A0A096NU56_PAPAN Loading...

NK1 homeobox 2

AlphaFold DB , UniProt , Accession A0A096NU56, Species PAPAN (Papio anubis, Olive baboon), Gene NKX1-2, Length 309 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
1M42.7Very low50.2Low244 Ų244147.7 Ų147.7100%1.20286%0.857SS**  098.40-87.7168.7173.900108.1
2L48.2Very low50.2Low162 Ų162142.7 Ų142.785%0.84885%0.845SS**  trans-113.3112.2172.4-92.1138000107.1
3A49.8Very low50.4Low97 Ų97141.5 Ų141.580%0.80284%0.844SS**PPolyproline II helixtrans-72.6124.8175.600000109.2
4W49.3Very low50.6Low246 Ų246137.3 Ų137.393%0.93283%0.825SS**PPolyproline II helixtrans-89.9116.1167.8-72.476.2000107.9
5Q54.6Low50.6Low183 Ų183138.9 Ų138.986%0.85582%0.82SS**PPolyproline II helixtrans-77.3126.7179.3-15889.461.700109.9
6D46Very low51.2Low145 Ų145140.3 Ų140.378%0.77582%0.815SS**  trans15.4108.3157.5-148.8-110.1000118.5G8D6-G8 PolarHBondContact O-N 3.37Å
7G44.8Very low51.4Low75 Ų75141.2 Ų141.277%0.77381%0.807SS**  trans-73.2110.8167.600000110.7A9G7-A9 PolarHBondContact O-N 3.06Å
8G46.9Very low52.1Low67 Ų67142.5 Ų142.569%0.69181%0.809SS**  trans-52.2128.4173.100000112.5D6 K10D6-G8 PolarHBondContact O-N 3.37Å; G8-K10 PolarHBondContact O-N 3.05Å
9A54.7Low52.6Low108 Ų108140.1 Ų140.189%0.89380%0.802SS**  trans-58.3100.6174.900000110.6G7 A11G7-A9 PolarHBondContact O-N 3.06Å; A9-A11 PolarHBondContact O-N 3.06Å; A9-A11 VanDerWaalsContact O-N 3.14Å
10K54.3Low53.1Low206 Ų206139.8 Ų139.890%0.89679%0.791SS**  trans-73.8103.8172.2-156.6-177-172.9178.60107.9G8 A12G8-K10 PolarHBondContact O-N 3.05Å; K10-A12 PolarHBondContact O-N 3.16Å
11A60.5Low54.1Low92 Ų92135.7 Ų135.776%0.7677%0.772SS**  trans-49.6127.3173.700000110.3A9A9-A11 PolarHBondContact O-N 3.06Å; A9-A11 VanDerWaalsContact O-N 3.14Å
12A50.9Low55.4Low87 Ų87128.8 Ų128.872%0.71974%0.743SS**  trans-60.4144.5178.600000110.5K10 S14K10-A12 PolarHBondContact O-N 3.16Å; A12-S14 PolarHBondContact O-N 3.49Å
13P52.5Low56.5Low128 Ų128127.4 Ų127.483%0.83174%0.736SS**  trans-62.5110.9175.524.4-30.9000109.2H15P13-H15 PolarHBondContact O-N 3.22Å
14S53.2Low57.9Low82 Ų82125.1 Ų125.157%0.57371%0.71SS**  trans-59.8105.4172.645.80000108.6A12 H16A12-S14 PolarHBondContact O-N 3.49Å; S14-H16 VanDerWaalsContact C-N 3.28Å; S14-H16 PolarHBondContact O-N 3.45Å; S14-H16 PolarHBondContact OG-CE1 3.33Å; S14-H16 PolarHBondContact OG-NE2 3.2Å
15H50.8Low59.3Low162 Ų162117.6 Ų117.675%0.7569%0.687SS**  trans-65.389.7177-161.6-75.3000108.3P13 K17P13-H15 PolarHBondContact O-N 3.22Å; H15-K17 PolarHBondContact O-N 3.01Å
16H59.6Low60.4Low161 Ų161115.2 Ų115.275%0.74568%0.68SS**  trans-67.579.9171.8-63.6-46.3000108.5S14 I18S14-H16 VanDerWaalsContact C-N 3.28Å; S14-H16 PolarHBondContact O-N 3.45Å; S14-H16 PolarHBondContact OG-CE1 3.33Å; S14-H16 PolarHBondContact OG-NE2 3.2Å; H16-I18 PolarHBondContact O-N 3.45Å
17K55.5Low62Low155 Ų155111.5 Ų111.567%0.67466%0.66SS**  trans-55.5131.4157.9-71.5164.9165.2175.30105.7H15 S19H15-K17 PolarHBondContact O-N 3.01Å; K17-S19 PolarHBondContact O-N 3.43Å; K17-S19 PolarHBondContact O-OG 2.98Å
18I62.9Low63.2Low165 Ų165112.9 Ų112.985%0.84666%0.655SS**  trans-66.178171-59.6158.8000106.2H16 F20H16-I18 PolarHBondContact O-N 3.45Å; I18-F20 PolarHBondContact O-N 3.47Å; I18-F20 VanDerWaalsContact O-N 3.16Å
19S61.3Low64.1Low97 Ų97116 Ų11668%0.67865%0.652SS**  trans-80.892.6175.4-61.10000105.5K17 S21K17-S19 PolarHBondContact O-N 3.43Å; K17-S19 PolarHBondContact O-OG 2.98Å; S19-S21 PolarHBondContact O-N 3.35Å
20F62.8Low64.8Low133 Ų133115.8 Ų115.858%0.58363%0.631SS**  trans-81.699.2172.6-151.5-109.5000107I18 I25I18-F20 PolarHBondContact O-N 3.47Å; I18-F20 VanDerWaalsContact O-N 3.16Å; F20-I25 HydrophobicContact CD1-CD1 3.92Å; F20-I25 HydrophobicContact CD1-CG1 3.9Å; F20-I25 HydrophobicContact CE1-CD1 3.52Å; F20-I25 HydrophobicContact CE1-CG1 3.22Å; F20-I25 HydrophobicContact CZ-CG1 3.91Å
21S74Confident65.1Low54 Ų54113.4 Ų113.438%0.37862%0.621SS.*  trans-75.9145.1174.1-174.40000108.9S19 L23 D24S19-S21 PolarHBondContact O-N 3.35Å; S21-L23 PolarHBondContact O-N 3.12Å; S21-L23 VanDerWaalsContact O-N 3.11Å; S21-L23 PolarHBondContact OG-N 3.49Å; S21-D24 VanDerWaalsContact CB-OD2 3.27Å; S21-D24 WeakPolarHBondContact CB-OD2 3.39Å; S21-D24 PolarHBondContact N-OD2 3.47Å; S21-D24 VanDerWaalsContact O-CB 3.28Å; S21-D24 WeakPolarHBondContact O-CB 3.29Å; S21-D24 PolarHBondContact O-N 3.03Å
22V70.6Confident65.2Low100 Ų100113.7 Ų113.761%0.60661%0.613SS**Hα-helixtrans-56.4-28.2171.6167.20000111D24 I25 L26V22-D24 VanDerWaalsContact C-N 3.31Å; V22-D24 PolarHBondContact O-N 3.06Å; V22-I25 PolarHBondContact O-N 2.96Å; V22-L26 HydrophobicContact CG1-CD1 4.36Å
23L72.1Confident65.6Low132 Ų132120 Ų12069%0.69162%0.619SS**Hα-helixtrans-66.9-30174.9-77.375.2000112.5S21 I25 L26 D27S21-L23 PolarHBondContact O-N 3.12Å; S21-L23 VanDerWaalsContact O-N 3.11Å; S21-L23 PolarHBondContact OG-N 3.49Å; L23-I25 PolarHBondContact O-N 3.35Å; L23-L26 PolarHBondContact O-N 3.35Å; L23-D27 PolarHBondContact O-N 3.29Å; L23-D27 VanDerWaalsContact O-N 3.16Å
24D77.9Confident65.7Low49 Ų49118.2 Ų118.226%0.26261%0.614SS.*Hα-helixtrans-65.8-27.6175.4-72.6-68.1000112.6S21 V22 L26 K30S21-D24 VanDerWaalsContact CB-OD2 3.27Å; S21-D24 WeakPolarHBondContact CB-OD2 3.39Å; S21-D24 PolarHBondContact N-OD2 3.47Å; S21-D24 VanDerWaalsContact O-CB 3.28Å; S21-D24 WeakPolarHBondContact O-CB 3.29Å; S21-D24 PolarHBondContact O-N 3.03Å; V22-D24 VanDerWaalsContact C-N 3.31Å; V22-D24 PolarHBondContact O-N 3.06Å; D24-L26 VanDerWaalsContact C-N 3.34Å; D24-K30 HydrophobicContact CB-CD 3.97Å; D24-K30 WeakPolarHBondContact O-CD 3.47Å; D24-K30 WeakPolarHBondContact OD1-CE 3.34Å
25I80.4Confident65.9Low89 Ų89118.5 Ų118.546%0.45662%0.622SS.*Hα-helixtrans-75.8-30.6178.8-59.2171.1000110.8F20 V22 L23F20-I25 HydrophobicContact CD1-CD1 3.92Å; F20-I25 HydrophobicContact CD1-CG1 3.9Å; F20-I25 HydrophobicContact CE1-CD1 3.52Å; F20-I25 HydrophobicContact CE1-CG1 3.22Å; F20-I25 HydrophobicContact CZ-CG1 3.91Å; V22-I25 PolarHBondContact O-N 2.96Å; L23-I25 PolarHBondContact O-N 3.35Å
26L75.9Confident65.9Low132 Ų132118.9 Ų118.969%0.69163%0.628SS**Hα-helixtrans-94.8-4.9-174.8-66171.9000112.9V22 L23 D24 P28V22-L26 HydrophobicContact CG1-CD1 4.36Å; L23-L26 PolarHBondContact O-N 3.35Å; D24-L26 VanDerWaalsContact C-N 3.34Å; L26-P28 WeakPolarHBondContact O-CD 3.36Å
27D79.9Confident65.5Low68 Ų68116.7 Ų116.736%0.36463%0.628SS.*  trans-73.2109.3175.8-177.3-3000110.7L23 Q29 K30L23-D27 PolarHBondContact O-N 3.29Å; L23-D27 VanDerWaalsContact O-N 3.16Å; D27-Q29 PolarHBondContact O-N 3.03Å; D27-Q29 WeakPolarHBondContact OD1-CB 3.25Å; D27-Q29 PolarHBondContact OD1-N 3.27Å; D27-K30 HydrophobicContact CB-CB 4.07Å; D27-K30 PolarHBondContact O-N 3.27Å
28P70.4Confident65.2Low104 Ų104113.8 Ų113.868%0.67563%0.633SS**THydrogen-bonded Turntrans-66.9-17.6-178.930-35.6000113L26L26-P28 WeakPolarHBondContact O-CD 3.36Å
29Q66.8Low64.4Low131 Ų131112.4 Ų112.461%0.61263%0.632SS**THydrogen-bonded Turntrans-85.7-16.9177.7-71.1-126.4-50.900113.4D27 F31 T32D27-Q29 PolarHBondContact O-N 3.03Å; D27-Q29 WeakPolarHBondContact OD1-CB 3.25Å; D27-Q29 PolarHBondContact OD1-N 3.27Å; Q29-F31 VanDerWaalsContact C-N 3.27Å; Q29-F31 PolarHBondContact O-N 2.92Å; Q29-T32 WeakPolarHBondContact CA-OG1 3.39Å; Q29-T32 PolarHBondContact O-N 3.12Å; Q29-T32 PolarHBondContact O-OG1 2.88Å
30K67.8Low64.1Low104 Ų104119 Ų11945%0.45264%0.642SS.*THydrogen-bonded Turntrans-69.9-24.7-176.3-153.7176-164-83.30113.3D24 D27D24-K30 HydrophobicContact CB-CD 3.97Å; D24-K30 WeakPolarHBondContact O-CD 3.47Å; D24-K30 WeakPolarHBondContact OD1-CE 3.34Å; D27-K30 HydrophobicContact CB-CB 4.07Å; D27-K30 PolarHBondContact O-N 3.27Å
31F60.8Low63.2Low156 Ų156118.5 Ų118.568%0.68465%0.653SS**THydrogen-bonded Turntrans-99-10.9178.3-64.3-79.6000114Q29Q29-F31 VanDerWaalsContact C-N 3.27Å; Q29-F31 PolarHBondContact O-N 2.92Å
32T63.3Low61.6Low99 Ų99120.1 Ų120.161%0.60767%0.669SS**THydrogen-bonded Turntrans-96.3-9.2-177.655.40000113.7Q29 A34Q29-T32 WeakPolarHBondContact CA-OG1 3.39Å; Q29-T32 PolarHBondContact O-N 3.12Å; Q29-T32 PolarHBondContact O-OG1 2.88Å; T32-A34 PolarHBondContact O-N 3.44Å
