X2JE28_DROME Loading...

CG9919-PA

AlphaFold DB , UniProt , Accession X2JE28, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG9919, Length 317 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.8Very low41.8Very low247 Ų247147.5 Ų147.5100%1.21783%0.833SS**  0134.10-142.4173.1-157.200107.4
2M36.8Very low41.4Very low168 Ų168144.9 Ų144.983%0.82883%0.831SS**  trans-61.1149.4-166.8-61.2134.3125.300114.5
3N34.4Very low42.3Very low149 Ų149144.1 Ų144.180%0.79784%0.837SS**  177.8129.896.6-90.2-41.5000112.3
4M46.5Very low43Very low162 Ų162144.1 Ų144.180%0.79883%0.832SS**  trans-66.1147.3155.3-85.6-162.5166.300110.1
5L44.4Very low43.9Very low170 Ų170146.7 Ų146.789%0.8983%0.834SS**  trans-155132.4146-104.7149.3000109.9
6F47.3Very low44.6Very low187 Ų187148.9 Ų148.982%0.8284%0.842SS**  trans-65.1151.2-174.5-78.9-107.3000113.9
7G39.8Very low45.1Very low69 Ų69146.9 Ų146.971%0.71185%0.847SS**  trans-162.996.5167.500000112.5C9G7-C9 PolarHBondContact O-N 3.32Å
8N45.3Very low46Very low147 Ų147142.2 Ų142.279%0.78684%0.836SS**  trans-58.9125.8171.2-76.4-8.6000111.4
9C43.7Very low46.8Very low130 Ų130141.1 Ų141.188%0.87883%0.834SS**  trans-11685.8158.3-640000108.2G7 G11G7-C9 PolarHBondContact O-N 3.32Å; C9-G11 PolarHBondContact O-N 3.16Å
10V44.7Very low47.2Very low131 Ų131139 Ų13979%0.79482%0.824SS**  trans-57102.1161.1172.90000106.9S12V10-S12 PolarHBondContact O-N 3.25Å
11G43.7Very low47.9Very low62 Ų62136.4 Ų136.464%0.63981%0.811SS**  trans-69.2120173.100000109.5C9 C13C9-G11 PolarHBondContact O-N 3.16Å; G11-C13 PolarHBondContact O-N 3.29Å
12S38Very low49Very low117 Ų117131.1 Ų131.182%0.81879%0.788SS**  trans-54117.5176-74.90000111.7V10 D14V10-S12 PolarHBondContact O-N 3.25Å; S12-D14 PolarHBondContact O-N 3.38Å; S12-D14 VanDerWaalsContact O-N 3.15Å
13C52.2Low49.8Very low134 Ų134130.6 Ų130.691%0.90578%0.781SS**SBendtrans-82.949.5170.6-67.80000111.8G11G11-C13 PolarHBondContact O-N 3.29Å
14D52.6Low50.7Low144 Ų144129 Ų12977%0.7777%0.772SS**  trans-138.329-171.5-136-1.6000114.9S12S12-D14 PolarHBondContact O-N 3.38Å; S12-D14 VanDerWaalsContact O-N 3.15Å
15Q56.9Low51Low184 Ų184128.8 Ų128.886%0.8677%0.773SS**  trans-161.669.5173.1-128.9157.146.800113.4
16L54.5Low51.6Low182 Ų182124.6 Ų124.695%0.95376%0.758SS**  trans-155.398150.6-123.975.1000108.1
17A53.6Low52.1Low114 Ų114121.6 Ų121.694%0.94275%0.748SS**  trans-71.8132.6-172.100000113
18G61.7Low53.4Low63 Ų63123.7 Ų123.765%0.64975%0.749SS**  trans139.9127.5158.200000112.9
19P60.9Low54.5Low121 Ų121122.2 Ų122.279%0.78675%0.747SS**PPolyproline II helixtrans-58.4141.1168.125.5-31.4000109.1
20P54.8Low55.4Low98 Ų98121.4 Ų121.464%0.63674%0.74SS**PPolyproline II helixtrans-56.2136.1176.524.6-32.6000108.5D22P20-D22 PolarHBondContact O-N 3.46Å
21P60.3Low56.2Low86 Ų86121.3 Ų121.356%0.55874%0.742SS**PPolyproline II helixtrans-62.6137.1-174.925.8-34.3000110.7F23P21-F23 HydrophobicContact CB-CD2 3.77Å; P21-F23 HydrophobicContact CB-CE2 4.3Å; P21-F23 HydrophobicContact CG-CD2 4.49Å; P21-F23 PolarHBondContact O-N 2.92Å
22D55.9Low56.7Low136 Ų136123.9 Ų123.973%0.72774%0.741SS**G310 helixtrans-639.5-178.2-68.4-46000114.7P20 I24 L25P20-D22 PolarHBondContact O-N 3.46Å; D22-I24 PolarHBondContact O-N 3.48Å; D22-L25 PolarHBondContact O-N 3.47Å
23F54.3Low57.4Low157 Ų157122.2 Ų122.269%0.68973%0.727SS**G310 helixtrans-71-7.2175.4-64.9-64.2000114P21 L25 S26P21-F23 HydrophobicContact CB-CD2 3.77Å; P21-F23 HydrophobicContact CB-CE2 4.3Å; P21-F23 HydrophobicContact CG-CD2 4.49Å; P21-F23 PolarHBondContact O-N 2.92Å; F23-L25 VanDerWaalsContact C-N 3.33Å; F23-S26 WeakPolarHBondContact CA-OG 3.44Å; F23-S26 PolarHBondContact O-N 3.01Å; F23-S26 PolarHBondContact O-OG 3.23Å
24I53.3Low57.6Low116 Ų116120.2 Ų120.260%0.59572%0.715SS**G310 helixtrans-73.6-26173.6-61.4171000111.6D22 S26 M27D22-I24 PolarHBondContact O-N 3.48Å; I24-S26 VanDerWaalsContact C-N 3.26Å; I24-S26 PolarHBondContact O-N 2.89Å; I24-M27 HydrophobicContact CB-CE 4.15Å; I24-M27 HydrophobicContact CG1-CE 4Å; I24-M27 HydrophobicContact CG2-CE 4.05Å
25L53.8Low57.8Low157 Ų157122.4 Ų122.482%0.82272%0.718SS**G310 helixtrans-76.2-13.3175.9-76.5162.5000113.4D22 F23D22-L25 PolarHBondContact O-N 3.47Å; F23-L25 VanDerWaalsContact C-N 3.33Å
26S56Low57.5Low82 Ų82119.4 Ų119.457%0.57371%0.707SS**G310 helixtrans-98.8-0.6178.138.30000114.2F23 I24 P28F23-S26 WeakPolarHBondContact CA-OG 3.44Å; F23-S26 PolarHBondContact O-N 3.01Å; F23-S26 PolarHBondContact O-OG 3.23Å; I24-S26 VanDerWaalsContact C-N 3.26Å; I24-S26 PolarHBondContact O-N 2.89Å; S26-P28 WeakPolarHBondContact O-CD 3.48Å
27M57.7Low57.5Low123 Ų123116.1 Ų116.161%0.60669%0.69SS**SBendtrans-76.3120.8170.8-79.8-173.8-80.500109.2I24I24-M27 HydrophobicContact CB-CE 4.15Å; I24-M27 HydrophobicContact CG1-CE 4Å; I24-M27 HydrophobicContact CG2-CE 4.05Å
28P66.8Low57.3Low114 Ų114115 Ų11574%0.7468%0.675SS**PPolyproline II helixtrans-59.6134.8169.925.5-31.7000108.1S26S26-P28 WeakPolarHBondContact O-CD 3.48Å
29P68.2Low56.5Low116 Ų116120.6 Ų120.675%0.75368%0.681SS**PPolyproline II helixtrans-56.7139.9178.323.2-32.3000109.2
30P62.4Low55.9Low112 Ų112118.8 Ų118.873%0.72767%0.67SS**PPolyproline II helixtrans-56.2140.7179.223.1-32.5000109.6L32P30-L32 PolarHBondContact O-N 2.79Å
31P63.3Low55.6Low129 Ų129118.8 Ų118.884%0.83868%0.677SS**PPolyproline II helixtrans-57.8126.3178.423.6-32.3000109.1
32L53.5Low54.9Low116 Ų116120.4 Ų120.461%0.60769%0.686SS**PPolyproline II helixtrans-58140.1178.9-70.8160.6000109.6P30 L36P30-L32 PolarHBondContact O-N 2.79Å; L32-L36 HydrophobicContact CD2-CD1 3.94Å
33P53.5Low54.5Low82 Ų82119 Ų11953%0.53268%0.682SS.*PPolyproline II helixtrans-58.4143.2175.624.3-32.7000110.1F35 L36P33-F35 HydrophobicContact CB-CD2 4.46Å; P33-F35 PolarHBondContact O-N 2.95Å; P33-L36 PolarHBondContact O-N 2.98Å
34S55.1Low54.1Low93 Ų93118.7 Ų118.765%0.6569%0.687SS**THydrogen-bonded Turntrans-55.9-4.4-173.642.10000116.3
35F56.2Low53.9Low189 Ų189120.8 Ų120.883%0.82970%0.698SS**THydrogen-bonded Turntrans-84-17.4175.4-57.2-75.6000114P33P33-F35 HydrophobicContact CB-CD2 4.46Å; P33-F35 PolarHBondContact O-N 2.95Å
36L52.5Low53.5Low121 Ų121120 Ų12063%0.63469%0.694SS**SBendtrans-94.3-14.1174.5-69.5173.3000113L32 P33 S38L32-L36 HydrophobicContact CD2-CD1 3.94Å; P33-L36 PolarHBondContact O-N 2.98Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 2.83Å
37I53.6Low52.8Low114 Ų114122.4 Ų122.459%0.58571%0.705SS**  trans-81.286.4170-66.2150.8000106.3K39I37-K39 PolarHBondContact O-N 2.94Å
38S49Very low52.1Low90 Ų90122 Ų12263%0.62971%0.711SS**  trans-62.891.9164.450.70000107.1L36 P40L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 2.83Å; S38-P40 WeakPolarHBondContact O-CD 3.35Å
39K46.1Very low51.1Low180 Ų180121.8 Ų121.878%0.78371%0.713SS**  trans-57.5108.2170.8-178167.9179.5163.30107I37 A41I37-K39 PolarHBondContact O-N 2.94Å; K39-A41 PolarHBondContact O-N 3.23Å; K39-A41 VanDerWaalsContact O-N 3.11Å
40P47.6Very low49.9Very low84 Ų84122.6 Ų122.655%0.54571%0.711SS.*  trans-69.3114.2168.930.4-28.8000105.5S38 T42 V43S38-P40 WeakPolarHBondContact O-CD 3.35Å; P40-T42 PolarHBondContact O-N 3.13Å; P40-V43 HydrophobicContact CB-CG2 3.96Å; P40-V43 HydrophobicContact CG-CG2 3.88Å
41A47.6Very low49.3Very low97 Ų97125.7 Ų125.780%0.80272%0.716SS**SBendtrans-69.610.5176.900000112.9K39K39-A41 PolarHBondContact O-N 3.23Å; K39-A41 VanDerWaalsContact O-N 3.11Å
42T47.1Very low48.4Very low121 Ų121124.9 Ų124.974%0.74271%0.713SS**  trans-152.667.1-172.754.70000110.6P40P40-T42 PolarHBondContact O-N 3.13Å
43V47.7Very low48.2Very low105 Ų105128.1 Ų128.164%0.63673%0.725SS**  trans-13849.7156.4-161.50000108.7P40P40-V43 HydrophobicContact CB-CG2 3.96Å; P40-V43 HydrophobicContact CG-CG2 3.88Å
44D44.4Very low48Very low151 Ų151129.5 Ų129.581%0.80773%0.734SS**SBendtrans-95.8134.8142.5-79.7-45.8000104.4
45I49.9Very low47.4Very low161 Ų161130.5 Ų130.583%0.82674%0.74SS**SBendtrans87.167-175.2-41.1155.2000113.4
