBondContact O-NH2 3.33Å; Y110-I118 HydrophobicContact CD2-CG1 4.48Å; Y110-H121 AromaticContact CE2-CD2 3.69Å; Y110-H121 AromaticContact CE2-NE2 3.51Å; Y110-H121 AromaticContact CZ-NE2 3.63Å; Y110-H121 PolarHBondContact OH-NE2 3.19Å; Y110-H121 VanDerWaalsContact OH-NE2 3.11Å
111G95.1Very high95.6Very high32 Ų3275.3 Ų75.333%0.3337%0.366SS..  trans79.4150.3-176.300000113.4V107 K113 R114V107-G111 CarbonylContact O-C 3.59Å; V107-G111 WeakPolarHBondContact O-CA 3.44Å; V107-G111 PolarHBondContact O-N 3Å; G111-K113 PolarHBondContact O-N 3.46Å; G111-R114 PolarHBondContact O-N 3Å
112A94.4Very high95.4Very high43 Ų4371.2 Ų71.236%0.35535%0.347SS..THydrogen-bonded Turntrans-69.536-177.200000115.2V107 W115V107-A112 HydrophobicContact CG1-CB 3.87Å; A112-W115 HydrophobicContact CB-CH2 4.11Å; A112-W115 HydrophobicContact CB-CZ2 3.81Å; A112-W115 WeakPolarHBondContact O-CZ2 3.44Å; A112-W115 PolarHBondContact O-NE1 3.48Å
113K94.6Very high95.1Very high191 Ų19175.2 Ų75.283%0.8337%0.367SS*.THydrogen-bonded Turntrans-128.2-35.5179.1-62.5-178.3-178.7178.30112.4G111 W115G111-K113 PolarHBondContact O-N 3.46Å; K113-W115 VanDerWaalsContact C-N 3.28Å; K113-W115 PolarHBondContact O-N 2.88Å
114R95.1Very high94.7Very high138 Ų13876.2 Ų76.252%0.52138%0.377SS..  trans-87.551.1-171.3-69.5-173-77.2-170.5-6.5113.6Y110 G111 S116 V117 I118Y110-R114 VanDerWaalsContact O-CZ 3.3Å; Y110-R114 PolarHBondContact O-NE 2.94Å; Y110-R114 PolarHBondContact O-NH2 3.33Å; G111-R114 PolarHBondContact O-N 3Å; R114-S116 VanDerWaalsContact C-N 3.3Å; R114-S116 PolarHBondContact O-N 2.7Å; R114-V117 HydrophobicContact CB-CB 4.23Å; R114-V117 HydrophobicContact CB-CG2 4.2Å; R114-V117 WeakPolarHBondContact O-CB 3.37Å; R114-V117 PolarHBondContact O-N 3.22Å; R114-I118 PolarHBondContact O-N 3.32Å
115W96.6Very high94.6Very high28 Ų2874.1 Ų74.111%0.10637%0.366CS..Hα-helixtrans-57.3-35.2-172.4-59.6108.4000114.9V107 A112 K113 V117 I118 A119 G127 C130 R131 W134 H135V107-W115 HydrophobicContact CG2-CH2 3.7Å; V107-W115 HydrophobicContact CG2-CZ3 3.58Å; A112-W115 HydrophobicContact CB-CH2 4.11Å; A112-W115 HydrophobicContact CB-CZ2 3.81Å; A112-W115 WeakPolarHBondContact O-CZ2 3.44Å; A112-W115 PolarHBondContact O-NE1 3.48Å; K113-W115 VanDerWaalsContact C-N 3.28Å; K113-W115 PolarHBondContact O-N 2.88Å; W115-V117 VanDerWaalsContact C-N 3.32Å; W115-V117 PolarHBondContact O-N 3.24Å; W115-I118 HydrophobicContact CD2-CD1 4.4Å; W115-I118 HydrophobicContact CE3-CD1 3.76Å; W115-I118 HydrophobicContact CZ3-CD1 3.88Å; W115-A119 WeakPolarHBondContact O-CB 3.38Å; W115-A119 PolarHBondContact O-N 2.95Å; W115-G127 WeakPolarHBondContact O-CA 3.3Å; W115-C130 HydrophobicContact CE3-CB 4.13Å; W115-R131 HydrophobicContact CD2-CB 3.59Å; W115-R131 HydrophobicContact CD2-CG 4.02Å; W115-R131 HydrophobicContact CE3-CB 3.97Å; W115-R131 HydrophobicContact CG-CB 3.81Å; W115-R131 HydrophobicContact CG-CG 4.25Å; W115-R131 HydrophobicContact CZ2-CB 4.47Å; W115-R131 HydrophobicContact CZ2-CG 4.21Å; W115-W134 HydrophobicContact CH2-CB 3.54Å; W115-W134 AromaticContact CH2-CD1 3.63Å; W115-W134 HydrophobicContact CH2-CD2 4.41Å; W115-W134 AromaticContact CH2-CG 3.55Å; W115-W134 HydrophobicContact CH2-CG 3.55Å; W115-W134 HydrophobicContact CZ2-CG 4.47Å; W115-W134 HydrophobicContact CZ3-CB 3.85Å; W115-W134 HydrophobicContact CZ3-CG 4.27Å; W115-H135 AromaticContact CZ2-CE1 3.54Å
116S94.8Very high94.4Very high95 Ų9572.3 Ų72.366%0.66436%0.358SS*.Hα-helixtrans-69.6-26.6175.5-50.40000113.3R114R114-S116 VanDerWaalsContact C-N 3.3Å; R114-S116 PolarHBondContact O-N 2.7Å
117V95.2Very high94.3Very high56 Ų5671.9 Ų71.934%0.33936%0.358SS..Hα-helixtrans-79.9-45175.3-177.60000109.9R114 W115 A119 K120 H121R114-V117 HydrophobicContact CB-CB 4.23Å; R114-V117 HydrophobicContact CB-CG2 4.2Å; R114-V117 WeakPolarHBondContact O-CB 3.37Å; R114-V117 PolarHBondContact O-N 3.22Å; W115-V117 VanDerWaalsContact C-N 3.32Å; W115-V117 PolarHBondContact O-N 3.24Å; V117-A119 PolarHBondContact O-N 3.39Å; V117-K120 WeakPolarHBondContact O-CB 3.2Å; V117-K120 PolarHBondContact O-N 2.98Å; V117-H121 PolarHBondContact O-CD2 2.9Å
118I95.9Very high94.2Very high0 Ų079 Ų790%039%0.388CS..Hα-helixtrans-54.5-43174.7-66.2162.5000110.5L106 V107 Y110 R114 W115 K120 H121 L122 C130L106-I118 HydrophobicContact CB-CB 4.41Å; L106-I118 HydrophobicContact CB-CG1 4.13Å; L106-I118 HydrophobicContact CB-CG2 3.89Å; L106-I118 HydrophobicContact CD1-CG2 4.14Å; V107-I118 HydrophobicContact CG2-CD1 3.75Å; Y110-I118 HydrophobicContact CD2-CG1 4.48Å; R114-I118 PolarHBondContact O-N 3.32Å; W115-I118 HydrophobicContact CD2-CD1 4.4Å; W115-I118 HydrophobicContact CE3-CD1 3.76Å; W115-I118 HydrophobicContact CZ3-CD1 3.88Å; I118-K120 PolarHBondContact O-N 3.45Å; I118-H121 PolarHBondContact O-N 3.14Å; I118-L122 HydrophobicContact CG2-CD1 4.36Å; I118-C130 HydrophobicContact CG2-CB 4.3Å
119A95Very high94.1Very high14 Ų1473.5 Ų73.512%0.11636%0.363CS..Hα-helixtrans-59-38176.300000114.1W115 V117 H121 L122 R125W115-A119 WeakPolarHBondContact O-CB 3.38Å; W115-A119 PolarHBondContact O-N 2.95Å; V117-A119 PolarHBondContact O-N 3.39Å; A119-H121 PolarHBondContact O-N 3.25Å; A119-H121 VanDerWaalsContact O-N 3.13Å; A119-L122 PolarHBondContact O-N 3.43Å; A119-R125 WeakPolarHBondContact CB-O 3.49Å
120K93.4Very high94.1Very high184 Ų18466.5 Ų66.580%0.833%0.332SS*.Hα-helixtrans-61.9-21.1178.9-70.4-178.6177.1-171.60113.3V117 I118V117-K120 WeakPolarHBondContact O-CB 3.2Å; V117-K120 PolarHBondContact O-N 2.98Å; I118-K120 PolarHBondContact O-N 3.45Å
121H92.6Very high94.2Very high86 Ų8670.2 Ų70.240%0.39835%0.346SS..THydrogen-bonded Turntrans-93.62.2177.4-64.4-72.9000113.7R102 L106 Y110 V117 I118 A119R102-H121 PolarHBondContact NH1-O 3.4Å; R102-H121 VanDerWaalsContact NH1-O 3.09Å; L106-H121 HydrophobicContact CD1-CB 3.58Å; L106-H121 HydrophobicContact CD2-CB 3.65Å; L106-H121 HydrophobicContact CG-CB 4.29Å; Y110-H121 AromaticContact CE2-CD2 3.69Å; Y110-H121 AromaticContact CE2-NE2 3.51Å; Y110-H121 AromaticContact CZ-NE2 3.63Å; Y110-H121 PolarHBondContact OH-NE2 3.19Å; Y110-H121 VanDerWaalsContact OH-NE2 3.11Å; V117-H121 PolarHBondContact O-CD2 2.9Å; I118-H121 PolarHBondContact O-N 3.14Å; A119-H121 PolarHBondContact O-N 3.25Å; A119-H121 VanDerWaalsContact O-N 3.13Å
122L92.3Very high94.3Very high10 Ų1073.2 Ų73.25%0.05235%0.351CS..SBendtrans-118.1130.8178.2-66.6164.8000109.5R102 V103 L106 I118 A119 G124 R125 C130R102-L122 HydrophobicContact CB-CD2 3.82Å; V103-L122 HydrophobicContact CG2-CD1 3.62Å; L106-L122 HydrophobicContact CD1-CG 4.2Å; I118-L122 HydrophobicContact CG2-CD1 4.36Å; A119-L122 PolarHBondContact O-N 3.43Å; L122-G124 PolarHBondContact O-N 2.91Å; L122-R125 HydrophobicContact CB-CB 3.97Å; L122-R125 HydrophobicContact CB-CG 4.4Å; L122-R125 HydrophobicContact CD1-CB 4.4Å; L122-C130 VanDerWaalsContact CD1-SG 3.57Å
123K89.2Confident94.3Very high175 Ų17573.8 Ų73.876%0.76134%0.344SS*.THydrogen-bonded Turntrans-72119.7179-64.7-171.4177-173.60108.6I91 R125I91-K123 VanDerWaalsContact CD1-O 3.24Å; I91-K123 WeakPolarHBondContact CD1-O 3.18Å; K123-R125 VanDerWaalsContact C-N 3.28Å; K123-R125 PolarHBondContact O-N 3.14Å
124G89.4Confident94.5Very high21 Ų2166.1 Ų66.122%0.21631%0.31CS..THydrogen-bonded Turntrans69.88.4172.600000117.5E89 L90 I91 L122E89-G124 WeakPolarHBondContact O-CA 3.43Å; L90-G124 CarbonylContact C-O 3.59Å; L90-G124 WeakPolarHBondContact CA-O 3.16Å; I91-G124 PolarHBondContact N-O 3.35Å; L122-G124 PolarHBondContact O-N 2.91Å
125R94.3Very high94.5Very high9 Ų962.6 Ų62.63%0.03430%0.3CS..  trans-104.2129.4177.2-63.1-63.1-170.8171.810.6111.3I91 G93 P94 W95 E99 A119 L122 K123I91-R125 VanDerWaalsContact CG2-CZ 3.41Å; I91-R125 PolarHBondContact O-NH1 2.87Å; G93-R125 PolarHBondContact O-NH1 3.08Å; G93-R125 PolarHBondContact O-NH2 3.29Å; P94-R125 PolarHBondContact O-NH2 3.04Å; W95-R125 HydrophobicContact CH2-CB 4.33Å; W95-R125 HydrophobicContact CH2-CG 4.13Å; W95-R125 HydrophobicContact CZ3-CG 4.37Å; E99-R125 VanDerWaalsContact CD-NH2 3.34Å; E99-R125 WeakPolarHBondContact OE1-CG 3.27Å; E99-R125 IonicContact OE1-CZ 3.62Å; E99-R125 IonicContact OE1-NE 3.6Å; E99-R125 PolarHBondContact OE1-NE 3.34Å; E99-R125 IonicContact OE1-NH2 2.81Å; E99-R125 PolarHBondContact OE1-NH2 3.41Å; E99-R125 IonicContact OE2-CZ 3.38Å; E99-R125 IonicContact OE2-NE 3.75Å; E99-R125 IonicContact OE2-NH2 3.5Å; E99-R125 PolarHBondContact OE2-NH2 2.91Å; A119-R125 WeakPolarHBondContact CB-O 3.49Å; L122-R125 HydrophobicContact CB-CB 3.97Å; L122-R125 HydrophobicContact CB-CG 4.4Å; L122-R125 HydrophobicContact CD1-CB 4.4Å; K123-R125 VanDerWaalsContact C-N 3.28Å; K123-R125 PolarHBondContact O-N 3.14Å
126I93.6Very high94.4Very high53 Ų5362.3 Ų62.327%0.27230%0.3SS..  trans-86144179.9-55.2176.3000109.8K84 L90 K128 Q129 C130K84-I126 WeakPolarHBondContact O-CD1 3.33Å; L90-I126 HydrophobicContact CD1-CD1 4.28Å; L90-I126 HydrophobicContact CD2-CD1 3.92Å; L90-I126 HydrophobicContact CD2-CG1 3.83Å; I126-K128 PolarHBondContact O-N 2.84Å; I126-Q129 WeakPolarHBondContact O-CA 3.4Å; I126-Q129 WeakPolarHBondContact O-CB 3.4Å; I126-Q129 PolarHBondContact O-N 3.42Å; I126-C130 PolarHBondContact O-N 3.14Å; I126-C130 VanDerWaalsContact O-N 3.14Å; I126-C130 PolarHBondContact O-SG 3.09Å; I126-C130 VanDerWaalsContact O-SG 3.41Å
127G94.9Very high94.4Very high8 Ų861.7 Ų61.78%0.08229%0.286CS..Hα-helixtrans-53.7-28.3-179.300000115.2W115 C130 R131W115-G127 WeakPolarHBondContact O-CA 3.3Å; G127-C130 PolarHBondContact O-N 2.81Å; G127-R131 WeakPolarHBondContact O-CB 3.33Å; G127-R131 PolarHBondContact O-N 3.32Å
128K93.8Very high94.3Very high158 Ų15860 Ų6069%0.68728%0.275SS*.Hα-helixtrans-60.7-49170-175.7-172.9171.4-170.90111.6I126 C130 R131 E132I126-K128 PolarHBondContact O-N 2.84Å; K128-C130 VanDerWaalsContact C-N 3.32Å; K128-C130 PolarHBondContact O-N 3.06Å; K128-R131 PolarHBondContact O-N 2.99Å; K128-E132 VanDerWaalsContact O-CB 3.3Å; K128-E132 WeakPolarHBondContact O-CB 3.36Å; K128-E132 PolarHBondContact O-N 3.01Å
129Q95.1Very high94.2Very high49 Ų4961.1 Ų61.123%0.22928%0.282CS..Hα-helixtrans-61.8-42.9177.9-59.1169.7-75.500110I91 W95 I126 E132 R133I91-Q129 PolarHBondContact O-NE2 3.2Å; I91-Q129 VanDerWaalsContact O-NE2 3.11Å; W95-Q129 HydrophobicContact CZ2-CB 3.88Å; I126-Q129 WeakPolarHBondContact O-CA 3.4Å; I126-Q129 WeakPolarHBondContact O-CB 3.4Å; I126-Q129 PolarHBondContact O-N 3.42Å; Q129-E132 PolarHBondContact O-N 3.46Å; Q129-R133 VanDerWaalsContact O-CB 3.3Å; Q129-R133 WeakPolarHBondContact O-CB 3.18Å; Q129-R133 PolarHBondContact O-N 3.13Å
130C96.5Very high94.1Very high0 Ų066 Ų660%031%0.312CS..Hα-helixtrans-60-46.5176.7-52.20000112W115 I118 L122 I126 G127 K128 R133 W134W115-C130 HydrophobicContact CE3-CB 4.13Å; I118-C130 HydrophobicContact CG2-CB 4.3Å; L122-C130 VanDerWaalsContact CD1-SG 3.57Å; I126-C130 PolarHBondContact O-N 3.14Å; I126-C130 VanDerWaalsContact O-N 3.14Å; I126-C130 PolarHBondContact O-SG 3.09Å; I126-C130 VanDerWaalsContact O-SG 3.41Å; G127-C130 PolarHBondContact O-N 2.81Å; K128-C130 VanDerWaalsContact C-N 3.32Å; K128-C130 PolarHBondContact O-N 3.06Å; C130-R133 PolarHBondContact O-N 3.39Å; C130-W134 WeakPolarHBondContact O-CB 3.48Å; C130-W134 PolarHBondContact O-N 2.74Å
131R96.8Very high94Very high125 Ų12564.1 Ų64.147%0.47231%0.306SS..Hα-helixtrans-58.9-49175.5-176.7-176.2175.4-79.9-6111.1W115 G127 K128 W134 H135W115-R131 HydrophobicContact CD2-CB 3.59Å; W115-R131 HydrophobicContact CD2-CG 4.02Å; W115-R131 HydrophobicContact CE3-CB 3.97Å; W115-R131 HydrophobicContact CG-CB 3.81Å; W115-R131 HydrophobicContact CG-CG 4.25Å; W115-R131 HydrophobicContact CZ2-CB 4.47Å; W115-R131 HydrophobicContact CZ2-CG 4.21Å; G127-R131 WeakPolarHBondContact O-CB 3.33Å; G127-R131 PolarHBondContact O-N 3.32Å; K128-R131 PolarHBondContact O-N 2.99Å; R131-W134 PolarHBondContact O-N 3.33Å; R131-H135 PolarHBondContact O-N 3Å; R131-H135 PolarHBondContact O-ND1 3.13Å
132E95.9Very high94.1Very high95 Ų9561 Ų6144%0.44429%0.293SS..Hα-helixtrans-65-41-177-171169.7168.800111.6K128 Q129 N136K128-E132 VanDerWaalsContact O-CB 3.3Å; K128-E132 WeakPolarHBondContact O-CB 3.36Å; K128-E132 PolarHBondContact O-N 3.01Å; Q129-E132 PolarHBondContact O-N 3.46Å; E132-N136 VanDerWaalsContact O-CB 3.29Å; E132-N136 WeakPolarHBondContact O-CB 3.25Å; E132-N136 PolarHBondContact O-N 3.45Å; E132-N136 PolarHBondContact O-ND2 3.07Å
133R96.5Very high94Very high54 Ų5465.2 Ų65.220%0.20431%0.311CS..Hα-helixtrans-65.2-45.2174.7-173.161.7172.8177.8-2.7112W95 D100 Q129 C130 H137 L138W95-R133 HydrophobicContact CD2-CB 4.21Å; W95-R133 HydrophobicContact CD2-CG 3.65Å; W95-R133 HydrophobicContact CE3-CG 4.02Å; W95-R133 HydrophobicContact CG-CG 4.02Å; W95-R133 HydrophobicContact CH2-CB 4.21Å; W95-R133 HydrophobicContact CH2-CG 4.41Å; W95-R133 HydrophobicContact CZ2-CB 3.66Å; W95-R133 HydrophobicContact CZ2-CG 4.03Å; W95-R133 HydrophobicContact CZ3-CG 4.4Å; D100-R133 WeakPolarHBondContact OD1-CG 3.44Å; D100-R133 IonicContact OD1-CZ 3.79Å; D100-R133 IonicContact OD1-NE 3.48Å; D100-R133 PolarHBondContact OD1-NE 3.29Å; D100-R133 IonicContact OD1-NH2 2.74Å; D100-R133 PolarHBondContact OD1-NH2 3.35Å; D100-R133 IonicContact OD2-CZ 3.78Å; D100-R133 IonicContact OD2-NE 3.54Å; D100-R133 IonicContact OD2-NH2 3.58Å; D100-R133 PolarHBondContact OD2-NH2 3.34Å; Q129-R133 VanDerWaalsContact O-CB 3.3Å; Q129-R133 WeakPolarHBondContact O-CB 3.18Å; Q129-R133 PolarHBondContact O-N 3.13Å; C130-R133 PolarHBondContact O-N 3.39Å; R133-H137 WeakPolarHBondContact O-CB 3.27Å; R133-H137 PolarHBondContact O-N 3.01Å; R133-L138 HydrophobicContact CG-CD1 3.76Å; R133-L138 HydrophobicContact CG-CG 4.05Å; R133-L138 PolarHBondContact O-N 2.84Å