33R59.5Low60.3Low220 Ų220121.5 Ų121.583%0.8368%0.68SS**  trans-8426.6177.4-72.8-172.891.9167.17.5114.9A35R33-A35 PolarHBondContact O-N 3.13Å
34A54.3Low59.2Low89 Ų89127 Ų12774%0.73669%0.692SS**  trans-72.7102.1171.400000110.6T32T32-A34 PolarHBondContact O-N 3.44Å
35A57.2Low57.8Low89 Ų89133 Ų13374%0.73672%0.718SS**  trans48.289.9147.300000117.8R33R33-A35 PolarHBondContact O-N 3.13Å
36L51.7Low55.9Low169 Ų169133.7 Ų133.789%0.88574%0.737SS**  trans-75.5127.2144.4-66.7179000107.7A38L36-A38 PolarHBondContact O-N 3.17Å; L36-A38 VanDerWaalsContact O-N 3.16Å
37P50.4Low54.5Low115 Ų115137.9 Ų137.975%0.74774%0.744SS**  trans-64.2118.9175.225.9-31.6000108.8V39P37-V39 PolarHBondContact O-N 2.74Å
38A48.7Very low52.6Low94 Ų94144 Ų14478%0.77777%0.767SS**  trans-59.2112.6169.900000108.6L36 R40L36-A38 PolarHBondContact O-N 3.17Å; L36-A38 VanDerWaalsContact O-N 3.16Å; A38-R40 PolarHBondContact O-N 2.88Å
39V47.7Very low51.2Low137 Ų137144.1 Ų144.183%0.8377%0.77SS**  trans-57.3110.5168173.70000107.1P37 P41P37-V39 PolarHBondContact O-N 2.74Å; V39-P41 VanDerWaalsContact O-CD 3.29Å; V39-P41 WeakPolarHBondContact O-CD 3.46Å
40R53.4Low50Low234 Ų234145.6 Ų145.688%0.88378%0.782SS**PPolyproline II helixtrans-69.6120.9171.6-68.6174.369.6179.52.3108.2A38A38-R40 PolarHBondContact O-N 2.88Å
41P43.9Very low48.6Very low124 Ų124144.8 Ų144.881%0.80580%0.795SS**PPolyproline II helixtrans-73.5140.5160.328.9-29.2000109.8V39V39-P41 VanDerWaalsContact O-CD 3.29Å; V39-P41 WeakPolarHBondContact O-CD 3.46Å
42A41.7Very low47.8Very low87 Ų87145.1 Ų145.172%0.71980%0.798SS**PPolyproline II helixtrans-57.1155.8-175.200000114.3R44A42-R44 PolarHBondContact O-N 3.32Å
43P43.4Very low47.3Very low129 Ų129148.1 Ų148.184%0.83881%0.809SS**PPolyproline II helixtrans-74.5121.5178.331.5-30000109.2
44R47.2Very low46.5Very low248 Ų248145.4 Ų145.494%0.93681%0.806SS**PPolyproline II helixtrans-84.7125.6166-85.7-171.3161.1136.6-2109.4A42A42-R44 PolarHBondContact O-N 3.32Å
45E48.7Very low45.8Very low174 Ų174145.4 Ų145.481%0.81381%0.806SS**PPolyproline II helixtrans-47.3134174.7-55.4-180155.100112.4
46A41.3Very low44.9Very low104 Ų104144.5 Ų144.586%0.8681%0.805SS**  trans-121.6101.1156.100000107.5
47R47.4Very low44.3Very low220 Ų220146.1 Ų146.183%0.8381%0.805SS**  trans-74.6134.9167.2-57.3173.3104.4-176.56.2108.4
48K39.5Very low43.6Very low197 Ų197147.5 Ų147.586%0.85781%0.806SS**  trans159.5103144.5-90.8160179.5-176.50108.7
49S41.4Very low43Very low106 Ų106147.5 Ų147.574%0.74181%0.806SS**  81.2131104.772.60000110.9
50L40.1Very low42.4Very low162 Ų162146.1 Ų146.185%0.84880%0.803SS**  cis177.1146.440.6-17664.4000107.8
51A39.8Very low41.3Very low88 Ų88139.5 Ų139.573%0.72779%0.792SS**  trans67.6113.8163.600000117.4
52E42.7Very low41Very low162 Ų162144.9 Ų144.976%0.75780%0.797SS**  cis69.6114.637.1-150.9169.1158.700114.3
53I54.3Low40.7Very low162 Ų162147.9 Ų147.983%0.83180%0.8SS**  trans17490151.2-83.4154.7000102
54E42.1Very low41.1Very low163 Ų163146.9 Ų146.976%0.76279%0.794SS**  39.2135.483.8-83-163.7136.500112.6
55A38.5Very low40.5Very low90 Ų90140.4 Ų140.474%0.74478%0.782SS**  cis-160.7144.88.500000103.8
56G38.4Very low39.8Very low70 Ų70142.3 Ų142.372%0.72278%0.782SS**  77.3105.575.600000111.1
57K40.6Very low39.6Very low203 Ų203146.4 Ų146.488%0.88378%0.783SS**  trans-163.4129.9146-150.665.6172.3179.50114.1
58D35.3Very low39.3Very low143 Ų143143.4 Ų143.477%0.76578%0.782SS**  trans-74.3178.8-177.3-53.6-85.8000116.5
59A35.5Very low39.2Very low94 Ų94143.4 Ų143.478%0.77779%0.786SS**  trans86.3113.8155.300000116
60S35.3Very low39.2Very low109 Ų109144.3 Ų144.376%0.76279%0.786SS**  76.3129.469-170.40000114.2
61S31.4Very low39.8Very low95 Ų95142.4 Ų142.466%0.66478%0.784SS**  trans89.4124.7149.8-74.70000121.2
62R35.8Very low39.5Very low237 Ų237145.6 Ų145.689%0.89479%0.789SS**  80.5110.2129.7-79.3175.7163.4171.4-5.5119.7
63D36.3Very low39.1Very low149 Ų149141.9 Ų141.980%0.79779%0.786SS**  trans-39.7159.1134.1-84.3-73.5000112.9
64P51.4Low38.3Very low109 Ų109139 Ų13971%0.70879%0.787SS**  cis-158.2-169.943.344.9-22.7000118.1
65V34.8Very low37.9Very low111 Ų111134.7 Ų134.767%0.67379%0.785SS**  trans96.3114.8143.1163.40000121
66R35Very low38.5Very low215 Ų215137 Ų13781%0.81179%0.793SS**  trans48.3128.9132.3-59-178.7163.4124.5-3.5123
67Q36.4Very low38.3Very low190 Ų190137.5 Ų137.589%0.88880%0.798SS**  trans-164.4112.2131.6-99.8162-800104.2
68L41.1Very low38.3Very low157 Ų157133.3 Ų133.382%0.82280%0.801SS**  52.395.550.9-147.694.2000112.7
69E36.1Very low38.2Very low197 Ų197129.5 Ų129.592%0.92180%0.795SS**  trans-155124135.3-70.8-148.7107.800110.6
70T42.8Very low38.2Very low124 Ų124134.6 Ų134.676%0.76180%0.803SS**  trans-84.9161.9158.744.50000109.2
71P52.7Low38.2Very low122 Ų122134.2 Ų134.279%0.79281%0.807SS**  -141.5140.190.424.9-3.9000112
72D32.1Very low38.7Very low155 Ų155135.2 Ų135.283%0.82981%0.814SS**  79.413870.3-157.4-106.2000115.2
73A35.5Very low39.4Very low84 Ų84129.3 Ų129.369%0.69481%0.806SS**  trans83.699.4163.400000119.9
74A38Very low39.7Very low103 Ų103130.2 Ų130.285%0.85181%0.81SS**  144.3108.9109.600000112.4
75G32.5Very low39Very low71 Ų71134.5 Ų134.573%0.73282%0.821SS**  trans-92.4-159.8149.900000109.6
76P51.9Low38.9Very low139 Ų139132.3 Ų132.390%0.90382%0.821SS**  cis-128.1175.5-31.336.6-20.5000110.6
77G33.8Very low39.4Very low81 Ų81127.5 Ų127.584%0.83582%0.82SS**  trans178.5105.6169.200000116
78A39.9Very low39.4Very low114 Ų114127.6 Ų127.694%0.94282%0.82SS**  trans-85.2156.9170.700000112
79G34.1Very low39.3Very low63 Ų63124.3 Ų124.365%0.64982%0.816SS**  trans150.394.1167.900000111
80Q36Very low39.5Very low201 Ų201123.8 Ų123.894%0.93981%0.814SS**  56.4112.296-68.6-162.675.400114.5
81A34.8Very low39.5Very low101 Ų101127.2 Ų127.284%0.83582%0.821SS**  154.5113.3125.200000111.5
82S42.2Very low39.1Very low116 Ų116130.8 Ų130.881%0.81183%0.827SS**  trans-66.2157.4148.8-47.40000108.6
83P50.2Low39.7Very low113 Ų113132.7 Ų132.773%0.73483%0.831SS**  -155.9153.381.229.2-5000119.2
84L41.6Very low39.8Very low168 Ų168136.2 Ų136.288%0.8884%0.838SS**  trans50.4118.8138.7-78.8147.5000123.7
85E37.9Very low40.1Very low199 Ų199135.5 Ų135.593%0.9383%0.833SS**  trans150131.4131.3-94.9-159.796.500106.8
86G31.6Very low40.5Very low66 Ų66141.4 Ų141.468%0.6884%0.841SS**  cis174175.97.100000105.9
87S45.8Very low40.2Very low113 Ų113141.8 Ų141.879%0.7984%0.835SS**  trans91.379167.4-550000119.3
88E36.7Very low41.1Very low192 Ų192143.2 Ų143.290%0.89783%0.83SS**  16.8120.1121.327.2-179.882.800118.9
89A38.6Very low40.7Very low89 Ų89140.9 Ų140.974%0.73682%0.817SS**  162.1112.7114.600000111.6
90E41.8Very low41Very low185 Ų185149 Ų14986%0.86483%0.828SS**  trans37.8119.5134.5-46.3-174158.300120
91E42.7Very low41.6Very low197 Ų197143.2 Ų143.292%0.92181%0.808SS**  175.3150.1115.4-90.7175-176.500111.9
92E43.4Very low41.6Very low196 Ų196149.4 Ų149.492%0.91681%0.81SS**  trans-71.6153.8-158-65.6175.5130.900116.9
93E44.3Very low41.3Very low195 Ų195155.2 Ų155.291%0.91181%0.814SS**  trans-66.5137168.7-72.5-171.5120.700112.7
94D38.7Very low40.6Very low159 Ų159160.8 Ų160.885%0.8582%0.82SS**  trans-148.2117.9141.9-162.8-122.8000112.1
95A43.8Very low40.2Very low88 Ų88161.3 Ų161.373%0.72782%0.818SS**  trans52.9122.9146.900000122.4
96E39.8Very low40.3Very low194 Ų194163.3 Ų163.391%0.90782%0.817SS**  trans-67.2137.6-177.7-58.5177.592.100116.2
97D46.6Very low40.4Very low147 Ų147164.6 Ų164.679%0.78682%0.821SS**  trans-88.4135.5149.4173.557.1000108.2G99D97-G99 PolarHBondContact OD1-N 3.47Å
98P52.2Low39.9Very low112 Ų112163.4 Ų163.473%0.72782%0.819SS**  -147.8136.111329.8-10.7000116
99G32.2Very low40Very low64 Ų64164.9 Ų164.966%0.6682%0.816SS**  trans-58.1144.6162.100000115.6D97D97-G99 PolarHBondContact OD1-N 3.47Å
100R40.1Very low39.9Very low233 Ų233167.7 Ų167.788%0.87982%0.818SS**  trans-65.2-177.4164.4-122.8-170.6165.7-120.4-0.7112
101P49.7Very low39.9Very low81 Ų81166.1 Ų166.153%0.52682%0.815SS.*  cis-135.9173.3-2127.2-5.4000113.8