46L45.6Very low47.2Very low141 Ų141130.4 Ų130.474%0.73874%0.739SS**SBend175129.3108.9-127.974.1000111.1
47V41.7Very low46.8Very low131 Ų131127.4 Ų127.479%0.79473%0.732SS**  trans96.3131.4156.3-173.20000117.5
48P42.6Very low46.7Very low114 Ų114126.5 Ų126.574%0.7474%0.741SS**  trans-88.8154.8-17120-0.8000112.6N50P48-N50 PolarHBondContact O-N 3.08Å
49S45.3Very low46.9Very low110 Ų110131.7 Ų131.777%0.76975%0.753SS**  trans-15.5115.6161.6-177.30000116.8
50N42.8Very low46.9Very low133 Ų133131.3 Ų131.371%0.71176%0.756SS**  -174.8128.8123.5-114.8-41000112.2P48 S52P48-N50 PolarHBondContact O-N 3.08Å; N50-S52 PolarHBondContact O-N 2.97Å
51E50.3Low46.7Very low178 Ų178133 Ų13383%0.83277%0.769SS**SBendtrans45.572.6146.2-58.2-74.6144.200117.3
52S44.7Very low46.2Very low111 Ų111131.8 Ų131.878%0.77677%0.765SS**  trans-171119.314340.70000109.9N50N50-S52 PolarHBondContact O-N 2.97Å
53Q49.4Very low46.1Very low185 Ų185136 Ų13686%0.86478%0.776SS**  trans-58.4129.1172.7-70.5173.6-25.600109.2C55Q53-C55 PolarHBondContact O-N 2.9Å
54P48.6Very low45.7Very low110 Ų110134.7 Ų134.771%0.71478%0.783SS**  trans-70.7106.8172.627.4-30.7000108.5F56P54-F56 PolarHBondContact O-N 3.25Å
55C42.3Very low45.7Very low115 Ų115135.4 Ų135.478%0.77778%0.784SS**  trans-58.1107167.1-94.30000109.5Q53 A57Q53-C55 PolarHBondContact O-N 2.9Å; C55-A57 PolarHBondContact O-N 2.94Å
56F53.2Low45.5Very low186 Ų186134.8 Ų134.882%0.81678%0.778SS**THydrogen-bonded Turntrans-73.216.1176.6-115.5-89.2000114P54P54-F56 PolarHBondContact O-N 3.25Å
57A43.7Very low45.1Very low58 Ų58136.7 Ų136.748%0.47978%0.782SS.*THydrogen-bonded Turntrans-981.7-175.300000114.3C55 F59 M60C55-A57 PolarHBondContact O-N 2.94Å; A57-F59 PolarHBondContact O-N 3.14Å; A57-M60 PolarHBondContact O-N 3.14Å
58A51Low45.1Very low95 Ų95135.4 Ų135.479%0.78577%0.771SS**THydrogen-bonded Turntrans-62-15.4178.700000113.5
59F52.9Low45.3Very low199 Ų199137.4 Ų137.487%0.87377%0.771SS**THydrogen-bonded Turntrans-87.4-10.9176.8-162.4-100.1000114.3A57A57-F59 PolarHBondContact O-N 3.14Å
60M47.2Very low45.1Very low172 Ų172138.1 Ų138.185%0.84778%0.776SS**THydrogen-bonded Turntrans-109.6-5.2-177.1-63.1-159.581.500114.8A57 G62A57-M60 PolarHBondContact O-N 3.14Å; M60-G62 PolarHBondContact O-N 3.28Å
61C43.5Very low44.9Very low120 Ų120134.3 Ų134.381%0.81177%0.768SS**SBendtrans-89.791.2173.3-87.30000111.7
62G36.5Very low44.8Very low71 Ų71133.6 Ų133.673%0.73277%0.77SS**  trans79.7106.1131.100000118.7M60 G64M60-G62 PolarHBondContact O-N 3.28Å; G62-G64 PolarHBondContact O-N 3.43Å
63H45Very low44.9Very low211 Ų211133.1 Ų133.198%0.97777%0.772SS**  trans-57.5123.5147.6-90.953.7000110.1
64G38.1Very low44.8Very low76 Ų76131.6 Ų131.678%0.78477%0.769SS**  trans-163.3107.7173.900000111.3G62G62-G64 PolarHBondContact O-N 3.43Å
65M45Very low44.7Very low167 Ų167133.1 Ų133.182%0.82377%0.769SS**  trans-30.1147.4177.1-68.7-108.274.300119.2
66Q46.8Very low45Very low148 Ų148135.3 Ų135.369%0.69277%0.767SS**  trans71.1105.1145.3-68.6-90.413.600118.6
67H37.3Very low44.7Very low180 Ų180133.6 Ų133.683%0.83377%0.766SS**  -154.2130.7124.2-155.3-78.8000110.8
68N40.8Very low45Very low104 Ų104134.7 Ų134.756%0.55677%0.766SS**  trans-57158.9173.7-74.9-28.1000113.1
69E47.1Very low44.7Very low157 Ų157141.2 Ų141.273%0.73477%0.771SS**  trans69.2122.9137.166.4-153.1112.200120.9
70S40.9Very low44.7Very low125 Ų125134.7 Ų134.787%0.87475%0.75SS**  trans90.4112.8152.675.90000117.9
71G37.7Very low45.2Very low53 Ų53131.3 Ų131.355%0.54674%0.735SS.*  trans121.283.5148.700000115.5A73G71-A73 VanDerWaalsContact C-N 3.3Å; G71-A73 PolarHBondContact O-N 3.47Å
72N48.3Very low46.1Very low163 Ų163128.8 Ų128.887%0.87272%0.719SS**  trans38.940.9130.459.8-10.6000120.1L74N72-L74 PolarHBondContact O-N 3.17Å
73A47.8Very low47.4Very low100 Ų100132.1 Ų132.183%0.82671%0.713SS**  trans-78.172.2155.100000108.9G71 M75G71-A73 VanDerWaalsContact C-N 3.3Å; G71-A73 PolarHBondContact O-N 3.47Å; A73-M75 PolarHBondContact O-N 3.01Å
74L46.4Very low48.3Very low153 Ų153125.4 Ų125.480%0.80169%0.69SS**  trans-55.8124.8175.5-170.8145.8000109.1N72N72-L74 PolarHBondContact O-N 3.17Å
75M48.3Very low49.6Very low143 Ų143125.8 Ų125.870%0.70467%0.674SS**  trans74.764.5163.9-146.114610800114.2A73 L77A73-M75 PolarHBondContact O-N 3.01Å; M75-L77 PolarHBondContact O-N 3.31Å
76E47.8Very low51Low160 Ų160123.1 Ų123.175%0.74866%0.659SS**  -17.789115.6-163.6-175.8177.600110.2V78E76-V78 HydrophobicContact CB-CG2 4.45Å; E76-V78 HydrophobicContact CG-CG2 3.65Å; E76-V78 PolarHBondContact O-N 2.73Å
77L46.2Very low52.5Low150 Ų150119.6 Ų119.679%0.78565%0.651SS**  trans-66.685.8148.6-97.497.5000103.4M75 R79M75-L77 PolarHBondContact O-N 3.31Å; L77-R79 PolarHBondContact O-N 3.38Å
78V50Low54.8Low81 Ų81114.8 Ų114.849%0.49163%0.634SS.*  trans-41.791.5145.8175.50000103.7E76 S80E76-V78 HydrophobicContact CB-CG2 4.45Å; E76-V78 HydrophobicContact CG-CG2 3.65Å; E76-V78 PolarHBondContact O-N 2.73Å; V78-S80 PolarHBondContact O-N 3.32Å
79R45.3Very low57.1Low233 Ų233118.6 Ų118.688%0.87964%0.64SS**  trans-64.181.5151.7-171.4169.7-177.888-1.1101.4L77 D81L77-R79 PolarHBondContact O-N 3.38Å; R79-D81 PolarHBondContact O-N 3.25Å
80S53.2Low58.8Low61 Ų61116.9 Ų116.943%0.42764%0.636SS.*  trans-59.391.8169.830.70000102.5V78 S82 L85V78-S80 PolarHBondContact O-N 3.32Å; S80-S82 PolarHBondContact O-N 2.9Å; S80-L85 VanDerWaalsContact CB-CD1 3.44Å
81D57.8Low61Low101 Ų101117.8 Ų117.854%0.5462%0.624SS.*  trans-54105.3168.2-155.3-7.7000102.7R79 K83 S84 L85R79-D81 PolarHBondContact O-N 3.25Å; D81-K83 PolarHBondContact O-N 3.34Å; D81-S84 WeakPolarHBondContact O-CA 3.22Å; D81-S84 WeakPolarHBondContact O-CB 3.48Å; D81-S84 PolarHBondContact O-N 3.19Å; D81-L85 PolarHBondContact O-N 3.36Å
82S60.9Low63.5Low68 Ų68118.3 Ų118.348%0.47662%0.617SS.*Hα-helixtrans-55.4-29.6-167.655.30000110S80 S84 L85 E86S80-S82 PolarHBondContact O-N 2.9Å; S82-S84 PolarHBondContact O-N 3.26Å; S82-L85 PolarHBondContact O-N 3.48Å; S82-E86 VanDerWaalsContact O-CB 3.28Å; S82-E86 WeakPolarHBondContact O-CB 3.49Å; S82-E86 WeakPolarHBondContact O-CG 3.19Å; S82-E86 PolarHBondContact O-N 2.73Å
83K64.5Low65.5Low141 Ų141114 Ų11461%0.61360%0.599SS**Hα-helixtrans-59.4-39.3171.3-59.8178179.9175.90114.1D81 S87D81-K83 PolarHBondContact O-N 3.34Å; K83-S87 WeakPolarHBondContact O-CB 3.21Å; K83-S87 PolarHBondContact O-N 3.34Å; K83-S87 PolarHBondContact O-OG 3.38Å
84S64.2Low67.6Low70 Ų70112.3 Ų112.349%0.4958%0.582SS.*Hα-helixtrans-71.6-44178-177.40000111.2D81 S82 S87 V88D81-S84 WeakPolarHBondContact O-CA 3.22Å; D81-S84 WeakPolarHBondContact O-CB 3.48Å; D81-S84 PolarHBondContact O-N 3.19Å; S82-S84 PolarHBondContact O-N 3.26Å; S84-S87 WeakPolarHBondContact O-CB 3.47Å; S84-S87 PolarHBondContact O-N 3.48Å; S84-V88 WeakPolarHBondContact O-CG2 3.29Å; S84-V88 PolarHBondContact O-N 2.93Å
85L65.7Low69.9Low84 Ų84107.7 Ų107.744%0.4456%0.562SS.*Hα-helixtrans-66.5-42.9175-67.6-174.1000111.7S80 D81 S82 S87 V88 W89S80-L85 VanDerWaalsContact CB-CD1 3.44Å; D81-L85 PolarHBondContact O-N 3.36Å; S82-L85 PolarHBondContact O-N 3.48Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 2.88Å; L85-V88 PolarHBondContact O-N 3.13Å; L85-V88 VanDerWaalsContact O-N 3.17Å; L85-W89 PolarHBondContact O-N 2.78Å
86E73.8Confident72.2Confident111 Ų111105.7 Ų105.752%0.51955%0.553SS.*Hα-helixtrans-56.5-41.4172-75.7163.7-162.400111.2S82 V88 W89 L90S82-E86 VanDerWaalsContact O-CB 3.28Å; S82-E86 WeakPolarHBondContact O-CB 3.49Å; S82-E86 WeakPolarHBondContact O-CG 3.19Å; S82-E86 PolarHBondContact O-N 2.73Å; E86-V88 PolarHBondContact O-N 3.08Å; E86-W89 PolarHBondContact O-N 3.17Å; E86-L90 WeakPolarHBondContact O-CB 3.07Å; E86-L90 WeakPolarHBondContact O-CG 3.27Å; E86-L90 PolarHBondContact O-N 3.31Å