134W96.8Very high94.1Very high30 Ų3064.4 Ų64.411%0.11431%0.307CS..Iπ-helixtrans-57.7-59.2176.8176.5-97.9000111.9V103 I104 V107 W115 C130 R131 N136 H137 L138 N139V103-W134 HydrophobicContact CG1-CB 4.41Å; V103-W134 HydrophobicContact CG1-CE3 4.32Å; I104-W134 HydrophobicContact CB-CZ3 4.4Å; I104-W134 HydrophobicContact CG1-CZ3 4.02Å; V107-W134 HydrophobicContact CB-CD2 4.31Å; V107-W134 HydrophobicContact CB-CE3 4Å; V107-W134 HydrophobicContact CB-CH2 4.3Å; V107-W134 HydrophobicContact CB-CZ3 4Å; V107-W134 HydrophobicContact CG1-CD2 3.91Å; V107-W134 HydrophobicContact CG1-CE3 3.99Å; V107-W134 HydrophobicContact CG1-CH2 3.74Å; V107-W134 HydrophobicContact CG1-CZ2 3.64Å; V107-W134 HydrophobicContact CG1-CZ3 3.91Å; V107-W134 HydrophobicContact CG2-CD2 4.04Å; V107-W134 HydrophobicContact CG2-CE3 3.91Å; V107-W134 HydrophobicContact CG2-CG 4.41Å; V107-W134 HydrophobicContact CG2-CZ3 4.42Å; W115-W134 HydrophobicContact CH2-CB 3.54Å; W115-W134 AromaticContact CH2-CD1 3.63Å; W115-W134 HydrophobicContact CH2-CD2 4.41Å; W115-W134 AromaticContact CH2-CG 3.55Å; W115-W134 HydrophobicContact CH2-CG 3.55Å; W115-W134 HydrophobicContact CZ2-CG 4.47Å; W115-W134 HydrophobicContact CZ3-CB 3.85Å; W115-W134 HydrophobicContact CZ3-CG 4.27Å; C130-W134 WeakPolarHBondContact O-CB 3.48Å; C130-W134 PolarHBondContact O-N 2.74Å; R131-W134 PolarHBondContact O-N 3.33Å; W134-N136 VanDerWaalsContact C-N 3.28Å; W134-N136 PolarHBondContact O-N 2.81Å; W134-H137 PolarHBondContact O-N 2.68Å; W134-L138 HydrophobicContact CE3-CB 3.79Å; W134-L138 HydrophobicContact CZ3-CB 4.21Å; W134-L138 PolarHBondContact O-N 3.38Å; W134-L138 VanDerWaalsContact O-N 3.13Å; W134-N139 HydrophobicContact CD2-CB 4.31Å; W134-N139 HydrophobicContact CZ2-CB 3.98Å; W134-N139 WeakPolarHBondContact O-CB 3.39Å; W134-N139 PolarHBondContact O-N 3.4Å
135H95.2Very high94.2Very high65 Ų6567.6 Ų67.630%0.30132%0.323SS..Iπ-helixtrans-65.6-28.7-172.8-69.576000113W115 R131 V142 T177W115-H135 AromaticContact CZ2-CE1 3.54Å; R131-H135 PolarHBondContact O-N 3Å; R131-H135 PolarHBondContact O-ND1 3.13Å; H135-V142 WeakPolarHBondContact O-CG2 3.44Å; H135-T177 VanDerWaalsContact O-CG2 3.3Å; H135-T177 WeakPolarHBondContact O-CG2 3.49Å
136N95.6Very high94.2Very high21 Ų2171.9 Ų71.911%0.11235%0.354CS..Iπ-helixtrans-94.8-21.4-177.8-72.1-47.7000115.4E132 W134 T177 N179E132-N136 VanDerWaalsContact O-CB 3.29Å; E132-N136 WeakPolarHBondContact O-CB 3.25Å; E132-N136 PolarHBondContact O-N 3.45Å; E132-N136 PolarHBondContact O-ND2 3.07Å; W134-N136 VanDerWaalsContact C-N 3.28Å; W134-N136 PolarHBondContact O-N 2.81Å; N136-T177 PolarHBondContact OD1-OG1 3.39Å; N136-N179 WeakPolarHBondContact OD1-CB 3.16Å
137H93.9Very high94.2Very high82 Ų8272.6 Ų72.638%0.3835%0.354SS..Iπ-helixtrans-142.8-29.3-167.6-58.1-70.5000116.1R133 W134 K144R133-H137 WeakPolarHBondContact O-CB 3.27Å; R133-H137 PolarHBondContact O-N 3.01Å; W134-H137 PolarHBondContact O-N 2.68Å; H137-K144 WeakPolarHBondContact O-CE 3.3Å; H137-K144 PolarHBondContact O-NZ 2.76Å
138L94.3Very high94.2Very high20 Ų2075.1 Ų75.111%0.10537%0.367CS..Iπ-helixtrans-107.6-26-170.6-51.3179.6000114.3D100 V103 I104 R133 W134 P140D100-L138 HydrophobicContact CB-CD1 4.04Å; D100-L138 HydrophobicContact CB-CD2 3.76Å; V103-L138 HydrophobicContact CB-CD1 3.77Å; V103-L138 HydrophobicContact CG1-CD1 3.69Å; I104-L138 HydrophobicContact CD1-CB 4.48Å; I104-L138 HydrophobicContact CG1-CB 4.09Å; I104-L138 HydrophobicContact CG1-CD1 4.36Å; R133-L138 HydrophobicContact CG-CD1 3.76Å; R133-L138 HydrophobicContact CG-CG 4.05Å; R133-L138 PolarHBondContact O-N 2.84Å; W134-L138 HydrophobicContact CE3-CB 3.79Å; W134-L138 HydrophobicContact CZ3-CB 4.21Å; W134-L138 PolarHBondContact O-N 3.38Å; W134-L138 VanDerWaalsContact O-N 3.13Å; L138-P140 WeakPolarHBondContact O-CD 3.48Å
139N93.4Very high94.2Very high25 Ų2571.8 Ų71.813%0.13435%0.354CS..SBendtrans-57.7122.7172.7-178.56.9000110W134 E141 V142W134-N139 HydrophobicContact CD2-CB 4.31Å; W134-N139 HydrophobicContact CZ2-CB 3.98Å; W134-N139 WeakPolarHBondContact O-CB 3.39Å; W134-N139 PolarHBondContact O-N 3.4Å; N139-E141 PolarHBondContact ND2-OE2 3.19Å; N139-E141 PolarHBondContact O-N 3.3Å; N139-E141 VanDerWaalsContact O-N 3.1Å; N139-E141 WeakPolarHBondContact OD1-CG 3.37Å; N139-E141 PolarHBondContact OD1-N 3.11Å; N139-E141 PolarHBondContact OD1-OE2 2.7Å; N139-V142 HydrophobicContact CB-CG2 4.05Å; N139-V142 WeakPolarHBondContact O-CB 3.36Å; N139-V142 PolarHBondContact O-N 3.19Å
140P92.6Very high94.1Very high117 Ų11774.2 Ų74.276%0.7637%0.366SS*.THydrogen-bonded Turntrans-56.5-24.1179.5-28.336.7000114.8L138 V142L138-P140 WeakPolarHBondContact O-CD 3.48Å; P140-V142 PolarHBondContact O-N 3.48Å
141E91.8Very high94.1Very high144 Ų14475.1 Ų75.167%0.67337%0.37SS*.THydrogen-bonded Turntrans-66-16.4176.5-58.4173143.200113.4N139 K143 G175N139-E141 PolarHBondContact ND2-OE2 3.19Å; N139-E141 PolarHBondContact O-N 3.3Å; N139-E141 VanDerWaalsContact O-N 3.1Å; N139-E141 WeakPolarHBondContact OD1-CG 3.37Å; N139-E141 PolarHBondContact OD1-N 3.11Å; N139-E141 PolarHBondContact OD1-OE2 2.7Å; E141-K143 PolarHBondContact O-N 3.27Å; E141-G175 WeakPolarHBondContact O-CA 3.4Å
142V93.5Very high94Very high21 Ų2169.6 Ų69.613%0.12735%0.35CS..SBendtrans-82.1110.3-175.4179.80000111.4H135 N139 P140 K144 G175 T177H135-V142 WeakPolarHBondContact O-CG2 3.44Å; N139-V142 HydrophobicContact CB-CG2 4.05Å; N139-V142 WeakPolarHBondContact O-CB 3.36Å; N139-V142 PolarHBondContact O-N 3.19Å; P140-V142 PolarHBondContact O-N 3.48Å; V142-K144 PolarHBondContact O-N 2.77Å; V142-G175 WeakPolarHBondContact CA-O 3.31Å; V142-T177 HydrophobicContact CG1-CG2 4.14Å; V142-T177 HydrophobicContact CG2-CG2 3.91Å
143K90.5Very high94Very high98 Ų9868.7 Ų68.743%0.42634%0.342SS..  trans-67.3117.4177.1-72.4175.1176.2167.90111.6E141 P174 G175 R176E141-K143 PolarHBondContact O-N 3.27Å; K143-P174 WeakPolarHBondContact CD-O 3.4Å; K143-P174 WeakPolarHBondContact CE-O 3.35Å; K143-P174 PolarHBondContact NZ-O 3.47Å; K143-G175 PolarHBondContact N-O 3.07Å; K143-R176 PolarHBondContact O-NH1 3.27Å
144K91.3Very high93.9Very high157 Ų15769.2 Ų69.268%0.68335%0.348SS*.  trans-97.46.9177.3-66.2163.6-173.9172.20113.3H137 V142H137-K144 WeakPolarHBondContact O-CE 3.3Å; H137-K144 PolarHBondContact O-NZ 2.76Å; V142-K144 PolarHBondContact O-N 2.77Å
145T92.1Very high93.9Very high88 Ų8867.8 Ų67.854%0.5434%0.343SS..SBendtrans-66.5159.6174.849.50000111.8R176T145-R176 PolarHBondContact O-NH1 3.16Å; T145-R176 PolarHBondContact O-NH2 3.37Å; T145-R176 PolarHBondContact OG1-NH2 2.61Å
146S93.6Very high93.9Very high100 Ų10066.8 Ų66.870%0.69934%0.337SS*.PPolyproline II helixtrans-52.6153.716450.20000111.4R176S146-R176 PolarHBondContact O-NH2 3.49Å
147W95.1Very high93.9Very high68 Ų6870 Ų7026%0.25835%0.351SS..PPolyproline II helixtrans-68.8142.3170.9-64.698.9000110.5E151 I155 R176 A180 I181 H184W147-E151 WeakPolarHBondContact CA-OE2 3.2Å; W147-E151 HydrophobicContact CE3-CB 4.03Å; W147-E151 HydrophobicContact CZ3-CB 4.49Å; W147-I155 HydrophobicContact CE3-CD1 4.09Å; W147-I155 HydrophobicContact CH2-CD1 4.31Å; W147-I155 HydrophobicContact CZ3-CD1 3.73Å; W147-R176 HydrophobicContact CH2-CB 4.11Å; W147-R176 HydrophobicContact CH2-CG 3.96Å; W147-R176 HydrophobicContact CZ3-CB 4.22Å; W147-R176 HydrophobicContact CZ3-CG 3.68Å; W147-A180 HydrophobicContact CH2-CB 4.2Å; W147-A180 HydrophobicContact CZ2-CB 4Å; W147-I181 HydrophobicContact CH2-CG1 3.88Å; W147-I181 HydrophobicContact CZ3-CG1 4.38Å; W147-H184 AromaticContact CD1-CD2 3.94Å; W147-H184 AromaticContact CD1-CE1 3.55Å; W147-H184 AromaticContact CD1-CG 3.66Å; W147-H184 AromaticContact CD1-ND1 3.44Å; W147-H184 AromaticContact CD1-NE2 3.87Å; W147-H184 HydrophobicContact CD2-CB 4.32Å; W147-H184 AromaticContact CD2-CD2 3.56Å; W147-H184 AromaticContact CD2-CG 3.86Å; W147-H184 AromaticContact CD2-NE2 3.88Å; W147-H184 AromaticContact CE2-CD2 3.74Å; W147-H184 AromaticContact CE2-CG 3.58Å; W147-H184 AromaticContact CE3-CD2 3.99Å; W147-H184 AromaticContact CG-CD2 3.72Å; W147-H184 AromaticContact CG-CE1 3.67Å; W147-H184 AromaticContact CG-CG 3.92Å; W147-H184 AromaticContact CG-ND1 3.93Å; W147-H184 AromaticContact CG-NE2 3.56Å; W147-H184 HydrophobicContact CH2-CB 4.45Å; W147-H184 HydrophobicContact CZ2-CB 3.66Å; W147-H184 AromaticContact NE1-CD2 3.96Å; W147-H184 AromaticContact NE1-CG 3.45Å; W147-H184 AromaticContact NE1-ND1 3.61Å
148T94.6Very high94Very high60 Ų6066.5 Ų66.537%0.36834%0.336SS..  trans-104.2159.317388.20000111E150 E151 D152T148-E150 WeakPolarHBondContact CB-OE2 3.42Å; T148-E150 PolarHBondContact O-N 2.86Å; T148-E150 PolarHBondContact OG1-N 2.85Å; T148-E150 PolarHBondContact OG1-OE2 2.72Å; T148-E151 PolarHBondContact N-OE2 2.86Å; T148-E151 VanDerWaalsContact N-OE2 3.09Å; T148-E151 PolarHBondContact O-N 2.94Å; T148-E151 VanDerWaalsContact O-N 3.11Å; T148-E151 PolarHBondContact OG1-N 2.57Å; T148-D152 PolarHBondContact O-N 2.98Å
149E92.4Very high94Very high89 Ų8967.1 Ų67.142%0.41634%0.338SS..Hα-helixtrans-65.6-25.8-179.8-153.6-163.112600111.9D152 R153 L199E149-D152 PolarHBondContact O-N 3.24Å; E149-R153 WeakPolarHBondContact O-CB 3.27Å; E149-R153 VanDerWaalsContact O-CG 3.22Å; E149-R153 WeakPolarHBondContact O-CG 3.4Å; E149-R153 PolarHBondContact O-N 3.04Å; E149-R153 IonicContact OE1-CZ 3.79Å; E149-R153 IonicContact OE1-NH1 2.7Å; E149-R153 PolarHBondContact OE1-NH1 3.26Å; E149-R153 IonicContact OE2-NH1 3.71Å; E149-L199 HydrophobicContact CG-CD2 3.66Å; E149-L199 WeakPolarHBondContact OE1-CD2 3.26Å
150E94.4Very high94.1Very high99 Ų9972.2 Ų72.246%0.46336%0.362SS..Hα-helixtrans-63.5-46.4172-60.357.5-124.700111T148 R153 I154T148-E150 WeakPolarHBondContact CB-OE2 3.42Å; T148-E150 PolarHBondContact O-N 2.86Å; T148-E150 PolarHBondContact OG1-N 2.85Å; T148-E150 PolarHBondContact OG1-OE2 2.72Å; E150-R153 PolarHBondContact O-N 3.42Å; E150-R153 IonicContact OE1-CZ 3.63Å; E150-R153 IonicContact OE1-NH1 3.76Å; E150-R153 IonicContact OE1-NH2 2.69Å; E150-R153 PolarHBondContact OE1-NH2 3.38Å; E150-I154 WeakPolarHBondContact O-CD1 3.47Å; E150-I154 VanDerWaalsContact O-CG1 3.29Å; E150-I154 WeakPolarHBondContact O-CG1 3.4Å; E150-I154 PolarHBondContact O-N 3.46Å
151E96.1Very high94.2Very high19 Ų1973 Ų739%0.08935%0.353CS..Hα-helixtrans-63.9-45.4176.3-63.4-179.1122.300110.4W147 T148 R153 I154 I155 L173 R176W147-E151 WeakPolarHBondContact CA-OE2 3.2Å; W147-E151 HydrophobicContact CE3-CB 4.03Å; W147-E151 HydrophobicContact CZ3-CB 4.49Å; T148-E151 PolarHBondContact N-OE2 2.86Å; T148-E151 VanDerWaalsContact N-OE2 3.09Å; T148-E151 PolarHBondContact O-N 2.94Å; T148-E151 VanDerWaalsContact O-N 3.11Å; T148-E151 PolarHBondContact OG1-N 2.57Å; E151-R153 PolarHBondContact O-N 3.06Å; E151-I154 WeakPolarHBondContact O-CB 3.27Å; E151-I154 PolarHBondContact O-N 3.48Å; E151-I155 VanDerWaalsContact O-CG1 3.29Å; E151-I155 WeakPolarHBondContact O-CG1 3.49Å; E151-I155 PolarHBondContact O-N 3.43Å; E151-L173 HydrophobicContact CB-CD2 4.01Å; E151-L173 HydrophobicContact CG-CD2 4.05Å; E151-R176 WeakPolarHBondContact OE1-CG 3.25Å; E151-R176 IonicContact OE1-CZ 3.5Å; E151-R176 IonicContact OE1-NE 2.75Å; E151-R176 PolarHBondContact OE1-NE 3.21Å; E151-R176 IonicContact OE1-NH2 3.37Å; E151-R176 PolarHBondContact OE1-NH2 3.36Å; E151-R176 IonicContact OE2-CZ 3.51Å; E151-R176 IonicContact OE2-NE 3.46Å; E151-R176 PolarHBondContact OE2-NE 2.86Å; E151-R176 IonicContact OE2-NH2 2.7Å; E151-R176 PolarHBondContact OE2-NH2 2.86Å
152D95Very high94.4Very high9 Ų968.7 Ų68.75%0.04833%0.334CS..Hα-helixtrans-61.1-42.9176.9-79.231.4000111.6T148 E149 I154 I155 Y156 H184 M189 L199T148-D152 PolarHBondContact O-N 2.98Å; E149-D152 PolarHBondContact O-N 3.24Å; D152-I154 VanDerWaalsContact C-N 3.31Å; D152-I154 PolarHBondContact O-N 3.31Å; D152-I155 PolarHBondContact O-N 3.2Å; D152-Y156 WeakPolarHBondContact O-CB 3.24Å; D152-Y156 PolarHBondContact O-N 2.9Å; D152-H184 VanDerWaalsContact CG-NE2 3.28Å; D152-H184 IonicContact OD1-CD2 3.51Å; D152-H184 IonicContact OD1-CE1 2.72Å; D152-H184 IonicContact OD1-NE2 2.73Å; D152-H184 PolarHBondContact OD1-NE2 2.96Å; D152-H184 IonicContact OD2-CE1 2.72Å; D152-H184 IonicContact OD2-NE2 3.15Å; D152-H184 PolarHBondContact OD2-NE2 3.49Å; D152-H184 VanDerWaalsContact OD2-NE2 3.15Å; D152-M189 HydrophobicContact CB-CE 3.72Å; D152-M189 HydrophobicContact CB-SD 4.25Å; D152-M189 WeakPolarHBondContact O-CE 3.18Å; D152-L199 HydrophobicContact CB-CD1 3.8Å
153R94.8Very high94.5Very high76 Ų7668.9 Ų68.929%0.28734%0.341SS..Hα-helixtrans-61.9-37.9175.4-73.9-177.9-52.1-110.2-0.1111.9E149 E150 E151 Q157 L199E149-R153 WeakPolarHBondContact O-CB 3.27Å; E149-R153 VanDerWaalsContact O-CG 3.22Å; E149-R153 WeakPolarHBondContact O-CG 3.4Å; E149-R153 PolarHBondContact O-N 3.04Å; E149-R153 IonicContact OE1-CZ 3.79Å; E149-R153 IonicContact OE1-NH1 2.7Å; E149-R153 PolarHBondContact OE1-NH1 3.26Å; E149-R153 IonicContact OE2-NH1 3.71Å; E150-R153 PolarHBondContact O-N 3.42Å; E150-R153 IonicContact OE1-CZ 3.63Å; E150-R153 IonicContact OE1-NH1 3.76Å; E150-R153 IonicContact OE1-NH2 2.69Å; E150-R153 PolarHBondContact OE1-NH2 3.38Å; E151-R153 PolarHBondContact O-N 3.06Å; R153-Q157 WeakPolarHBondContact O-CG 3.48Å; R153-Q157 PolarHBondContact O-N 3.15Å; R153-Q157 VanDerWaalsContact O-N 3.13Å; R153-L199 HydrophobicContact CG-CB 4.19Å; R153-L199 HydrophobicContact CG-CD1 3.91Å; R153-L199 HydrophobicContact CG-CD2 3.81Å; R153-L199 HydrophobicContact CG-CG 4.16Å
154I96Very high94.7Very high65 Ų6569 Ų6933%0.33335%0.346SS..Hα-helixtrans-66.4-46.4173.3-68.1163.1000110.8E150 E151 D152 Y156 A158 L172 L173E150-I154 WeakPolarHBondContact O-CD1 3.47Å; E150-I154 VanDerWaalsContact O-CG1 3.29Å; E150-I154 WeakPolarHBondContact O-CG1 3.4Å; E150-I154 PolarHBondContact O-N 3.46Å; E151-I154 WeakPolarHBondContact O-CB 3.27Å; E151-I154 PolarHBondContact O-N 3.48Å; D152-I154 VanDerWaalsContact C-N 3.31Å; D152-I154 PolarHBondContact O-N 3.31Å; I154-Y156 PolarHBondContact O-N 2.9Å; I154-A158 WeakPolarHBondContact O-CB 3.06Å; I154-A158 PolarHBondContact O-N 3.39Å; I154-L172 HydrophobicContact CG2-CB 3.83Å; I154-L172 HydrophobicContact CG2-CD1 4.42Å; I154-L173 HydrophobicContact CB-CD2 3.95Å; I154-L173 HydrophobicContact CD1-CD2 3.97Å; I154-L173 HydrophobicContact CG2-CD1 4.35Å; I154-L173 HydrophobicContact CG2-CD2 3.73Å; I154-L173 HydrophobicContact CG2-CG 3.9Å