102R34.2Very low40Very low231 Ų231162.5 Ų162.587%0.87281%0.808SS**  164.4129.8117.6-90.6-177.4-178.6-173.32.9116.1
103R35Very low39.6Very low237 Ų237156.5 Ų156.589%0.89480%0.799SS**  78.392.5124.9-164.3-174.2-169.2-139.33.8119.7
104R35.1Very low39.8Very low231 Ų231153.5 Ų153.587%0.87280%0.796SS**  trans-170.3141.4136.5-105.7174.5172.4177.6-4104.7
105E34.7Very low39.9Very low178 Ų178150.6 Ų150.683%0.83279%0.794SS**  cis-166.4165.540.1-137.5163.1125.700110.6
106R40Very low39.6Very low241 Ų241157.8 Ų157.891%0.90980%0.803SS**  trans-118.3120.2-179.5168.7-170.6-178.1-132.63.5107.4
107A33.1Very low39.6Very low93 Ų93154.1 Ų154.177%0.76980%0.798SS**  trans-179.3111.9154.400000108.4
108A36.1Very low39.9Very low89 Ų89152 Ų15274%0.73679%0.793SS**  98.1153.376.300000112.2
109R37.8Very low39.1Very low223 Ų223154.3 Ų154.384%0.84280%0.799SS**  trans102.692.9170.6-51.5-80.2164.3-166.4-4.3113.6
110L37.3Very low39.4Very low147 Ų147155.1 Ų155.177%0.7780%0.799SS**  75.5127.773.5-79.5169.1000116
111L41.8Very low39.7Very low153 Ų153150.2 Ų150.280%0.80180%0.798SS**  trans103.9159.2156.5-51-170.5000117.7
112P43.9Very low39.1Very low121 Ų121151.3 Ų151.379%0.78681%0.813SS**  -124.8177.8-99.3233.6000112.8
113G34.4Very low39Very low70 Ų70144 Ų14472%0.72281%0.81SS**  trans-67.9-175.9-174.300000116.6
114P49.8Very low38.9Very low132 Ų132136.9 Ų136.986%0.85780%0.802SS**  -137.4148.6120.735.4-22.7000114.4
115A40.1Very low39Very low98 Ų98133.8 Ų133.881%0.8180%0.802SS**  trans-62.9146.5164.600000111.6
116R37Very low39.2Very low239 Ų239130.2 Ų130.290%0.90280%0.803SS**  trans-15996.3157-128.9173.6167.1-167.3-4.9111.4
117S41.2Very low39.2Very low117 Ų117124.7 Ų124.782%0.81880%0.801SS**  trans-79.2149.6138-66.60000107.7
118P52.7Low39.4Very low102 Ų102123.9 Ų123.966%0.66280%0.802SS**  -148.5157.510636.3-18.7000115.2
119D34.2Very low39.6Very low161 Ų161128.2 Ų128.286%0.86181%0.807SS**  trans58.5140.8145.1-87.1-82.2000125
120A38.6Very low39.7Very low81 Ų81123.1 Ų123.167%0.66980%0.803SS**  trans-69.6-179.2175.500000113
121P46.8Very low39.6Very low130 Ų130122.6 Ų122.684%0.84481%0.81SS**  -136.4150.9103.635.4-24.2000114.9
122A36.6Very low39.7Very low103 Ų103124.2 Ų124.285%0.85181%0.813SS**  trans-79.7157.9162.600000111.5
123G32.4Very low39.3Very low78 Ų78126.4 Ų126.480%0.80482%0.818SS**  trans119.9129.8171.700000111.4
124A33.6Very low39.7Very low87 Ų87126.1 Ų126.172%0.71982%0.815SS**  cis-165.1143.614.900000109.8
125L37.9Very low39.3Very low167 Ų167124.1 Ų124.187%0.87482%0.819SS**  trans48.7113.2132.4-52.1171.2000119.7
126A37.1Very low39Very low103 Ų103123.4 Ų123.485%0.85182%0.82SS**  trans-154.7109.3134.900000110.1
127S41Very low38.9Very low125 Ų125115.7 Ų115.787%0.87482%0.815SS**  trans-60149.3172.6-49.10000112.2
128G37.1Very low39.7Very low76 Ų76116.1 Ų116.178%0.78482%0.816SS**  trans-166.379.8174.300000110.7
129E39.6Very low39.2Very low179 Ų179118.5 Ų118.584%0.83683%0.828SS**  trans-14.3140.6163.7-56-10189.600117.9
130P40.3Very low39.4Very low117 Ų117114.4 Ų114.476%0.7682%0.823SS**  trans-92.1126.4169.633.8-26000111.4
131C35.3Very low39.6Very low136 Ų136116.1 Ų116.192%0.91983%0.831SS**  trans-89.9111163.8-72.90000109.7
132E43.6Very low39.9Very low187 Ų187115.9 Ų115.987%0.87483%0.829SS**  trans-74.5141154.4-53.4-151.7114.100108.8
133D35.8Very low40.7Very low167 Ų167117.2 Ų117.289%0.89383%0.829SS**  trans-157.1127.3147.5-164.6-118.7000110.1
134G42.3Very low41Very low63 Ų63116.9 Ų116.965%0.64983%0.826SS**  trans-106153.1-176.200000113
135G43.2Very low41.4Very low91 Ų91118.6 Ų118.694%0.93883%0.833SS**  trans68.9120.4138.800000120.2
136G33.3Very low42.1Very low82 Ų82117 Ų11785%0.84583%0.832SS**  trans143.9112.8148.800000115.6
137G34.2Very low42.7Very low77 Ų77115.8 Ų115.879%0.79483%0.83SS**  trans-87.6-167.9151.200000110.2
138P59Low43Very low127 Ų127115.2 Ų115.283%0.82583%0.826SS**  cis-139.1-169.80.539.7-19000115.3
139V42.7Very low43.5Very low152 Ų152117.6 Ų117.692%0.92183%0.827SS**  trans93.4131.6151101.70000121.3
140G38Very low44.1Very low74 Ų74120.1 Ų120.176%0.76383%0.829SS**  trans143.893.3159.100000116.2
141S41.7Very low44.5Very low118 Ų118120.3 Ų120.383%0.82583%0.83SS**  trans-75.4167.3172.6-47.70000112.6
142P54.5Low45.3Very low125 Ų125125.1 Ų125.181%0.81283%0.829SS**  -147.1178.677.634.3-11.5000115.5
143P52.6Low45.7Very low130 Ų130127.8 Ų127.884%0.84483%0.831SS**  trans-102.6162.3-159.538.4-30.7000114.7
144G37.5Very low46.6Very low72 Ų72131.1 Ų131.174%0.74283%0.831SS**  trans121.4101.915400000116.4
145S43.8Very low47.1Very low123 Ų123138.9 Ų138.986%0.8684%0.841SS**  trans172.4127.4135.2-80.10000110.4
146P52.6Low47.4Very low133 Ų133140.8 Ų140.886%0.86483%0.834SS**  trans-88.413717834.5-28.7000110.3
147G48.9Very low48.6Very low78 Ų78141.5 Ų141.580%0.80482%0.822SS**  trans122.879.9162.100000116
148S46.3Very low49.5Very low113 Ų113143.6 Ų143.679%0.7982%0.821SS**  trans-165.3135.9142.5-124.40000111.4R150S148-R150 PolarHBondContact O-N 3.24Å
149P47.7Very low49.3Very low125 Ų125143.6 Ų143.681%0.81282%0.815SS**PPolyproline II helixtrans-69.3120.8-177.127-30.5000110.3
150R52.6Low49.9Very low233 Ų233141.9 Ų141.988%0.87981%0.808SS**PPolyproline II helixtrans-52.5131.5174.9-69.6178.5162.5-163.9-5.6110.5S148 R152S148-R150 PolarHBondContact O-N 3.24Å; R150-R152 PolarHBondContact O-N 2.85Å; R150-R152 VanDerWaalsContact O-N 3.15Å
151P49.2Very low51.1Low121 Ų121141.1 Ų141.179%0.78679%0.794SS**PPolyproline II helixtrans-64.1121.3168.626.8-30.1000107.4R153P151-R153 PolarHBondContact O-N 3.13Å; P151-R153 VanDerWaalsContact O-N 3.07Å
152R52.1Low52.5Low236 Ų236143.8 Ų143.889%0.89179%0.791SS**PPolyproline II helixtrans-52.4120.4174.5-74.6-162.9160.4-139.2-4.3108.3R150 R154R150-R152 PolarHBondContact O-N 2.85Å; R150-R152 VanDerWaalsContact O-N 3.15Å; R152-R154 PolarHBondContact O-N 2.99Å
153R51.4Low53.4Low244 Ų244143.8 Ų143.892%0.92179%0.791SS**  trans-35.8104.5165.3-90.9-179166.3-163.2-3.7108.1P151 R155P151-R153 PolarHBondContact O-N 3.13Å; P151-R153 VanDerWaalsContact O-N 3.07Å; R153-R155 PolarHBondContact O-N 3.45Å
154R54.6Low54.6Low237 Ų237149.1 Ų149.189%0.89479%0.794SS**  trans-56.9111.4161-84.9-172.3176.3-153.90.7104.4R152 V156R152-R154 PolarHBondContact O-N 2.99Å; R154-V156 VanDerWaalsContact C-N 3.28Å; R154-V156 PolarHBondContact O-N 3.37Å
155R52.8Low56.7Low226 Ų226157.2 Ų157.285%0.85380%0.803SS**  trans-55.899.4170.1-160.1-173-74-178.6-4.2105R153 V157R153-R155 PolarHBondContact O-N 3.45Å; R155-V157 HydrophobicContact CG-CG1 4.35Å; R155-V157 PolarHBondContact O-N 3.14Å
156V50.4Low58.5Low130 Ų130155.9 Ų155.979%0.78880%0.799SS**  trans-67.189165.9176.80000103.8R154 P158R154-V156 VanDerWaalsContact C-N 3.28Å; R154-V156 PolarHBondContact O-N 3.37Å; V156-P158 VanDerWaalsContact O-CD 3.3Å; V156-P158 WeakPolarHBondContact O-CD 3.23Å
157V57.9Low60.2Low98 Ų98161.4 Ų161.459%0.59480%0.802SS**  trans-63.1119163.4-70.70000105R155 N159R155-V157 HydrophobicContact CG-CG1 4.35Å; R155-V157 PolarHBondContact O-N 3.14Å; V157-N159 PolarHBondContact O-N 3.02Å
158P52.8Low62.1Low120 Ų120162.8 Ų162.878%0.77980%0.796SS**  trans-60108.8169.823.8-30000105.9V156 C160V156-P158 VanDerWaalsContact O-CD 3.3Å; V156-P158 WeakPolarHBondContact O-CD 3.23Å; P158-C160 VanDerWaalsContact C-N 3.26Å; P158-C160 PolarHBondContact O-N 3.22Å
159N54.8Low64.4Low128 Ų128161.9 Ų161.968%0.68480%0.795SS**  trans-67.682.7-172.2-174.753.3000109.4V157 A161V157-N159 PolarHBondContact O-N 3.02Å; N159-A161 PolarHBondContact O-N 3.2Å; N159-A161 WeakPolarHBondContact OD1-CB 3.44Å
160C55.7Low66.8Low115 Ų115158.6 Ų158.678%0.77777%0.768SS**  trans-81.234.3161.2-1630000110.5P158 K162P158-C160 VanDerWaalsContact C-N 3.26Å; P158-C160 PolarHBondContact O-N 3.22Å; C160-K162 PolarHBondContact O-N 2.79Å
161A62.6Low69Low58 Ų58151.1 Ų151.148%0.47975%0.748SS.*  trans-79.6101.1164.600000106.5N159 P163N159-A161 PolarHBondContact O-N 3.2Å; N159-A161 WeakPolarHBondContact OD1-CB 3.44Å; A161-P163 VanDerWaalsContact O-N 3.16Å
162K71.3Confident71.3Confident174 Ų174154.1 Ų154.176%0.75775%0.745SS**  trans-40.3126.2162.3-108.579.2172.8-176.60107.6C160 R164C160-K162 PolarHBondContact O-N 2.79Å; K162-R164 PolarHBondContact O-N 2.88Å