87S77.9Confident74.4Confident73 Ų73100 Ų10051%0.5154%0.537SS..Hα-helixtrans-64-40176.4-610000112.7K83 S84 L85 L90 F91K83-S87 WeakPolarHBondContact O-CB 3.21Å; K83-S87 PolarHBondContact O-N 3.34Å; K83-S87 PolarHBondContact O-OG 3.38Å; S84-S87 WeakPolarHBondContact O-CB 3.47Å; S84-S87 PolarHBondContact O-N 3.48Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 2.88Å; S87-L90 PolarHBondContact O-N 3.05Å; S87-F91 WeakPolarHBondContact O-CB 3.19Å; S87-F91 PolarHBondContact O-N 3.25Å
88V86.7Confident76.8Confident79 Ų7998.3 Ų98.348%0.47953%0.527SS..Hα-helixtrans-67-43.1174.9174.20000110.9S84 L85 E86 L90 F91 V92S84-V88 WeakPolarHBondContact O-CG2 3.29Å; S84-V88 PolarHBondContact O-N 2.93Å; L85-V88 PolarHBondContact O-N 3.13Å; L85-V88 VanDerWaalsContact O-N 3.17Å; E86-V88 PolarHBondContact O-N 3.08Å; V88-L90 PolarHBondContact O-N 3.45Å; V88-F91 PolarHBondContact O-N 3.4Å; V88-V92 HydrophobicContact CG1-CG2 4.43Å; V88-V92 WeakPolarHBondContact O-CB 3.35Å; V88-V92 VanDerWaalsContact O-CG2 3.27Å; V88-V92 WeakPolarHBondContact O-CG2 3.45Å; V88-V92 PolarHBondContact O-N 3.27Å
89W88.4Confident79Confident184 Ų184101.5 Ų101.570%0.69754%0.535SS*.Hα-helixtrans-65-37.6176-81.3104.5000112.5L85 E86 V92 S93L85-W89 PolarHBondContact O-N 2.78Å; E86-W89 PolarHBondContact O-N 3.17Å; W89-V92 PolarHBondContact O-N 3.03Å; W89-S93 WeakPolarHBondContact O-CB 3.29Å; W89-S93 PolarHBondContact O-N 2.75Å
90L83.9Confident81.4Confident121 Ų12194.7 Ų94.763%0.63452%0.519SS*.Hα-helixtrans-66.8-39.3173.3-73175000111.6E86 S87 V88 S94E86-L90 WeakPolarHBondContact O-CB 3.07Å; E86-L90 WeakPolarHBondContact O-CG 3.27Å; E86-L90 PolarHBondContact O-N 3.31Å; S87-L90 PolarHBondContact O-N 3.05Å; V88-L90 PolarHBondContact O-N 3.45Å; L90-S94 WeakPolarHBondContact O-CB 3.04Å; L90-S94 PolarHBondContact O-N 3.46Å
91F85.6Confident83.5Confident145 Ų14598 Ų9864%0.63653%0.526SS*.Hα-helixtrans-63.6-46.4173.6179-101.8000111.5S87 V88 S94 C95S87-F91 WeakPolarHBondContact O-CB 3.19Å; S87-F91 PolarHBondContact O-N 3.25Å; V88-F91 PolarHBondContact O-N 3.4Å; F91-S94 PolarHBondContact O-N 3.38Å; F91-C95 WeakPolarHBondContact O-CB 3.46Å; F91-C95 PolarHBondContact O-N 3.07Å; F91-C95 PolarHBondContact O-SG 2.85Å
92V90.6Very high85.3Confident63 Ų6394.9 Ų94.938%0.38252%0.517SS..Hα-helixtrans-63.8-44.6177.1172.70000110.9V88 W89 S94 C95 I96V88-V92 HydrophobicContact CG1-CG2 4.43Å; V88-V92 WeakPolarHBondContact O-CB 3.35Å; V88-V92 VanDerWaalsContact O-CG2 3.27Å; V88-V92 WeakPolarHBondContact O-CG2 3.45Å; V88-V92 PolarHBondContact O-N 3.27Å; W89-V92 PolarHBondContact O-N 3.03Å; V92-S94 PolarHBondContact O-N 2.67Å; V92-C95 PolarHBondContact O-N 3.46Å; V92-I96 HydrophobicContact CG1-CD1 3.85Å; V92-I96 WeakPolarHBondContact O-CD1 3.47Å; V92-I96 VanDerWaalsContact O-CG1 3.25Å; V92-I96 WeakPolarHBondContact O-CG1 2.89Å; V92-I96 PolarHBondContact O-N 3.45Å
93S90.8Very high87Confident73 Ų7394.3 Ų94.351%0.5151%0.513SS..Hα-helixtrans-63-40.6176-178.60000111.8W89 I96 G97W89-S93 WeakPolarHBondContact O-CB 3.29Å; W89-S93 PolarHBondContact O-N 2.75Å; S93-I96 PolarHBondContact O-N 2.78Å; S93-G97 PolarHBondContact O-N 2.88Å
94S92.6Very high88.5Confident65 Ų6593.7 Ų93.746%0.45551%0.511SS..Hα-helixtrans-63.5-45.3175.8-177.80000111.5L90 F91 V92 I96 G97 I98L90-S94 WeakPolarHBondContact O-CB 3.04Å; L90-S94 PolarHBondContact O-N 3.46Å; F91-S94 PolarHBondContact O-N 3.38Å; V92-S94 PolarHBondContact O-N 2.67Å; S94-I96 PolarHBondContact O-N 3.47Å; S94-G97 PolarHBondContact O-N 3.29Å; S94-I98 VanDerWaalsContact O-CG1 3.3Å; S94-I98 WeakPolarHBondContact O-CG1 3.24Å; S94-I98 PolarHBondContact O-N 3.21Å
95C94.5Very high89.9Confident56 Ų5694 Ų9438%0.37851%0.507SS..Hα-helixtrans-60.2-43.5175.8-72.50000112.2F91 V92 G97 I98 F99F91-C95 WeakPolarHBondContact O-CB 3.46Å; F91-C95 PolarHBondContact O-N 3.07Å; F91-C95 PolarHBondContact O-SG 2.85Å; V92-C95 PolarHBondContact O-N 3.46Å; C95-G97 VanDerWaalsContact C-N 3.35Å; C95-I98 PolarHBondContact O-N 2.68Å; C95-F99 PolarHBondContact O-N 3.25Å
96I95.4Very high91.3Very high101 Ų10192.3 Ų92.352%0.51851%0.505SS..Hα-helixtrans-65-41.9175.7-64.2160.3000110.2V92 S93 S94 F99 V100V92-I96 HydrophobicContact CG1-CD1 3.85Å; V92-I96 WeakPolarHBondContact O-CD1 3.47Å; V92-I96 VanDerWaalsContact O-CG1 3.25Å; V92-I96 WeakPolarHBondContact O-CG1 2.89Å; V92-I96 PolarHBondContact O-N 3.45Å; S93-I96 PolarHBondContact O-N 2.78Å; S94-I96 PolarHBondContact O-N 3.47Å; I96-F99 PolarHBondContact O-N 3.21Å; I96-V100 HydrophobicContact CG2-CG2 4.32Å; I96-V100 WeakPolarHBondContact O-CG2 3.4Å; I96-V100 PolarHBondContact O-N 3.34Å
97G95.1Very high92.2Very high40 Ų4092.4 Ų92.441%0.41251%0.508SS..Hα-helixtrans-60.3-45.8176.700000112.7S93 S94 C95 F99 V100 F101S93-G97 PolarHBondContact O-N 2.88Å; S94-G97 PolarHBondContact O-N 3.29Å; C95-G97 VanDerWaalsContact C-N 3.35Å; G97-F99 VanDerWaalsContact C-N 3.33Å; G97-F99 PolarHBondContact O-N 3.14Å; G97-V100 PolarHBondContact O-N 3.24Å; G97-F101 WeakPolarHBondContact O-CB 3.24Å; G97-F101 PolarHBondContact O-N 2.71Å
98I96.3Very high92.8Very high115 Ų11592.2 Ų92.259%0.5950%0.501SS*.Hα-helixtrans-63.6-40.4176.7-66163.3000110.6S94 C95 G102S94-I98 VanDerWaalsContact O-CG1 3.3Å; S94-I98 WeakPolarHBondContact O-CG1 3.24Å; S94-I98 PolarHBondContact O-N 3.21Å; C95-I98 PolarHBondContact O-N 2.68Å; I98-G102 PolarHBondContact O-N 3.27Å
99F96.4Very high93Very high148 Ų14893 Ų9365%0.64951%0.505SS*.Hα-helixtrans-64-48.4177-174.5-97.3000111.8C95 I96 G97 G102 C103C95-F99 PolarHBondContact O-N 3.25Å; I96-F99 PolarHBondContact O-N 3.21Å; G97-F99 VanDerWaalsContact C-N 3.33Å; G97-F99 PolarHBondContact O-N 3.14Å; F99-G102 PolarHBondContact O-N 3.49Å; F99-C103 PolarHBondContact O-N 3.48Å; F99-C103 PolarHBondContact O-SG 2.98Å; F99-C103 VanDerWaalsContact O-SG 3.35Å
100V96.3Very high93Very high89 Ų8989.4 Ų89.454%0.53950%0.498SS..Hα-helixtrans-64.2-43.8178.5173.70000111.1I96 G97 C103 F104I96-V100 HydrophobicContact CG2-CG2 4.32Å; I96-V100 WeakPolarHBondContact O-CG2 3.4Å; I96-V100 PolarHBondContact O-N 3.34Å; G97-V100 PolarHBondContact O-N 3.24Å; V100-C103 PolarHBondContact O-N 3.15Å; V100-F104 WeakPolarHBondContact O-CB 3.37Å; V100-F104 PolarHBondContact O-N 3.26Å
101F96.1Very high93.1Very high130 Ų13091.5 Ų91.557%0.5750%0.497SS*.Hα-helixtrans-64.7-40.6176.9-175.5-107.6000111.8G97 F104 L105G97-F101 WeakPolarHBondContact O-CB 3.24Å; G97-F101 PolarHBondContact O-N 2.71Å; F101-F104 PolarHBondContact O-N 2.87Å; F101-L105 HydrophobicContact CD1-CD1 3.75Å; F101-L105 HydrophobicContact CD1-CG 4.32Å; F101-L105 HydrophobicContact CE1-CD1 3.29Å; F101-L105 HydrophobicContact CE1-CG 3.97Å; F101-L105 HydrophobicContact CE2-CG 4.46Å; F101-L105 HydrophobicContact CZ-CD1 3.77Å; F101-L105 HydrophobicContact CZ-CD2 4.32Å; F101-L105 HydrophobicContact CZ-CG 4.04Å; F101-L105 WeakPolarHBondContact O-CB 3.5Å; F101-L105 WeakPolarHBondContact O-CG 3.44Å; F101-L105 PolarHBondContact O-N 2.8Å
102G96.4Very high92.7Very high36 Ų3687 Ų8737%0.37148%0.483SS..Hα-helixtrans-61.8-44.4173.700000112.4I98 F99 L105 A106I98-G102 PolarHBondContact O-N 3.27Å; F99-G102 PolarHBondContact O-N 3.49Å; G102-L105 PolarHBondContact O-N 3.31Å; G102-A106 WeakPolarHBondContact O-CB 3.32Å; G102-A106 PolarHBondContact O-N 3.37Å
103C95.8Very high92.1Very high57 Ų5790.8 Ų90.839%0.38549%0.49SS..Hα-helixtrans-62.4-42.9173.5-72.30000111.9F99 V100 A106 L107F99-C103 PolarHBondContact O-N 3.48Å; F99-C103 PolarHBondContact O-SG 2.98Å; F99-C103 VanDerWaalsContact O-SG 3.35Å; V100-C103 PolarHBondContact O-N 3.15Å; C103-A106 PolarHBondContact O-N 2.87Å; C103-L107 WeakPolarHBondContact O-CG 3.14Å; C103-L107 PolarHBondContact O-N 2.85Å