155I96.2Very high95Very high0 Ų068.2 Ų68.20%034%0.339CS..Hα-helixtrans-59.1-47178.2-65.5168.6000110.4W147 E151 D152 A158 H159 L173 I181 W185 M189W147-I155 HydrophobicContact CE3-CD1 4.09Å; W147-I155 HydrophobicContact CH2-CD1 4.31Å; W147-I155 HydrophobicContact CZ3-CD1 3.73Å; E151-I155 VanDerWaalsContact O-CG1 3.29Å; E151-I155 WeakPolarHBondContact O-CG1 3.49Å; E151-I155 PolarHBondContact O-N 3.43Å; D152-I155 PolarHBondContact O-N 3.2Å; I155-A158 PolarHBondContact O-N 3.1Å; I155-H159 WeakPolarHBondContact O-CB 3.5Å; I155-H159 PolarHBondContact O-N 3.08Å; I155-L173 HydrophobicContact CD1-CD1 4.1Å; I155-L173 HydrophobicContact CG1-CD1 3.48Å; I155-L173 VanDerWaalsContact CG1-CD1 3.48Å; I155-I181 HydrophobicContact CD1-CG2 4.08Å; I155-I181 HydrophobicContact CG1-CG2 3.96Å; I155-I181 HydrophobicContact CG2-CG2 4.04Å; I155-W185 HydrophobicContact CG2-CE3 3.84Å; I155-W185 HydrophobicContact CG2-CZ3 4.42Å; I155-M189 HydrophobicContact CB-SD 3.83Å; I155-M189 HydrophobicContact CD1-SD 4.18Å; I155-M189 HydrophobicContact CG2-SD 3.61Å
156Y94.4Very high95.3Very high44 Ų4465.6 Ų65.617%0.17332%0.319CS..Hα-helixtrans-62.5-53.2-178.8175.3-126.2000112.1D152 I154 A158 H159 E160 W185 V193 L199 Q200D152-Y156 WeakPolarHBondContact O-CB 3.24Å; D152-Y156 PolarHBondContact O-N 2.9Å; I154-Y156 PolarHBondContact O-N 2.9Å; Y156-A158 VanDerWaalsContact C-N 3.3Å; Y156-A158 PolarHBondContact O-N 3.4Å; Y156-H159 PolarHBondContact O-N 2.77Å; Y156-E160 PolarHBondContact O-N 2.87Å; Y156-W185 HydrophobicContact CD2-CH2 4.33Å; Y156-W185 HydrophobicContact CD2-CZ3 4.41Å; Y156-V193 HydrophobicContact CD2-CG1 3.8Å; Y156-V193 HydrophobicContact CD2-CG2 4.14Å; Y156-V193 HydrophobicContact CE2-CG1 3.4Å; Y156-V193 VanDerWaalsContact CE2-CG1 3.4Å; Y156-L199 HydrophobicContact CD1-CB 4.16Å; Y156-Q200 HydrophobicContact CE1-CG 4.46Å
157Q95.3Very high95.4Very high90 Ų9063.6 Ų63.642%0.42131%0.308SS..Hα-helixtrans-65-32.6179.4-68.2-175.82500113R153 K161R153-Q157 WeakPolarHBondContact O-CG 3.48Å; R153-Q157 PolarHBondContact O-N 3.15Å; R153-Q157 VanDerWaalsContact O-N 3.13Å; Q157-K161 VanDerWaalsContact O-CD 3.27Å; Q157-K161 WeakPolarHBondContact O-CD 3.4Å; Q157-K161 VanDerWaalsContact O-CG 3.29Å; Q157-K161 WeakPolarHBondContact O-CG 3.32Å; Q157-K161 PolarHBondContact O-N 3.33Å
158A96.6Very high95.5Very high7 Ų764.4 Ų64.46%0.05832%0.315CS..Hα-helixtrans-76.2-34.6176.300000111.7I154 I155 Y156 K161 L162 I169 L172I154-A158 WeakPolarHBondContact O-CB 3.06Å; I154-A158 PolarHBondContact O-N 3.39Å; I155-A158 PolarHBondContact O-N 3.1Å; Y156-A158 VanDerWaalsContact C-N 3.3Å; Y156-A158 PolarHBondContact O-N 3.4Å; A158-K161 PolarHBondContact O-N 3.07Å; A158-L162 WeakPolarHBondContact O-CA 3.33Å; A158-L162 WeakPolarHBondContact O-CB 3.43Å; A158-L162 WeakPolarHBondContact O-CG 3.24Å; A158-L162 PolarHBondContact O-N 3.5Å; A158-I169 HydrophobicContact CB-CB 4.42Å; A158-I169 HydrophobicContact CB-CD1 4.34Å; A158-I169 HydrophobicContact CB-CG1 3.92Å; A158-I169 HydrophobicContact CB-CG2 3.94Å; A158-L172 HydrophobicContact CB-CD1 3.72Å
159H95.5Very high95.6Very high33 Ų3361.5 Ų61.515%0.15330%0.298CS..Hα-helixtrans-70-39.7175-172.2-90.7000112.1I155 Y156 K161 G163 N164 W166 I169 W185I155-H159 WeakPolarHBondContact O-CB 3.5Å; I155-H159 PolarHBondContact O-N 3.08Å; Y156-H159 PolarHBondContact O-N 2.77Å; H159-K161 VanDerWaalsContact C-N 3.29Å; H159-K161 PolarHBondContact O-N 3.25Å; H159-G163 PolarHBondContact CD2-O 2.75Å; H159-G163 WeakPolarHBondContact O-CA 3.48Å; H159-G163 PolarHBondContact O-N 2.9Å; H159-N164 PolarHBondContact NE2-OD1 2.85Å; H159-W166 AromaticContact CD2-CH2 3.42Å; H159-W166 VanDerWaalsContact CD2-CH2 3.42Å; H159-W166 WeakPolarHBondContact CD2-CH2 3.23Å; H159-W166 AromaticContact CD2-CZ3 3.7Å; H159-W166 AromaticContact NE2-CH2 3.69Å; H159-I169 HydrophobicContact CB-CD1 4.3Å; H159-W185 HydrophobicContact CB-CE3 4.49Å; H159-W185 HydrophobicContact CB-CH2 4.21Å; H159-W185 HydrophobicContact CB-CZ3 4.13Å; H159-W185 AromaticContact CE1-CE2 3.77Å; H159-W185 AromaticContact CE1-CZ2 3.49Å; H159-W185 VanDerWaalsContact CE1-CZ2 3.49Å; H159-W185 WeakPolarHBondContact CE1-CZ2 3.49Å; H159-W185 AromaticContact CG-CH2 3.9Å; H159-W185 AromaticContact CG-CZ2 3.88Å; H159-W185 AromaticContact ND1-CE2 3.88Å; H159-W185 AromaticContact ND1-CH2 3.54Å; H159-W185 AromaticContact ND1-CZ2 3.32Å; H159-W185 VanDerWaalsContact ND1-CZ2 3.32Å; H159-W185 WeakPolarHBondContact ND1-CZ2 3.28Å; H159-W185 AromaticContact NE2-CE2 3.93Å; H159-W185 AromaticContact NE2-NE1 3.94Å
160E94.2Very high95.8Very high133 Ų13358.3 Ų58.362%0.62129%0.286SS*.Hα-helixtrans-55.3-44.7171.6-178.4-176-12900111.7Y156Y156-E160 PolarHBondContact O-N 2.87Å
161K95.6Very high95.9Very high134 Ų13460.4 Ų60.458%0.58329%0.294SS*.Hα-helixtrans-84.1-30.9-176.1-65.1165.5-167165.50113.9Q157 A158 H159Q157-K161 VanDerWaalsContact O-CD 3.27Å; Q157-K161 WeakPolarHBondContact O-CD 3.4Å; Q157-K161 VanDerWaalsContact O-CG 3.29Å; Q157-K161 WeakPolarHBondContact O-CG 3.32Å; Q157-K161 PolarHBondContact O-N 3.33Å; A158-K161 PolarHBondContact O-N 3.07Å; H159-K161 VanDerWaalsContact C-N 3.29Å; H159-K161 PolarHBondContact O-N 3.25Å
162L95.8Very high95.9Very high52 Ų5263.9 Ų63.927%0.27231%0.313SS..Hα-helixtrans-116.1-14.5-170.4-54.3177.1000114.3A158 R165 E168 I169A158-L162 WeakPolarHBondContact O-CA 3.33Å; A158-L162 WeakPolarHBondContact O-CB 3.43Å; A158-L162 WeakPolarHBondContact O-CG 3.24Å; A158-L162 PolarHBondContact O-N 3.5Å; L162-R165 HydrophobicContact CB-CB 4.19Å; L162-R165 WeakPolarHBondContact O-CG 3.3Å; L162-R165 PolarHBondContact O-NE 3.35Å; L162-E168 HydrophobicContact CD1-CB 4.07Å; L162-I169 HydrophobicContact CD1-CG1 4.22Å
163G94.8Very high95.9Very high26 Ų2663.7 Ų63.727%0.26831%0.311SS..SBendtrans60.8-147.4-169.800000112.2H159 R165H159-G163 PolarHBondContact CD2-O 2.75Å; H159-G163 WeakPolarHBondContact O-CA 3.48Å; H159-G163 PolarHBondContact O-N 2.9Å; G163-R165 PolarHBondContact O-N 2.99Å
164N96.3Very high95.9Very high100 Ų10064.7 Ų64.754%0.53533%0.328SS..SBendtrans-71.328.7-177.6-63.6-8.8000114.7H159 W166H159-N164 PolarHBondContact NE2-OD1 2.85Å; N164-W166 HydrophobicContact CB-CZ2 3.9Å; N164-W166 VanDerWaalsContact O-CD1 3.26Å; N164-W166 PolarHBondContact O-N 2.89Å; N164-W166 PolarHBondContact O-NE1 3.19Å; N164-W166 WeakPolarHBondContact OD1-CZ2 3.34Å
165R96.8Very high95.7Very high141 Ų14162.8 Ų62.853%0.53233%0.325SS..  trans-80.759.8175.8-75.5-174.4-85.9-175.7-6.4111L162 G163 A167 E168 I169L162-R165 HydrophobicContact CB-CB 4.19Å; L162-R165 WeakPolarHBondContact O-CG 3.3Å; L162-R165 PolarHBondContact O-NE 3.35Å; G163-R165 PolarHBondContact O-N 2.99Å; R165-A167 VanDerWaalsContact C-N 3.25Å; R165-A167 PolarHBondContact O-N 3.48Å; R165-A167 VanDerWaalsContact O-N 3.11Å; R165-E168 HydrophobicContact CB-CB 4.22Å; R165-E168 HydrophobicContact CB-CG 4.2Å; R165-E168 WeakPolarHBondContact O-CB 3.44Å; R165-E168 PolarHBondContact O-N 3.25Å; R165-I169 PolarHBondContact O-N 3.29Å; R165-I169 VanDerWaalsContact O-N 3.12Å
166W97.3Very high95.7Very high32 Ų3263.6 Ų63.612%0.12133%0.328CS..Hα-helixtrans-53.8-35.8-171.5-51.7118.2000114.6H159 N164 E168 I169 A170 D178 I181 K182 W185H159-W166 AromaticContact CD2-CH2 3.42Å; H159-W166 VanDerWaalsContact CD2-CH2 3.42Å; H159-W166 WeakPolarHBondContact CD2-CH2 3.23Å; H159-W166 AromaticContact CD2-CZ3 3.7Å; H159-W166 AromaticContact NE2-CH2 3.69Å; N164-W166 HydrophobicContact CB-CZ2 3.9Å; N164-W166 VanDerWaalsContact O-CD1 3.26Å; N164-W166 PolarHBondContact O-N 2.89Å; N164-W166 PolarHBondContact O-NE1 3.19Å; N164-W166 WeakPolarHBondContact OD1-CZ2 3.34Å; W166-E168 VanDerWaalsContact C-N 3.31Å; W166-E168 PolarHBondContact O-N 3.05Å; W166-I169 HydrophobicContact CE3-CD1 4Å; W166-I169 HydrophobicContact CZ3-CD1 4.16Å; W166-I169 PolarHBondContact O-N 2.92Å; W166-A170 WeakPolarHBondContact O-CB 3.42Å; W166-A170 PolarHBondContact O-N 2.85Å; W166-D178 HydrophobicContact CB-CB 3.89Å; W166-I181 HydrophobicContact CE3-CG2 3.82Å; W166-I181 HydrophobicContact CZ3-CG2 4.15Å; W166-K182 HydrophobicContact CD2-CB 3.78Å; W166-K182 HydrophobicContact CD2-CG 4.34Å; W166-K182 HydrophobicContact CE3-CB 4.37Å; W166-K182 HydrophobicContact CG-CB 3.82Å; W166-K182 HydrophobicContact CG-CG 4.38Å; W166-K182 HydrophobicContact CZ2-CG 4.46Å; W166-W185 HydrophobicContact CH2-CB 3.77Å; W166-W185 AromaticContact CH2-CD1 3.58Å; W166-W185 HydrophobicContact CH2-CD2 4.22Å; W166-W185 AromaticContact CH2-CG 3.54Å; W166-W185 HydrophobicContact CH2-CG 3.54Å; W166-W185 HydrophobicContact CZ3-CB 3.99Å; W166-W185 HydrophobicContact CZ3-CG 4.1Å
167A96.8Very high95.8Very high58 Ų5862.4 Ų62.448%0.47933%0.325SS..Hα-helixtrans-70.8-22.5177.100000114R165 D178R165-A167 VanDerWaalsContact C-N 3.25Å; R165-A167 PolarHBondContact O-N 3.48Å; R165-A167 VanDerWaalsContact O-N 3.11Å; A167-D178 HydrophobicContact CB-CB 4.41Å
168E97.3Very high95.9Very high85 Ų8561.6 Ų61.640%0.39732%0.323SS..Hα-helixtrans-82.2-42170.7-61.6-56.4128.100110.6L162 R165 W166 A170 K171L162-E168 HydrophobicContact CD1-CB 4.07Å; R165-E168 HydrophobicContact CB-CB 4.22Å; R165-E168 HydrophobicContact CB-CG 4.2Å; R165-E168 WeakPolarHBondContact O-CB 3.44Å; R165-E168 PolarHBondContact O-N 3.25Å; W166-E168 VanDerWaalsContact C-N 3.31Å; W166-E168 PolarHBondContact O-N 3.05Å; E168-A170 VanDerWaalsContact C-N 3.26Å; E168-A170 PolarHBondContact O-N 2.89Å; E168-K171 WeakPolarHBondContact O-CB 3.41Å; E168-K171 PolarHBondContact O-N 2.64Å; E168-K171 VanDerWaalsContact O-N 3.09Å; E168-K171 WeakPolarHBondContact OE1-CE 3.07Å; E168-K171 IonicContact OE1-NZ 2.7Å; E168-K171 PolarHBondContact OE1-NZ 2.7Å; E168-K171 WeakPolarHBondContact OE2-CE 3.21Å; E168-K171 IonicContact OE2-NZ 2.67Å; E168-K171 PolarHBondContact OE2-NZ 2.85Å
169I96.9Very high95.9Very high0 Ų062.7 Ų62.70%033%0.328CS..Hα-helixtrans-61.2-36.6175.8-56.6176.7000110.8A158 H159 L162 R165 W166 K171 L172 L173 I181A158-I169 HydrophobicContact CB-CB 4.42Å; A158-I169 HydrophobicContact CB-CD1 4.34Å; A158-I169 HydrophobicContact CB-CG1 3.92Å; A158-I169 HydrophobicContact CB-CG2 3.94Å; H159-I169 HydrophobicContact CB-CD1 4.3Å; L162-I169 HydrophobicContact CD1-CG1 4.22Å; R165-I169 PolarHBondContact O-N 3.29Å; R165-I169 VanDerWaalsContact O-N 3.12Å; W166-I169 HydrophobicContact CE3-CD1 4Å; W166-I169 HydrophobicContact CZ3-CD1 4.16Å; W166-I169 PolarHBondContact O-N 2.92Å; I169-K171 PolarHBondContact O-N 3.09Å; I169-L172 WeakPolarHBondContact O-CB 3.48Å; I169-L172 PolarHBondContact O-N 2.9Å; I169-L173 HydrophobicContact CG2-CD1 4.25Å; I169-I181 HydrophobicContact CG2-CD1 4.37Å; I169-I181 HydrophobicContact CG2-CG2 3.99Å
170A96.9Very high95.9Very high22 Ų2262.6 Ų62.618%0.18233%0.333CS..G310 helixtrans-59.5-28.5175.400000114W166 E168 L172 L173 D178 I181W166-A170 WeakPolarHBondContact O-CB 3.42Å; W166-A170 PolarHBondContact O-N 2.85Å; E168-A170 VanDerWaalsContact C-N 3.26Å; E168-A170 PolarHBondContact O-N 2.89Å; A170-L172 PolarHBondContact O-N 3.09Å; A170-L173 PolarHBondContact O-N 3.1Å; A170-D178 HydrophobicContact CB-CB 4.34Å; A170-I181 VanDerWaalsContact CA-CD1 3.46Å; A170-I181 HydrophobicContact CB-CD1 3.82Å
171K96.4Very high96Very high142 Ų14256.2 Ų56.262%0.61730%0.303SS*.G310 helixtrans-67.9-21.3176.3-58.1174.8-169.4170.40112.6E168 I169E168-K171 WeakPolarHBondContact O-CB 3.41Å; E168-K171 PolarHBondContact O-N 2.64Å; E168-K171 VanDerWaalsContact O-N 3.09Å; E168-K171 WeakPolarHBondContact OE1-CE 3.07Å; E168-K171 IonicContact OE1-NZ 2.7Å; E168-K171 PolarHBondContact OE1-NZ 2.7Å; E168-K171 WeakPolarHBondContact OE2-CE 3.21Å; E168-K171 IonicContact OE2-NZ 2.67Å; E168-K171 PolarHBondContact OE2-NZ 2.85Å; I169-K171 PolarHBondContact O-N 3.09Å
172L95.6Very high96Very high93 Ų9353.1 Ų53.149%0.48729%0.29SS..G310 helixtrans-87.7-8.7177.6-52177.5000112.8I154 A158 I169 A170I154-L172 HydrophobicContact CG2-CB 3.83Å; I154-L172 HydrophobicContact CG2-CD1 4.42Å; A158-L172 HydrophobicContact CB-CD1 3.72Å; I169-L172 WeakPolarHBondContact O-CB 3.48Å; I169-L172 PolarHBondContact O-N 2.9Å; A170-L172 PolarHBondContact O-N 3.09Å
173L95.3Very high96.1Very high4 Ų454.5 Ų54.52%0.02130%0.297CS..SBendtrans-128.378.1-170.9-68.7169.5000110.3E151 I154 I155 I169 A170 G175 R176 I181E151-L173 HydrophobicContact CB-CD2 4.01Å; E151-L173 HydrophobicContact CG-CD2 4.05Å; I154-L173 HydrophobicContact CB-CD2 3.95Å; I154-L173 HydrophobicContact CD1-CD2 3.97Å; I154-L173 HydrophobicContact CG2-CD1 4.35Å; I154-L173 HydrophobicContact CG2-CD2 3.73Å; I154-L173 HydrophobicContact CG2-CG 3.9Å; I155-L173 HydrophobicContact CD1-CD1 4.1Å; I155-L173 HydrophobicContact CG1-CD1 3.48Å; I155-L173 VanDerWaalsContact CG1-CD1 3.48Å; I169-L173 HydrophobicContact CG2-CD1 4.25Å; A170-L173 PolarHBondContact O-N 3.1Å; L173-G175 PolarHBondContact O-N 2.75Å; L173-G175 VanDerWaalsContact O-N 3.12Å; L173-R176 HydrophobicContact CB-CB 3.91Å; L173-R176 HydrophobicContact CB-CG 4.16Å; L173-R176 PolarHBondContact O-N 2.96Å; L173-I181 HydrophobicContact CB-CD1 4.37Å; L173-I181 HydrophobicContact CD1-CD1 3.71Å; L173-I181 HydrophobicContact CD1-CG1 3.91Å
174P93.2Very high96.1Very high97 Ų9753.8 Ų53.863%0.6329%0.287SS*.THydrogen-bonded Turntrans-58.2119.4-173.222.1-33.2000111.4K143K143-P174 WeakPolarHBondContact CD-O 3.4Å; K143-P174 WeakPolarHBondContact CE-O 3.35Å; K143-P174 PolarHBondContact NZ-O 3.47Å
175G92.8Very high96Very high26 Ų2649.9 Ų49.927%0.26827%0.265SS..THydrogen-bonded Turntrans88.81.9-177.200000115.8E141 V142 K143 L173E141-G175 WeakPolarHBondContact O-CA 3.4Å; V142-G175 WeakPolarHBondContact CA-O 3.31Å; K143-G175 PolarHBondContact N-O 3.07Å; L173-G175 PolarHBondContact O-N 2.75Å; L173-G175 VanDerWaalsContact O-N 3.12Å
176R95.7Very high95.9Very high17 Ų1747.5 Ų47.56%0.06426%0.263CS..  trans-102.5136.7168.6-60-62.3-168.9174.312.4110K143 T145 S146 W147 E151 L173 I181K143-R176 PolarHBondContact O-NH1 3.27Å; T145-R176 PolarHBondContact O-NH1 3.16Å; T145-R176 PolarHBondContact O-NH2 3.37Å; T145-R176 PolarHBondContact OG1-NH2 2.61Å; S146-R176 PolarHBondContact O-NH2 3.49Å; W147-R176 HydrophobicContact CH2-CB 4.11Å; W147-R176 HydrophobicContact CH2-CG 3.96Å; W147-R176 HydrophobicContact CZ3-CB 4.22Å; W147-R176 HydrophobicContact CZ3-CG 3.68Å; E151-R176 WeakPolarHBondContact OE1-CG 3.25Å; E151-R176 IonicContact OE1-CZ 3.5Å; E151-R176 IonicContact OE1-NE 2.75Å; E151-R176 PolarHBondContact OE1-NE 3.21Å; E151-R176 IonicContact OE1-NH2 3.37Å; E151-R176 PolarHBondContact OE1-NH2 3.36Å; E151-R176 IonicContact OE2-CZ 3.51Å; E151-R176 IonicContact OE2-NE 3.46Å; E151-R176 PolarHBondContact OE2-NE 2.86Å; E151-R176 IonicContact OE2-NH2 2.7Å; E151-R176 PolarHBondContact OE2-NH2 2.86Å; L173-R176 HydrophobicContact CB-CB 3.91Å; L173-R176 HydrophobicContact CB-CG 4.16Å; L173-R176 PolarHBondContact O-N 2.96Å; R176-I181 HydrophobicContact CB-CD1 4.22Å; R176-I181 HydrophobicContact CB-CG1 4.18Å