163P73.4Confident73.5Confident126 Ų126150.4 Ų150.482%0.81874%0.738SS**PPolyproline II helixtrans-51.2118.5178.6-26.833.6000109.4A161 R165A161-P163 VanDerWaalsContact O-N 3.16Å; P163-R165 PolarHBondContact O-N 3.19Å
164R79.1Confident75.8Confident241 Ų241139.9 Ų139.991%0.90970%0.699SS**PPolyproline II helixtrans-61.6133.1172-69.7-171.6-179.4-134.72106.9K162 A166K162-R164 PolarHBondContact O-N 2.88Å; R164-A166 PolarHBondContact O-N 3.43Å; R164-A166 VanDerWaalsContact O-N 3.14Å
165R80.2Confident77.9Confident243 Ų243131.9 Ų131.992%0.91767%0.674SS**PPolyproline II helixtrans-50.8125175-89.8174.5177.4157.4-1109P163 R167P163-R165 PolarHBondContact O-N 3.19Å; R165-R167 PolarHBondContact O-N 3.37Å
166A81.4Confident80Confident94 Ų94124.4 Ų124.478%0.77765%0.653SS**PPolyproline II helixtrans-55.2137.9174.500000109.2R164 T168R164-A166 PolarHBondContact O-N 3.43Å; R164-A166 VanDerWaalsContact O-N 3.14Å; A166-T168 PolarHBondContact O-N 2.68Å
167R89.9Confident82.3Confident249 Ų249119.7 Ų119.794%0.9463%0.628SS**PPolyproline II helixtrans-71.9127.2175.4-72.8179.9172.6163.8-2.6108.5R165R165-R167 PolarHBondContact O-N 3.37Å
168T88.8Confident84.3Confident108 Ų108115 Ų11566%0.66360%0.599SS**PPolyproline II helixtrans-79.5129.4170.755.90000109.5A166A166-T168 PolarHBondContact O-N 2.68Å
169A94.4Very high86.4Confident94 Ų94111 Ų11178%0.77757%0.57SS**PPolyproline II helixtrans-94.5148.6173.400000110.7
170F97.9Very high88.5Confident56 Ų56109.9 Ų109.925%0.24656%0.564CS.*PPolyproline II helixtrans-84147.3171.3-59.3-52.2000110.2Q174 L175 L202 Q206 W210F170-Q174 HydrophobicContact CB-CB 4.33Å; F170-L175 HydrophobicContact CB-CD2 3.98Å; F170-L175 HydrophobicContact CB-CG 4.1Å; F170-L175 HydrophobicContact CD2-CD2 4.21Å; F170-L202 HydrophobicContact CD1-CD1 3.9Å; F170-L202 HydrophobicContact CD1-CD2 3.7Å; F170-L202 HydrophobicContact CD1-CG 4.48Å; F170-L202 HydrophobicContact CE1-CD1 3.81Å; F170-L202 HydrophobicContact CE1-CD2 3.68Å; F170-L202 HydrophobicContact CE1-CG 4.37Å; F170-Q206 HydrophobicContact CE1-CB 4.04Å; F170-Q206 HydrophobicContact CE1-CG 4.21Å; F170-Q206 HydrophobicContact CZ-CB 3.92Å; F170-Q206 HydrophobicContact CZ-CG 4.23Å; F170-W210 AromaticContact CD2-CD1 3.68Å; F170-W210 HydrophobicContact CE2-CB 4.28Å; F170-W210 AromaticContact CE2-CD1 3.58Å; F170-W210 HydrophobicContact CE2-CG 4.3Å
171T98.3Very high90.5Very high76 Ų76109.7 Ų109.747%0.46655%0.55SS.*PPolyproline II helixtrans-70.4162.5173.871.60000110.7E173 Q174 L175T171-E173 PolarHBondContact O-N 3.47Å; T171-Q174 PolarHBondContact O-N 3.07Å; T171-Q174 VanDerWaalsContact OG1-CG 3.23Å; T171-Q174 WeakPolarHBondContact OG1-CG 3.26Å; T171-Q174 PolarHBondContact OG1-N 2.8Å; T171-Q174 PolarHBondContact OG1-OE1 3.31Å; T171-L175 WeakPolarHBondContact O-CG 3.24Å; T171-L175 PolarHBondContact O-N 3.48Å; T171-L175 VanDerWaalsContact O-N 3.1Å
172Y98Very high92.2Very high184 Ų184107.2 Ų107.272%0.72253%0.529SS*.Hα-helixtrans-59.7-45.6177.5178.5-102.6000112Q174 L175 V176Y172-Q174 VanDerWaalsContact C-N 3.32Å; Y172-Q174 PolarHBondContact O-N 3.31Å; Y172-L175 WeakPolarHBondContact O-CB 3.15Å; Y172-L175 PolarHBondContact O-N 3.37Å; Y172-L175 VanDerWaalsContact O-N 3.08Å; Y172-V176 HydrophobicContact CD1-CG2 4.04Å; Y172-V176 HydrophobicContact CD2-CG2 4.45Å; Y172-V176 HydrophobicContact CE1-CG2 3.56Å; Y172-V176 HydrophobicContact CE2-CG2 4.03Å; Y172-V176 HydrophobicContact CG-CG2 4.46Å; Y172-V176 WeakPolarHBondContact O-CG2 3.3Å; Y172-V176 PolarHBondContact O-N 2.91Å
173E98.3Very high93.5Very high157 Ų157108.1 Ų108.173%0.73453%0.527SS*.Hα-helixtrans-59.5-42178.8-62.5-172.7169.700112.3T171 L175 V176 A177T171-E173 PolarHBondContact O-N 3.47Å; E173-L175 VanDerWaalsContact C-N 3.34Å; E173-L175 PolarHBondContact O-N 3.49Å; E173-V176 PolarHBondContact O-N 3.47Å; E173-A177 PolarHBondContact O-N 2.88Å
174Q98.5Very high94.6Very high24 Ų24105.9 Ų105.911%0.11252%0.519CS..Hα-helixtrans-59.9-44.8174.5-72.7171.3-20.500111.3F170 T171 Y172 A177 L178 L200F170-Q174 HydrophobicContact CB-CB 4.33Å; T171-Q174 PolarHBondContact O-N 3.07Å; T171-Q174 VanDerWaalsContact OG1-CG 3.23Å; T171-Q174 WeakPolarHBondContact OG1-CG 3.26Å; T171-Q174 PolarHBondContact OG1-N 2.8Å; T171-Q174 PolarHBondContact OG1-OE1 3.31Å; Y172-Q174 VanDerWaalsContact C-N 3.32Å; Y172-Q174 PolarHBondContact O-N 3.31Å; Q174-A177 PolarHBondContact O-N 3.35Å; Q174-L178 WeakPolarHBondContact O-CB 3.4Å; Q174-L178 WeakPolarHBondContact O-CD1 3.41Å; Q174-L178 WeakPolarHBondContact O-CG 3.48Å; Q174-L178 PolarHBondContact O-N 3.46Å; Q174-L200 HydrophobicContact CG-CB 4.36Å; Q174-L200 PolarHBondContact NE2-O 2.93Å
175L98.4Very high95.5Very high68 Ų6896.7 Ų96.736%0.35649%0.49SS..Hα-helixtrans-63.8-41.1178.7-67.5173000112.1F170 T171 Y172 E173 L178 E179 W210F170-L175 HydrophobicContact CB-CD2 3.98Å; F170-L175 HydrophobicContact CB-CG 4.1Å; F170-L175 HydrophobicContact CD2-CD2 4.21Å; T171-L175 WeakPolarHBondContact O-CG 3.24Å; T171-L175 PolarHBondContact O-N 3.48Å; T171-L175 VanDerWaalsContact O-N 3.1Å; Y172-L175 WeakPolarHBondContact O-CB 3.15Å; Y172-L175 PolarHBondContact O-N 3.37Å; Y172-L175 VanDerWaalsContact O-N 3.08Å; E173-L175 VanDerWaalsContact C-N 3.34Å; E173-L175 PolarHBondContact O-N 3.49Å; L175-L178 PolarHBondContact O-N 3.34Å; L175-E179 VanDerWaalsContact O-CB 3.29Å; L175-E179 WeakPolarHBondContact O-CB 3.49Å; L175-E179 PolarHBondContact O-N 2.83Å; L175-W210 VanDerWaalsContact CD2-NE1 3.34Å
176V98.5Very high96.3Very high70 Ų7090.7 Ų90.742%0.42447%0.467SS..Hα-helixtrans-62.4-47.5177.6172.10000110.7Y172 E173 E179 N180Y172-V176 HydrophobicContact CD1-CG2 4.04Å; Y172-V176 HydrophobicContact CD2-CG2 4.45Å; Y172-V176 HydrophobicContact CE1-CG2 3.56Å; Y172-V176 HydrophobicContact CE2-CG2 4.03Å; Y172-V176 HydrophobicContact CG-CG2 4.46Å; Y172-V176 WeakPolarHBondContact O-CG2 3.3Å; Y172-V176 PolarHBondContact O-N 2.91Å; E173-V176 PolarHBondContact O-N 3.47Å; V176-E179 PolarHBondContact O-N 3.29Å; V176-N180 WeakPolarHBondContact O-CB 3.23Å; V176-N180 PolarHBondContact O-N 3.18Å
177A98.4Very high97.1Very high30 Ų3093.1 Ų93.125%0.24846%0.458CS..Hα-helixtrans-64.5-42.1178.800000112.6E173 Q174 N180 K181 L200E173-A177 PolarHBondContact O-N 2.88Å; Q174-A177 PolarHBondContact O-N 3.35Å; A177-N180 PolarHBondContact O-N 2.88Å; A177-K181 PolarHBondContact O-N 3.45Å; A177-L200 HydrophobicContact CB-CD1 4.01Å; A177-L200 HydrophobicContact CB-CD2 3.58Å; A177-L200 HydrophobicContact CB-CG 4.41Å
178L98.6Very high97.5Very high0 Ų082.5 Ų82.50%042%0.419CS..Hα-helixtrans-61.1-43.7175.1-73.6165.5000111.6Q174 L175 K181 F182 L196 L200 L202 V207 W210 F211Q174-L178 WeakPolarHBondContact O-CB 3.4Å; Q174-L178 WeakPolarHBondContact O-CD1 3.41Å; Q174-L178 WeakPolarHBondContact O-CG 3.48Å; Q174-L178 PolarHBondContact O-N 3.46Å; L175-L178 PolarHBondContact O-N 3.34Å; L178-K181 PolarHBondContact O-N 2.97Å; L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 2.96Å; L178-L196 HydrophobicContact CD2-CD2 3.89Å; L178-L196 HydrophobicContact CD2-CG 4.42Å; L178-L200 HydrophobicContact CD2-CD1 3.96Å; L178-L200 HydrophobicContact CG-CD1 3.77Å; L178-L202 HydrophobicContact CD1-CD1 4.23Å; L178-V207 HydrophobicContact CD2-CG1 4.21Å; L178-W210 HydrophobicContact CB-CD2 3.95Å; L178-W210 HydrophobicContact CB-CE3 3.89Å; L178-W210 HydrophobicContact CB-CH2 3.64Å; L178-W210 HydrophobicContact CB-CZ2 3.67Å; L178-W210 HydrophobicContact CB-CZ3 3.74Å; L178-W210 HydrophobicContact CD1-CD2 3.85Å; L178-W210 HydrophobicContact CD1-CE3 4.46Å; L178-W210 HydrophobicContact CD1-CG 3.85Å; L178-W210 HydrophobicContact CD2-CD2 4.37Å; L178-W210 HydrophobicContact CD2-CE3 4.22Å; L178-W210 HydrophobicContact CG-CD2 4.28Å; L178-W210 HydrophobicContact CG-CE3 4.42Å; L178-F211 HydrophobicContact CD2-CE2 4.02Å