104F96.4Very high91Very high127 Ų12791.4 Ų91.456%0.55749%0.488SS*.Hα-helixtrans-65.1-43.6178.6-168.2-106.7000111.9V100 F101 A106 L107 I108V100-F104 WeakPolarHBondContact O-CB 3.37Å; V100-F104 PolarHBondContact O-N 3.26Å; F101-F104 PolarHBondContact O-N 2.87Å; F104-A106 VanDerWaalsContact C-N 3.35Å; F104-A106 PolarHBondContact O-N 3.28Å; F104-L107 PolarHBondContact O-N 2.82Å; F104-I108 HydrophobicContact CD1-CD1 3.53Å; F104-I108 HydrophobicContact CD1-CG1 4.35Å; F104-I108 HydrophobicContact CE1-CD1 3.35Å; F104-I108 HydrophobicContact CE1-CG1 4.2Å; F104-I108 HydrophobicContact CG-CD1 4.43Å; F104-I108 HydrophobicContact CZ-CD1 4.11Å; F104-I108 WeakPolarHBondContact O-CG1 3.41Å; F104-I108 PolarHBondContact O-N 2.8Å
105L94.1Very high89.7Confident78 Ų7891.3 Ų91.341%0.40849%0.487SS..Hα-helixtrans-61.2-42.2172.2-78.9177.9000111.8F101 G102 L107 I108 V109F101-L105 HydrophobicContact CD1-CD1 3.75Å; F101-L105 HydrophobicContact CD1-CG 4.32Å; F101-L105 HydrophobicContact CE1-CD1 3.29Å; F101-L105 HydrophobicContact CE1-CG 3.97Å; F101-L105 HydrophobicContact CE2-CG 4.46Å; F101-L105 HydrophobicContact CZ-CD1 3.77Å; F101-L105 HydrophobicContact CZ-CD2 4.32Å; F101-L105 HydrophobicContact CZ-CG 4.04Å; F101-L105 WeakPolarHBondContact O-CB 3.5Å; F101-L105 WeakPolarHBondContact O-CG 3.44Å; F101-L105 PolarHBondContact O-N 2.8Å; G102-L105 PolarHBondContact O-N 3.31Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 2.79Å; L105-I108 PolarHBondContact O-N 3.37Å; L105-V109 WeakPolarHBondContact O-CB 3.43Å; L105-V109 VanDerWaalsContact O-CG2 3.29Å; L105-V109 WeakPolarHBondContact O-CG2 3.24Å; L105-V109 PolarHBondContact O-N 3.44Å
106A94.8Very high88Confident48 Ų4895.2 Ų95.240%0.39750%0.498SS..Hα-helixtrans-62.9-40.8176.400000111.8G102 C103 F104 V109 M110G102-A106 WeakPolarHBondContact O-CB 3.32Å; G102-A106 PolarHBondContact O-N 3.37Å; C103-A106 PolarHBondContact O-N 2.87Å; F104-A106 VanDerWaalsContact C-N 3.35Å; F104-A106 PolarHBondContact O-N 3.28Å; A106-V109 PolarHBondContact O-N 2.88Å; A106-M110 WeakPolarHBondContact O-CB 3.3Å; A106-M110 VanDerWaalsContact O-CG 3.32Å; A106-M110 WeakPolarHBondContact O-CG 3.34Å; A106-M110 PolarHBondContact O-N 3.46Å
107L92.5Very high86.1Confident113 Ų11397.3 Ų97.359%0.59250%0.503SS*.Hα-helixtrans-65.6-41.9174.6-70.9174.9000112C103 F104 L105 M110 R111C103-L107 WeakPolarHBondContact O-CG 3.14Å; C103-L107 PolarHBondContact O-N 2.85Å; F104-L107 PolarHBondContact O-N 2.82Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 2.79Å; L107-M110 PolarHBondContact O-N 3.4Å; L107-R111 VanDerWaalsContact O-CB 3.24Å; L107-R111 WeakPolarHBondContact O-CB 3.18Å; L107-R111 PolarHBondContact O-N 3.3Å
108I90.8Very high84.1Confident69 Ų6999.3 Ų99.335%0.35451%0.511SS..Hα-helixtrans-60.7-48.3173.2-70.4166.6000109.6F104 L105 M110 R111 C112F104-I108 HydrophobicContact CD1-CD1 3.53Å; F104-I108 HydrophobicContact CD1-CG1 4.35Å; F104-I108 HydrophobicContact CE1-CD1 3.35Å; F104-I108 HydrophobicContact CE1-CG1 4.2Å; F104-I108 HydrophobicContact CG-CD1 4.43Å; F104-I108 HydrophobicContact CZ-CD1 4.11Å; F104-I108 WeakPolarHBondContact O-CG1 3.41Å; F104-I108 PolarHBondContact O-N 2.8Å; L105-I108 PolarHBondContact O-N 3.37Å; I108-M110 VanDerWaalsContact C-N 3.34Å; I108-M110 PolarHBondContact O-N 2.84Å; I108-R111 PolarHBondContact O-N 3.34Å; I108-C112 WeakPolarHBondContact O-CA 3.43Å; I108-C112 WeakPolarHBondContact O-CB 3.32Å; I108-C112 PolarHBondContact O-N 2.88Å; I108-C112 PolarHBondContact O-SG 3.34Å
109V90.6Very high81.9Confident94 Ų94103.2 Ų103.257%0.5752%0.52SS*.Hα-helixtrans-63.1-40.8179171.10000110.9L105 A106 R113L105-V109 WeakPolarHBondContact O-CB 3.43Å; L105-V109 VanDerWaalsContact O-CG2 3.29Å; L105-V109 WeakPolarHBondContact O-CG2 3.24Å; L105-V109 PolarHBondContact O-N 3.44Å; A106-V109 PolarHBondContact O-N 2.88Å; V109-R113 WeakPolarHBondContact O-CA 3.45Å; V109-R113 WeakPolarHBondContact O-CB 3.35Å; V109-R113 PolarHBondContact O-N 2.88Å
110M88.9Confident79.8Confident110 Ų110101.5 Ų101.554%0.54251%0.514SS..Hα-helixtrans-64.3-42.7174.6-76.1-17617900111.6A106 L107 I108 R113 D114A106-M110 WeakPolarHBondContact O-CB 3.3Å; A106-M110 VanDerWaalsContact O-CG 3.32Å; A106-M110 WeakPolarHBondContact O-CG 3.34Å; A106-M110 PolarHBondContact O-N 3.46Å; L107-M110 PolarHBondContact O-N 3.4Å; I108-M110 VanDerWaalsContact C-N 3.34Å; I108-M110 PolarHBondContact O-N 2.84Å; M110-R113 WeakPolarHBondContact O-CB 3.19Å; M110-R113 PolarHBondContact O-N 2.91Å; M110-D114 VanDerWaalsContact O-CG 3.23Å; M110-D114 PolarHBondContact O-N 3.04Å
111R84.5Confident77.5Confident165 Ų165102 Ų10262%0.62351%0.513SS*.Hα-helixtrans-70.7-40.6-179.5-161.867.2175.781.2-2.2112.2L107 I108 D114 S115L107-R111 VanDerWaalsContact O-CB 3.24Å; L107-R111 WeakPolarHBondContact O-CB 3.18Å; L107-R111 PolarHBondContact O-N 3.3Å; I108-R111 PolarHBondContact O-N 3.34Å; R111-D114 PolarHBondContact O-N 3.27Å; R111-S115 WeakPolarHBondContact O-CB 3.32Å; R111-S115 PolarHBondContact O-N 2.77Å; R111-S115 PolarHBondContact O-OG 3.38Å
112C78.6Confident75.4Confident50 Ų5099.6 Ų99.634%0.33852%0.517SS..Hα-helixtrans-63.6-42.9169.5-72.90000109.7I108 D114 S115 F116I108-C112 WeakPolarHBondContact O-CA 3.43Å; I108-C112 WeakPolarHBondContact O-CB 3.32Å; I108-C112 PolarHBondContact O-N 2.88Å; I108-C112 PolarHBondContact O-SG 3.34Å; C112-D114 VanDerWaalsContact C-N 3.35Å; C112-D114 PolarHBondContact O-N 3.47Å; C112-S115 CarbonylContact O-C 3.5Å; C112-S115 PolarHBondContact O-N 3.49Å; C112-S115 VanDerWaalsContact O-N 3.14Å; C112-F116 HydrophobicContact CB-CD2 3.87Å; C112-F116 HydrophobicContact CB-CE2 3.98Å; C112-F116 VanDerWaalsContact O-CB 3.27Å; C112-F116 WeakPolarHBondContact O-CB 3.43Å; C112-F116 WeakPolarHBondContact O-CD2 3.34Å; C112-F116 PolarHBondContact O-N 2.85Å
113R77.7Confident73Confident143 Ų143103.6 Ų103.654%0.5453%0.531SS..Hα-helixtrans-57.4-50.1175.7-170.9-17779.9160.74.5109.7V109 M110 S115 F116 F117V109-R113 WeakPolarHBondContact O-CA 3.45Å; V109-R113 WeakPolarHBondContact O-CB 3.35Å; V109-R113 PolarHBondContact O-N 2.88Å; M110-R113 WeakPolarHBondContact O-CB 3.19Å; M110-R113 PolarHBondContact O-N 2.91Å; R113-S115 VanDerWaalsContact C-N 3.28Å; R113-S115 PolarHBondContact O-N 3.36Å; R113-F116 PolarHBondContact O-N 3.47Å; R113-F117 HydrophobicContact CB-CD2 4.31Å; R113-F117 HydrophobicContact CG-CD2 3.24Å; R113-F117 HydrophobicContact CG-CE2 3.39Å; R113-F117 HydrophobicContact CG-CG 4.37Å; R113-F117 VanDerWaalsContact O-CB 3.24Å; R113-F117 WeakPolarHBondContact O-CB 3.1Å; R113-F117 VanDerWaalsContact O-CD2 3.24Å; R113-F117 WeakPolarHBondContact O-CD2 3.48Å; R113-F117 PolarHBondContact O-N 3.17Å
114D67.9Low70.8Confident86 Ų86105.2 Ų105.246%0.4653%0.534SS..Hα-helixtrans-62.9-37178.3-62.1-22.9000111.4M110 R111 C112 S118M110-D114 VanDerWaalsContact O-CG 3.23Å; M110-D114 PolarHBondContact O-N 3.04Å; R111-D114 PolarHBondContact O-N 3.27Å; C112-D114 VanDerWaalsContact C-N 3.35Å; C112-D114 PolarHBondContact O-N 3.47Å; D114-S118 WeakPolarHBondContact O-CA 3.34Å; D114-S118 WeakPolarHBondContact O-CB 3.27Å; D114-S118 PolarHBondContact O-N 3.44Å
115S64.1Low68.4Low62 Ų62107.2 Ų107.243%0.43454%0.543SS..Hα-helixtrans-70.7-40.9174.6-71.10000114R111 C112 R113 Y119R111-S115 WeakPolarHBondContact O-CB 3.32Å; R111-S115 PolarHBondContact O-N 2.77Å; R111-S115 PolarHBondContact O-OG 3.38Å; C112-S115 CarbonylContact O-C 3.5Å; C112-S115 PolarHBondContact O-N 3.49Å; C112-S115 VanDerWaalsContact O-N 3.14Å; R113-S115 VanDerWaalsContact C-N 3.28Å; R113-S115 PolarHBondContact O-N 3.36Å; S115-Y119 WeakPolarHBondContact O-CB 3.49Å; S115-Y119 PolarHBondContact O-N 2.83Å; S115-Y119 VanDerWaalsContact O-N 3.07Å
116F58.8Low66.1Low138 Ų138112 Ų11261%0.60556%0.563SS**Hα-helixtrans-74.5-41.6-179.9-82.7-72.6000111.1C112 R113 H120C112-F116 HydrophobicContact CB-CD2 3.87Å; C112-F116 HydrophobicContact CB-CE2 3.98Å; C112-F116 VanDerWaalsContact O-CB 3.27Å; C112-F116 WeakPolarHBondContact O-CB 3.43Å; C112-F116 WeakPolarHBondContact O-CD2 3.34Å; C112-F116 PolarHBondContact O-N 2.85Å; R113-F116 PolarHBondContact O-N 3.47Å; F116-H120 WeakPolarHBondContact O-CB 3.11Å; F116-H120 PolarHBondContact O-CD2 3.32Å; F116-H120 VanDerWaalsContact O-CD2 3.27Å; F116-H120 PolarHBondContact O-N 3.35Å