177T96.9Very high95.7Very high19 Ų1949.2 Ų49.212%0.11728%0.28CS..  trans-89.2156.5179.973.90000111.6H135 N136 V142 N179 A180 I181H135-T177 VanDerWaalsContact O-CG2 3.3Å; H135-T177 WeakPolarHBondContact O-CG2 3.49Å; N136-T177 PolarHBondContact OD1-OG1 3.39Å; V142-T177 HydrophobicContact CG1-CG2 4.14Å; V142-T177 HydrophobicContact CG2-CG2 3.91Å; T177-N179 PolarHBondContact O-N 3.16Å; T177-A180 WeakPolarHBondContact O-CB 3.41Å; T177-A180 PolarHBondContact O-N 2.79Å; T177-A180 WeakPolarHBondContact OG1-CB 3.32Å; T177-A180 PolarHBondContact OG1-N 3.44Å; T177-A180 VanDerWaalsContact OG1-N 3.07Å; T177-I181 WeakPolarHBondContact O-CD1 3.14Å; T177-I181 WeakPolarHBondContact O-CG1 3.4Å; T177-I181 PolarHBondContact O-N 3.48Å
178D96.4Very high95.3Very high72 Ų7248.9 Ų48.939%0.38527%0.272SS..Hα-helixtrans-53.9-39.5172.870.8-54.5000111.6W166 A167 A170 K182W166-D178 HydrophobicContact CB-CB 3.89Å; A167-D178 HydrophobicContact CB-CB 4.41Å; A170-D178 HydrophobicContact CB-CB 4.34Å; D178-K182 WeakPolarHBondContact O-CB 3.33Å; D178-K182 PolarHBondContact O-N 2.76Å
179N96.5Very high94.8Very high31 Ų3144.9 Ų44.917%0.16625%0.253CS..Hα-helixtrans-65.9-42.4175.3-171.756.1000112.4N136 T177 K182 N183N136-N179 WeakPolarHBondContact OD1-CB 3.16Å; T177-N179 PolarHBondContact O-N 3.16Å; N179-K182 WeakPolarHBondContact OD1-CE 3.34Å; N179-K182 PolarHBondContact OD1-NZ 2.66Å; N179-N183 WeakPolarHBondContact O-CB 3.42Å; N179-N183 PolarHBondContact O-N 3.22Å; N179-N183 PolarHBondContact O-ND2 3.3Å; N179-N183 PolarHBondContact O-OD1 2.93Å
180A96.3Very high94.2Very high30 Ų3050.7 Ų50.725%0.24828%0.275CS..Hα-helixtrans-63.8-46.8177.700000111.5W147 T177 N183 H184W147-A180 HydrophobicContact CH2-CB 4.2Å; W147-A180 HydrophobicContact CZ2-CB 4Å; T177-A180 WeakPolarHBondContact O-CB 3.41Å; T177-A180 PolarHBondContact O-N 2.79Å; T177-A180 WeakPolarHBondContact OG1-CB 3.32Å; T177-A180 PolarHBondContact OG1-N 3.44Å; T177-A180 VanDerWaalsContact OG1-N 3.07Å; A180-N183 PolarHBondContact O-N 2.94Å; A180-H184 PolarHBondContact O-N 2.96Å
181I96.8Very high93.4Very high0 Ų057.2 Ų57.20%030%0.295CS..Hα-helixtrans-62.4-49.5178.9-64.1158000110.6W147 I155 W166 I169 A170 L173 R176 T177 N183 H184 W185W147-I181 HydrophobicContact CH2-CG1 3.88Å; W147-I181 HydrophobicContact CZ3-CG1 4.38Å; I155-I181 HydrophobicContact CD1-CG2 4.08Å; I155-I181 HydrophobicContact CG1-CG2 3.96Å; I155-I181 HydrophobicContact CG2-CG2 4.04Å; W166-I181 HydrophobicContact CE3-CG2 3.82Å; W166-I181 HydrophobicContact CZ3-CG2 4.15Å; I169-I181 HydrophobicContact CG2-CD1 4.37Å; I169-I181 HydrophobicContact CG2-CG2 3.99Å; A170-I181 VanDerWaalsContact CA-CD1 3.46Å; A170-I181 HydrophobicContact CB-CD1 3.82Å; L173-I181 HydrophobicContact CB-CD1 4.37Å; L173-I181 HydrophobicContact CD1-CD1 3.71Å; L173-I181 HydrophobicContact CD1-CG1 3.91Å; R176-I181 HydrophobicContact CB-CD1 4.22Å; R176-I181 HydrophobicContact CB-CG1 4.18Å; T177-I181 WeakPolarHBondContact O-CD1 3.14Å; T177-I181 WeakPolarHBondContact O-CG1 3.4Å; T177-I181 PolarHBondContact O-N 3.48Å; I181-N183 VanDerWaalsContact C-N 3.27Å; I181-N183 PolarHBondContact O-N 2.81Å; I181-H184 PolarHBondContact O-N 3.46Å; I181-W185 WeakPolarHBondContact O-CB 3.43Å; I181-W185 PolarHBondContact O-N 2.78Å
182K96.4Very high92.5Very high68 Ų6854 Ų5430%0.29628%0.281SS..Hα-helixtrans-54.1-43.9174.1174.5-163.671.8-168.70111.7W166 D178 N179 N186W166-K182 HydrophobicContact CD2-CB 3.78Å; W166-K182 HydrophobicContact CD2-CG 4.34Å; W166-K182 HydrophobicContact CE3-CB 4.37Å; W166-K182 HydrophobicContact CG-CB 3.82Å; W166-K182 HydrophobicContact CG-CG 4.38Å; W166-K182 HydrophobicContact CZ2-CG 4.46Å; D178-K182 WeakPolarHBondContact O-CB 3.33Å; D178-K182 PolarHBondContact O-N 2.76Å; N179-K182 WeakPolarHBondContact OD1-CE 3.34Å; N179-K182 PolarHBondContact OD1-NZ 2.66Å; K182-N186 PolarHBondContact O-N 3.45Å; K182-N186 PolarHBondContact O-ND2 3.02Å
183N96.1Very high91.5Very high81 Ų8150.4 Ų50.443%0.43326%0.263SS..Hα-helixtrans-67.7-49.4-178.2-69.9-4.3000110.8N179 A180 I181 W185 N186 S187N179-N183 WeakPolarHBondContact O-CB 3.42Å; N179-N183 PolarHBondContact O-N 3.22Å; N179-N183 PolarHBondContact O-ND2 3.3Å; N179-N183 PolarHBondContact O-OD1 2.93Å; A180-N183 PolarHBondContact O-N 2.94Å; I181-N183 VanDerWaalsContact C-N 3.27Å; I181-N183 PolarHBondContact O-N 2.81Å; N183-W185 VanDerWaalsContact C-N 3.33Å; N183-W185 PolarHBondContact O-N 2.87Å; N183-N186 PolarHBondContact O-N 3.26Å; N183-N186 VanDerWaalsContact O-N 3.14Å; N183-S187 PolarHBondContact O-N 3.32Å; N183-S187 PolarHBondContact O-OG 3.32Å; N183-S187 VanDerWaalsContact O-OG 3.08Å
184H95.3Very high90.4Very high12 Ų1255.7 Ų55.76%0.05629%0.287CS..Hα-helixtrans-60.8-38.8178.3-178.253.1000113.2W147 D152 A180 I181 N186 S187 T188 M189W147-H184 AromaticContact CD1-CD2 3.94Å; W147-H184 AromaticContact CD1-CE1 3.55Å; W147-H184 AromaticContact CD1-CG 3.66Å; W147-H184 AromaticContact CD1-ND1 3.44Å; W147-H184 AromaticContact CD1-NE2 3.87Å; W147-H184 HydrophobicContact CD2-CB 4.32Å; W147-H184 AromaticContact CD2-CD2 3.56Å; W147-H184 AromaticContact CD2-CG 3.86Å; W147-H184 AromaticContact CD2-NE2 3.88Å; W147-H184 AromaticContact CE2-CD2 3.74Å; W147-H184 AromaticContact CE2-CG 3.58Å; W147-H184 AromaticContact CE3-CD2 3.99Å; W147-H184 AromaticContact CG-CD2 3.72Å; W147-H184 AromaticContact CG-CE1 3.67Å; W147-H184 AromaticContact CG-CG 3.92Å; W147-H184 AromaticContact CG-ND1 3.93Å; W147-H184 AromaticContact CG-NE2 3.56Å; W147-H184 HydrophobicContact CH2-CB 4.45Å; W147-H184 HydrophobicContact CZ2-CB 3.66Å; W147-H184 AromaticContact NE1-CD2 3.96Å; W147-H184 AromaticContact NE1-CG 3.45Å; W147-H184 AromaticContact NE1-ND1 3.61Å; D152-H184 VanDerWaalsContact CG-NE2 3.28Å; D152-H184 IonicContact OD1-CD2 3.51Å; D152-H184 IonicContact OD1-CE1 2.72Å; D152-H184 IonicContact OD1-NE2 2.73Å; D152-H184 PolarHBondContact OD1-NE2 2.96Å; D152-H184 IonicContact OD2-CE1 2.72Å; D152-H184 IonicContact OD2-NE2 3.15Å; D152-H184 PolarHBondContact OD2-NE2 3.49Å; D152-H184 VanDerWaalsContact OD2-NE2 3.15Å; A180-H184 PolarHBondContact O-N 2.96Å; I181-H184 PolarHBondContact O-N 3.46Å; H184-N186 PolarHBondContact O-N 3Å; H184-S187 WeakPolarHBondContact CA-OG 3.29Å; H184-S187 PolarHBondContact O-OG 2.7Å; H184-T188 WeakPolarHBondContact ND1-CB 3.31Å; H184-T188 PolarHBondContact ND1-OG1 3.21Å; H184-T188 WeakPolarHBondContact O-CA 3.48Å; H184-T188 VanDerWaalsContact O-CB 3.27Å; H184-T188 WeakPolarHBondContact O-CB 3.39Å; H184-T188 PolarHBondContact O-N 2.79Å; H184-T188 PolarHBondContact O-OG1 3.47Å; H184-M189 PolarHBondContact O-N 3.23Å; H184-M189 VanDerWaalsContact O-N 3.14Å
185W95.5Very high88.8Confident18 Ų1858.6 Ų58.67%0.06829%0.292CS..Iπ-helixtrans-57.1-48.8172.8179.7-95.7000111.9I155 Y156 H159 W166 I181 N183 M189 R190I155-W185 HydrophobicContact CG2-CE3 3.84Å; I155-W185 HydrophobicContact CG2-CZ3 4.42Å; Y156-W185 HydrophobicContact CD2-CH2 4.33Å; Y156-W185 HydrophobicContact CD2-CZ3 4.41Å; H159-W185 HydrophobicContact CB-CE3 4.49Å; H159-W185 HydrophobicContact CB-CH2 4.21Å; H159-W185 HydrophobicContact CB-CZ3 4.13Å; H159-W185 AromaticContact CE1-CE2 3.77Å; H159-W185 AromaticContact CE1-CZ2 3.49Å; H159-W185 VanDerWaalsContact CE1-CZ2 3.49Å; H159-W185 WeakPolarHBondContact CE1-CZ2 3.49Å; H159-W185 AromaticContact CG-CH2 3.9Å; H159-W185 AromaticContact CG-CZ2 3.88Å; H159-W185 AromaticContact ND1-CE2 3.88Å; H159-W185 AromaticContact ND1-CH2 3.54Å; H159-W185 AromaticContact ND1-CZ2 3.32Å; H159-W185 VanDerWaalsContact ND1-CZ2 3.32Å; H159-W185 WeakPolarHBondContact ND1-CZ2 3.28Å; H159-W185 AromaticContact NE2-CE2 3.93Å; H159-W185 AromaticContact NE2-NE1 3.94Å; W166-W185 HydrophobicContact CH2-CB 3.77Å; W166-W185 AromaticContact CH2-CD1 3.58Å; W166-W185 HydrophobicContact CH2-CD2 4.22Å; W166-W185 AromaticContact CH2-CG 3.54Å; W166-W185 HydrophobicContact CH2-CG 3.54Å; W166-W185 HydrophobicContact CZ3-CB 3.99Å; W166-W185 HydrophobicContact CZ3-CG 4.1Å; I181-W185 WeakPolarHBondContact O-CB 3.43Å; I181-W185 PolarHBondContact O-N 2.78Å; N183-W185 VanDerWaalsContact C-N 3.33Å; N183-W185 PolarHBondContact O-N 2.87Å; W185-M189 HydrophobicContact CD2-CB 4.36Å; W185-M189 HydrophobicContact CE3-CB 3.73Å; W185-M189 HydrophobicContact CE3-CG 4.38Å; W185-M189 HydrophobicContact CE3-SD 3.93Å; W185-M189 HydrophobicContact CZ3-CB 4.12Å; W185-M189 HydrophobicContact CZ3-CE 4.39Å; W185-M189 HydrophobicContact CZ3-SD 4.34Å; W185-M189 PolarHBondContact O-N 3.26Å; W185-R190 VanDerWaalsContact O-CB 3.27Å; W185-R190 WeakPolarHBondContact O-CB 3.24Å; W185-R190 PolarHBondContact O-N 3.05Å
186N94.3Very high87.2Confident90 Ų9063.5 Ų63.548%0.48131%0.308SS..Iπ-helixtrans-77.9-31.9-175.6-72.4-71.9000113.6K182 N183 H184K182-N186 PolarHBondContact O-N 3.45Å; K182-N186 PolarHBondContact O-ND2 3.02Å; N183-N186 PolarHBondContact O-N 3.26Å; N183-N186 VanDerWaalsContact O-N 3.14Å; H184-N186 PolarHBondContact O-N 3Å
187S91.6Very high85.7Confident69 Ų6964 Ų6448%0.48332%0.319SS..Iπ-helixtrans-77.8-44.617759.10000112.6N183 H184 R191N183-S187 PolarHBondContact O-N 3.32Å; N183-S187 PolarHBondContact O-OG 3.32Å; N183-S187 VanDerWaalsContact O-OG 3.08Å; H184-S187 WeakPolarHBondContact CA-OG 3.29Å; H184-S187 PolarHBondContact O-OG 2.7Å; S187-R191 PolarHBondContact O-NH2 3.37Å
188T88.8Confident84.1Confident50 Ų5066.4 Ų66.431%0.30733%0.326SS..Iπ-helixtrans-116.4-61.4-159.6-36.80000111.3H184H184-T188 WeakPolarHBondContact ND1-CB 3.31Å; H184-T188 PolarHBondContact ND1-OG1 3.21Å; H184-T188 WeakPolarHBondContact O-CA 3.48Å; H184-T188 VanDerWaalsContact O-CB 3.27Å; H184-T188 WeakPolarHBondContact O-CB 3.39Å; H184-T188 PolarHBondContact O-N 2.79Å; H184-T188 PolarHBondContact O-OG1 3.47Å
189M88.3Confident82.7Confident1 Ų164.1 Ų64.11%0.00531%0.314CS..Iπ-helixtrans-72.6-45.3-164.6-60.9-164.17100113.2D152 I155 H184 W185 R191 K192 V193 L199D152-M189 HydrophobicContact CB-CE 3.72Å; D152-M189 HydrophobicContact CB-SD 4.25Å; D152-M189 WeakPolarHBondContact O-CE 3.18Å; I155-M189 HydrophobicContact CB-SD 3.83Å; I155-M189 HydrophobicContact CD1-SD 4.18Å; I155-M189 HydrophobicContact CG2-SD 3.61Å; H184-M189 PolarHBondContact O-N 3.23Å; H184-M189 VanDerWaalsContact O-N 3.14Å; W185-M189 HydrophobicContact CD2-CB 4.36Å; W185-M189 HydrophobicContact CE3-CB 3.73Å; W185-M189 HydrophobicContact CE3-CG 4.38Å; W185-M189 HydrophobicContact CE3-SD 3.93Å; W185-M189 HydrophobicContact CZ3-CB 4.12Å; W185-M189 HydrophobicContact CZ3-CE 4.39Å; W185-M189 HydrophobicContact CZ3-SD 4.34Å; W185-M189 PolarHBondContact O-N 3.26Å; M189-R191 VanDerWaalsContact C-N 3.34Å; M189-R191 PolarHBondContact O-N 3.33Å; M189-K192 PolarHBondContact O-N 2.99Å; M189-V193 HydrophobicContact CB-CG2 4.46Å; M189-V193 HydrophobicContact CE-CG2 4.42Å; M189-V193 WeakPolarHBondContact O-CG2 3.47Å; M189-V193 PolarHBondContact O-N 3.28Å; M189-L199 HydrophobicContact CE-CD1 3.89Å
190R83.7Confident81Confident122 Ų12267.6 Ų67.646%0.4633%0.329SS..Hα-helixtrans-51.3-50.3-167.6-178177176.2-162.3-8.4112.8W185 E194W185-R190 VanDerWaalsContact O-CB 3.27Å; W185-R190 WeakPolarHBondContact O-CB 3.24Å; W185-R190 PolarHBondContact O-N 3.05Å; R190-E194 HydrophobicContact CG-CG 4.5Å; R190-E194 WeakPolarHBondContact CG-OE1 3.46Å; R190-E194 IonicContact CZ-OE1 2.98Å; R190-E194 IonicContact NE-OE1 2.68Å; R190-E194 PolarHBondContact NE-OE1 2.69Å; R190-E194 IonicContact NE-OE2 2.68Å; R190-E194 IonicContact NH2-OE1 3.19Å; R190-E194 VanDerWaalsContact O-CB 3.27Å; R190-E194 WeakPolarHBondContact O-CB 3.25Å; R190-E194 WeakPolarHBondContact O-CG 3.38Å; R190-E194 PolarHBondContact O-N 2.77Å
191R79.9Confident78.9Confident159 Ų15973.6 Ų73.660%0.636%0.357SS*.Hα-helixtrans-68.4-39.5178.9-72-179.9-69.4153.51.8112.9S187 M189 E194 Q195S187-R191 PolarHBondContact O-NH2 3.37Å; M189-R191 VanDerWaalsContact C-N 3.34Å; M189-R191 PolarHBondContact O-N 3.33Å; R191-E194 PolarHBondContact O-N 3.02Å; R191-Q195 VanDerWaalsContact O-CB 3.27Å; R191-Q195 WeakPolarHBondContact O-CB 3.23Å; R191-Q195 WeakPolarHBondContact O-CG 3.42Å; R191-Q195 PolarHBondContact O-N 3.48Å
192K77.1Confident76.9Confident76 Ų7678.7 Ų78.733%0.3339%0.388SS..Hα-helixtrans-65.3-40.5177.6-65.5-165.3164.9-162.70112.8M189 E196 G197 Y198M189-K192 PolarHBondContact O-N 2.99Å; K192-E196 WeakPolarHBondContact CD-OE2 3.25Å; K192-E196 VanDerWaalsContact CG-OE2 3.25Å; K192-E196 WeakPolarHBondContact CG-OE2 3.36Å; K192-E196 WeakPolarHBondContact O-CA 3.47Å; K192-E196 WeakPolarHBondContact O-CB 3.39Å; K192-E196 PolarHBondContact O-N 3.33Å; K192-G197 PolarHBondContact O-N 3.02Å; K192-Y198 HydrophobicContact CB-CD1 4.14Å; K192-Y198 HydrophobicContact CB-CG 4.24Å; K192-Y198 HydrophobicContact CD-CD1 4.28Å; K192-Y198 PolarHBondContact O-N 3.28Å
193V74.8Confident74.8Confident16 Ų1680.7 Ų80.710%0.09741%0.411CS..Hα-helixtrans-68.1-41.2175.7171.70000110.9Y156 M189 Q200Y156-V193 HydrophobicContact CD2-CG1 3.8Å; Y156-V193 HydrophobicContact CD2-CG2 4.14Å; Y156-V193 HydrophobicContact CE2-CG1 3.4Å; Y156-V193 VanDerWaalsContact CE2-CG1 3.4Å; M189-V193 HydrophobicContact CB-CG2 4.46Å; M189-V193 HydrophobicContact CE-CG2 4.42Å; M189-V193 WeakPolarHBondContact O-CG2 3.47Å; M189-V193 PolarHBondContact O-N 3.28Å; V193-Q200 PolarHBondContact O-NE2 2.72Å
194E72.1Confident72.6Confident116 Ų11685.9 Ų85.954%0.54243%0.43SS..Hα-helixtrans-74.4-29.6179.3-72.3169.4-176.200113.6R190 R191R190-E194 HydrophobicContact CG-CG 4.5Å; R190-E194 WeakPolarHBondContact CG-OE1 3.46Å; R190-E194 IonicContact CZ-OE1 2.98Å; R190-E194 IonicContact NE-OE1 2.68Å; R190-E194 PolarHBondContact NE-OE1 2.69Å; R190-E194 IonicContact NE-OE2 2.68Å; R190-E194 IonicContact NH2-OE1 3.19Å; R190-E194 VanDerWaalsContact O-CB 3.27Å; R190-E194 WeakPolarHBondContact O-CB 3.25Å; R190-E194 WeakPolarHBondContact O-CG 3.38Å; R190-E194 PolarHBondContact O-N 2.77Å; R191-E194 PolarHBondContact O-N 3.02Å