179E98.5Very high97.9Very high36 Ų3680.1 Ų80.117%0.16841%0.407CS..Hα-helixtrans-66.6-41177.4-168.965.3-13500111.8L175 V176 F182 R183 W210 R214L175-E179 VanDerWaalsContact O-CB 3.29Å; L175-E179 WeakPolarHBondContact O-CB 3.49Å; L175-E179 PolarHBondContact O-N 2.83Å; V176-E179 PolarHBondContact O-N 3.29Å; E179-F182 WeakPolarHBondContact O-CB 3.4Å; E179-F182 PolarHBondContact O-N 3.47Å; E179-R183 WeakPolarHBondContact O-CG 3.43Å; E179-R183 PolarHBondContact O-N 3.02Å; E179-W210 HydrophobicContact CB-CH2 4.39Å; E179-R214 VanDerWaalsContact CD-NH2 3.29Å; E179-R214 IonicContact OE1-CZ 3.01Å; E179-R214 IonicContact OE1-NE 3.13Å; E179-R214 PolarHBondContact OE1-NE 2.83Å; E179-R214 VanDerWaalsContact OE1-NE 3.13Å; E179-R214 IonicContact OE1-NH1 3.88Å; E179-R214 IonicContact OE1-NH2 3.74Å; E179-R214 PolarHBondContact OE1-NH2 3.11Å; E179-R214 IonicContact OE2-CZ 3.06Å; E179-R214 IonicContact OE2-NE 2.64Å; E179-R214 PolarHBondContact OE2-NE 3.2Å; E179-R214 IonicContact OE2-NH1 3.02Å; E179-R214 PolarHBondContact OE2-NH1 3.21Å; E179-R214 IonicContact OE2-NH2 2.87Å; E179-R214 PolarHBondContact OE2-NH2 2.89Å
180N98.4Very high98.1Very high104 Ų10479.9 Ų79.956%0.55640%0.396SS*.Hα-helixtrans-61.1-46176.2-168.932.8000111.3V176 A177 F182 R183 A184V176-N180 WeakPolarHBondContact O-CB 3.23Å; V176-N180 PolarHBondContact O-N 3.18Å; A177-N180 PolarHBondContact O-N 2.88Å; N180-F182 VanDerWaalsContact C-N 3.32Å; N180-F182 PolarHBondContact O-N 3.43Å; N180-R183 PolarHBondContact O-N 3.31Å; N180-A184 PolarHBondContact O-N 2.94Å
181K98.2Very high98.1Very high111 Ų11181 Ų8148%0.48341%0.41SS..Hα-helixtrans-62.2-38.3173.7-79.8-65.5-171.3-177.80112.6A177 L178 R183 A184 T185 L196 F211A177-K181 PolarHBondContact O-N 3.45Å; L178-K181 PolarHBondContact O-N 2.97Å; K181-R183 VanDerWaalsContact C-N 3.31Å; K181-R183 PolarHBondContact O-N 3.36Å; K181-A184 WeakPolarHBondContact O-CB 3.37Å; K181-A184 PolarHBondContact O-N 3.1Å; K181-A184 VanDerWaalsContact O-N 3.17Å; K181-T185 PolarHBondContact O-N 3.45Å; K181-L196 HydrophobicContact CB-CD2 4.08Å; K181-L196 HydrophobicContact CG-CD1 3.87Å; K181-L196 HydrophobicContact CG-CD2 4.02Å; K181-F211 HydrophobicContact CB-CZ 4.26Å
182F98.4Very high98.1Very high7 Ų781.3 Ų81.33%0.03141%0.406CS..Hα-helixtrans-64-34.5178.2-174.1-97.9000113.5L178 E179 N180 A184 T185 R186 W210 F211 R214 R215 W218L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 2.96Å; E179-F182 WeakPolarHBondContact O-CB 3.4Å; E179-F182 PolarHBondContact O-N 3.47Å; N180-F182 VanDerWaalsContact C-N 3.32Å; N180-F182 PolarHBondContact O-N 3.43Å; F182-A184 VanDerWaalsContact C-N 3.29Å; F182-T185 WeakPolarHBondContact CA-O 3.26Å; F182-T185 CarbonylContact O-C 3.36Å; F182-R186 HydrophobicContact CE1-CG 4.34Å; F182-R186 HydrophobicContact CE2-CB 4.02Å; F182-R186 HydrophobicContact CE2-CG 4.28Å; F182-R186 HydrophobicContact CZ-CB 4.14Å; F182-R186 HydrophobicContact CZ-CG 3.97Å; F182-W210 HydrophobicContact CB-CH2 4.45Å; F182-W210 HydrophobicContact CB-CZ3 4.18Å; F182-F211 HydrophobicContact CB-CE1 4.24Å; F182-F211 HydrophobicContact CB-CZ 4.32Å; F182-F211 AromaticContact CD2-CD1 3.85Å; F182-F211 HydrophobicContact CD2-CD1 3.85Å; F182-F211 AromaticContact CD2-CE1 3.76Å; F182-F211 HydrophobicContact CD2-CE1 3.76Å; F182-F211 HydrophobicContact CE2-CD1 4.47Å; F182-R214 HydrophobicContact CB-CG 4.45Å; F182-R214 HydrophobicContact CD1-CG 3.72Å; F182-R214 HydrophobicContact CD2-CB 4.23Å; F182-R214 HydrophobicContact CD2-CG 3.58Å; F182-R214 HydrophobicContact CE1-CG 3.77Å; F182-R214 HydrophobicContact CE2-CB 4.16Å; F182-R214 HydrophobicContact CE2-CG 3.64Å; F182-R214 HydrophobicContact CG-CG 3.62Å; F182-R214 HydrophobicContact CZ-CG 3.74Å; F182-R215 HydrophobicContact CE2-CG 3.76Å; F182-R215 HydrophobicContact CZ-CG 4.16Å; F182-W218 HydrophobicContact CE1-CB 4.25Å; F182-W218 HydrophobicContact CE1-CG 4.17Å; F182-W218 HydrophobicContact CZ-CB 4.15Å; F182-W218 HydrophobicContact CZ-CG 4.29Å
183R97.4Very high98.2Very high192 Ų19274.8 Ų74.873%0.72538%0.38SS*.Hα-helixtrans-64.3-36.6174.4-68.5172.3-170.8174.80.7111.8E179 N180 K181E179-R183 WeakPolarHBondContact O-CG 3.43Å; E179-R183 PolarHBondContact O-N 3.02Å; N180-R183 PolarHBondContact O-N 3.31Å; K181-R183 VanDerWaalsContact C-N 3.31Å; K181-R183 PolarHBondContact O-N 3.36Å
184A97.4Very high98.2Very high79 Ų7971 Ų7165%0.65336%0.364SS*.Hα-helixtrans-72.6-49.1176.600000111.6N180 K181 F182N180-A184 PolarHBondContact O-N 2.94Å; K181-A184 WeakPolarHBondContact O-CB 3.37Å; K181-A184 PolarHBondContact O-N 3.1Å; K181-A184 VanDerWaalsContact O-N 3.17Å; F182-A184 VanDerWaalsContact C-N 3.29Å
185T97.1Very high98.2Very high49 Ų4974.1 Ų74.130%0.30138%0.382SS..  trans-140127.4178.881.90000110.8K181 F182 Y187 L188K181-T185 PolarHBondContact O-N 3.45Å; F182-T185 WeakPolarHBondContact CA-O 3.26Å; F182-T185 CarbonylContact O-C 3.36Å; T185-Y187 PolarHBondContact O-N 3.08Å; T185-Y187 PolarHBondContact OG1-O 3.37Å; T185-L188 WeakPolarHBondContact OG1-CD2 3.46Å
186R97.3Very high98.2Very high116 Ų11671.5 Ų71.544%0.43837%0.368SS..SBendtrans-75.1-17.3179.1-62.4-175.6-172.4107.97112.8F182 R215F182-R186 HydrophobicContact CE1-CG 4.34Å; F182-R186 HydrophobicContact CE2-CB 4.02Å; F182-R186 HydrophobicContact CE2-CG 4.28Å; F182-R186 HydrophobicContact CZ-CB 4.14Å; F182-R186 HydrophobicContact CZ-CG 3.97Å; R186-R215 VanDerWaalsContact O-CD 3.31Å; R186-R215 WeakPolarHBondContact O-CD 3.46Å
187Y98.1Very high98.2Very high146 Ų14668.4 Ų68.457%0.57335%0.35SS*.SBendtrans-134132-177.7-63-105000108.6T185 R215T185-Y187 PolarHBondContact O-N 3.08Å; T185-Y187 PolarHBondContact OG1-O 3.37Å; Y187-R215 VanDerWaalsContact CD1-NH1 3.28Å
188L98.1Very high98.2Very high25 Ų2573.6 Ų73.613%0.13137%0.373CS..  trans-104.3137.4177.9-62.1177000110.9T185 E192 R193 L196 V207 F211T185-L188 WeakPolarHBondContact OG1-CD2 3.46Å; L188-E192 HydrophobicContact CB-CB 4.31Å; L188-E192 HydrophobicContact CD2-CB 4.1Å; L188-R193 HydrophobicContact CB-CB 4.38Å; L188-R193 HydrophobicContact CD1-CB 4.49Å; L188-L196 HydrophobicContact CD1-CD2 3.96Å; L188-V207 HydrophobicContact CD1-CG1 4.08Å; L188-F211 HydrophobicContact CD1-CD1 4.15Å; L188-F211 HydrophobicContact CD1-CD2 3.85Å; L188-F211 HydrophobicContact CD1-CE1 3.76Å; L188-F211 HydrophobicContact CD1-CE2 3.45Å; L188-F211 VanDerWaalsContact CD1-CE2 3.45Å; L188-F211 HydrophobicContact CD1-CG 4.2Å; L188-F211 HydrophobicContact CD1-CZ 3.41Å; L188-F211 VanDerWaalsContact CD1-CZ 3.41Å; L188-F211 HydrophobicContact CD2-CE1 4.1Å; L188-F211 HydrophobicContact CD2-CZ 4.13Å; L188-F211 HydrophobicContact CG-CD1 3.99Å; L188-F211 HydrophobicContact CG-CE1 3.58Å; L188-F211 HydrophobicContact CG-CE2 4.24Å; L188-F211 HydrophobicContact CG-CG 4.48Å; L188-F211 HydrophobicContact CG-CZ 3.74Å
189S98.3Very high98.1Very high58 Ų5878.4 Ų78.441%0.40641%0.407SS..  trans-64.2166.3162.969.30000111.2C191 E192 R193S189-C191 VanDerWaalsContact C-N 3.32Å; S189-C191 PolarHBondContact O-N 3.28Å; S189-E192 VanDerWaalsContact CB-OE2 3.26Å; S189-E192 WeakPolarHBondContact CB-OE2 3.16Å; S189-E192 PolarHBondContact N-OE2 3.22Å; S189-E192 PolarHBondContact O-N 2.81Å; S189-E192 VanDerWaalsContact OG-CD 3.3Å; S189-E192 VanDerWaalsContact OG-CG 3.24Å; S189-E192 WeakPolarHBondContact OG-CG 3.45Å; S189-E192 PolarHBondContact OG-N 3.47Å; S189-E192 PolarHBondContact OG-OE2 2.92Å; S189-R193 WeakPolarHBondContact O-CB 3.33Å; S189-R193 PolarHBondContact O-N 3.35Å; S189-R193 VanDerWaalsContact O-N 3.07Å
190V98.1Very high98.1Very high89 Ų8977.9 Ų77.954%0.53941%0.405SS..Hα-helixtrans-59.6-45.3178.4-179.50000110.7R193 L194V190-R193 PolarHBondContact O-N 2.97Å; V190-L194 HydrophobicContact CG1-CD1 4.21Å; V190-L194 WeakPolarHBondContact O-CG 3.44Å; V190-L194 PolarHBondContact O-N 3.39Å
191C98.2Very high98.1Very high80 Ų8078 Ų7854%0.54141%0.413SS..Hα-helixtrans-62.5-47.8-179.9-172.20000112.1S189 R193 L194 N195S189-C191 VanDerWaalsContact C-N 3.32Å; S189-C191 PolarHBondContact O-N 3.28Å; C191-R193 VanDerWaalsContact C-N 3.28Å; C191-R193 PolarHBondContact O-N 3.37Å; C191-L194 PolarHBondContact O-N 3.46Å; C191-N195 PolarHBondContact O-N 3.43Å; C191-N195 PolarHBondContact O-ND2 2.96Å