117F56.1Low63.7Low145 Ų145114.8 Ų114.864%0.63658%0.575SS**Hα-helixtrans-71.7-37.2173.6-80.2-91.7000111.3R113 Y119 H120 D121R113-F117 HydrophobicContact CB-CD2 4.31Å; R113-F117 HydrophobicContact CG-CD2 3.24Å; R113-F117 HydrophobicContact CG-CE2 3.39Å; R113-F117 HydrophobicContact CG-CG 4.37Å; R113-F117 VanDerWaalsContact O-CB 3.24Å; R113-F117 WeakPolarHBondContact O-CB 3.1Å; R113-F117 VanDerWaalsContact O-CD2 3.24Å; R113-F117 WeakPolarHBondContact O-CD2 3.48Å; R113-F117 PolarHBondContact O-N 3.17Å; F117-Y119 VanDerWaalsContact C-N 3.34Å; F117-Y119 PolarHBondContact O-N 2.91Å; F117-H120 PolarHBondContact O-N 2.8Å; F117-D121 WeakPolarHBondContact O-CB 3.43Å; F117-D121 PolarHBondContact O-N 2.68Å
118S52.7Low61.2Low83 Ų83113.1 Ų113.158%0.5858%0.578SS**Hα-helixtrans-65-36.2174.7-176.10000112.4D114 A122D114-S118 WeakPolarHBondContact O-CA 3.34Å; D114-S118 WeakPolarHBondContact O-CB 3.27Å; D114-S118 PolarHBondContact O-N 3.44Å; S118-A122 PolarHBondContact O-N 2.96Å
119Y51.2Low59.1Low197 Ų197117 Ų11777%0.77360%0.598SS**Hα-helixtrans-71.2-37.3174.3-132.3-92.8000112.7S115 F117 N123S115-Y119 WeakPolarHBondContact O-CB 3.49Å; S115-Y119 PolarHBondContact O-N 2.83Å; S115-Y119 VanDerWaalsContact O-N 3.07Å; F117-Y119 VanDerWaalsContact C-N 3.34Å; F117-Y119 PolarHBondContact O-N 2.91Å; Y119-N123 PolarHBondContact O-N 3.02Å
120H51.5Low56.5Low112 Ų112120.1 Ų120.152%0.51961%0.611SS.*Hα-helixtrans-75.6-31.5176.1-84-62.9000113.3F116 F117 A122 N123 I124F116-H120 WeakPolarHBondContact O-CB 3.11Å; F116-H120 PolarHBondContact O-CD2 3.32Å; F116-H120 VanDerWaalsContact O-CD2 3.27Å; F116-H120 PolarHBondContact O-N 3.35Å; F117-H120 PolarHBondContact O-N 2.8Å; H120-A122 VanDerWaalsContact C-N 3.33Å; H120-N123 CarbonylContact O-C 3.6Å; H120-N123 PolarHBondContact O-N 3.42Å; H120-I124 HydrophobicContact CB-CD1 4.03Å; H120-I124 WeakPolarHBondContact O-CB 3.39Å; H120-I124 WeakPolarHBondContact O-CD1 3.14Å; H120-I124 WeakPolarHBondContact O-CG1 3.25Å; H120-I124 PolarHBondContact O-N 3.25Å
121D47.4Very low54.2Low98 Ų98119.6 Ų119.652%0.52462%0.624SS.*Hα-helixtrans-77.1-21.2179.1-1525.6000112F117 K125F117-D121 WeakPolarHBondContact O-CB 3.43Å; F117-D121 PolarHBondContact O-N 2.68Å; D121-K125 WeakPolarHBondContact O-CG 3.28Å
122A52Low52.3Low80 Ų80120.5 Ų120.566%0.66164%0.641SS**Hα-helixtrans-75.8-26.7166.500000112.9S118 H120S118-A122 PolarHBondContact O-N 2.96Å; H120-A122 VanDerWaalsContact C-N 3.33Å
123N47.2Very low50.2Low121 Ų121121.2 Ų121.265%0.64766%0.657SS**Hα-helixtrans-95-26.8-179-162.3-76.1000113.2Y119 H120Y119-N123 PolarHBondContact O-N 3.02Å; H120-N123 CarbonylContact O-C 3.6Å; H120-N123 PolarHBondContact O-N 3.42Å
124I49.7Very low48.1Very low90 Ų90123 Ų12346%0.46267%0.671SS.*G310 helixtrans-84.2-8.8-179.3-71.2167.3000112.9H120 Q126 T127 A128H120-I124 HydrophobicContact CB-CD1 4.03Å; H120-I124 WeakPolarHBondContact O-CB 3.39Å; H120-I124 WeakPolarHBondContact O-CD1 3.14Å; H120-I124 WeakPolarHBondContact O-CG1 3.25Å; H120-I124 PolarHBondContact O-N 3.25Å; I124-Q126 PolarHBondContact O-N 3.24Å; I124-Q126 VanDerWaalsContact O-N 3.08Å; I124-T127 PolarHBondContact O-N 3.37Å; I124-T127 VanDerWaalsContact O-N 3.17Å; I124-A128 PolarHBondContact O-N 2.92Å
125K45Very low46.8Very low169 Ų169124.3 Ų124.374%0.73569%0.694SS**G310 helixtrans-67.1-5.8171.8-76.7179.9-172.5-163.20114.4D121D121-K125 WeakPolarHBondContact O-CG 3.28Å
126Q45.3Very low45.7Very low179 Ų179126.5 Ų126.584%0.83671%0.705SS**G310 helixtrans-103.44173.9-135.5172-3.200114.5I124I124-Q126 PolarHBondContact O-N 3.24Å; I124-Q126 VanDerWaalsContact O-N 3.08Å
127T45.8Very low45Very low107 Ų107129.4 Ų129.466%0.65672%0.717SS**  trans-14828.6176.1-11.40000114.4I124 I129I124-T127 PolarHBondContact O-N 3.37Å; I124-T127 VanDerWaalsContact O-N 3.17Å; T127-I129 PolarHBondContact O-N 3.27Å
128A38.7Very low44.2Very low78 Ų78128.1 Ų128.165%0.64573%0.726SS**  trans-73.377.315600000108.5I124 N130I124-A128 PolarHBondContact O-N 2.92Å; A128-N130 PolarHBondContact O-N 3.5Å; A128-N130 VanDerWaalsContact O-N 3.13Å
129I47.8Very low43.9Very low149 Ų149131.9 Ų131.976%0.76474%0.74SS**  trans-54.2116.1159.434.4170.6000107.4T127 A131T127-I129 PolarHBondContact O-N 3.27Å; I129-A131 PolarHBondContact O-N 3.47Å
130N35.4Very low43.4Very low160 Ų160126.8 Ų126.886%0.85674%0.739SS**  trans-42.6102.6170.3-68.7-36.8000109.8A128 L132A128-N130 PolarHBondContact O-N 3.5Å; A128-N130 VanDerWaalsContact O-N 3.13Å; N130-L132 PolarHBondContact O-N 2.8Å
131A41.4Very low43.3Very low99 Ų99131.1 Ų131.182%0.81876%0.756SS**SBendtrans-69.1122.6163.900000107.2I129I129-A131 PolarHBondContact O-N 3.47Å
132L43.1Very low43.1Very low184 Ų184132.2 Ų132.296%0.96377%0.767SS**SBendtrans89.960.3163.8-140.568.4000117.2N130N130-L132 PolarHBondContact O-N 2.8Å
133G34.9Very low42.7Very low66 Ų66134 Ų13468%0.6877%0.774SS**SBendtrans-149.995.3153.200000109.6
134E33Very low42.7Very low181 Ų181132 Ų13285%0.84678%0.783SS**  trans65.987.8156.2-141.4147-163.900117.3T136E134-T136 PolarHBondContact O-N 3.32Å
135A41.4Very low42.4Very low113 Ų113131.4 Ų131.493%0.93480%0.799SS**  trans-67.494.3163.900000110.2
136T40.4Very low42.6Very low108 Ų108130.1 Ų130.166%0.66380%0.799SS**  trans-131.8113.2162.3-52.70000110.6E134E134-T136 PolarHBondContact O-N 3.32Å
137K45.3Very low42.8Very low198 Ų198129.8 Ų129.886%0.86180%0.802SS**  trans46.2100.6161.6-81.4176.1167175.80117.1
138S39Very low42.6Very low118 Ų118133.9 Ų133.983%0.82581%0.806SS**  -167.6131.5124.4400000111.1A140S138-A140 PolarHBondContact O-N 2.88Å
139N46.4Very low42.7Very low162 Ų162136.2 Ų136.287%0.86682%0.815SS**  trans-60.8129167.4-68.8-60.9000109.4
140A40.3Very low42.3Very low91 Ų91135 Ų13575%0.75282%0.818SS**  trans-136.680.7159.400000108.7S138 T142S138-A140 PolarHBondContact O-N 2.88Å; A140-T142 PolarHBondContact O-N 2.88Å
141F50.4Low42.8Very low202 Ų202130.9 Ų130.989%0.88681%0.806SS**  trans-68.9112.6150.1-101.7-90.5000107.5
142T43.1Very low43Very low122 Ų122131.7 Ų131.775%0.74880%0.801SS**  trans-144.784.9154.348.70000107.8A140A140-T142 PolarHBondContact O-N 2.88Å
143S43.7Very low43.3Very low116 Ų116127.7 Ų127.781%0.81180%0.795SS**  53.1105.2100.659.60000114.6
144G46.7Very low44Very low81 Ų81132.2 Ų132.284%0.83580%0.803SS**  trans142.62.7162.800000117.8
145G43.9Very low44.6Very low77 Ų77126 Ų12679%0.79478%0.78SS**  trans-96.3102.6-175.100000113.7
146I48.8Very low45.1Very low142 Ų142131.6 Ų131.673%0.72878%0.777SS**  trans3.9124.4148-67.3158.5000116Y148I146-Y148 HydrophobicContact CG2-CD2 3.66Å; I146-Y148 HydrophobicContact CG2-CE2 3.99Å; I146-Y148 PolarHBondContact O-N 3.49Å
147L48.3Very low45.7Very low172 Ų172133.7 Ų133.790%0.90178%0.784SS**SBendtrans-5990.6172.5-64.4163000112.2
148Y42.9Very low46.1Very low193 Ų193130.3 Ų130.376%0.75778%0.775SS**  trans-141.4138155-79.5-78.2000109.3I146 C150I146-Y148 HydrophobicContact CG2-CD2 3.66Å; I146-Y148 HydrophobicContact CG2-CE2 3.99Å; I146-Y148 PolarHBondContact O-N 3.49Å; Y148-C150 PolarHBondContact O-N 3.01Å; Y148-C150 VanDerWaalsContact O-N 3.14Å
149P41.2Very low46.7Very low126 Ų126128.6 Ų128.682%0.81876%0.756SS**  trans-61.9119178.1-17.930000110.2A151P149-A151 PolarHBondContact O-N 3.17Å; P149-A151 VanDerWaalsContact O-N 3.14Å
150C39Very low47.1Very low124 Ų124127.6 Ų127.684%0.83875%0.746SS**  trans-57.3115.2166-74.90000109.3Y148 T152Y148-C150 PolarHBondContact O-N 3.01Å; Y148-C150 VanDerWaalsContact O-N 3.14Å; C150-T152 PolarHBondContact O-N 2.77Å
151A45Very low47.7Very low73 Ų73126.9 Ų126.960%0.60374%0.735SS**  trans-76.2103.4163.500000108.4P149P149-A151 PolarHBondContact O-N 3.17Å; P149-A151 VanDerWaalsContact O-N 3.14Å
152T45.2Very low47.9Very low117 Ų117122.4 Ų122.472%0.71872%0.717SS**  trans-56.8137.4158.6-52.10000108.2C150 N154C150-T152 PolarHBondContact O-N 2.77Å; T152-N154 PolarHBondContact O-N 3.45Å