195Q59.1Low70.1Confident157 Ų15793.2 Ų93.273%0.73447%0.469SS*.Hα-helixtrans-116.2-33.2-172.2-58.8-172.1-75.800115.9R191R191-Q195 VanDerWaalsContact O-CB 3.27Å; R191-Q195 WeakPolarHBondContact O-CB 3.23Å; R191-Q195 WeakPolarHBondContact O-CG 3.42Å; R191-Q195 PolarHBondContact O-N 3.48Å
196E59.8Low67.9Low129 Ų12997.1 Ų97.160%0.60350%0.499SS*.SBendtrans-105.1-2.9-169.3-55.8177.3163.200112.9K192 Y198K192-E196 WeakPolarHBondContact CD-OE2 3.25Å; K192-E196 VanDerWaalsContact CG-OE2 3.25Å; K192-E196 WeakPolarHBondContact CG-OE2 3.36Å; K192-E196 WeakPolarHBondContact O-CA 3.47Å; K192-E196 WeakPolarHBondContact O-CB 3.39Å; K192-E196 PolarHBondContact O-N 3.33Å; E196-Y198 PolarHBondContact O-N 2.98Å
197G63.8Low65.8Low28 Ų28100.7 Ų100.729%0.28952%0.518SS..  trans65.316.4-172.600000113.4K192 L199 Q200K192-G197 PolarHBondContact O-N 3.02Å; G197-L199 PolarHBondContact O-N 3.33Å; G197-Q200 WeakPolarHBondContact O-CB 3.06Å; G197-Q200 PolarHBondContact O-N 2.94Å
198Y63.4Low63.4Low69 Ų69102.7 Ų102.727%0.27153%0.532SS..THydrogen-bonded Turntrans-53.5125.6-174.5-168.8-122.9000110.2K192 E196 Q200K192-Y198 HydrophobicContact CB-CD1 4.14Å; K192-Y198 HydrophobicContact CB-CG 4.24Å; K192-Y198 HydrophobicContact CD-CD1 4.28Å; K192-Y198 PolarHBondContact O-N 3.28Å; E196-Y198 PolarHBondContact O-N 2.98Å; Y198-Q200 VanDerWaalsContact C-N 3.31Å; Y198-Q200 PolarHBondContact O-N 3.26Å
199L66.4Low61.2Low25 Ų25105.8 Ų105.813%0.13156%0.556CS.*THydrogen-bonded Turntrans70.92.8-179.2-41.2178000117.2E149 D152 R153 Y156 M189 G197 N201E149-L199 HydrophobicContact CG-CD2 3.66Å; E149-L199 WeakPolarHBondContact OE1-CD2 3.26Å; D152-L199 HydrophobicContact CB-CD1 3.8Å; R153-L199 HydrophobicContact CG-CB 4.19Å; R153-L199 HydrophobicContact CG-CD1 3.91Å; R153-L199 HydrophobicContact CG-CD2 3.81Å; R153-L199 HydrophobicContact CG-CG 4.16Å; Y156-L199 HydrophobicContact CD1-CB 4.16Å; M189-L199 HydrophobicContact CE-CD1 3.89Å; G197-L199 PolarHBondContact O-N 3.33Å; L199-N201 VanDerWaalsContact C-N 3.27Å; L199-N201 PolarHBondContact O-N 2.98Å
200Q60.9Low59.1Low103 Ų103113.9 Ų113.948%0.48160%0.599SS.*  trans-75-13.8178-61.7-175.419.100113.8Y156 V193 G197 Y198 T202Y156-Q200 HydrophobicContact CE1-CG 4.46Å; V193-Q200 PolarHBondContact O-NE2 2.72Å; G197-Q200 WeakPolarHBondContact O-CB 3.06Å; G197-Q200 PolarHBondContact O-N 2.94Å; Y198-Q200 VanDerWaalsContact C-N 3.31Å; Y198-Q200 PolarHBondContact O-N 3.26Å; Q200-T202 PolarHBondContact O-N 2.72Å
201N53.2Low57.1Low157 Ų157112.7 Ų112.784%0.8461%0.609SS**THydrogen-bonded Turntrans-85.170.1-173-74.1-5.9000113.9L199L199-N201 VanDerWaalsContact C-N 3.27Å; L199-N201 PolarHBondContact O-N 2.98Å
202T55.6Low55.3Low106 Ų106113.3 Ų113.365%0.6562%0.621SS**THydrogen-bonded Turntrans-134.2-25.7165.548.10000115Q200Q200-T202 PolarHBondContact O-N 2.72Å
203S51.3Low53.6Low110 Ų110116.9 Ų116.977%0.76964%0.644SS**SBendtrans-109.513.5-172.2-57.30000115.6
204K50.4Low51.8Low191 Ų191123.2 Ų123.283%0.8367%0.672SS**  trans-134.849.5-179.7-69-174.7-179.3173.30113.3
205N43.2Very low50.1Low165 Ų165120.9 Ų120.988%0.88268%0.679SS**  trans-124.656.2164.6-163.341000112.7
206S49.3Very low49Very low100 Ų100123.4 Ų123.470%0.69968%0.683SS**SBendtrans-138.1111155.159.20000107.8
207N50.2Low48Very low165 Ų165125 Ų12588%0.88269%0.694SS**SBendtrans67.570.2172.6-54-11.3000117.8
208S39.9Very low46.7Very low111 Ų111133.3 Ų133.378%0.77672%0.722SS**  trans-160.164.7146.267.60000114
209S43.2Very low45.3Very low116 Ų116136.4 Ų136.481%0.81175%0.748SS**  trans-85.6111.4157.255.80000109.2
210L44.3Very low43.7Very low170 Ų170141.3 Ų141.389%0.8978%0.779SS**  trans179.3117.8146.8-100.1167000111.6
211S42.1Very low42.4Very low98 Ų98143 Ų14369%0.68579%0.792SS**  trans13.6132155.5-163.70000121.4
212M41.2Very low41.7Very low172 Ų172143.6 Ų143.685%0.84779%0.789SS**  -153.3102.6118.1-111.4-62.617900111.5
213N41.4Very low40.8Very low151 Ų151144.4 Ų144.481%0.80779%0.794SS**  trans-81127.9163.8-89.8-33.7000109.2
214H37.5Very low40.2Very low149 Ų149147.7 Ų147.769%0.6980%0.799SS**  trans-11568.5171.7-153.474.1000111.7
215G35.6Very low39.3Very low66 Ų66144 Ų14468%0.6880%0.797SS**  trans-78.2123.9170.900000111.1I217G215-I217 PolarHBondContact O-N 3.34Å
216Y35.6Very low38.9Very low211 Ų211145.3 Ų145.383%0.82780%0.795SS**  trans-74.3116.6178.2-69.9-96.3000111.4
217I39.5Very low39Very low162 Ų162144.9 Ų144.983%0.83179%0.79SS**  trans-124.5135.5165.2-65.7-176000109.1G215G215-I217 PolarHBondContact O-N 3.34Å
218K36.6Very low38.2Very low202 Ų202145.1 Ų145.188%0.87879%0.786SS**  trans-77.9140.2179.1-68178.4178176.90110.8
219T33.3Very low38Very low135 Ų135148.4 Ų148.483%0.82879%0.789SS**  trans-90.2134.5173.6520000112
220T32.6Very low37.6Very low127 Ų127148 Ų14878%0.77979%0.786SS**  trans-141.7147163.238.60000111
221N35.3Very low38.1Very low138 Ų138145.3 Ų145.374%0.73878%0.779SS**  trans72.893.8163-58.8-8.1000120.1
222H37.5Very low37.6Very low171 Ų171145.9 Ų145.979%0.79278%0.782SS**  60.8133.2110.1-75.5-69.7000123.2
223V36Very low37.3Very low123 Ų123146.3 Ų146.375%0.74578%0.782SS**  trans98.51031321590000120.5
224M39.8Very low37.1Very low178 Ų178142.9 Ų142.988%0.87778%0.775SS**  trans84.4134.7136.7-68-66.6-168.600124.5
225S30.5Very low37.1Very low113 Ų113144.3 Ų144.379%0.7978%0.782SS**  trans100117.6144.2-1390000121.4
226F36.5Very low37Very low193 Ų193149 Ų14985%0.84679%0.79SS**  trans-86-173153.7-77.4-79000109
227P50.1Low37.5Very low92 Ų92144.4 Ų144.460%0.59779%0.786SS**  cis-143.9178.88.947.1-29.4000118.5
228H34.7Very low37.9Very low170 Ų170141.7 Ų141.779%0.78778%0.779SS**  trans53.2136.4157.4-51.7-47.5000119.1
229H34.5Very low37.7Very low180 Ų180138.5 Ų138.583%0.83378%0.776SS**  -171.4-176.758.554.2-76.4000112.5
230S34.1Very low37.7Very low108 Ų108138.1 Ų138.176%0.75577%0.774SS**  trans-156.2-178176.7-39.50000108.8
231P54.8Low37.8Very low113 Ų113142.7 Ų142.773%0.73478%0.779SS**  cis-127.8-169.8-2335.3-16.5000112
232S32Very low37.5Very low109 Ų109143.2 Ų143.276%0.76278%0.781SS**  144.5154.2126.9-64.70000117.8
233H34.9Very low37.2Very low181 Ų181144.5 Ų144.584%0.83878%0.78SS**  trans78.7142.5157.3-126-73.2000120.9
234A37.9Very low37.2Very low80 Ų80144.3 Ų144.366%0.66177%0.774SS**  trans-127.4162.4-179.400000111.5
235Q36.4Very low36.8Very low179 Ų179139.8 Ų139.884%0.83676%0.76SS**  trans-166.2154.2153.5-109.3159.927.800112.5
236L33.9Very low36.8Very low164 Ų164141.6 Ų141.686%0.85976%0.756SS**  trans-109.1-174.9163.3-61.1169.2000106.8
237P46Very low36.7Very low115 Ų115137.2 Ų137.275%0.74775%0.745SS**  cis-134.2-134.8-0.338.8-15.1000110.8
238P49.1Very low36.1Very low104 Ų104140.7 Ų140.768%0.67575%0.753SS**  -118.4155.1-58.126.6-8.9000115.4
239V32.5Very low35.8Very low135 Ų135143.9 Ų143.982%0.81876%0.758SS**  trans18.9127.1137-168.30000120.7
240T31.6Very low35.9Very low127 Ų127142.9 Ų142.978%0.77976%0.758SS**  trans-161125.9134.810.50000111.1
241Y35.1Very low36Very low224 Ų224143.3 Ų143.388%0.87876%0.758SS**  176.5163124.3-106.3-78.4000110.9
242N29.9Very low35.1Very low148 Ų148147.6 Ų147.679%0.79177%0.766SS**  trans-103.5174.3-164.3-76.2-28.7000114.6
243Y31.6Very low35.5Very low198 Ų198147.3 Ų147.378%0.77676%0.761SS**  trans79.7117.9163.3-110.2-115.2000115.6
244I35.6Very low35.5Very low119 Ų119147.5 Ų147.561%0.6177%0.765SS**  66.712662.3-67.3167.8000109.7
245S31Very low35.3Very low84 Ų84148.4 Ų148.459%0.58777%0.772SS**  cis-171.2179.50.5-103.90000107.5
246E30.7Very low35.2Very low151 Ų151147.4 Ų147.471%0.70677%0.772SS**  cis-151.4133.2-15.8-116.3155.9107.500104.5
247T34.9Very low35.2Very low101 Ų101147.4 Ų147.462%0.6277%0.767SS**  80.3157.289102.20000112.9
248H36.1Very low34.6Very low164 Ų164149.9 Ų149.976%0.75977%0.773SS**  cis-128.1149.2-5.2-51.3-109.3000111.2
249R28.2Very low33.9Very low237 Ų237152 Ų15289%0.89478%0.779SS**  trans-149.2161.9151-100.3-154.9-179.7-143.62.3109.6
250L38Very low34.4Very low160 Ų160153.3 Ų153.384%0.83878%0.78SS**  trans74156.9-179.6-48.8-176.1000113.3
251P35.5Very low34.5Very low116 Ų116155.1 Ų155.175%0.75378%0.783SS**  cis-122.8159.48.841.4-28.5000116.3
252F35.3Very low34.3Very low204 Ų204151.4 Ų151.490%0.89578%0.779SS**  trans-77.7150.9149.1-91.9-87.9000108.9
253P42.3Very low34.8Very low103 Ų103151.6 Ų151.667%0.66978%0.778SS**  -142.5172.2120.739.3-27.8000115
254M33.2Very low34.7Very low185 Ų185147.6 Ų147.691%0.91178%0.777SS**  trans72.9112.2166.8-52.4-151.5-63.400117.7
255A34.9Very low34.6Very low98 Ų98149.3 Ų149.381%0.8178%0.782SS**  trans-88156.1164.400000110.9
256L33.3Very low34.8Very low159 Ų159153.3 Ų153.383%0.83279%0.791SS**  trans-154.1135.3156.8-108.6174.9000110.9
257H34.5Very low34.7Very low164 Ų164149.6 Ų149.676%0.75979%0.794SS**  trans30.8111.4161.1-85.779.6000120.4
258L33.8Very low35Very low166 Ų166151.2 Ų151.287%0.86980%0.804SS**  trans-89.3126.1149-75.4172.9000109.6I260L258-I260 PolarHBondContact O-N 2.83Å
259N33.9Very low34.9Very low149 Ų149147.6 Ų147.680%0.79780%0.802SS**  trans-73.5112.1171.7-92.5-35.8000110.4L261N259-L261 VanDerWaalsContact C-N 3.34Å; N259-L261 PolarHBondContact O-N 3.29Å; N259-L261 VanDerWaalsContact O-N 3.13Å
260I43.1Very low35.3Very low163 Ų163140.8 Ų140.884%0.83680%0.796SS**  trans-84.878.1172.6-52.9177.9000108.9L258L258-I260 PolarHBondContact O-N 2.83Å
261L33.2Very low35.2Very low164 Ų164139.7 Ų139.786%0.85979%0.79SS**  trans-140.2140.8164.9-78.6-178.6000112N259N259-L261 VanDerWaalsContact C-N 3.34Å; N259-L261 PolarHBondContact O-N 3.29Å; N259-L261 VanDerWaalsContact O-N 3.13Å
262N31.5Very low35.1Very low146 Ų146142.3 Ų142.378%0.78179%0.792SS**  trans85.675170.3-149.19000118.2
263I39.3Very low35.3Very low153 Ų153140.4 Ų140.479%0.78578%0.779SS**  trans-120.8115.6155.2-60.7174.7000107.6
264P30.6Very low35Very low114 Ų114144.4 Ų144.474%0.7479%0.788SS**  trans-74.2131.7172.9-17.331.9000111.9
265Q32.5Very low35.4Very low155 Ų155143.6 Ų143.672%0.72478%0.776SS**  trans-121.2127.5163.3-72.9-157.538.900110.6
266H36.6Very low35.5Very low167 Ų167141.6 Ų141.677%0.77377%0.766SS**  177.2155105-93.4-67.8000110.3
267G29Very low36.2Very low74 Ų74140.1 Ų140.176%0.76376%0.759SS**  trans17240.6-175.300000113.3A269G267-A269 PolarHBondContact O-N 3.12Å
268T39.6Very low36.7Very low135 Ų135141.2 Ų141.283%0.82876%0.764SS**  trans-74.5110.1-167-34.80000111.8
269A35Very low38.1Very low88 Ų88136.6 Ų136.673%0.72774%0.74SS**  trans-132.8121.5173.100000110.7G267 I271G267-A269 PolarHBondContact O-N 3.12Å; A269-I271 PolarHBondContact O-N 3.01Å
270A35.1Very low39.6Very low94 Ų94133.8 Ų133.878%0.77773%0.73SS**  trans-64.7127.5-16700000114.1Q272A270-Q272 PolarHBondContact O-N 2.82Å; A270-Q272 VanDerWaalsContact O-N 3.13Å
271I36.5Very low41Very low137 Ų137131.1 Ų131.170%0.70371%0.714SS**  trans-80.888.6162.2-54.6-178.7000108A269 R273A269-I271 PolarHBondContact O-N 3.01Å; I271-R273 VanDerWaalsContact C-N 3.35Å; I271-R273 HydrophobicContact CG2-CG 3.83Å; I271-R273 PolarHBondContact O-N 3.45Å
272Q33.9Very low42.8Very low170 Ų170126.2 Ų126.279%0.79469%0.686SS**  trans-61.790.9171.3-169.278.111.500109.9A270A270-Q272 PolarHBondContact O-N 2.82Å; A270-Q272 VanDerWaalsContact O-N 3.13Å
273R39.6Very low45Very low164 Ų164124.2 Ų124.262%0.61967%0.672SS**  trans-89.2118.3169.9-64.6-161.8-178.5-179.55109.2I271 Y275I271-R273 VanDerWaalsContact C-N 3.35Å; I271-R273 HydrophobicContact CG2-CG 3.83Å; I271-R273 PolarHBondContact O-N 3.45Å; R273-Y275 HydrophobicContact CB-CD2 4.44Å; R273-Y275 HydrophobicContact CB-CE2 4.11Å; R273-Y275 WeakPolarHBondContact O-CD2 3.5Å; R273-Y275 PolarHBondContact O-N 3.48Å
274H36.3Very low46.8Very low188 Ų188123.3 Ų123.387%0.8766%0.664SS**  trans-58.8105.2160.9-85.9-81.4000108.8
275Y41.2Very low49.1Very low167 Ų167123.9 Ų123.966%0.65565%0.652SS**  trans-79.7151.2150.2-72.3-95.6000107.6R273R273-Y275 HydrophobicContact CB-CD2 4.44Å; R273-Y275 HydrophobicContact CB-CE2 4.11Å; R273-Y275 WeakPolarHBondContact O-CD2 3.5Å; R273-Y275 PolarHBondContact O-N 3.48Å
276G37.7Very low51.6Low57 Ų57120.3 Ų120.359%0.58864%0.64SS**  trans-64.3147.3164.300000110.2K282G276-K282 PolarHBondContact O-NZ 2.88Å
277D46.6Very low53.8Low128 Ų128118 Ų11868%0.68463%0.628SS**SBendtrans-80.8-172152.7-61.8-48.6000108.9K282D277-K282 IonicContact OD1-NZ 3.28Å; D277-K282 PolarHBondContact OD1-NZ 3.39Å
278E44.7Very low56.6Low186 Ų186118.8 Ų118.887%0.86961%0.612SS**  trans68.632.3-167.4-45.5-58.1100.400115.4
279D63.3Low58.8Low69 Ų69117.2 Ų117.237%0.36960%0.597SS.*  trans-115102.2155.3174.70000108.9E281 K282 E283D279-E281 VanDerWaalsContact C-N 3.25Å; D279-E281 PolarHBondContact O-N 3.14Å; D279-E281 WeakPolarHBondContact OD1-CA 3.47Å; D279-E281 WeakPolarHBondContact OD1-CB 3.2Å; D279-E281 PolarHBondContact OD1-N 3.23Å; D279-K282 HydrophobicContact CB-CB 3.8Å; D279-K282 VanDerWaalsContact CG-CB 3.44Å; D279-K282 WeakPolarHBondContact O-CB 3.49Å; D279-K282 PolarHBondContact O-N 3.29Å; D279-K282 PolarHBondContact OD1-N 3.03Å; D279-K282 VanDerWaalsContact OD2-CB 3.25Å; D279-K282 WeakPolarHBondContact OD2-CB 3.43Å; D279-E283 PolarHBondContact O-N 2.99Å
280P66.8Low61Low90 Ų90118.1 Ų118.158%0.58459%0.586SS**Hα-helixtrans-70.2-22.2-177.429.3-35.1000112.7E283 Q284P280-E283 PolarHBondContact O-N 3.41Å; P280-Q284 WeakPolarHBondContact O-CG 3.24Å; P280-Q284 PolarHBondContact O-N 3.05Å
281E72.2Confident63.3Low108 Ų108120.4 Ų120.451%0.50558%0.575SS.*Hα-helixtrans-78.2-33.4176.5-154.8-167.7-151.600110.4D279 R285D279-E281 VanDerWaalsContact C-N 3.25Å; D279-E281 PolarHBondContact O-N 3.14Å; D279-E281 WeakPolarHBondContact OD1-CA 3.47Å; D279-E281 WeakPolarHBondContact OD1-CB 3.2Å; D279-E281 PolarHBondContact OD1-N 3.23Å; E281-R285 VanDerWaalsContact CD-CZ 3.5Å; E281-R285 VanDerWaalsContact O-CG 3.25Å; E281-R285 WeakPolarHBondContact O-CG 3.16Å; E281-R285 PolarHBondContact O-N 2.8Å; E281-R285 IonicContact OE1-NH2 2.7Å; E281-R285 PolarHBondContact OE1-NH2 2.94Å; E281-R285 IonicContact OE2-CZ 3.09Å; E281-R285 IonicContact OE2-NH1 2.64Å; E281-R285 PolarHBondContact OE2-NH1 2.82Å; E281-R285 IonicContact OE2-NH2 3.65Å; E281-R285 PolarHBondContact OE2-NH2 2.89Å