192E98.4Very high98.1Very high82 Ų8273.8 Ų73.838%0.38340%0.396SS..Hα-helixtrans-62.2-37.9179.2-68.7166.5123.100112.3L188 S189 N195 L196L188-E192 HydrophobicContact CB-CB 4.31Å; L188-E192 HydrophobicContact CD2-CB 4.1Å; S189-E192 VanDerWaalsContact CB-OE2 3.26Å; S189-E192 WeakPolarHBondContact CB-OE2 3.16Å; S189-E192 PolarHBondContact N-OE2 3.22Å; S189-E192 PolarHBondContact O-N 2.81Å; S189-E192 VanDerWaalsContact OG-CD 3.3Å; S189-E192 VanDerWaalsContact OG-CG 3.24Å; S189-E192 WeakPolarHBondContact OG-CG 3.45Å; S189-E192 PolarHBondContact OG-N 3.47Å; S189-E192 PolarHBondContact OG-OE2 2.92Å; E192-N195 PolarHBondContact O-N 3.43Å; E192-L196 WeakPolarHBondContact O-CB 3.42Å; E192-L196 PolarHBondContact O-N 2.84Å
193R98.6Very high98.1Very high48 Ų4877.1 Ų77.118%0.18142%0.417CS..Hα-helixtrans-65.3-42177.3-167.9-168.2-59.7138.99.5111.7L188 S189 V190 C191 L196 A197 E204 V207L188-R193 HydrophobicContact CB-CB 4.38Å; L188-R193 HydrophobicContact CD1-CB 4.49Å; S189-R193 WeakPolarHBondContact O-CB 3.33Å; S189-R193 PolarHBondContact O-N 3.35Å; S189-R193 VanDerWaalsContact O-N 3.07Å; V190-R193 PolarHBondContact O-N 2.97Å; C191-R193 VanDerWaalsContact C-N 3.28Å; C191-R193 PolarHBondContact O-N 3.37Å; R193-L196 PolarHBondContact O-N 3.07Å; R193-A197 VanDerWaalsContact O-CB 3.25Å; R193-A197 WeakPolarHBondContact O-CB 3.35Å; R193-A197 PolarHBondContact O-N 3.4Å; R193-E204 HydrophobicContact CB-CG 4.46Å; R193-E204 WeakPolarHBondContact CD-O 3.38Å; R193-E204 WeakPolarHBondContact CD-OE1 3.42Å; R193-E204 HydrophobicContact CG-CG 3.78Å; R193-E204 IonicContact CZ-OE1 2.74Å; R193-E204 IonicContact NH1-OE1 3.29Å; R193-E204 PolarHBondContact NH1-OE1 2.89Å; R193-V207 HydrophobicContact CG-CB 3.97Å; R193-V207 HydrophobicContact CG-CG1 3.78Å
194L98.6Very high98.1Very high76 Ų7671.1 Ų71.140%0.39840%0.397SS..Hα-helixtrans-62.2-46.5175.9-70.7171.1000111V190 C191 L196 A197 L198 E204V190-L194 HydrophobicContact CG1-CD1 4.21Å; V190-L194 WeakPolarHBondContact O-CG 3.44Å; V190-L194 PolarHBondContact O-N 3.39Å; C191-L194 PolarHBondContact O-N 3.46Å; L194-L196 PolarHBondContact O-N 2.96Å; L194-A197 WeakPolarHBondContact O-CB 3.35Å; L194-A197 PolarHBondContact O-N 3.17Å; L194-L198 WeakPolarHBondContact O-CG 3.18Å; L194-L198 PolarHBondContact O-N 3.42Å; L194-E204 HydrophobicContact CD2-CB 4.22Å; L194-E204 HydrophobicContact CD2-CG 4.11Å
195N98.4Very high98.1Very high90 Ų9071.4 Ų71.448%0.48139%0.391SS..Hα-helixtrans-60.4-45.4178.3-68.2-19.3000111.7C191 E192 A197 L198 S199C191-N195 PolarHBondContact O-N 3.43Å; C191-N195 PolarHBondContact O-ND2 2.96Å; E192-N195 PolarHBondContact O-N 3.43Å; N195-A197 VanDerWaalsContact C-N 3.34Å; N195-A197 PolarHBondContact O-N 3.35Å; N195-L198 PolarHBondContact O-N 3.26Å; N195-S199 PolarHBondContact O-N 3.16Å; N195-S199 PolarHBondContact O-OG 3.24Å; N195-S199 VanDerWaalsContact O-OG 3.12Å
196L98.4Very high98.2Very high13 Ų1371.5 Ų71.57%0.06839%0.388CS..Hα-helixtrans-66.7-36.9179.4-169.558.8000112.5L178 K181 L188 E192 R193 L194 S199 L200 V207 F211L178-L196 HydrophobicContact CD2-CD2 3.89Å; L178-L196 HydrophobicContact CD2-CG 4.42Å; K181-L196 HydrophobicContact CB-CD2 4.08Å; K181-L196 HydrophobicContact CG-CD1 3.87Å; K181-L196 HydrophobicContact CG-CD2 4.02Å; L188-L196 HydrophobicContact CD1-CD2 3.96Å; E192-L196 WeakPolarHBondContact O-CB 3.42Å; E192-L196 PolarHBondContact O-N 2.84Å; R193-L196 PolarHBondContact O-N 3.07Å; L194-L196 PolarHBondContact O-N 2.96Å; L196-S199 PolarHBondContact O-N 3.04Å; L196-L200 HydrophobicContact CD1-CD1 3.76Å; L196-L200 HydrophobicContact CD1-CG 4.11Å; L196-L200 HydrophobicContact CG-CD1 3.98Å; L196-L200 WeakPolarHBondContact O-CB 3.43Å; L196-L200 WeakPolarHBondContact O-CG 3.31Å; L196-L200 PolarHBondContact O-N 3.42Å; L196-L200 VanDerWaalsContact O-N 3.13Å; L196-V207 HydrophobicContact CD2-CG1 4.05Å; L196-F211 HydrophobicContact CD2-CE2 3.99Å; L196-F211 HydrophobicContact CD2-CZ 4.4Å
197A98.4Very high98.2Very high6 Ų666 Ų665%0.0537%0.367CS..Hα-helixtrans-61.1-46.4175.600000111.1R193 L194 N195 L200 S201 L202 V207R193-A197 VanDerWaalsContact O-CB 3.25Å; R193-A197 WeakPolarHBondContact O-CB 3.35Å; R193-A197 PolarHBondContact O-N 3.4Å; L194-A197 WeakPolarHBondContact O-CB 3.35Å; L194-A197 PolarHBondContact O-N 3.17Å; N195-A197 VanDerWaalsContact C-N 3.34Å; N195-A197 PolarHBondContact O-N 3.35Å; A197-L200 PolarHBondContact O-N 3.19Å; A197-S201 PolarHBondContact O-N 2.87Å; A197-S201 VanDerWaalsContact O-N 3.12Å; A197-L202 CarbonylContact C-O 3.43Å; A197-L202 WeakPolarHBondContact CB-O 3.48Å; A197-L202 PolarHBondContact O-N 3.33Å; A197-L202 VanDerWaalsContact O-O 3.09Å; A197-V207 HydrophobicContact CB-CG2 3.97Å
198L98.4Very high98.2Very high139 Ų13964.7 Ų64.773%0.72837%0.365SS*.Hα-helixtrans-62.1-48.2176.5-67.9173.1000112L194 N195 L200 S201L194-L198 WeakPolarHBondContact O-CG 3.18Å; L194-L198 PolarHBondContact O-N 3.42Å; N195-L198 PolarHBondContact O-N 3.26Å; L198-L200 VanDerWaalsContact C-N 3.26Å; L198-L200 PolarHBondContact O-N 3.42Å; L198-S201 PolarHBondContact O-N 3.31Å
199S98.2Very high98.2Very high101 Ų10167.8 Ų67.871%0.70638%0.38SS*.Hα-helixtrans-63.2-30.2-178.7-58.70000113.7N195 L196N195-S199 PolarHBondContact O-N 3.16Å; N195-S199 PolarHBondContact O-OG 3.24Å; N195-S199 VanDerWaalsContact O-OG 3.12Å; L196-S199 PolarHBondContact O-N 3.04Å
200L97.9Very high98.3Very high24 Ų2466.4 Ų66.413%0.12637%0.366CS..THydrogen-bonded Turntrans-102.86.5-176.4-60.9-177.3000113.9Q174 A177 L178 L196 A197 L198 L202Q174-L200 HydrophobicContact CG-CB 4.36Å; Q174-L200 PolarHBondContact NE2-O 2.93Å; A177-L200 HydrophobicContact CB-CD1 4.01Å; A177-L200 HydrophobicContact CB-CD2 3.58Å; A177-L200 HydrophobicContact CB-CG 4.41Å; L178-L200 HydrophobicContact CD2-CD1 3.96Å; L178-L200 HydrophobicContact CG-CD1 3.77Å; L196-L200 HydrophobicContact CD1-CD1 3.76Å; L196-L200 HydrophobicContact CD1-CG 4.11Å; L196-L200 HydrophobicContact CG-CD1 3.98Å; L196-L200 WeakPolarHBondContact O-CB 3.43Å; L196-L200 WeakPolarHBondContact O-CG 3.31Å; L196-L200 PolarHBondContact O-N 3.42Å; L196-L200 VanDerWaalsContact O-N 3.13Å; A197-L200 PolarHBondContact O-N 3.19Å; L198-L200 VanDerWaalsContact C-N 3.26Å; L198-L200 PolarHBondContact O-N 3.42Å; L200-L202 HydrophobicContact CB-CD1 4.25Å; L200-L202 HydrophobicContact CB-CG 4.12Å; L200-L202 PolarHBondContact O-N 3.41Å
201S98.2Very high98.3Very high106 Ų10662.6 Ų62.674%0.74134%0.343SS*.THydrogen-bonded Turntrans50.540.2-173.360.80000113.6A197 L198A197-S201 PolarHBondContact O-N 2.87Å; A197-S201 VanDerWaalsContact O-N 3.12Å; L198-S201 PolarHBondContact O-N 3.31Å
202L97.7Very high98.3Very high23 Ų2363 Ų6312%0.1234%0.337CS..  trans-111.2163.1175.7-62.7-177.1000110.8F170 L178 A197 L200 Q206 V207F170-L202 HydrophobicContact CD1-CD1 3.9Å; F170-L202 HydrophobicContact CD1-CD2 3.7Å; F170-L202 HydrophobicContact CD1-CG 4.48Å; F170-L202 HydrophobicContact CE1-CD1 3.81Å; F170-L202 HydrophobicContact CE1-CD2 3.68Å; F170-L202 HydrophobicContact CE1-CG 4.37Å; L178-L202 HydrophobicContact CD1-CD1 4.23Å; A197-L202 CarbonylContact C-O 3.43Å; A197-L202 WeakPolarHBondContact CB-O 3.48Å; A197-L202 PolarHBondContact O-N 3.33Å; A197-L202 VanDerWaalsContact O-O 3.09Å; L200-L202 HydrophobicContact CB-CD1 4.25Å; L200-L202 HydrophobicContact CB-CG 4.12Å; L200-L202 PolarHBondContact O-N 3.41Å; L202-Q206 HydrophobicContact CB-CB 4.42Å; L202-V207 HydrophobicContact CB-CG2 4.17Å; L202-V207 HydrophobicContact CD1-CG2 4.44Å
203T98.4Very high98.3Very high77 Ų7764 Ų6447%0.47235%0.345SS..  trans-81.7151.8169.461.60000111.2T205 Q206 V207T203-T205 PolarHBondContact O-N 3.26Å; T203-T205 VanDerWaalsContact O-N 3.17Å; T203-Q206 WeakPolarHBondContact O-CB 3.1Å; T203-Q206 PolarHBondContact O-N 3.29Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.17Å; T203-Q206 VanDerWaalsContact OG1-CD 3.29Å; T203-Q206 VanDerWaalsContact OG1-CG 3.23Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.49Å; T203-Q206 PolarHBondContact OG1-N 3.02Å; T203-Q206 PolarHBondContact OG1-OE1 2.91Å; T203-V207 PolarHBondContact O-N 3.06Å; T203-V207 VanDerWaalsContact O-N 3.13Å