153A51.1Low48.5Very low100 Ų100121.6 Ų121.683%0.82671%0.708SS**THydrogen-bonded Turntrans-59.810.6-161.500000118.6
154N48.6Very low49Very low161 Ų161121.5 Ų121.586%0.86170%0.702SS**THydrogen-bonded Turntrans-121.58.5-173.9-74.4-21.5000115.8T152T152-N154 PolarHBondContact O-N 3.45Å
155S45.8Very low49.3Very low51 Ų51123.4 Ų123.436%0.35769%0.693SS.*  trans-119.542.2-173.464.70000114.4
156R51Low49.5Very low230 Ų230123.2 Ų123.287%0.86867%0.674SS**Hα-helixtrans-72.2-30.5-176-140.4179.5169.299.72.5113.3
157D53Low49.7Very low151 Ų151120.8 Ų120.881%0.80767%0.67SS**Hα-helixtrans-85.4-25-176.1-73-32.1000114.6
158L53.9Low49.9Very low127 Ų127121.1 Ų121.167%0.66566%0.659SS**Hα-helixtrans-81.9-30.2-176.5-147.1152.6000112.1Q162L158-Q162 PolarHBondContact O-N 2.89Å
159L53.1Low50.5Low83 Ų83116.1 Ų116.144%0.43565%0.645SS.*Hα-helixtrans-78.3-28.6-180-74.2170.8000113.6S161 Q162 L163L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 3.24Å; L159-Q162 PolarHBondContact O-N 3.46Å; L159-L163 HydrophobicContact CB-CD1 4.48Å; L159-L163 WeakPolarHBondContact O-CB 3.42Å; L159-L163 WeakPolarHBondContact O-CD1 3.37Å; L159-L163 PolarHBondContact O-N 3.18Å
160Q53.8Low51.1Low141 Ų141115.1 Ų115.166%0.65963%0.632SS**Hα-helixtrans-63.9-39.1173.3-165.981.631.400110.9V164Q160-V164 VanDerWaalsContact O-CG2 3.29Å; Q160-V164 WeakPolarHBondContact O-CG2 3.44Å; Q160-V164 PolarHBondContact O-N 3.33Å
161S53.1Low51.6Low75 Ų75117.9 Ų117.952%0.52463%0.625SS.*Hα-helixtrans-68.4-36.9176.1168.30000112.8L159 N165L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 3.24Å; S161-N165 PolarHBondContact O-ND2 2.8Å
162Q53.7Low51.9Low108 Ų108117.4 Ų117.451%0.50562%0.621SS.*Hα-helixtrans-75.1-40.2178.1-94.4-81.6-59.700113.1L158 L159 V164 N165 D166L158-Q162 PolarHBondContact O-N 2.89Å; L159-Q162 PolarHBondContact O-N 3.46Å; Q162-V164 VanDerWaalsContact C-N 3.28Å; Q162-V164 PolarHBondContact O-N 3.43Å; Q162-N165 PolarHBondContact O-N 2.97Å; Q162-D166 PolarHBondContact O-N 3.32Å
163L55.7Low52.3Low105 Ų105116.9 Ų116.955%0.5562%0.618SS.*Hα-helixtrans-65.8-28.7177.2-97.386.6000113.3L159 N165 L169L159-L163 HydrophobicContact CB-CD1 4.48Å; L159-L163 WeakPolarHBondContact O-CB 3.42Å; L159-L163 WeakPolarHBondContact O-CD1 3.37Å; L159-L163 PolarHBondContact O-N 3.18Å; L163-N165 VanDerWaalsContact C-N 3.35Å; L163-L169 HydrophobicContact CD2-CD2 4.21Å; L163-L169 HydrophobicContact CG-CD2 4.24Å
164V54.8Low52.3Low114 Ų114118.1 Ų118.169%0.69161%0.61SS**Hα-helixtrans-76.7-23.6177172.50000112Q160 Q162Q160-V164 VanDerWaalsContact O-CG2 3.29Å; Q160-V164 WeakPolarHBondContact O-CG2 3.44Å; Q160-V164 PolarHBondContact O-N 3.33Å; Q162-V164 VanDerWaalsContact C-N 3.28Å; Q162-V164 PolarHBondContact O-N 3.43Å
165N53.3Low52.5Low121 Ų121115.7 Ų115.765%0.64760%0.601SS**Hα-helixtrans-90.1-19.1179.6-95-66000114.2S161 Q162 L163 S167S161-N165 PolarHBondContact O-ND2 2.8Å; Q162-N165 PolarHBondContact O-N 2.97Å; L163-N165 VanDerWaalsContact C-N 3.35Å; N165-S167 PolarHBondContact O-N 2.73Å; N165-S167 VanDerWaalsContact O-N 3.08Å
166D48.9Very low52.6Low74 Ų74119.3 Ų119.340%0.39662%0.623SS.*  trans-85.885.9-178.6-122.9-13.3000110.8Q162 R168 L169Q162-D166 PolarHBondContact O-N 3.32Å; D166-R168 PolarHBondContact O-N 2.84Å; D166-L169 PolarHBondContact O-N 3.41Å
167S52.3Low52.3Low91 Ų91114.8 Ų114.864%0.63661%0.612SS**Hα-helixtrans-52.9-14.2171.656.50000113.7N165N165-S167 PolarHBondContact O-N 2.73Å; N165-S167 VanDerWaalsContact O-N 3.08Å
168R53.1Low51.7Low178 Ų178110.5 Ų110.567%0.67260%0.604SS**Hα-helixtrans-78.8-18.9174.4-69.2-177.6-172.8-101.10.4114.9D166 W171D166-R168 PolarHBondContact O-N 2.84Å; R168-W171 PolarHBondContact O-NE1 2.78Å
169L53.7Low51.4Low89 Ų89109.8 Ų109.847%0.46661%0.605SS.*Hα-helixtrans-83.5-23.8175.3-112.273.2000112.4L163 D166 A172L163-L169 HydrophobicContact CD2-CD2 4.21Å; L163-L169 HydrophobicContact CG-CD2 4.24Å; D166-L169 PolarHBondContact O-N 3.41Å; L169-A172 PolarHBondContact O-N 3.3Å
170L55.7Low50.9Low104 Ų104114.9 Ų114.955%0.54562%0.618SS.*Hα-helixtrans-69.1-30.4178.9-83159.2000113.1A172 T173 L174L170-A172 VanDerWaalsContact C-N 3.32Å; L170-T173 PolarHBondContact O-OG1 3.49Å; L170-L174 WeakPolarHBondContact O-CD1 3.41Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.06Å
171W47.8Very low50.3Low182 Ų182115.8 Ų115.869%0.68962%0.622SS**THydrogen-bonded Turntrans-77.7-18175.364.4-102.4000113.3R168 T173R168-W171 PolarHBondContact O-NE1 2.78Å; W171-T173 VanDerWaalsContact C-N 3.34Å
172A51.2Low49.6Very low64 Ų64119.7 Ų119.753%0.52963%0.63SS.*THydrogen-bonded Turntrans-82.5-12.5175.600000113L169 L170L169-A172 PolarHBondContact O-N 3.3Å; L170-A172 VanDerWaalsContact C-N 3.32Å
173T55.5Low49.2Very low105 Ų105121.7 Ų121.764%0.64464%0.642SS**THydrogen-bonded Turntrans-116.1-0.3-177.361.10000114.3L170 W171L170-T173 PolarHBondContact O-OG1 3.49Å; W171-T173 VanDerWaalsContact C-N 3.34Å
174L50.5Low48.6Very low126 Ų126123.6 Ų123.666%0.6665%0.652SS**  trans-10861.2175.9-70.3168.2000111.1L170 P176L170-L174 WeakPolarHBondContact O-CD1 3.41Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.06Å; L174-P176 WeakPolarHBondContact O-CD 3.08Å
175T52.1Low48.1Very low110 Ų110126.7 Ų126.768%0.67566%0.659SS**  trans-90.4103.4153.2-25.80000106.2H177T175-H177 PolarHBondContact O-N 3.06Å
176P49.3Very low47.2Very low128 Ų128126.5 Ų126.583%0.83166%0.658SS**  trans-74.66.2-170.229.8-34.8000114L174L174-P176 WeakPolarHBondContact O-CD 3.08Å
177H43.7Very low47.2Very low134 Ų134127.7 Ų127.762%0.6267%0.671SS**SBendtrans-154.4117.2-179.9-142.1-82.1000108.5T175 T179T175-H177 PolarHBondContact O-N 3.06Å; H177-T179 PolarHBondContact O-N 2.72Å
178G40.7Very low46.8Very low62 Ų62131 Ų13164%0.63968%0.677SS**  trans-53.7132.316300000108.3R180G178-R180 PolarHBondContact O-N 3.05Å
179T46.8Very low46.5Very low112 Ų112130.7 Ų130.769%0.68769%0.689SS**  trans-63.284.8174.6-33.90000108.1H177 H181H177-T179 PolarHBondContact O-N 2.72Å; T179-H181 PolarHBondContact O-N 2.81Å
180R42.6Very low45.8Very low189 Ų189129.7 Ų129.771%0.71370%0.7SS**  trans-61.599.1152.7-82.6-178157.9164.6-6.2104.5G178 F182G178-R180 PolarHBondContact O-N 3.05Å; R180-F182 HydrophobicContact CB-CD2 4.05Å; R180-F182 HydrophobicContact CB-CE2 3.68Å; R180-F182 HydrophobicContact CB-CZ 4.22Å; R180-F182 PolarHBondContact O-N 2.75Å
181H41.8Very low45.5Very low161 Ų161133.8 Ų133.875%0.74572%0.716SS**  trans-58.992.2161.4-77.5-102.3000106.6T179 I183T179-H181 PolarHBondContact O-N 2.81Å; H181-I183 VanDerWaalsContact C-N 3.34Å; H181-I183 PolarHBondContact O-N 3.42Å
182F39.3Very low44.9Very low157 Ų157136 Ų13669%0.68973%0.726SS**  trans-75.4100.6156-67.3-79.1000105R180 I184R180-F182 HydrophobicContact CB-CD2 4.05Å; R180-F182 HydrophobicContact CB-CE2 3.68Å; R180-F182 HydrophobicContact CB-CZ 4.22Å; R180-F182 PolarHBondContact O-N 2.75Å; F182-I184 VanDerWaalsContact C-N 3.27Å; F182-I184 PolarHBondContact O-N 3.04Å
183I44.7Very low44.7Very low149 Ų149141 Ų14176%0.76474%0.738SS**  trans-61103.1156.4-60.8167.6000103.8H181 E185H181-I183 VanDerWaalsContact C-N 3.34Å; H181-I183 PolarHBondContact O-N 3.42Å; I183-E185 PolarHBondContact O-N 3.02Å
184I42.6Very low44.5Very low146 Ų146141.5 Ų141.575%0.74975%0.746SS**  trans-71.489.7164.8-65.3167.8000104.1F182 N186F182-I184 VanDerWaalsContact C-N 3.27Å; F182-I184 PolarHBondContact O-N 3.04Å; I184-N186 HydrophobicContact CG2-CB 3.71Å; I184-N186 PolarHBondContact O-N 2.68Å
185E44.3Very low44.3Very low179 Ų179139.6 Ų139.684%0.83674%0.739SS**  trans-71.170.9160.4-167.4167-151.400106.4I183 S187I183-E185 PolarHBondContact O-N 3.02Å; E185-S187 VanDerWaalsContact C-N 3.32Å; E185-S187 PolarHBondContact O-N 3.02Å
186N35.3Very low44.2Very low117 Ų117142 Ų14263%0.62675%0.748SS**  trans-81.495.8162.3-167.464.9000105.8I184 Q188I184-N186 HydrophobicContact CG2-CB 3.71Å; I184-N186 PolarHBondContact O-N 2.68Å; N186-Q188 VanDerWaalsContact C-N 3.31Å; N186-Q188 PolarHBondContact O-N 2.81Å