282K69.9Low65.5Low61 Ų61118 Ų11827%0.26556%0.563SS.*Hα-helixtrans-64-42.2165.7166.9177.4160.7-102.20111.8G276 D277 D279 R285 V286G276-K282 PolarHBondContact O-NZ 2.88Å; D277-K282 IonicContact OD1-NZ 3.28Å; D277-K282 PolarHBondContact OD1-NZ 3.39Å; D279-K282 HydrophobicContact CB-CB 3.8Å; D279-K282 VanDerWaalsContact CG-CB 3.44Å; D279-K282 WeakPolarHBondContact O-CB 3.49Å; D279-K282 PolarHBondContact O-N 3.29Å; D279-K282 PolarHBondContact OD1-N 3.03Å; D279-K282 VanDerWaalsContact OD2-CB 3.25Å; D279-K282 WeakPolarHBondContact OD2-CB 3.43Å; K282-R285 PolarHBondContact O-N 3.32Å; K282-V286 WeakPolarHBondContact O-CG2 3.36Å; K282-V286 PolarHBondContact O-N 2.89Å
283E78.4Confident67.6Low103 Ų103115 Ų11548%0.48155%0.552SS.*Hα-helixtrans-62.9-42.2176.8-162.5-165.5146.800111.7D279 P280 V286 K287D279-E283 PolarHBondContact O-N 2.99Å; P280-E283 PolarHBondContact O-N 3.41Å; E283-V286 PolarHBondContact O-N 3.38Å; E283-K287 HydrophobicContact CG-CD 4.42Å; E283-K287 WeakPolarHBondContact O-CG 3.41Å; E283-K287 PolarHBondContact O-N 3.3Å; E283-K287 VanDerWaalsContact OE1-CE 3.29Å; E283-K287 WeakPolarHBondContact OE1-CE 3.39Å; E283-K287 IonicContact OE1-NZ 2.61Å; E283-K287 PolarHBondContact OE1-NZ 3.05Å
284Q76.3Confident68.9Low135 Ų135111.9 Ų111.963%0.63155%0.545SS*.Hα-helixtrans-61-44172.7-73.6174.813.300112.2P280 V286 K287 E288P280-Q284 WeakPolarHBondContact O-CG 3.24Å; P280-Q284 PolarHBondContact O-N 3.05Å; Q284-V286 VanDerWaalsContact C-N 3.34Å; Q284-V286 PolarHBondContact O-N 2.68Å; Q284-K287 PolarHBondContact O-N 2.85Å; Q284-E288 WeakPolarHBondContact O-CB 3.35Å; Q284-E288 PolarHBondContact O-N 2.61Å
285R80.4Confident70.6Confident126 Ų126105.2 Ų105.248%0.47552%0.523SS..Hα-helixtrans-61.8-38.8174.2-72.1168.3-175.7118.11.9112.7E281 K282 E288 I289E281-R285 VanDerWaalsContact CD-CZ 3.5Å; E281-R285 VanDerWaalsContact O-CG 3.25Å; E281-R285 WeakPolarHBondContact O-CG 3.16Å; E281-R285 PolarHBondContact O-N 2.8Å; E281-R285 IonicContact OE1-NH2 2.7Å; E281-R285 PolarHBondContact OE1-NH2 2.94Å; E281-R285 IonicContact OE2-CZ 3.09Å; E281-R285 IonicContact OE2-NH1 2.64Å; E281-R285 PolarHBondContact OE2-NH1 2.82Å; E281-R285 IonicContact OE2-NH2 3.65Å; E281-R285 PolarHBondContact OE2-NH2 2.89Å; K282-R285 PolarHBondContact O-N 3.32Å; R285-E288 PolarHBondContact O-N 2.94Å; R285-I289 WeakPolarHBondContact O-CB 3.27Å; R285-I289 WeakPolarHBondContact O-CD1 3.5Å; R285-I289 VanDerWaalsContact O-CG1 3.23Å; R285-I289 WeakPolarHBondContact O-CG1 3.2Å; R285-I289 PolarHBondContact O-N 3.03Å
286V83.6Confident71.9Confident79 Ų79100.3 Ų100.348%0.47951%0.511SS..Hα-helixtrans-65.6-45.3175.6169.30000110.5K282 E283 Q284 E288 I289 E290K282-V286 WeakPolarHBondContact O-CG2 3.36Å; K282-V286 PolarHBondContact O-N 2.89Å; E283-V286 PolarHBondContact O-N 3.38Å; Q284-V286 VanDerWaalsContact C-N 3.34Å; Q284-V286 PolarHBondContact O-N 2.68Å; V286-E288 PolarHBondContact O-N 2.86Å; V286-I289 PolarHBondContact O-N 2.9Å; V286-E290 VanDerWaalsContact O-CB 3.31Å; V286-E290 WeakPolarHBondContact O-CB 3.4Å; V286-E290 PolarHBondContact O-N 2.91Å
287K84.1Confident73.3Confident119 Ų119101.7 Ų101.752%0.51750%0.501SS..Hα-helixtrans-65.2-35176.4-76172.4168.5172.30113.1E283 Q284 R291E283-K287 HydrophobicContact CG-CD 4.42Å; E283-K287 WeakPolarHBondContact O-CG 3.41Å; E283-K287 PolarHBondContact O-N 3.3Å; E283-K287 VanDerWaalsContact OE1-CE 3.29Å; E283-K287 WeakPolarHBondContact OE1-CE 3.39Å; E283-K287 IonicContact OE1-NZ 2.61Å; E283-K287 PolarHBondContact OE1-NZ 3.05Å; Q284-K287 PolarHBondContact O-N 2.85Å; K287-R291 WeakPolarHBondContact O-CB 3.29Å; K287-R291 PolarHBondContact O-N 2.96Å
288E87.7Confident73.9Confident91 Ų91100.2 Ų100.243%0.42549%0.494SS..Hα-helixtrans-63.9-47.1171.2-172.272-96.300111.1Q284 R285 V286 R291 L292Q284-E288 WeakPolarHBondContact O-CB 3.35Å; Q284-E288 PolarHBondContact O-N 2.61Å; R285-E288 PolarHBondContact O-N 2.94Å; V286-E288 PolarHBondContact O-N 2.86Å; E288-R291 PolarHBondContact O-N 3.3Å; E288-R291 IonicContact OE1-CZ 2.69Å; E288-R291 IonicContact OE1-NE 3.7Å; E288-R291 PolarHBondContact OE1-NE 2.72Å; E288-R291 IonicContact OE1-NH2 3.33Å; E288-R291 PolarHBondContact OE1-NH2 3.22Å; E288-L292 HydrophobicContact CG-CD1 4.21Å; E288-L292 WeakPolarHBondContact O-CB 3.33Å; E288-L292 VanDerWaalsContact O-CG 3.24Å; E288-L292 WeakPolarHBondContact O-CG 3.38Å; E288-L292 PolarHBondContact O-N 3.24Å
289I84.8Confident74.8Confident102 Ų10298.1 Ų98.152%0.52348%0.484SS..Hα-helixtrans-64.2-40.9177-71.7165.1000111.3R285 V286 L292 L293R285-I289 WeakPolarHBondContact O-CB 3.27Å; R285-I289 WeakPolarHBondContact O-CD1 3.5Å; R285-I289 VanDerWaalsContact O-CG1 3.23Å; R285-I289 WeakPolarHBondContact O-CG1 3.2Å; R285-I289 PolarHBondContact O-N 3.03Å; V286-I289 PolarHBondContact O-N 2.9Å; I289-L292 PolarHBondContact O-N 3.33Å; I289-L293 HydrophobicContact CG2-CD1 4.02Å; I289-L293 WeakPolarHBondContact O-CB 3.31Å; I289-L293 PolarHBondContact O-N 3.43Å
290E83.1Confident74.3Confident107 Ų107100.9 Ų100.950%0.550%0.498SS..Hα-helixtrans-66.1-41.9176.5-175.3172.5-148.800111.4V286 L292 L293 M294V286-E290 VanDerWaalsContact O-CB 3.31Å; V286-E290 WeakPolarHBondContact O-CB 3.4Å; V286-E290 PolarHBondContact O-N 2.91Å; E290-L292 VanDerWaalsContact C-N 3.33Å; E290-L292 PolarHBondContact O-N 2.6Å; E290-L293 PolarHBondContact O-N 2.91Å; E290-M294 WeakPolarHBondContact O-CB 3.27Å; E290-M294 VanDerWaalsContact O-CG 3.27Å; E290-M294 WeakPolarHBondContact O-CG 3.46Å; E290-M294 PolarHBondContact O-N 3.38Å
291R82Confident73.6Confident142 Ų142103.4 Ų103.454%0.53650%0.5SS..Hα-helixtrans-61.7-39.5172.5-171.6-166.470.373.7-0.9112K287 E288 A295K287-R291 WeakPolarHBondContact O-CB 3.29Å; K287-R291 PolarHBondContact O-N 2.96Å; E288-R291 PolarHBondContact O-N 3.3Å; E288-R291 IonicContact OE1-CZ 2.69Å; E288-R291 IonicContact OE1-NE 3.7Å; E288-R291 PolarHBondContact OE1-NE 2.72Å; E288-R291 IonicContact OE1-NH2 3.33Å; E288-R291 PolarHBondContact OE1-NH2 3.22Å; R291-A295 WeakPolarHBondContact O-CB 3.26Å; R291-A295 PolarHBondContact O-N 3.03Å
292L82.2Confident72.4Confident87 Ų87104.5 Ų104.546%0.45551%0.508SS..Hα-helixtrans-72.3-36.1176.4-71.3167.8000112.4E288 I289 E290 A295 T296E288-L292 HydrophobicContact CG-CD1 4.21Å; E288-L292 WeakPolarHBondContact O-CB 3.33Å; E288-L292 VanDerWaalsContact O-CG 3.24Å; E288-L292 WeakPolarHBondContact O-CG 3.38Å; E288-L292 PolarHBondContact O-N 3.24Å; I289-L292 PolarHBondContact O-N 3.33Å; E290-L292 VanDerWaalsContact C-N 3.33Å; E290-L292 PolarHBondContact O-N 2.6Å; L292-A295 PolarHBondContact O-N 3.26Å; L292-T296 PolarHBondContact O-N 3.49Å; L292-T296 PolarHBondContact O-OG1 2.78Å
293L78.5Confident71.1Confident107 Ų107108.5 Ų108.556%0.5653%0.528SS*.Hα-helixtrans-64.6-46170.7-86.9163.7000111.2I289 E290 A295 T296 E297I289-L293 HydrophobicContact CG2-CD1 4.02Å; I289-L293 WeakPolarHBondContact O-CB 3.31Å; I289-L293 PolarHBondContact O-N 3.43Å; E290-L293 PolarHBondContact O-N 2.91Å; L293-A295 VanDerWaalsContact C-N 3.33Å; L293-A295 PolarHBondContact O-N 2.91Å; L293-T296 WeakPolarHBondContact CA-OG1 3.41Å; L293-T296 PolarHBondContact O-N 2.85Å; L293-T296 PolarHBondContact O-OG1 3.38Å; L293-E297 VanDerWaalsContact O-CB 3.29Å; L293-E297 WeakPolarHBondContact O-CB 3.46Å; L293-E297 PolarHBondContact O-N 2.87Å
294M68.1Low69.2Low97 Ų97109.7 Ų109.748%0.47854%0.544SS..Hα-helixtrans-64.7-36.6176.1-71.3-72.8165.100112.1E290 N298E290-M294 WeakPolarHBondContact O-CB 3.27Å; E290-M294 VanDerWaalsContact O-CG 3.27Å; E290-M294 WeakPolarHBondContact O-CG 3.46Å; E290-M294 PolarHBondContact O-N 3.38Å; M294-N298 WeakPolarHBondContact O-CB 3.37Å; M294-N298 VanDerWaalsContact O-CG 3.23Å; M294-N298 PolarHBondContact O-N 2.95Å; M294-N298 PolarHBondContact O-ND2 2.81Å
295A71.9Confident67.2Low48 Ų48108.7 Ų108.740%0.39755%0.552SS.*Hα-helixtrans-63.4-48.3173.200000111.7R291 L292 L293 N298 E299R291-A295 WeakPolarHBondContact O-CB 3.26Å; R291-A295 PolarHBondContact O-N 3.03Å; L292-A295 PolarHBondContact O-N 3.26Å; L293-A295 VanDerWaalsContact C-N 3.33Å; L293-A295 PolarHBondContact O-N 2.91Å; A295-N298 PolarHBondContact O-N 2.67Å; A295-E299 PolarHBondContact O-N 3.49Å
296T68.1Low64.9Low65 Ų65111.3 Ų111.340%0.39958%0.575SS.*Hα-helixtrans-72.6-29.5179.648.50000113.4L292 L293 E299 L300L292-T296 PolarHBondContact O-N 3.49Å; L292-T296 PolarHBondContact O-OG1 2.78Å; L293-T296 WeakPolarHBondContact CA-OG1 3.41Å; L293-T296 PolarHBondContact O-N 2.85Å; L293-T296 PolarHBondContact O-OG1 3.38Å; T296-E299 PolarHBondContact O-N 3.07Å; T296-L300 WeakPolarHBondContact O-CB 3.15Å; T296-L300 WeakPolarHBondContact O-CG 3.45Å; T296-L300 PolarHBondContact O-N 2.94Å
297E66.4Low62.5Low85 Ų85113 Ų11340%0.39759%0.59SS.*Hα-helixtrans-69.2-39.6172.1-167.4-171.2141.100111.4L293 E299 L300 K301L293-E297 VanDerWaalsContact O-CB 3.29Å; L293-E297 WeakPolarHBondContact O-CB 3.46Å; L293-E297 PolarHBondContact O-N 2.87Å; E297-E299 VanDerWaalsContact C-N 3.3Å; E297-E299 PolarHBondContact O-N 2.73Å; E297-L300 PolarHBondContact O-N 2.72Å; E297-K301 WeakPolarHBondContact O-CB 3.48Å; E297-K301 WeakPolarHBondContact O-CG 3.41Å; E297-K301 PolarHBondContact O-N 2.73Å; E297-K301 WeakPolarHBondContact OE1-CE 3.31Å; E297-K301 IonicContact OE1-NZ 2.86Å; E297-K301 PolarHBondContact OE1-NZ 3.35Å
298N60.3Low60.1Low98 Ų98116.4 Ų116.452%0.52461%0.61SS.*Hα-helixtrans-66.7-32.3173.5-73.9-36.6000112.3M294 A295M294-N298 WeakPolarHBondContact O-CB 3.37Å; M294-N298 VanDerWaalsContact O-CG 3.23Å; M294-N298 PolarHBondContact O-N 2.95Å; M294-N298 PolarHBondContact O-ND2 2.81Å; A295-N298 PolarHBondContact O-N 2.67Å
299E63.4Low57.6Low141 Ų141119.1 Ų119.166%0.65963%0.627SS**Hα-helixtrans-72-40.3173-162.8166.6-147.300111.7A295 T296 E297 I302A295-E299 PolarHBondContact O-N 3.49Å; T296-E299 PolarHBondContact O-N 3.07Å; E297-E299 VanDerWaalsContact C-N 3.3Å; E297-E299 PolarHBondContact O-N 2.73Å; E299-I302 PolarHBondContact O-N 3.4Å
300L52.2Low55.2Low128 Ų128121.9 Ų121.967%0.6764%0.642SS**Hα-helixtrans-71.8-28.2176.4-73.3167.9000113.6T296 E297 I302 Q303T296-L300 WeakPolarHBondContact O-CB 3.15Å; T296-L300 WeakPolarHBondContact O-CG 3.45Å; T296-L300 PolarHBondContact O-N 2.94Å; E297-L300 PolarHBondContact O-N 2.72Å; L300-I302 PolarHBondContact O-N 3.29Å; L300-I302 VanDerWaalsContact O-N 3.16Å; L300-Q303 PolarHBondContact O-N 3Å
301K52.4Low52.6Low143 Ų143122.1 Ų122.162%0.62266%0.656SS**THydrogen-bonded Turntrans-66.2-9.2173.6-87173.1-179160.60114.2E297E297-K301 WeakPolarHBondContact O-CB 3.48Å; E297-K301 WeakPolarHBondContact O-CG 3.41Å; E297-K301 PolarHBondContact O-N 2.73Å; E297-K301 WeakPolarHBondContact OE1-CE 3.31Å; E297-K301 IonicContact OE1-NZ 2.86Å; E297-K301 PolarHBondContact OE1-NZ 3.35Å
302I47.6Very low50.1Low130 Ų130124.7 Ų124.767%0.66767%0.671SS**THydrogen-bonded Turntrans-94.1-0.1179.7-63.5171.3000111.8E299 L300E299-I302 PolarHBondContact O-N 3.4Å; L300-I302 PolarHBondContact O-N 3.29Å; L300-I302 VanDerWaalsContact O-N 3.16Å
303Q40.8Very low48.1Very low146 Ų146126.5 Ų126.568%0.68269%0.688SS**SBendtrans-128.3123.8178.6-66.7-64.2-16.400113.3L300L300-Q303 PolarHBondContact O-N 3Å
304P40.1Very low45.7Very low127 Ų127127.2 Ų127.283%0.82570%0.702SS**  trans-78.3146.8177.632.4-34.3000112.2
305S33.8Very low44Very low114 Ų114133.3 Ų133.380%0.79772%0.72SS**  trans-110.6157-171.9590000114
306L31.6Very low42Very low182 Ų182135.6 Ų135.695%0.95374%0.739SS**  trans-133.5148.3168.2-77.5176.3000110.3
307S32.9Very low40.2Very low115 Ų115138.1 Ų138.180%0.80475%0.754SS**  trans-106.3160.2-171.856.90000113.3
308M33.8Very low38.6Very low190 Ų190142.9 Ų142.994%0.93678%0.777SS**  trans-136.4153.9167.7-91.8-65.6-165.300110.1
309N35.3Very low37.1Very low147 Ų147143.5 Ų143.579%0.78679%0.789SS**  trans-139.3137.8-164.7-156.8-4.4000109.6
310L33.4Very low35.5Very low161 Ų161142.8 Ų142.884%0.84380%0.799SS**  trans-145.1148.8176.9-81.3179.1000111.1
311S30.3Very low34.8Very low112 Ų112145 Ų14578%0.78381%0.81SS**  trans-129.8151.5-179.3-53.80000110.7
312F29.4Very low33.8Very low196 Ų196145.3 Ų145.386%0.8683%0.825SS**  trans-128.5141.5175.5-94.5-90.6000110.7
313P39.6Very low33Very low125 Ų125144.3 Ų144.381%0.81283%0.829SS**  trans-83.2158175.334.3-34.5000112.3
314S28.9Very low32.4Very low122 Ų122143 Ų14385%0.85384%0.836SS**  trans-101.6152.2174.4-1730000111.3
315W30.9Very low32.2Very low225 Ų225141.5 Ų141.585%0.85283%0.829SS**  trans-119.8133.2169.377.3-66.6000110.1
316A31.6Very low32.2Very low96 Ų96144.5 Ų144.579%0.79384%0.836SS**  trans-149.2110.1171.900000108.2
317T30Very low32.1Very low117 Ų117139 Ų13972%0.71882%0.823SS**  trans-95.1119.2-178.4-50.20000109.8
318Q31.8Very low32Very low186 Ų186138.6 Ų138.687%0.86983%0.827SS**  trans-109.9145.1159.7-72.6-162.729.600109.9
319S30Very low31.8Very low111 Ų111133.7 Ų133.778%0.77682%0.816SS**  trans-80.6138.5173.2-50.30000110.7
320S29.4Very low31.6Very low126 Ų126132.7 Ų132.788%0.88182%0.816SS**  trans-157.9155.7153.5-870000111.4
321L36.1Very low31.5Very low173 Ų173130.5 Ų130.591%0.90681%0.814SS**  trans-95.5144.3-169.1-60.9157.6000111.3
322T31.7Very low31.5Very low150 Ų150133.1 Ų133.192%0.9282%0.818SS**  trans-144.6158.2148.446.50000109.8
323S31.1Very low31.5Very low110 Ų110128.5 Ų128.577%0.76981%0.81SS**  trans-138.3128.9-171.655.10000112.9
324S29.2Very low31.1Very low117 Ų117130 Ų13082%0.81881%0.806SS**  trans-176.7139.7155.5-83.40000107
325S35.3Very low31.3Very low97 Ų97131.8 Ų131.868%0.67880%0.799SS**  cis126.692.16.963.70000108.7
326D33.2Very low31.5Very low176 Ų176128 Ų12894%0.94179%0.791SS**  trans-172.7140.2160.5-94.1-31.1000106.5
327G31Very low31.4Very low67 Ų67129.2 Ų129.269%0.69179%0.788SS**  cis-179.5173.3-8.300000111.7
328A30Very low31.4Very low107 Ų107127.9 Ų127.988%0.88479%0.79SS**  trans75.7138.3164.300000122.8
329A29.7Very low31.2Very low86 Ų86123.7 Ų123.771%0.71179%0.786SS**  trans93.7105.3141.400000123.2
330T30.5Very low32.5Very low127 Ų127124.4 Ų124.478%0.77979%0.788SS**  trans58.7111133.357.70000122.4
331S31.6Very low32.4Very low115 Ų115123 Ų12380%0.80479%0.785SS**  167.7131.7101.1-74.90000117.1
332L30.4Very low32.3Very low166 Ų166122.7 Ų122.787%0.86978%0.783SS**  trans61.4145.7140.6-130.367.5000124.9
333S30.2Very low33.2Very low99 Ų99120.5 Ų120.569%0.69277%0.771SS**  trans-6.5137.7166.554.60000121.1
334H30.1Very low33.3Very low156 Ų156122.7 Ų122.772%0.72277%0.773SS**  cis92.8134.523.2-154.873.4000116.7
335F33Very low33.3Very low161 Ų161122.5 Ų122.571%0.70676%0.764SS**  trans71.3147.9177.3-73.4-39.6000119.6
336Q35.5Very low33.1Very low146 Ų146125.4 Ų125.468%0.68277%0.766SS**  cis-169.7155.2-20.5-153.9175.62.900114.1