204E98.2Very high98.2Very high66 Ų6664 Ų6431%0.30834%0.344SS..Hα-helixtrans-51-42.5174.3-170.6-166.9161.700111.5R193 L194 Q206 V207 K208R193-E204 HydrophobicContact CB-CG 4.46Å; R193-E204 WeakPolarHBondContact CD-O 3.38Å; R193-E204 WeakPolarHBondContact CD-OE1 3.42Å; R193-E204 HydrophobicContact CG-CG 3.78Å; R193-E204 IonicContact CZ-OE1 2.74Å; R193-E204 IonicContact NH1-OE1 3.29Å; R193-E204 PolarHBondContact NH1-OE1 2.89Å; L194-E204 HydrophobicContact CD2-CB 4.22Å; L194-E204 HydrophobicContact CD2-CG 4.11Å; E204-Q206 PolarHBondContact O-N 3.26Å; E204-V207 PolarHBondContact O-N 3.05Å; E204-K208 WeakPolarHBondContact O-CB 3.43Å; E204-K208 PolarHBondContact O-N 3.45Å
205T98.1Very high98.2Very high86 Ų8663 Ų6353%0.52834%0.335SS..Hα-helixtrans-62.9-40.2178.5-60.30000112.3T203 K208 I209T203-T205 PolarHBondContact O-N 3.26Å; T203-T205 VanDerWaalsContact O-N 3.17Å; T205-K208 PolarHBondContact O-N 3.05Å; T205-I209 HydrophobicContact CG2-CD1 3.79Å; T205-I209 HydrophobicContact CG2-CG1 4.37Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.29Å; T205-I209 PolarHBondContact O-N 3Å
206Q98Very high98.1Very high50 Ų5062.6 Ų62.623%0.23434%0.336CS..Hα-helixtrans-63.7-44.8176.1-79.5165.4-43.700111.4F170 L202 T203 E204 K208 I209 W210F170-Q206 HydrophobicContact CE1-CB 4.04Å; F170-Q206 HydrophobicContact CE1-CG 4.21Å; F170-Q206 HydrophobicContact CZ-CB 3.92Å; F170-Q206 HydrophobicContact CZ-CG 4.23Å; L202-Q206 HydrophobicContact CB-CB 4.42Å; T203-Q206 WeakPolarHBondContact O-CB 3.1Å; T203-Q206 PolarHBondContact O-N 3.29Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.17Å; T203-Q206 VanDerWaalsContact OG1-CD 3.29Å; T203-Q206 VanDerWaalsContact OG1-CG 3.23Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.49Å; T203-Q206 PolarHBondContact OG1-N 3.02Å; T203-Q206 PolarHBondContact OG1-OE1 2.91Å; E204-Q206 PolarHBondContact O-N 3.26Å; Q206-K208 PolarHBondContact O-N 2.8Å; Q206-I209 PolarHBondContact O-N 3.46Å; Q206-W210 WeakPolarHBondContact O-CB 3.4Å; Q206-W210 PolarHBondContact O-N 3.45Å
207V98.4Very high98Very high0 Ų067.2 Ų67.20%036%0.356CS..Hα-helixtrans-62.1-44.3175.6-179.40000110.6L178 L188 R193 L196 A197 L202 T203 E204 I209 W210 F211L178-V207 HydrophobicContact CD2-CG1 4.21Å; L188-V207 HydrophobicContact CD1-CG1 4.08Å; R193-V207 HydrophobicContact CG-CB 3.97Å; R193-V207 HydrophobicContact CG-CG1 3.78Å; L196-V207 HydrophobicContact CD2-CG1 4.05Å; A197-V207 HydrophobicContact CB-CG2 3.97Å; L202-V207 HydrophobicContact CB-CG2 4.17Å; L202-V207 HydrophobicContact CD1-CG2 4.44Å; T203-V207 PolarHBondContact O-N 3.06Å; T203-V207 VanDerWaalsContact O-N 3.13Å; E204-V207 PolarHBondContact O-N 3.05Å; V207-I209 PolarHBondContact O-N 3.1Å; V207-W210 PolarHBondContact O-N 3.36Å; V207-F211 HydrophobicContact CG1-CD2 3.91Å; V207-F211 HydrophobicContact CG1-CE2 4.1Å; V207-F211 WeakPolarHBondContact O-CD2 3.41Å; V207-F211 PolarHBondContact O-N 3.16Å
208K98.3Very high97.9Very high120 Ų12068.4 Ų68.452%0.52236%0.359SS..Hα-helixtrans-57.5-49.1175.6173.8-179.9163.2-178.10112.1E204 T205 Q206 W210 F211 Q212E204-K208 WeakPolarHBondContact O-CB 3.43Å; E204-K208 PolarHBondContact O-N 3.45Å; T205-K208 PolarHBondContact O-N 3.05Å; Q206-K208 PolarHBondContact O-N 2.8Å; K208-W210 VanDerWaalsContact C-N 3.35Å; K208-F211 PolarHBondContact O-N 2.69Å; K208-Q212 WeakPolarHBondContact O-CB 3.31Å; K208-Q212 PolarHBondContact O-N 3.16Å
209I98.2Very high97.7Very high89 Ų8968.7 Ų68.746%0.45636%0.355SS..Hα-helixtrans-64.2-42.7179.4-69.8168.2000110.2T205 Q206 V207 Q212 N213T205-I209 HydrophobicContact CG2-CD1 3.79Å; T205-I209 HydrophobicContact CG2-CG1 4.37Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.29Å; T205-I209 PolarHBondContact O-N 3Å; Q206-I209 PolarHBondContact O-N 3.46Å; V207-I209 PolarHBondContact O-N 3.1Å; I209-Q212 PolarHBondContact O-N 3.33Å; I209-N213 WeakPolarHBondContact O-CB 3.4Å; I209-N213 VanDerWaalsContact O-CG 3.25Å; I209-N213 PolarHBondContact O-N 2.93Å; I209-N213 PolarHBondContact O-ND2 2.94Å
210W98.3Very high97.5Very high29 Ų2972.6 Ų72.611%0.1136%0.359CS..Hα-helixtrans-60.8-48.7177.9-169.898.9000111.5F170 L175 L178 E179 F182 Q206 V207 K208 Q212 N213 R214F170-W210 AromaticContact CD2-CD1 3.68Å; F170-W210 HydrophobicContact CE2-CB 4.28Å; F170-W210 AromaticContact CE2-CD1 3.58Å; F170-W210 HydrophobicContact CE2-CG 4.3Å; L175-W210 VanDerWaalsContact CD2-NE1 3.34Å; L178-W210 HydrophobicContact CB-CD2 3.95Å; L178-W210 HydrophobicContact CB-CE3 3.89Å; L178-W210 HydrophobicContact CB-CH2 3.64Å; L178-W210 HydrophobicContact CB-CZ2 3.67Å; L178-W210 HydrophobicContact CB-CZ3 3.74Å; L178-W210 HydrophobicContact CD1-CD2 3.85Å; L178-W210 HydrophobicContact CD1-CE3 4.46Å; L178-W210 HydrophobicContact CD1-CG 3.85Å; L178-W210 HydrophobicContact CD2-CD2 4.37Å; L178-W210 HydrophobicContact CD2-CE3 4.22Å; L178-W210 HydrophobicContact CG-CD2 4.28Å; L178-W210 HydrophobicContact CG-CE3 4.42Å; E179-W210 HydrophobicContact CB-CH2 4.39Å; F182-W210 HydrophobicContact CB-CH2 4.45Å; F182-W210 HydrophobicContact CB-CZ3 4.18Å; Q206-W210 WeakPolarHBondContact O-CB 3.4Å; Q206-W210 PolarHBondContact O-N 3.45Å; V207-W210 PolarHBondContact O-N 3.36Å; K208-W210 VanDerWaalsContact C-N 3.35Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.36Å; W210-N213 PolarHBondContact O-N 2.75Å; W210-R214 HydrophobicContact CE3-CB 4.01Å; W210-R214 HydrophobicContact CE3-CG 4.49Å; W210-R214 HydrophobicContact CH2-CB 4.15Å; W210-R214 HydrophobicContact CH2-CG 3.82Å; W210-R214 HydrophobicContact CZ3-CB 3.76Å; W210-R214 HydrophobicContact CZ3-CG 3.75Å; W210-R214 VanDerWaalsContact O-CB 3.31Å; W210-R214 WeakPolarHBondContact O-CB 3.39Å; W210-R214 PolarHBondContact O-N 3.4Å
211F98.6Very high97.2Very high9 Ų976.8 Ų76.84%0.03938%0.377CS..Hα-helixtrans-63.8-33.6177.2-93.4-103000112.8L178 K181 F182 L188 L196 V207 K208 R215L178-F211 HydrophobicContact CD2-CE2 4.02Å; K181-F211 HydrophobicContact CB-CZ 4.26Å; F182-F211 HydrophobicContact CB-CE1 4.24Å; F182-F211 HydrophobicContact CB-CZ 4.32Å; F182-F211 AromaticContact CD2-CD1 3.85Å; F182-F211 HydrophobicContact CD2-CD1 3.85Å; F182-F211 AromaticContact CD2-CE1 3.76Å; F182-F211 HydrophobicContact CD2-CE1 3.76Å; F182-F211 HydrophobicContact CE2-CD1 4.47Å; L188-F211 HydrophobicContact CD1-CD1 4.15Å; L188-F211 HydrophobicContact CD1-CD2 3.85Å; L188-F211 HydrophobicContact CD1-CE1 3.76Å; L188-F211 HydrophobicContact CD1-CE2 3.45Å; L188-F211 VanDerWaalsContact CD1-CE2 3.45Å; L188-F211 HydrophobicContact CD1-CG 4.2Å; L188-F211 HydrophobicContact CD1-CZ 3.41Å; L188-F211 VanDerWaalsContact CD1-CZ 3.41Å; L188-F211 HydrophobicContact CD2-CE1 4.1Å; L188-F211 HydrophobicContact CD2-CZ 4.13Å; L188-F211 HydrophobicContact CG-CD1 3.99Å; L188-F211 HydrophobicContact CG-CE1 3.58Å; L188-F211 HydrophobicContact CG-CE2 4.24Å; L188-F211 HydrophobicContact CG-CG 4.48Å; L188-F211 HydrophobicContact CG-CZ 3.74Å; L196-F211 HydrophobicContact CD2-CE2 3.99Å; L196-F211 HydrophobicContact CD2-CZ 4.4Å; V207-F211 HydrophobicContact CG1-CD2 3.91Å; V207-F211 HydrophobicContact CG1-CE2 4.1Å; V207-F211 WeakPolarHBondContact O-CD2 3.41Å; V207-F211 PolarHBondContact O-N 3.16Å; K208-F211 PolarHBondContact O-N 2.69Å; F211-R215 WeakPolarHBondContact O-CG 3.23Å; F211-R215 PolarHBondContact O-N 3.46Å; F211-R215 PolarHBondContact O-NE 3.38Å
212Q98.5Very high96.7Very high90 Ų9074.7 Ų74.742%0.42136%0.358SS..Hα-helixtrans-65.6-47.9173.5-173.859.264.700111.4K208 I209 W210 R214 R215 T216K208-Q212 WeakPolarHBondContact O-CB 3.31Å; K208-Q212 PolarHBondContact O-N 3.16Å; I209-Q212 PolarHBondContact O-N 3.33Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.36Å; Q212-R214 VanDerWaalsContact C-N 3.3Å; Q212-R214 PolarHBondContact O-N 3.27Å; Q212-R215 PolarHBondContact O-N 3.43Å; Q212-T216 PolarHBondContact O-N 2.64Å; Q212-T216 VanDerWaalsContact O-N 3.16Å; Q212-T216 PolarHBondContact O-OG1 3.45Å; Q212-T216 VanDerWaalsContact O-OG1 3.1Å