187S48.9Very low44Very low98 Ų98146.1 Ų146.169%0.68575%0.749SS**  trans-48.997.215741.90000109.4E185E185-S187 VanDerWaalsContact C-N 3.32Å; E185-S187 PolarHBondContact O-N 3.02Å
188Q42.5Very low44Very low162 Ų162151.3 Ų151.376%0.75776%0.763SS**SBendtrans-171.8115.8144.3-104.6170.224.900109.3N186N186-Q188 VanDerWaalsContact C-N 3.31Å; N186-Q188 PolarHBondContact O-N 2.81Å
189D47.1Very low43.9Very low170 Ų170152.1 Ų152.191%0.90977%0.771SS**  trans22.299.6149.7-63.3-50.7000116.9
190G38.6Very low43.6Very low69 Ų69157.2 Ų157.271%0.71178%0.783SS**  trans175.566.2174.100000116.5Y192G190-Y192 PolarHBondContact O-N 3.11Å
191H49.6Very low43.1Very low189 Ų189154 Ų15488%0.87579%0.79SS**  trans20.588.1141.8-120.4-49.5000117.3
192Y36.5Very low43Very low230 Ų230154.9 Ų154.990%0.90279%0.794SS**  trans-151.2100153.2-119.5-85.9000109.7G190 S194G190-Y192 PolarHBondContact O-N 3.11Å; Y192-S194 PolarHBondContact O-N 2.82Å
193E45.8Very low42.7Very low169 Ų169152 Ų15279%0.7979%0.793SS**  trans-73.7120.4166-72.6-154.1158.500109V195E193-V195 PolarHBondContact O-N 3.04Å
194S51Low42.4Very low114 Ų114152.8 Ų152.880%0.79779%0.793SS**  trans-77.5102164.249.20000108.8Y192 D196Y192-S194 PolarHBondContact O-N 2.82Å; S194-D196 PolarHBondContact O-N 2.98Å
195V46.3Very low42.1Very low87 Ų87152.6 Ų152.653%0.52780%0.799SS.*  trans-81.1101178.5-173.50000110E193 Y197E193-V195 PolarHBondContact O-N 3.04Å; V195-Y197 HydrophobicContact CB-CD2 4.49Å; V195-Y197 HydrophobicContact CB-CE2 4.21Å; V195-Y197 HydrophobicContact CG1-CD2 3.55Å; V195-Y197 HydrophobicContact CG1-CE2 3.24Å; V195-Y197 HydrophobicContact CG1-CG 4.34Å
196D50.9Low41.5Very low159 Ų159152.8 Ų152.885%0.8580%0.797SS**  trans-89.3106.1165.4-87.8-31.8000110.6S194 R198S194-D196 PolarHBondContact O-N 2.98Å; D196-R198 PolarHBondContact O-N 3.5Å; D196-R198 VanDerWaalsContact O-N 3.16Å
197Y45Very low41.4Very low216 Ų216157 Ų15785%0.84780%0.804SS**  trans-78.684.4171.3-76.2-90000110.8V195V195-Y197 HydrophobicContact CB-CD2 4.49Å; V195-Y197 HydrophobicContact CB-CE2 4.21Å; V195-Y197 HydrophobicContact CG1-CD2 3.55Å; V195-Y197 HydrophobicContact CG1-CE2 3.24Å; V195-Y197 HydrophobicContact CG1-CG 4.34Å
198R43.6Very low40.5Very low243 Ų243155.2 Ų155.292%0.91780%0.801SS**  trans-149.3100.3162.2-154.3175.9-165.3-117.43.7112.9D196D196-R198 PolarHBondContact O-N 3.5Å; D196-R198 VanDerWaalsContact O-N 3.16Å
199G37.8Very low40Very low78 Ų78156.7 Ų156.780%0.80480%0.801SS**  trans9178.2153.500000116.9S201G199-S201 PolarHBondContact O-N 2.98Å
200K40.7Very low39.4Very low219 Ų219157.4 Ų157.495%0.95280%0.799SS**  trans-64119.1158.9-73.3165173.6175.70110
201S33.4Very low39.2Very low122 Ų122163.8 Ų163.885%0.85381%0.808SS**  trans-136.5109.3140.3630000108.5G199G199-S201 PolarHBondContact O-N 2.98Å
202H38.5Very low38.4Very low180 Ų180162.7 Ų162.783%0.83380%0.802SS**  trans-87.9143.8-176.5-158.250.9000109.8
203S34Very low38.5Very low95 Ų95157.2 Ų157.266%0.66480%0.797SS**  trans76.1139160.491.30000115.7
204Q38.5Very low38.1Very low166 Ų166156.9 Ų156.978%0.77680%0.796SS**  cis-150.2144.635.1-66.9-159.3-20.400113.7
205V36.9Very low37.3Very low143 Ų143156.4 Ų156.487%0.86779%0.793SS**  trans-72.9123.6154.4176.80000107.5
206F29.7Very low36.9Very low183 Ų183161.3 Ų161.380%0.80381%0.807SS**  trans-141114.2161-155.1-95.5000111.1
207R33.5Very low36.4Very low205 Ų205159.1 Ų159.177%0.77480%0.799SS**  trans-91.4125171.8-171.5-170.1-120.5-133.73.9106.8
208G31.4Very low36Very low60 Ų60156.9 Ų156.962%0.61979%0.794SS**  trans-157127.8176.700000111.9
209Y31.9Very low35.9Very low193 Ų193148.4 Ų148.476%0.75777%0.772SS**  trans-78.8153.9-174.7-74.9-101.1000113.6
210E32.8Very low36Very low185 Ų185154.4 Ų154.486%0.86478%0.776SS**  trans45.2124.8151.7-68.6-169.2138.500121.6
211K34.5Very low35.9Very low204 Ų204150.3 Ų150.389%0.88777%0.765SS**  -165128.2113.7-147.6170.9-178177.30112.8
212H34.5Very low36.4Very low166 Ų166152.3 Ų152.377%0.76977%0.766SS**  trans-73.7127.6171.9-158.473.8000110.5
213S36.9Very low36.6Very low114 Ų114150.3 Ų150.380%0.79776%0.761SS**  trans-14499159.761.90000110.8
214Q39.3Very low36.8Very low162 Ų162149.2 Ų149.276%0.75777%0.765SS**  trans-22.6151.8146.2-61.8176.2-7.300113.2
215S34.1Very low36.7Very low105 Ų105150.7 Ų150.773%0.73477%0.769SS**  cis-178142.412.546.80000107.1
216F36.2Very low37.3Very low190 Ų190149 Ų14983%0.83376%0.759SS**  trans-153.7107.4134.9-170.8-102000109.2K218F216-K218 HydrophobicContact CE1-CB 4.43Å
217V40.3Very low37.8Very low112 Ų112146.4 Ų146.468%0.67975%0.754SS**  trans-86.6137.8174.7171.10000108.7
218K38.1Very low38.4Very low169 Ų169147.8 Ų147.874%0.73576%0.76SS**  trans-146.376146.7-164.1171.7-176.91790107.5F216F216-K218 HydrophobicContact CE1-CB 4.43Å
219S41.7Very low39.3Very low65 Ų65151.9 Ų151.946%0.45577%0.768SS.*  47.894.994.573.40000113.3
220F39.2Very low39.9Very low205 Ų205153.3 Ų153.390%0.89977%0.774SS**  trans-135.495.8130.1-91.4-76.1000107.5
221D38.2Very low40.5Very low133 Ų133152.2 Ų152.271%0.71177%0.769SS**  trans-56.4132.9164.8-67.1-70.7000110.5
222N44.2Very low41.4Very low164 Ų164149.2 Ų149.288%0.87776%0.762SS**  trans-135.1106.4138.2-160.12.6000108.9
223N42.9Very low42.1Very low137 Ų137146.1 Ų146.173%0.73376%0.757SS**  trans-47153.1179.7-64.3-11.9000115.2
224G37.5Very low42.5Very low72 Ų72146.6 Ų146.674%0.74276%0.755SS**  trans151.9107.3130.300000116.4
225F36.5Very low43.2Very low197 Ų197144.1 Ų144.186%0.86475%0.754SS**  trans83.890161.3-94.9-100.7000117.4
226V49Very low43.9Very low107 Ų107146.8 Ų146.865%0.64876%0.758SS**  87.1104.779.9171.80000111.8
227D41.9Very low44.6Very low130 Ų130145.8 Ų145.870%0.69576%0.758SS**  trans23.1114.7139.2-48.8-27.4000118.4
228Y46Very low44.9Very low233 Ų233146.6 Ų146.691%0.91476%0.759SS**  trans-136.7103.4131.7-105.6-80.7000108.4Y230Y228-Y230 PolarHBondContact O-N 3.36Å
229D49.5Very low45.1Very low147 Ų147143.4 Ų143.479%0.78676%0.758SS**  trans-53.4121.8156.5-68.9-49.7000109
230Y44.5Very low45.4Very low222 Ų222151 Ų15187%0.87178%0.778SS**  trans-136.185.9156.3-150.3-92.2000108.1Y228Y228-Y230 PolarHBondContact O-N 3.36Å
231E46.5Very low45.7Very low163 Ų163149 Ų14976%0.76277%0.771SS**  trans16.9106.4143.5-64.3-82.3112.600115.9
232D52.7Low46.1Very low140 Ų140148.9 Ų148.975%0.74977%0.771SS**  trans-69.4139.1148.8-171.325.7000107.5T234D232-T234 PolarHBondContact OD1-N 2.79Å; D232-T234 VanDerWaalsContact OD1-N 3.13Å
233P48.7Very low46.4Very low101 Ų101148.9 Ų148.966%0.65677%0.771SS**  -152.812793.435.6-14000115.8
234T45.5Very low46.9Very low124 Ų124150.9 Ų150.976%0.76178%0.778SS**  trans72.9148.9136.413.60000122D232D232-T234 PolarHBondContact OD1-N 2.79Å; D232-T234 VanDerWaalsContact OD1-N 3.13Å
235P54.3Low47.6Very low111 Ų111154.4 Ų154.472%0.72178%0.78SS**  trans-99.2157.8-168.739-27.3000112.8
236L48Very low48.2Very low160 Ų160150.2 Ų150.284%0.83878%0.775SS**  trans-132.3114164.2-84.1164.3000111.1
237M51.4Low47.9Very low169 Ų169148.9 Ų148.983%0.83378%0.783SS**  trans-92.9109.6164.2-139.2-66.5-64.600105.3
238D45.6Very low48Very low129 Ų129153.5 Ų153.569%0.6979%0.792SS**  trans-158.7141.8170-70.6-53.5000106
239S43.3Very low47.7Very low102 Ų102151 Ų15171%0.71379%0.789SS**  cis-168.2132.7-16.9174.60000102.7
240Y47.4Very low47.6Very low225 Ų225151.1 Ų151.188%0.88279%0.785SS**  trans-68.4150.4164.1-85.7-100.8000109.6
241H45.5Very low47.8Very low162 Ų162146 Ų14675%0.7578%0.778SS**  trans162.7108.4148.3-88.4-58.1000107.6
242D46.6Very low47.5Very low131 Ų131147 Ų14770%0.70178%0.783SS**  96.210286.7-89.9-25000111.8
243D51.7Low47.2Very low164 Ų164148.5 Ų148.588%0.87779%0.785SS**  trans-146.991.8152.3-72.1-49000105.5
244M53.1Low46.7Very low180 Ų180149.5 Ų149.589%0.88779%0.789SS**  42.982.390.8-75.8-68.8-166.100114.4
245D51.4Low46.3Very low145 Ų145149.9 Ų149.978%0.77579%0.792SS**  trans-168.4100.2135.9-124.5-16000108.8
246S50.2Low45.4Very low110 Ų110148.2 Ų148.277%0.76979%0.794SS**  55.8112.776.7114.70000113.1