337T29.5Very low32.9Very low120 Ų120121.5 Ų121.574%0.73675%0.753SS**  trans71.4132.5148.222.90000126.6
338A29.7Very low32.9Very low90 Ų90124.4 Ų124.474%0.74476%0.761SS**  trans75.7121.1130.200000125.3
339A28.4Very low33.2Very low97 Ų97127.2 Ų127.280%0.80276%0.76SS**  36164.4122.100000123.6
340P55.9Low34.3Very low126 Ų126128.1 Ų128.182%0.81876%0.759SS**  cis-136.7-159.1-25.737.1-15.7000114.1
341A28.3Very low34.4Very low97 Ų97130 Ų13080%0.80276%0.759SS**  trans110.8156.4148.300000121.8
342L33.7Very low34.4Very low166 Ų166132.4 Ų132.487%0.86976%0.757SS**  trans-108.3-170.8175-68.1172.7000108.7
343P51.1Low34.6Very low105 Ų105129.1 Ų129.168%0.68275%0.748SS**  cis-149.2-163.412.946.2-24.5000117.9
344L32.7Very low34.7Very low155 Ų155128.6 Ų128.681%0.81275%0.75SS**  trans69.5153.4160.9-97.972.6000118.2
345D29.2Very low34.8Very low114 Ų114126.3 Ų126.361%0.6175%0.752SS**  cis-160.1169.6-14.4-159.37.3000111.5
346Q31.6Very low34.7Very low158 Ų158123 Ų12374%0.73875%0.754SS**  trans61.7154.8157.8-77.2159.36000120.5
347S30Very low34.5Very low93 Ų93122.5 Ų122.565%0.6576%0.761SS**  cis-174.2126.7-36.452.40000110.2
348C30.2Very low34.7Very low129 Ų129128.4 Ų128.487%0.87277%0.77SS**  trans171.8136.6134.7-97.70000113.3
349L35.5Very low34.8Very low166 Ų166128.4 Ų128.487%0.86977%0.77SS**  trans-99.9180162.3-80.3173.7000107.9
350P52.8Low35Very low104 Ų104130 Ų13068%0.67578%0.775SS**  cis-128.6-167.21744-24.3000112.9
351E33.4Very low33.8Very low167 Ų167129.3 Ų129.378%0.7877%0.774SS**  cis-150.2171.114.4-157.3143.9-132.100113.4
352E30.4Very low33.9Very low165 Ų165132 Ų13277%0.77178%0.78SS**  trans-0.2123.8177.3-71.1-151.888.300120.9
353S35.3Very low33.8Very low97 Ų97129.3 Ų129.368%0.67878%0.782SS**  81.2121.367.2-64.30000112.9
354A31.6Very low32.7Very low88 Ų88128 Ų12873%0.72779%0.787SS**  cis81.8143.548.400000113.1
355S32.3Very low32.7Very low109 Ų109124.8 Ų124.876%0.76278%0.778SS**  cis-172.6161-10.4-1070000112.1
356A31.7Very low32.9Very low91 Ų91127.3 Ų127.375%0.75279%0.786SS**  trans62.2-177.5149.700000116.4
357T30.6Very low33Very low136 Ų136127.8 Ų127.883%0.83479%0.788SS**  cis-144.2165.15.3-38.50000111.6
358R35.3Very low33Very low243 Ų243128.8 Ų128.892%0.91779%0.794SS**  trans-81.4146.1168.9-46172.7-170.9177.11.9110.8
359A30.9Very low33Very low91 Ų91128.1 Ų128.175%0.75279%0.791SS**  trans-167.8130.5141.200000113.8
360S31.9Very low33.6Very low129 Ų129125.5 Ų125.590%0.90278%0.784SS**  trans41.5147.3139-54.50000124.5
361S31Very low32.5Very low113 Ų113127.7 Ų127.779%0.7980%0.796SS**  trans-102.9151-17853.80000114.8
362T30.1Very low32.3Very low152 Ų152128.5 Ų128.593%0.93380%0.797SS**  trans-136.1160.6155.840.80000109.8
363A33.3Very low32.3Very low111 Ų111126 Ų12692%0.91779%0.794SS**  trans-124.9161-154.800000116.4
364G27.5Very low32.1Very low77 Ų77129.2 Ų129.279%0.79480%0.803SS**  trans106.7152.3161.300000115.8
365S32.6Very low32.3Very low87 Ų87129.4 Ų129.461%0.60880%0.804SS**  cis-166.9152.3-17.1-168.50000110.9
366H33Very low32.4Very low167 Ų167132.8 Ų132.877%0.77381%0.81SS**  trans66.5150176.6-37.8-73.3000114.3
367H33.5Very low33.1Very low169 Ų169133.6 Ų133.678%0.78281%0.808SS**  cis-160.6154.230.740.4-81.8000113.4
368S30.6Very low33.2Very low113 Ų113135.2 Ų135.279%0.7981%0.811SS**  trans66.1118.1156.1-55.10000122.1
369S29Very low33.3Very low116 Ų116132.3 Ų132.381%0.81181%0.806SS**  trans-110.2-164.1152.7-45.90000107.6
370P49.7Very low33.5Very low111 Ų111135.9 Ų135.972%0.72181%0.809SS**  cis-137.5176.9-5.643.1-26.3000115.9
371T28.8Very low33.8Very low149 Ų149139.4 Ų139.491%0.91481%0.811SS**  trans-136.8153.2150.1-45.10000109.7
372F28.4Very low34.2Very low185 Ų185139.6 Ų139.681%0.81181%0.812SS**  trans-96.5160.6-159.8-137.7-104.9000115.1
373T32.1Very low34.5Very low113 Ų113138.7 Ų138.769%0.69381%0.807SS**  trans-91.4160.9175.450.30000113
374N30.8Very low34.8Very low163 Ų163141 Ų14187%0.87280%0.802SS**  trans-160.1152.1138.1-103.5-32.7000111.5
375A36Very low35.1Very low92 Ų92145.1 Ų145.176%0.7681%0.806SS**  trans-139.5158.2-176.200000111.2
376M34.7Very low35.1Very low180 Ų180146.6 Ų146.689%0.88782%0.816SS**  trans-158158.6168.9-100.1-49-173.300108.9
377P44.8Very low35.1Very low108 Ų108148.3 Ų148.370%0.70182%0.822SS**  -125158.2-110.940-28.1000115.7
378D33.3Very low35.2Very low170 Ų170148.2 Ų148.291%0.90983%0.826SS**  trans-79.7129.9170.5-65.1-66.2000112.2
379F36.8Very low35.2Very low182 Ų182148.3 Ų148.380%0.79883%0.827SS**  trans-153.289.3166-174-98.8000111.8
380M36.4Very low35.2Very low167 Ų167152.4 Ų152.482%0.82383%0.833SS**  trans168.449.8142-92.8-166.7-7100113.6
381E37.4Very low34.3Very low202 Ų202152.1 Ų152.194%0.94483%0.834SS**  trans-120.181.7161.8-75.7-163.6148.800110
382S38.6Very low34.3Very low117 Ų117152.8 Ų152.882%0.81883%0.828SS**  trans-153.828.5178.9-171.90000114.4
383V38.3Very low34.2Very low134 Ų134148.9 Ų148.981%0.81282%0.824SS**SBendtrans-143.4153166.2-164.40000108.4
384I39.1Very low34.8Very low160 Ų160148.7 Ų148.782%0.82183%0.825SS**SBendtrans76.243.3173.7-29.5171.9000116.1
385D32.6Very low34.7Very low163 Ų163148.7 Ų148.787%0.87282%0.82SS**SBendtrans-152.639.6152.1-125.7-11000114.7
386S33Very low34.4Very low118 Ų118151.6 Ų151.683%0.82582%0.817SS**  trans-146.963.3177.8-70.30000113.3
387F34.3Very low34.2Very low203 Ų203147.4 Ų147.489%0.8981%0.805SS**  trans-16186.8158.1-139.6-90.1000112.9
388L34.5Very low33.4Very low166 Ų166149.1 Ų149.187%0.86981%0.809SS**SBendtrans174.264.6150.8-99.3168.5000113.1
389S30.4Very low33.2Very low116 Ų116147.9 Ų147.981%0.81180%0.802SS**  trans-172.496.2155.2-86.30000112.3
390Q30Very low32.9Very low201 Ų201143.5 Ų143.594%0.93979%0.794SS**  trans-154.2137155.4-142.684.469.600108.7
391S30.2Very low32.8Very low105 Ų105142.8 Ų142.873%0.73479%0.793SS**  trans-143.2129.7-177.957.20000111.4
392M28.6Very low32.5Very low163 Ų163143.3 Ų143.380%0.80379%0.786SS**  trans63110.7156.7-58-76.987.100119.1
393S27Very low32.2Very low103 Ų103144.3 Ų144.372%0.7278%0.779SS**  75.7160.9128.8-57.10000120
394P44.4Very low32Very low110 Ų110142.7 Ų142.771%0.71477%0.774SS**  cis-134.2-177.9-28.429.1-7.2000114.1
395E28.2Very low31.7Very low163 Ų163144.1 Ų144.176%0.76278%0.78SS**  trans139.7136.1130.1-66.1-135.513600118
396H30.2Very low31.7Very low153 Ų153140.8 Ų140.871%0.70877%0.774SS**  trans60.9119150.6-88.5-71.5000125.7
397S29.5Very low31.8Very low91 Ų91141.9 Ų141.964%0.63678%0.776SS**  trans67.4144133.1-72.70000120.6
398D29.3Very low31.7Very low144 Ų144138.6 Ų138.677%0.7777%0.768SS**  cis-159.4178.1-3.9-130.1-56.5000114
399D28.2Very low31.6Very low144 Ų144136.3 Ų136.377%0.7776%0.761SS**  trans75.6175.7157.5-141.5-4.7000120.7
400S30.7Very low31.7Very low90 Ų90139.8 Ų139.863%0.62976%0.761SS**  trans-133.3156.9-131.2-46.40000115.8
401L33.6Very low32.3Very low152 Ų152136.2 Ų136.280%0.79676%0.755SS**  166.8130.3116.6-88.1166.7000114.5
402R32.6Very low32.1Very low214 Ų214139 Ų13981%0.80876%0.762SS**  trans33.5141.1132-91.5-179.9152.9162.8-6.1121.4
403M31.4Very low32.4Very low137 Ų137136.6 Ų136.668%0.67576%0.756SS**  cis-171.4156.49.2-154.716061.600114.6
404S34.1Very low32.3Very low100 Ų100138.5 Ų138.570%0.69976%0.758SS**  trans64.7140.2149.748.90000121
405M33Very low31.6Very low191 Ų191140.7 Ų140.794%0.94176%0.758SS**  cis-138.4-157.69.2-61.6-172.171.300113.7
406A32.7Very low31.5Very low92 Ų92138 Ų13876%0.7676%0.757SS**  trans-160.6-173.7-174.800000115.2
407V35.6Very low31.5Very low142 Ų142138.4 Ų138.486%0.86176%0.763SS**  trans80.9138.8167.5165.90000118.8
408D30.6Very low31.3Very low134 Ų134145.2 Ų145.272%0.71777%0.774SS**  cis-137.5-95.7-30-178.259.1000112.4
409T33.3Very low31.9Very low118 Ų118143.6 Ų143.672%0.72477%0.772SS**  cis-158158.2-0.7-46.50000109.7
410K33Very low31.8Very low188 Ų188145 Ų14582%0.81777%0.774SS**  trans-143.8156.6-178.4-61.1177.9-173.7167.70117.3
411P41.8Very low31.6Very low126 Ų126147.9 Ų147.982%0.81878%0.775SS**  trans-120.8168.8153.239.7-28.7000113.8
412L26.9Very low31.4Very low165 Ų165147 Ų14786%0.86477%0.767SS**  trans-164.8143.4-176-165.956.6000117.7
413V33.3Very low31.2Very low112 Ų112143.6 Ų143.668%0.67977%0.765SS**  trans73.2141.7152.9150.40000123.3
414D25.4Very low31Very low142 Ų142145 Ų14576%0.75977%0.77SS**  trans-159.6-161.7137.9-159.759.8000113.2
415H30.3Very low30.8Very low156 Ų156145.9 Ų145.972%0.72277%0.765SS**  trans-153.8-179.6-147.6-90.418000113.6
416S26.6Very low30.5Very low106 Ų106144.7 Ų144.774%0.74176%0.755SS**  cis-169.9-132.6-20.7179.10000109.4
417I29.9Very low30.3Very low162 Ų162150.3 Ų150.383%0.83176%0.757SS**  trans98.1152.8167.2-55177.4000118.3
418R25.3Very low30.4Very low234 Ų234150.1 Ų150.188%0.88376%0.756SS**  trans-154.5-172.9-166.8-74.7173.4164.4175.6-5.7109.9
419P41.4Very low31Very low110 Ų110149 Ų14971%0.71476%0.756SS**  cis-144-159.66.543.7-21.1000117.3
420Q25.4Very low30.9Very low175 Ų175150.6 Ų150.682%0.81876%0.76SS**  trans75.2156.1161.4-73.6-177.1-8.500119.5
421K28.4Very low30.9Very low149 Ų149149.4 Ų149.465%0.64876%0.761SS**  cis-152.5157.26.3-141.9-162.9-173-138.90114.5
422E27.4Very low30.5Very low133 Ų133153.7 Ų153.762%0.62176%0.761SS**  trans19.9129.9154.1-73.1155-14800126.5
423N28.4Very low31.3Very low144 Ų144157 Ų15777%0.7776%0.762SS**  35.3126.5127.6-51.3-6.4000124.3
424E28.8Very low31.2Very low166 Ų166157 Ų15778%0.77677%0.767SS**  163.6136.8105.1-84.5-135140.400116.6
425I29.2Very low31.7Very low119 Ų119157.5 Ų157.561%0.6177%0.768SS**  trans18.4126.2144.6-28.4170.4000120.7
426F26.4Very low31.9Very low165 Ų165157.2 Ų157.272%0.72477%0.771SS**  178.9163.3113.2-111.1-99.4000117.3
427R29.3Very low32.1Very low210 Ų210160.4 Ų160.479%0.79277%0.774SS**PPolyproline II helixtrans-58154.9-162.2-60.5168.1-175.8174.72.1119.8
428T37.9Very low32.3Very low138 Ų138157.8 Ų157.885%0.84777%0.77SS**PPolyproline II helixtrans-61.1140.6156.3-9.10000113.4
429P41.7Very low32.9Very low112 Ų112153.1 Ų153.173%0.72776%0.763SS**PPolyproline II helixtrans-95.7154.3161.335.2-30.9000112.6
430N32.3Very low33.1Very low151 Ų151153.8 Ų153.881%0.80777%0.767SS**  trans-132.6122.3178.2175.9-10.5000108.5
431I32.2Very low33.5Very low162 Ų162156.2 Ų156.283%0.83177%0.769SS**  trans-132143.9-175-63.4-177000110.7
432R34.9Very low33.8Very low217 Ų217155.7 Ų155.782%0.81978%0.778SS**  trans-113.9137-171.7-71.1176.6167.6-176.6-2.8113.4
433R42.3Very low34.6Very low235 Ų235154.9 Ų154.989%0.88779%0.785SS**  trans43.1122.8138-60-176.4177.4-166.2-1.1121.5
434S31.7Very low34.9Very low111 Ų111154 Ų15478%0.77679%0.785SS**  trans-151.7114.1133.451.40000107
435I36.4Very low35.6Very low153 Ų153151.8 Ų151.879%0.78579%0.785SS**  73.7130.770.1-64175.2000113
436L33.1Very low36Very low149 Ų149155.8 Ų155.878%0.7880%0.798SS**  trans79.7108171.7-139.574.8000118.1
437E31.7Very low36.4Very low174 Ų174159.8 Ų159.881%0.81381%0.808SS**  -161170.7110-151.362.6-88.500108.7
438S34.7Very low36.6Very low107 Ų107155.4 Ų155.475%0.74881%0.81SS**  trans-117.8151.1-171.263.90000115.5
439N37.5Very low36.3Very low135 Ų135156.5 Ų156.572%0.72281%0.811SS**  trans-61.2151.6-176.5-153.227000112.8
440P45.1Very low35.8Very low125 Ų125159.2 Ų159.281%0.81282%0.818SS**  -137.2154.3113.738-28.8000114.8
441R35.1Very low35.8Very low225 Ų225155 Ų15585%0.84981%0.811SS**  trans-117.7115.2-176-173.1-177.2-163.3149.44.1109.7
442T33.4Very low35.6Very low138 Ų138154.7 Ų154.785%0.84781%0.81SS**PPolyproline II helixtrans-81.2140.9-179.619.40000112.6
443P44.2Very low35.6Very low116 Ų116152.9 Ų152.975%0.75381%0.81SS**PPolyproline II helixtrans-94.4151.6-175.936.1-35.1000114
444T36.1Very low35Very low127 Ų127145 Ų14578%0.77980%0.802SS**PPolyproline II helixtrans-78.9137.7167.341.90000111.8
445P42.9Very low34.8Very low119 Ų119145.1 Ų145.177%0.77380%0.803SS**PPolyproline II helixtrans-90.9128.4-173.733.7-33.8000113.8
446F36.7Very low34.5Very low202 Ų202144.7 Ų144.789%0.88680%0.802SS**  trans-105.9125.7153.2-79.2-82.1000108.8S448F446-S448 PolarHBondContact O-N 2.63Å
447R35.6Very low34.3Very low249 Ų249145.8 Ų145.894%0.9480%0.8SS**  trans-87.5104.3175.1-80.5-172.1171.7-161.9-1.1110.4
448S33.9Very low34.2Very low119 Ų119144.2 Ų144.283%0.83280%0.796SS**  trans-79.8139.3157.1-62.30000109.5F446F446-S448 PolarHBondContact O-N 2.63Å
449N29.9Very low34Very low160 Ų160146.4 Ų146.486%0.85680%0.795SS**  trans-101.3119.9-174.7-16720.7000111.9
450L32.2Very low33.5Very low170 Ų170144 Ų14489%0.8979%0.788SS**  trans-143.4140.2167.8-66.7173.2000106.5
451G31.6Very low32.8Very low63 Ų63146.2 Ų146.265%0.64979%0.788SS**  cis167.4158.7-500000110.3
452L29.7Very low32.4Very low155 Ų155140.7 Ų140.781%0.81278%0.78SS**  trans-145.2149.2165.6-79.5103.3000107.3
453H34.2Very low32.2Very low178 Ų178140.3 Ų140.382%0.82477%0.772SS**  cis-122.9167.18.9-59.3-105.5000110.4
454G29.4Very low31.5Very low70 Ų70142.7 Ų142.772%0.72277%0.772SS**  trans-128.1161.1178.300000113.7
455S28.2Very low31.3Very low113 Ų113145.5 Ų145.579%0.7978%0.777SS**  trans-160120.7158.7-87.10000113.7
456L28.6Very low30.7Very low145 Ų145148.6 Ų148.676%0.75978%0.781SS**  trans58.8114.5133.8-59.4171.4000121.9
457K30.5Very low30.4Very low171 Ų171146.9 Ų146.974%0.74378%0.778SS**  78.3121.4125.7-73.5-172.8170.7-175.30122.1
458L28.8Very low30.3Very low141 Ų141140.1 Ų140.174%0.73876%0.764SS**  trans63.3160138-80.478.5000118.8
459Q30.6Very low30.3Very low154 Ų154142.8 Ų142.872%0.7276%0.763SS**  cis-171.8144.7-30.7169.3169.2-1.800109.7
460S27.3Very low30.3Very low83 Ų83140 Ų14058%0.5876%0.756SS**  trans68.8137.8159.4-80.20000121.6
461Q29.2Very low30.4Very low173 Ų173139.9 Ų139.981%0.80876%0.755SS**  trans69.6150.9133.5-72.2175.5-7.500120.6
462T26.8Very low30.5Very low109 Ų109145 Ų14567%0.66976%0.759SS**  cis-167.4163.7-41.29.80000108.1
463L29.5Very low30.5Very low130 Ų130145.1 Ų145.168%0.68176%0.755SS**  trans45.3104.9148.1-63.9165000117.7
464E29.1Very low30.4Very low165 Ų165144.2 Ų144.277%0.77175%0.752SS**  80.1135.598.8-79.3-179.4-173.100115.9
465Q32.1Very low31.1Very low186 Ų186146.2 Ų146.287%0.86975%0.752SS**  -175.4169.1120.9-100.5166.13900111.9
466Q31.6Very low31.2Very low184 Ų184147.2 Ų147.286%0.8675%0.746SS**  trans69.594.5-177.7-58.6-172.9-23.500114