247G43.1Very low44.8Very low79 Ų79145.5 Ų145.581%0.81479%0.789SS**  trans162.646.517800000116.2Q249G247-Q249 PolarHBondContact O-N 3.44Å
248Y42.7Very low44.1Very low227 Ų227144.3 Ų144.389%0.8979%0.785SS**  trans-58.4127.7157.6-113.5-100.2000108.8
249Q41.1Very low43.9Very low179 Ų179147.3 Ų147.384%0.83679%0.792SS**  trans-148.9129.4153.6-16264.832.300110.8G247G247-Q249 PolarHBondContact O-N 3.44Å
250E46.2Very low43.6Very low151 Ų151154.2 Ų154.271%0.70680%0.802SS**  trans-63.1165.9-167.5-83.5179.8154.200118
251P48.2Very low43.1Very low113 Ų113149.4 Ų149.473%0.73480%0.802SS**  trans-81.2132.1178.633.3-31.8000112
252H41.8Very low42.5Very low186 Ų186146.6 Ų146.686%0.86181%0.807SS**  trans-111.7110.4165.1-90.5-74.9000111
253E45.3Very low41.8Very low170 Ų170149.4 Ų149.479%0.79482%0.818SS**  trans-75.7164161.836.7-167.9139.100111.3
254V38.6Very low41.1Very low122 Ų122152.5 Ų152.574%0.73982%0.817SS**  trans122.499.2156.6-1770000116.3
255T36.9Very low40.1Very low133 Ų133149.3 Ų149.382%0.81681%0.808SS**  trans48.7125.2141.360.60000122.2
256G36.2Very low39.2Very low75 Ų75148.8 Ų148.877%0.77381%0.81SS**  121.7130.8114.100000117.5
257S34.9Very low38.3Very low103 Ų103152 Ų15272%0.7281%0.813SS**  trans102.5108.1142-148.30000119.6
258L37.3Very low37.6Very low145 Ų145153.8 Ų153.876%0.75981%0.813SS**  trans69.2112.8132.8-68.5167.8000120.9
259K39.9Very low37.1Very low192 Ų192149.4 Ų149.484%0.83580%0.804SS**  trans34.8113.8131.3-77.5-172.9173.3-178.10117.6
260R36.6Very low36.7Very low247 Ų247147 Ų14793%0.93280%0.797SS**  -163.4121.5122.8-116.2175.2-131.8-149.21.9112.1
261S37.8Very low36Very low124 Ų124145.2 Ų145.287%0.86780%0.796SS**  trans-61.5141.4158.1-44.70000109.7
262A33.4Very low35.2Very low103 Ų103146.7 Ų146.785%0.85180%0.798SS**  trans-147.8132.8155.700000110.8
263M31.1Very low34.9Very low190 Ų190143.9 Ų143.994%0.93679%0.794SS**  trans-73.6162.5-174.3-157.8159.18400111.3
264R38.3Very low35Very low228 Ų228140.9 Ų140.986%0.8679%0.789SS**  trans-60158.9175-65.5177.6179.2155.5-1113.5
265T30.9Very low34.7Very low113 Ų113140.7 Ų140.769%0.69379%0.788SS**  trans101.7115.7143.6-46.10000117.7
266V33Very low34.4Very low135 Ų135139.5 Ų139.582%0.81879%0.786SS**  trans-158.8109.5130.7-154.80000106.1
267E32Very low34Very low178 Ų178140 Ų14083%0.83279%0.79SS**  62.4123.675.8-96.8-175.7177.300117.3
268S27.7Very low33.7Very low116 Ų116138.4 Ų138.481%0.81179%0.79SS**  trans-169.2130.9159.1-141.20000105.3
269L31.6Very low33.3Very low135 Ų135137 Ų13771%0.70779%0.792SS**  cis-172.3135.25.7-179.271000107
270N32Very low32.9Very low129 Ų129132.9 Ų132.969%0.6979%0.788SS**  trans53.7147.9149.8-55.9-10.7000120.2
271T31.8Very low32.8Very low113 Ų113126 Ų12669%0.69378%0.778SS**  cis-168.7156.930.6-23.20000109.6
272D32.9Very low32.5Very low144 Ų144126.1 Ų126.177%0.7777%0.769SS**  trans88.990.2152.9-56.9-30.6000121.9
273T35.5Very low32.4Very low127 Ų127130.5 Ų130.578%0.77977%0.765SS**  trans-27.8174.8139.723.90000118.4
274P46.6Very low32.3Very low106 Ų106129.2 Ų129.269%0.68876%0.756SS**  cis-127.4175.2-25.428.9-7.3000110.1
275T31.4Very low31.9Very low118 Ų118123.8 Ų123.872%0.72475%0.748SS**  174.3133.679.9-41.80000108.7
276S30.7Very low31.9Very low109 Ų109123.7 Ų123.776%0.76275%0.752SS**  trans29.8125.9148.766.10000119.1
277G27.7Very low31.8Very low84 Ų84121.9 Ų121.987%0.86675%0.751SS**  cis118.2142.936.400000108.7
278G28.4Very low31.7Very low70 Ų70120.3 Ų120.372%0.72275%0.749SS**  trans117.191.9162.800000116.1
279S30.9Very low31.9Very low115 Ų115122 Ų12280%0.80474%0.744SS**  53.5146.1118-49.30000122.5
280S31Very low32Very low106 Ų106122.9 Ų122.974%0.74175%0.748SS**  trans87.4102.4147.8-57.10000115.6
281S33.1Very low31.9Very low102 Ų102119.7 Ų119.771%0.71375%0.745SS**  84.9113.781.775.70000113.5
282N32.3Very low32Very low128 Ų128121.7 Ų121.768%0.68475%0.752SS**  66.4129.4126.8-92.7-2.8000122.4
283Y30.5Very low31.9Very low194 Ų194121.8 Ų121.876%0.76176%0.758SS**  trans86140.8145.4-64.2-62.5000121.8
284H29.9Very low32.1Very low164 Ų164125.9 Ų125.976%0.75977%0.765SS**  trans96.396.5156.8-79.1-72.3000120.8
285T30.2Very low31.6Very low113 Ų113126.4 Ų126.469%0.69377%0.771SS**  33.2131.9119.843.90000121.8
286S30Very low32.2Very low112 Ų112129 Ų12978%0.78378%0.779SS**  trans95.5108.5135.3-63.60000119.7
287A32Very low32.3Very low96 Ų96128.7 Ų128.779%0.79378%0.776SS**  trans79.3135.3130.400000120.5
288N29.4Very low32.8Very low145 Ų145136.1 Ų136.178%0.77578%0.778SS**  trans96114.7153.6-92.5-12.7000120.2
289Q32.9Very low33.4Very low151 Ų151142.1 Ų142.171%0.70678%0.784SS**  trans106118.3130.7-80.5-16926.700120.1
290I32.8Very low33.7Very low154 Ų154143 Ų14379%0.7979%0.785SS**  trans84.3116.3137.4-60.8162.5000117.6
291G30.2Very low34.2Very low62 Ų62144.6 Ų144.664%0.63979%0.791SS**  130.8113.7126.900000116.8
292N33.2Very low34.3Very low156 Ų156147 Ų14783%0.83480%0.795SS**  trans80.791.4151.8-63.1-14.5000119.4
293T32Very low34.4Very low146 Ų146146.7 Ų146.790%0.89680%0.802SS**  trans-113.6117.5142.943.90000109
294K38.1Very low34.7Very low212 Ų212147.2 Ų147.292%0.92280%0.803SS**  trans-100.9109.6165.1-78.1-175.8177.4179.40107.6
295S37.1Very low35.6Very low117 Ų117151.1 Ų151.182%0.81881%0.811SS**PPolyproline II helixtrans-94.2135.317052.60000110.2
296I42.9Very low36Very low174 Ų174151.2 Ų151.289%0.89281%0.806SS**PPolyproline II helixtrans-80.4134.8177.9-80.6167.4000110.2
297S32.9Very low37Very low101 Ų101151.5 Ų151.571%0.70681%0.808SS**PPolyproline II helixtrans-72.5130.8-169.2-167.80000113.6
298R38.7Very low37.4Very low240 Ų240154 Ų15491%0.90681%0.809SS**PPolyproline II helixtrans-94.5125.5159.3-64.3-176-144.8174.46.2108.3
299K40.3Very low37.8Very low196 Ų196151.8 Ų151.885%0.85281%0.81SS**  trans-99.5114.9168.1-80.4-175.2172.7-172.80109.8
300T38.7Very low37.9Very low134 Ų134150.7 Ų150.782%0.82282%0.819SS**  trans-112.4122.9161.945.40000107.4
301T39.9Very low38.1Very low140 Ų140148.6 Ų148.686%0.85982%0.818SS**  trans-110.7110.5171.1-58.60000109.1
302L35.3Very low38.7Very low152 Ų152155 Ų15580%0.79683%0.832SS**  trans-92.9127.8170.8176.1146000107.7R304L302-R304 HydrophobicContact CD2-CB 4.05Å
303S35.4Very low39Very low121 Ų121155 Ų15585%0.84683%0.831SS**  trans-111.8114.8171.3-168.60000108.9
304R36.9Very low39.2Very low205 Ų205151.7 Ų151.777%0.77483%0.827SS**  trans-132.1114.9172.3-148.5-176.3-158.9-155.55.4106.7L302L302-R304 HydrophobicContact CD2-CB 4.05Å
305R47.8Very low39.6Very low246 Ų246147.9 Ų147.993%0.92882%0.821SS**  trans-121.5119.2159.9-92.8-173.2177.2165.6-0.4107.2
306I39.6Very low39.6Very low115 Ų115147.5 Ų147.559%0.5982%0.819SS**  trans-114.7136.7166.1-58170.9000104.7
307S50.1Low39.2Very low119 Ų119151.9 Ų151.983%0.83284%0.838SS**  trans-140.9135.3159.7-59.90000107.4
308D40.2Very low39.5Very low149 Ų149154.4 Ų154.480%0.79785%0.845SS**  trans-81.4153.4-158.7-68.2-62.6000116.1
309A38.7Very low39.6Very low98 Ų98149.9 Ų149.981%0.8184%0.842SS**  trans50124135.900000122.5
310S34.7Very low39.5Very low127 Ų127147.3 Ų147.389%0.88884%0.841SS**  -145.7133.5115.577.40000110.9
311S37.8Very low39.6Very low110 Ų110148.1 Ų148.177%0.76984%0.842SS**  trans-104.3129.7174127.50000107.4
312Q42.7Very low39.5Very low198 Ų198148.6 Ų148.693%0.92584%0.841SS**  trans-144.6104.1150.5-112.4175.519.300111
313N39Very low39.8Very low154 Ų154148.4 Ų148.482%0.82484%0.844SS**  trans-13143.2149.8-14811.9000118
314G35.8Very low40.1Very low78 Ų78150.4 Ų150.480%0.80484%0.844SS**  trans17175.8166.800000115.3
315T47.1Very low40.4Very low131 Ų131146.2 Ų146.280%0.80485%0.85SS**  trans-80.2131.4161.1400000111.8
316S36Very low39.8Very low110 Ų110137.8 Ų137.877%0.76984%0.843SS**  trans179.1122.3144.645.60000107.4
317M35.6Very low39.8Very low265 Ų265139.9 Ų139.9100%1.30587%0.866SS**  45.8095.5-75.6-149.1-168.500113.7

Retrieved 317 of 317 residues in 327.8 ms (Link to these results)