467M29.9Very low31.3Very low167 Ų167147.9 Ų147.982%0.82375%0.745SS**  cis83.5137.129.4-156.7-173.370.700114.2
468V34.1Very low31.1Very low106 Ų106144.9 Ų144.964%0.64275%0.745SS**  trans74.4141.3176.8-162.70000113.2
469E32.3Very low31.1Very low175 Ų175142.5 Ų142.582%0.81875%0.745SS**  cis-124.2-176.14.6-158.266.2-9200110.6
470S29.9Very low31Very low102 Ų102142.9 Ų142.971%0.71375%0.75SS**  trans-124.7176.3179.2-68.20000113.8
471I34.5Very low31.1Very low167 Ų167146.1 Ų146.186%0.85676%0.761SS**  trans119.4139.9152.9-61.2168.7000117.1
472K33.3Very low31.2Very low172 Ų172146 Ų14675%0.74876%0.76SS**  trans-44.5155.4173-78.7-176.5173.2-172.30116.5
473Q30.8Very low32.4Very low156 Ų156145 Ų14573%0.72976%0.756SS**  cis105.1129.136.5-159.9-175.410.500111.2
474E31.8Very low33.5Very low159 Ų159144.2 Ų144.274%0.74376%0.759SS**  trans69.6163.4173.9-72.2-147.395.500119.1
475P45.3Very low33.7Very low113 Ų113143 Ų14373%0.73476%0.757SS**  cis-131.7163.52.238.5-20.9000118.5
476M29.8Very low34.1Very low134 Ų134143.8 Ų143.866%0.6676%0.757SS**  trans27.4131.7136.6-55.7-67.2-85.300125.4
477E29.6Very low34.3Very low158 Ų158143.9 Ų143.974%0.73876%0.755SS**  trans71.9129.7130.2-68.7-169.8138.400127
478C26.2Very low34.6Very low109 Ų109144.5 Ų144.574%0.73676%0.76SS**  trans72.3100.8132.8-69.40000125.9
479A29.7Very low34.5Very low90 Ų90148.4 Ų148.474%0.74477%0.768SS**  80.3163.7117.200000123.1
480I29.2Very low34.4Very low162 Ų162148 Ų14883%0.83177%0.766SS**  trans76.9135.2170.3-56.6169.6000113.9
481D28Very low34.4Very low152 Ų152150 Ų15081%0.81376%0.764SS**  cis-144.3-1753.2-141.7-31.7000113.8
482Q30.8Very low34.1Very low169 Ų169147.6 Ų147.679%0.7976%0.757SS**  trans-110.4-167.5177.2-126.3-173.997.300111.1
483P53.8Low34Very low90 Ų90147.4 Ų147.458%0.58476%0.759SS**  cis-124.8-151.3-27.338.5-16.9000110.7
484P52Low34.2Very low112 Ų112145.4 Ų145.473%0.72776%0.762SS**  -144.7139.161.736.1-14.4000118.2
485L33.2Very low34.3Very low140 Ų140143.7 Ų143.773%0.73377%0.765SS**  trans32.2138.2131.5-52.9174.6000120
486K40.5Very low33.6Very low203 Ų203144 Ų14488%0.88377%0.768SS**  -149.2167.151-74.1174.3-176.61740114
487K36.7Very low33.5Very low186 Ų186143.6 Ų143.681%0.80976%0.764SS**  trans-91.4154.5-176.5-51.4169.9-177.7175.60112.6
488I35.8Very low33.5Very low180 Ų180145.1 Ų145.192%0.92376%0.764SS**  -161.1163121.7-103.2160.2000109.5
489K32.3Very low34.1Very low188 Ų188145.2 Ų145.282%0.81777%0.765SS**  trans-143.3118-162.2169.2-149.3171.9-168.90110.7
490Q29.8Very low34.4Very low166 Ų166145.8 Ų145.878%0.77676%0.761SS**  trans-157.5125.3154.2-95.4-167.8-77.100105.8
491E28.6Very low34.3Very low144 Ų144144.3 Ų144.367%0.67376%0.764SS**  90.813170.1-85-170.1144.500113.5
492V29.1Very low34.4Very low116 Ų116144.6 Ų144.670%0.70376%0.763SS**  trans72138.7147.5176.80000119.1
493E31.2Very low34.3Very low169 Ų169144.6 Ų144.679%0.7976%0.762SS**  trans46.8103.9162.6-71.7169.2135.800122.3
494S35.2Very low33.1Very low114 Ų114152 Ų15280%0.79778%0.779SS**  27.990.9117-177.90000118.9
495P33.8Very low32Very low123 Ų123155.2 Ų155.280%0.79978%0.784SS**  trans-76.6133.9158.5-1128.3000111.4
496C31.3Very low31.9Very low118 Ų118151.5 Ų151.580%0.79778%0.78SS**  trans-76.7144.4162.1-178.80000109.6
497E27Very low31.5Very low126 Ų126150 Ų15059%0.58978%0.776SS**  -179.2149.7124.5-101.3-168.7174.600115.3
498R29.6Very low31.3Very low191 Ų191148 Ų14872%0.72177%0.769SS**  trans48.4123.4144-61.8172-172.6151.32.2118.5
499S39.7Very low31.2Very low111 Ų111145.6 Ų145.678%0.77676%0.758SS**  55.112768.9-560000112.5
500P34.2Very low31Very low101 Ų101143.1 Ų143.166%0.65675%0.753SS**  -145.8144.791.237.2-22.1000115.5M502P500-M502 HydrophobicContact CB-CE 4.3Å; P500-M502 HydrophobicContact CB-CG 4.21Å; P500-M502 HydrophobicContact CG-CG 4.35Å
501C28.8Very low31.1Very low132 Ų132140.1 Ų140.189%0.89275%0.746SS**PPolyproline II helixtrans-85118.1146.2-179.90000106.4
502M29.2Very low31.4Very low158 Ų158140.8 Ų140.878%0.77875%0.75SS**PPolyproline II helixtrans-95.7140.8177.7-89.4-63.7169.500112.3P500P500-M502 HydrophobicContact CB-CE 4.3Å; P500-M502 HydrophobicContact CB-CG 4.21Å; P500-M502 HydrophobicContact CG-CG 4.35Å
503Q27.8Very low31.5Very low168 Ų168141 Ų14179%0.78575%0.746SS**PPolyproline II helixtrans-82.3157.7179.8-174.7172.9-1800109.9
504W30.6Very low31.6Very low245 Ų245142.3 Ų142.393%0.92875%0.75SS**  trans-120.1155.6156.7-91.8100.9000109.8
505E28.5Very low31.6Very low181 Ų181141.8 Ų141.885%0.84675%0.746SS**  trans-128.3152.4-156.7176.4175.6-140.600109.7
506G31.5Very low31.9Very low62 Ų62142 Ų14264%0.63975%0.748SS**  trans161.584.2174.300000116
507Q31.7Very low31.9Very low171 Ų171144.1 Ų144.180%0.79975%0.751SS**  trans61.5138.3138.2-71-173.6-63.600120.1
508E32.1Very low32.1Very low144 Ų144141.6 Ų141.667%0.67375%0.752SS**  cis-166.1176.3-8.3-155.7164.9-101.400110.5
509L33.1Very low32.2Very low130 Ų130137.6 Ų137.668%0.68175%0.753SS**  trans76.2111.1162.8-56.6178.8000120.2
510N29.3Very low31.9Very low135 Ų135136.6 Ų136.672%0.72275%0.751SS**  65.4133.3125.9-73.13.7000121.3
511T31.2Very low31.7Very low103 Ų103139.8 Ų139.863%0.63276%0.757SS**  cis-173.1150.6-7.95.70000110.2
512Q34.4Very low31.7Very low159 Ų159140.6 Ų140.674%0.74375%0.748SS**  trans67.6143.7152.7-51.9-90.441.200116.3
513L32.4Very low31.9Very low120 Ų120139 Ų13963%0.62875%0.747SS**  cis-156.3142-6-99.4156.4000111.3
514F32.5Very low33.2Very low197 Ų197136.3 Ų136.386%0.86474%0.744SS**  trans59.4161.8155.7-76-58.9000123.5
515S34.7Very low33.3Very low102 Ų102131.3 Ų131.371%0.71374%0.741SS**  trans-113.9159.8-160.5-25.30000113.4
516P41.4Very low33.6Very low129 Ų129127.6 Ų127.684%0.83873%0.734SS**  trans-83.9157.9151.335.6-31.6000111.2
517N31.1Very low34.3Very low161 Ų161129.7 Ų129.786%0.86174%0.737SS**  trans-143.3160.9173.8-168.415000110.2
518A31Very low34.3Very low74 Ų74129 Ų12961%0.61273%0.733SS**  trans72113.8162.700000120.3
519S31.7Very low34.4Very low107 Ų107128.4 Ų128.475%0.74874%0.735SS**  60.2107.2125.866.80000123
520A32.2Very low34.6Very low90 Ų90129.8 Ų129.874%0.74474%0.742SS**  67.6129.6105.200000123.5
521Q30.6Very low34.9Very low167 Ų167130.2 Ų130.278%0.7874%0.743SS**  trans86.8149.4134.7-115.6-179.2-67.200122.8
522E29Very low35Very low150 Ų150130.5 Ų130.570%0.70175%0.745SS**  trans69.2129.3165.2-55.9-55.312600121.5
523V34.2Very low35Very low124 Ų124127.6 Ų127.675%0.75274%0.743SS**  trans-85.2179.6165.1-103.10000110.1
524P54.4Low35Very low112 Ų112126.4 Ų126.473%0.72774%0.744SS**  cis-131.3-147.8-30.332.8-11.4000111.3
525V31.5Very low35.2Very low140 Ų140124 Ų12485%0.84874%0.74SS**  trans94.1138.9163-169.50000117
526S36.2Very low35.3Very low102 Ų102125.9 Ų125.971%0.71374%0.741SS**  trans-118.4154-179.8-172.30000109.3
527P46.2Very low35Very low107 Ų107123.8 Ų123.870%0.69573%0.729SS**  -156.3173.497.641.3-22.6000118.2
528H31.7Very low35.3Very low157 Ų157124.5 Ų124.573%0.72773%0.727SS**  trans68.7104.7153.9-80.9-64000123.1
529D34.8Very low35.5Very low131 Ų131128.4 Ų128.470%0.70174%0.738SS**  49.3130.9117.4-55.1-17.1000123.7
530L36.4Very low35.6Very low158 Ų158125.6 Ų125.683%0.82773%0.726SS**  174.7141.4105.4-78.4-177000105.6
531L35.6Very low35.7Very low144 Ų144130.5 Ų130.575%0.75473%0.733SS**  cis-162.9168.71.9-104.9168.9000106.6
532T33.6Very low36Very low109 Ų109132.2 Ų132.267%0.66974%0.738SS**  cis-160.2166.13.1-178.60000109.9
533S33.4Very low36.8Very low99 Ų99130.1 Ų130.169%0.69274%0.738SS**  trans71.4143.2155-55.30000119.6
534S32.2Very low36.7Very low95 Ų95134.5 Ų134.566%0.66474%0.742SS**  cis-173135.1-26.9-1090000110.7
535L37.6Very low35.7Very low147 Ų147138 Ų13877%0.7775%0.748SS**  trans47.8132.6133.6-57.9176.6000119.9
536L36.1Very low35.8Very low141 Ų141138.4 Ų138.474%0.73875%0.745SS**  cis-158.4146.17.2-90.2151.1000107.1
537S36.3Very low36.5Very low84 Ų84138.5 Ų138.559%0.58774%0.744SS**  64.9150.973.2-53.90000115.3
538E36.3Very low35.7Very low176 Ų176141.1 Ų141.182%0.82275%0.746SS**  cis-178.6158.6-23.5-102.3146.167.200106.6
539D36.4Very low35.7Very low156 Ų156143 Ų14383%0.83475%0.747SS**  cis-128.9-109-9.6178.731.2000108.2
540G33.3Very low35.4Very low49 Ų49141.3 Ų141.351%0.50574%0.738SS.*  cis173162.5-15.400000117.4
541H34Very low35.2Very low192 Ų192140.1 Ų140.189%0.88973%0.73SS**  trans66166.2169.5-57.3-56.8000120.8
542K36.2Very low34.9Very low203 Ų203141.2 Ų141.288%0.88374%0.736SS**  trans-113.8-176.5-173.6-46.8176-177.7174.50109.5
543P46.2Very low34.9Very low107 Ų107141 Ų14170%0.69574%0.739SS**  cis-140.6-153.53.145.3-24.3000115
544Y32.4Very low35.9Very low215 Ų215141.5 Ų141.584%0.84374%0.74SS**  trans-20.1130.2176-48.7-84.5000119.9
545H32.6Very low36Very low185 Ų185144.7 Ų144.786%0.85675%0.749SS**  -174.9150.8115.5-115.5-87.4000114.7
546L34.8Very low35.9Very low149 Ų149145.2 Ų145.278%0.7875%0.747SS**  trans-99.9150.7150.1-96.7161.8000106.7
547P49.5Very low35.8Very low105 Ų105145 Ų14568%0.68274%0.743SS**  -157175.463.542.8-21.9000118.9
548H30.4Very low35.6Very low161 Ų161147.5 Ų147.575%0.74575%0.745SS**  trans38.4130.8144.3-82-74.3000124.6
549R31.1Very low35.5Very low196 Ų196146.3 Ų146.374%0.7474%0.739SS**  trans70.4161.7138.8-83.9175.9164.9-121.98.5117.5
550D28.6Very low35.2Very low96 Ų96146.2 Ų146.251%0.51374%0.738SS.*  cis-149.7170.93.7-129.2-28.3000113.5
551M31.9Very low35.1Very low134 Ų134149.2 Ų149.266%0.6675%0.751SS**  trans35.7125.3154.1-56.7-57.9168.500122
552N30.3Very low36.3Very low166 Ų166145 Ų14589%0.88874%0.741SS**  -171148.199.7-97.5-31.9000114.3
553S34.3Very low36.1Very low106 Ų106146.8 Ų146.874%0.74174%0.742SS**  trans-152.2154.1170.4176.40000108.2
554P54.2Low35.4Very low109 Ų109150.3 Ų150.371%0.70875%0.75SS**  trans-147138.7133.833.5-17.1000116.1
555L34.3Very low36.5Very low162 Ų162145.3 Ų145.385%0.84874%0.743SS**  trans61.7144.9144.4-64.7160.6000117.9
556Q35.1Very low36.5Very low157 Ų157140.7 Ų140.773%0.73474%0.737SS**  cis-161.614646.3-173.4162.2-2.400113.4
557Q32.7Very low36.3Very low137 Ų137141 Ų14164%0.6475%0.745SS**  trans23.2147.1151.7-61.5169.9-63.200122.1
558Q32.4Very low35.5Very low136 Ų136142.2 Ų142.264%0.63676%0.755SS**  cis-163.5158.7-5-120.6168.9-65.800112.2
559Q35.1Very low35.5Very low151 Ų151137.7 Ų137.771%0.70675%0.752SS**  trans8.5144.4150.5-63.2165.1-5300120.3
560L29.7Very low35.8Very low155 Ų155137.8 Ų137.881%0.81276%0.758SS**  -152.117650.2-79.4166.9000114.7
561S32.2Very low36.5Very low112 Ų112139.6 Ų139.678%0.78377%0.772SS**  trans-152.3-173.1170.5-43.90000108
562P59Low36.7Very low103 Ų103141.8 Ų141.867%0.66978%0.781SS**  cis-128.5-145.8-13.543.6-26.4000111.5
563W31.5Very low36.9Very low241 Ų241141.9 Ų141.991%0.91378%0.776SS**  trans141.8150.4144.9-77.3106.4000114.1
564E32.1Very low36.9Very low181 Ų181144 Ų14485%0.84677%0.774SS**  trans-110.6-143.9-172.9-67.1-170.7107.900113.2
565P54.6Low36Very low109 Ų109146.1 Ų146.171%0.70878%0.778SS**  -128.4-178.8-94.639.7-23.3000117
566A31.8Very low36Very low89 Ų89145.8 Ų145.874%0.73678%0.776SS**  trans74.1136149.200000122.1
567T31.3Very low35.9Very low154 Ų154142.9 Ų142.995%0.94578%0.779SS**  trans-169.9173.7142.37.70000111.7
568C32.5Very low35.9Very low132 Ų132142.4 Ų142.489%0.89279%0.791SS**  trans-146.1148.2-168.8179.60000113.8
569G30.9Very low36Very low66 Ų66144.3 Ų144.368%0.6880%0.8SS**  trans165.3144.6163.700000110.8
570K37.5Very low36Very low198 Ų198145.3 Ų145.386%0.86181%0.805SS**  cis113.9111.115-95.4-154.7169.9-1630112.4
571T42.2Very low36.1Very low133 Ų133143.1 Ų143.182%0.81679%0.793SS**  trans163.4131.1154.236.90000106.4
572E36.8Very low36.5Very low180 Ų180146.5 Ų146.584%0.84180%0.797SS**  cis60.6126.247.6-66.8172.6147.500111.9
573E34.7Very low35.7Very low169 Ų169150.6 Ų150.679%0.7980%0.804SS**  cis-144.4-177.314.9-99.1-149.2110.500109.5
574H35.1Very low36Very low149 Ų149149.8 Ų149.869%0.6980%0.802SS**  cis175-148-28.2-174.4-166.8000108.1
575I35.3Very low36.3Very low155 Ų155148.3 Ų148.380%0.79580%0.799SS**  trans74.6161.8171-60.7178.2000116.8
576L33.7Very low35.2Very low154 Ų154149.8 Ų149.881%0.80680%0.801SS**  trans-124.8159.4-144.4-83.4157.8000116.8
577A32.1Very low35.5Very low97 Ų97151.8 Ų151.880%0.80280%0.804SS**  trans70.2119.8146.400000121.8
578S34.5Very low35.8Very low127 Ų127154.2 Ų154.289%0.88880%0.797SS**  -163.2165.8105-160.70000111.4
579E34.3Very low36.7Very low175 Ų175153.7 Ų153.782%0.81879%0.792SS**  trans-91.3149-174.9-57.2177.1100.700113.8
580Q34.1Very low37Very low173 Ų173157 Ų15781%0.80880%0.8SS**  174.9150.5117.5-97.1-178.437.800114.9
581N32.9Very low37.5Very low108 Ų108159.1 Ų159.158%0.57880%0.802SS**  trans45.3112.2151.7-72.4-55.8000120.6
582H40Very low37.8Very low184 Ų184158.3 Ų158.385%0.85280%0.797SS**  -170.2174.986.4-93.2108.3000112.9
583K42.4Very low37.9Very low188 Ų188157.7 Ų157.782%0.81780%0.799SS**  trans-109.7157.9-169.7-66.6172.7-178.8170.60112.9
584Y37.6Very low38.3Very low224 Ų224155.5 Ų155.588%0.87880%0.797SS**  trans-41.1137.2170.4-64.7-97000114.5
585I39.1Very low38.8Very low151 Ų151160.7 Ų160.777%0.77482%0.824SS**  trans-129.9111.9157.8-63.5-178.4000108.3T587I585-T587 HydrophobicContact CG2-CG2 4.38Å
586N31.4Very low39Very low140 Ų140161 Ų16175%0.74983%0.826SS**  trans-87.7129.8162-88.2-30.9000108.4
587T37.6Very low39.2Very low131 Ų131161.3 Ų161.380%0.80483%0.827SS**  trans-95.9114.6174.535.10000111.3I585I585-T587 HydrophobicContact CG2-CG2 4.38Å
588Y36.9Very low39.6Very low204 Ų204164.9 Ų164.980%0.883%0.828SS**  trans-115.1143.4163.9-80.2-81.3000109.6
589P50.8Low39.9Very low122 Ų122167.1 Ų167.179%0.79282%0.824SS**  trans-85.3139.3-169.632.7-35.2000113.5
590T37.3Very low40.3Very low136 Ų136166.6 Ų166.683%0.83483%0.825SS**  trans-91.1133.6171.7-540000110.7
591R47.8Very low40.7Very low242 Ų242166.2 Ų166.291%0.91383%0.826SS**  trans-142.1102.2157.1-161.1169.1-173.7169.62.1113
592T49.3Very low41.3Very low116 Ų116170.4 Ų170.471%0.71284%0.844SS**  trans5.3122.4155.4-44.80000118.9
593L39.4Very low41.4Very low166 Ų166169.3 Ų169.387%0.86984%0.843SS**  trans-80.8141.5153.9-119163.5000109.2
594V42.6Very low41.3Very low124 Ų124167.8 Ų167.875%0.75285%0.845SS**  trans-105.4145.4167.4179.50000107.8
595M45.4Very low41.6Very low257 Ų257162.6 Ų162.6100%1.26684%0.842SS**  trans-86.70-179.4-62.7179.167.800112

Retrieved 595 of 595 residues in 442.6 ms (Link to these results)