213N97.9Very high95.7Very high102 Ų10279.1 Ų79.155%0.54539%0.388SS..Hα-helixtrans-63-40.1177.3-69-19000111.4I209 W210 T216 K217I209-N213 WeakPolarHBondContact O-CB 3.4Å; I209-N213 VanDerWaalsContact O-CG 3.25Å; I209-N213 PolarHBondContact O-N 2.93Å; I209-N213 PolarHBondContact O-ND2 2.94Å; W210-N213 PolarHBondContact O-N 2.75Å; N213-T216 PolarHBondContact O-N 3.13Å; N213-K217 PolarHBondContact O-N 3.14Å
214R98Very high94.6Very high47 Ų4778.4 Ų78.418%0.17740%0.396CS..Hα-helixtrans-62.8-46.7179-173.666.9-163.5169.84.2111.9E179 F182 W210 Q212 T216 K217 W218E179-R214 VanDerWaalsContact CD-NH2 3.29Å; E179-R214 IonicContact OE1-CZ 3.01Å; E179-R214 IonicContact OE1-NE 3.13Å; E179-R214 PolarHBondContact OE1-NE 2.83Å; E179-R214 VanDerWaalsContact OE1-NE 3.13Å; E179-R214 IonicContact OE1-NH1 3.88Å; E179-R214 IonicContact OE1-NH2 3.74Å; E179-R214 PolarHBondContact OE1-NH2 3.11Å; E179-R214 IonicContact OE2-CZ 3.06Å; E179-R214 IonicContact OE2-NE 2.64Å; E179-R214 PolarHBondContact OE2-NE 3.2Å; E179-R214 IonicContact OE2-NH1 3.02Å; E179-R214 PolarHBondContact OE2-NH1 3.21Å; E179-R214 IonicContact OE2-NH2 2.87Å; E179-R214 PolarHBondContact OE2-NH2 2.89Å; F182-R214 HydrophobicContact CB-CG 4.45Å; F182-R214 HydrophobicContact CD1-CG 3.72Å; F182-R214 HydrophobicContact CD2-CB 4.23Å; F182-R214 HydrophobicContact CD2-CG 3.58Å; F182-R214 HydrophobicContact CE1-CG 3.77Å; F182-R214 HydrophobicContact CE2-CB 4.16Å; F182-R214 HydrophobicContact CE2-CG 3.64Å; F182-R214 HydrophobicContact CG-CG 3.62Å; F182-R214 HydrophobicContact CZ-CG 3.74Å; W210-R214 HydrophobicContact CE3-CB 4.01Å; W210-R214 HydrophobicContact CE3-CG 4.49Å; W210-R214 HydrophobicContact CH2-CB 4.15Å; W210-R214 HydrophobicContact CH2-CG 3.82Å; W210-R214 HydrophobicContact CZ3-CB 3.76Å; W210-R214 HydrophobicContact CZ3-CG 3.75Å; W210-R214 VanDerWaalsContact O-CB 3.31Å; W210-R214 WeakPolarHBondContact O-CB 3.39Å; W210-R214 PolarHBondContact O-N 3.4Å; Q212-R214 VanDerWaalsContact C-N 3.3Å; Q212-R214 PolarHBondContact O-N 3.27Å; R214-T216 PolarHBondContact O-N 3.27Å; R214-K217 PolarHBondContact O-N 2.95Å; R214-W218 WeakPolarHBondContact O-CB 3.28Å; R214-W218 PolarHBondContact O-N 2.9Å
215R97.5Very high93.2Very high56 Ų5678.2 Ų78.221%0.21141%0.406CS..Hα-helixtrans-60.1-43175.1-75.9-179.2-74.1151.51.4112.5F182 R186 Y187 F211 Q212 K217 W218 K219F182-R215 HydrophobicContact CE2-CG 3.76Å; F182-R215 HydrophobicContact CZ-CG 4.16Å; R186-R215 VanDerWaalsContact O-CD 3.31Å; R186-R215 WeakPolarHBondContact O-CD 3.46Å; Y187-R215 VanDerWaalsContact CD1-NH1 3.28Å; F211-R215 WeakPolarHBondContact O-CG 3.23Å; F211-R215 PolarHBondContact O-N 3.46Å; F211-R215 PolarHBondContact O-NE 3.38Å; Q212-R215 PolarHBondContact O-N 3.43Å; R215-K217 VanDerWaalsContact C-N 3.33Å; R215-K217 PolarHBondContact O-N 3.15Å; R215-W218 PolarHBondContact O-N 3.09Å; R215-K219 WeakPolarHBondContact O-CB 3.27Å; R215-K219 PolarHBondContact O-N 3.4Å
216T97.1Very high91.5Very high81 Ų8178.3 Ų78.350%0.49740%0.403SS..Hα-helixtrans-59.2-44.9176.6-57.10000111.6Q212 N213 R214 K220Q212-T216 PolarHBondContact O-N 2.64Å; Q212-T216 VanDerWaalsContact O-N 3.16Å; Q212-T216 PolarHBondContact O-OG1 3.45Å; Q212-T216 VanDerWaalsContact O-OG1 3.1Å; N213-T216 PolarHBondContact O-N 3.13Å; R214-T216 PolarHBondContact O-N 3.27Å; T216-K220 PolarHBondContact O-N 2.92Å
217K96.3Very high89.5Confident110 Ų11078.6 Ų78.648%0.47842%0.42SS..Hα-helixtrans-64.7-45.2176.8-175.6179.4175.5-178.40111.6N213 R214 R215 K219 K220 Q221N213-K217 PolarHBondContact O-N 3.14Å; R214-K217 PolarHBondContact O-N 2.95Å; R215-K217 VanDerWaalsContact C-N 3.33Å; R215-K217 PolarHBondContact O-N 3.15Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 3.29Å; K217-K220 PolarHBondContact O-N 3.29Å; K217-Q221 VanDerWaalsContact CE-NE2 3.29Å; K217-Q221 WeakPolarHBondContact O-CG 3.46Å; K217-Q221 PolarHBondContact O-N 3.43Å; K217-Q221 VanDerWaalsContact O-N 3.09Å
218W95.2Very high87.2Confident32 Ų3283.9 Ų83.912%0.12146%0.463CS..Hα-helixtrans-60.6-43.3180-177.188.9000111.8F182 R214 R215 K220 Q221 N222 A225 D226F182-W218 HydrophobicContact CE1-CB 4.25Å; F182-W218 HydrophobicContact CE1-CG 4.17Å; F182-W218 HydrophobicContact CZ-CB 4.15Å; F182-W218 HydrophobicContact CZ-CG 4.29Å; R214-W218 WeakPolarHBondContact O-CB 3.28Å; R214-W218 PolarHBondContact O-N 2.9Å; R215-W218 PolarHBondContact O-N 3.09Å; W218-K220 VanDerWaalsContact C-N 3.3Å; W218-K220 PolarHBondContact O-N 3.18Å; W218-Q221 PolarHBondContact O-N 3.27Å; W218-Q221 VanDerWaalsContact O-N 3.1Å; W218-N222 HydrophobicContact CH2-CB 4.33Å; W218-N222 HydrophobicContact CZ2-CB 4.23Å; W218-N222 PolarHBondContact NE1-ND2 3.28Å; W218-N222 PolarHBondContact O-N 2.95Å; W218-N222 PolarHBondContact O-ND2 2.96Å; W218-A225 HydrophobicContact CH2-CB 3.62Å; W218-A225 HydrophobicContact CZ2-CB 4.06Å; W218-A225 HydrophobicContact CZ3-CB 4.49Å; W218-D226 VanDerWaalsContact CH2-OD1 3.23Å; W218-D226 WeakPolarHBondContact CH2-OD1 3.47Å; W218-D226 HydrophobicContact CZ3-CB 4.42Å; W218-D226 WeakPolarHBondContact CZ3-OD1 3.44Å; W218-D226 WeakPolarHBondContact CZ3-OD2 3.36Å
219K94.8Very high85Confident145 Ų14582.3 Ų82.363%0.6347%0.472SS*.Hα-helixtrans-60.1-38.5176.1-174.1177.368.8169.80112.4R215 K217 Q221 N222R215-K219 WeakPolarHBondContact O-CB 3.27Å; R215-K219 PolarHBondContact O-N 3.4Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 3.29Å; K219-Q221 VanDerWaalsContact C-N 3.34Å; K219-N222 CarbonylContact O-C 3.59Å
220K93.4Very high82.6Confident183 Ų18387 Ų8780%0.79649%0.492SS*.Hα-helixtrans-68.7-32.8176.6-172.9176.3178.6-177.90112.4T216 K217 W218T216-K220 PolarHBondContact O-N 2.92Å; K217-K220 PolarHBondContact O-N 3.29Å; W218-K220 VanDerWaalsContact C-N 3.3Å; W218-K220 PolarHBondContact O-N 3.18Å
221Q91.5Very high80Confident111 Ų11192.8 Ų92.852%0.51953%0.531SS..Hα-helixtrans-82.2-22.9-179.7-69.8179.3-25.400113.3K217 W218 K219 P223K217-Q221 VanDerWaalsContact CE-NE2 3.29Å; K217-Q221 WeakPolarHBondContact O-CG 3.46Å; K217-Q221 PolarHBondContact O-N 3.43Å; K217-Q221 VanDerWaalsContact O-N 3.09Å; W218-Q221 PolarHBondContact O-N 3.27Å; W218-Q221 VanDerWaalsContact O-N 3.1Å; K219-Q221 VanDerWaalsContact C-N 3.34Å; Q221-P223 WeakPolarHBondContact O-CD 3.04Å
222N88.2Confident77.4Confident62 Ų6296 Ų9633%0.33257%0.567SS.*  trans-123.965-178.1-57.8-90.1000110.7W218 K219 G224 A225W218-N222 HydrophobicContact CH2-CB 4.33Å; W218-N222 HydrophobicContact CZ2-CB 4.23Å; W218-N222 PolarHBondContact NE1-ND2 3.28Å; W218-N222 PolarHBondContact O-N 2.95Å; W218-N222 PolarHBondContact O-ND2 2.96Å; K219-N222 CarbonylContact O-C 3.59Å; N222-G224 PolarHBondContact O-N 2.99Å; N222-A225 HydrophobicContact CB-CB 3.76Å; N222-A225 PolarHBondContact O-N 3.36Å
223P77.8Confident74.5Confident116 Ų11695.5 Ų95.575%0.75359%0.585SS**THydrogen-bonded Turntrans-63.9104174.428-32.3000108.8Q221Q221-P223 WeakPolarHBondContact O-CD 3.04Å
224G74.3Confident71.6Confident62 Ų6294.5 Ų94.564%0.63960%0.599SS**THydrogen-bonded Turntrans120.5-15.8177.900000115.8N222 D226 G227N222-G224 PolarHBondContact O-N 2.99Å; G224-D226 VanDerWaalsContact C-N 3.34Å; G224-D226 PolarHBondContact O-N 3.32Å; G224-G227 PolarHBondContact O-N 3.1Å
225A68.5Low69.1Low63 Ų6396.9 Ų96.952%0.52163%0.629SS.*THydrogen-bonded Turntrans-71.8-25.3-177.200000114.2W218 N222W218-A225 HydrophobicContact CH2-CB 3.62Å; W218-A225 HydrophobicContact CZ2-CB 4.06Å; W218-A225 HydrophobicContact CZ3-CB 4.49Å; N222-A225 HydrophobicContact CB-CB 3.76Å; N222-A225 PolarHBondContact O-N 3.36Å
226D62.6Low66.6Low88 Ų88100 Ų10047%0.47166%0.656SS.*THydrogen-bonded Turntrans-105.614.8174.2-72.1-12.7000111.9W218 G224W218-D226 VanDerWaalsContact CH2-OD1 3.23Å; W218-D226 WeakPolarHBondContact CH2-OD1 3.47Å; W218-D226 HydrophobicContact CZ3-CB 4.42Å; W218-D226 WeakPolarHBondContact CZ3-OD1 3.44Å; W218-D226 WeakPolarHBondContact CZ3-OD2 3.36Å; G224-D226 VanDerWaalsContact C-N 3.34Å; G224-D226 PolarHBondContact O-N 3.32Å
227G56Low64.1Low56 Ų56105.1 Ų105.158%0.57768%0.675SS**THydrogen-bonded Turntrans-9727.5-161.600000117.6G224G224-G227 PolarHBondContact O-N 3.1Å
228A50.6Low61.8Low110 Ų110106.3 Ų106.391%0.90969%0.694SS**THydrogen-bonded Turntrans-89.5-4.6168.400000113.4
229A52.6Low59.1Low87 Ų87108.4 Ų108.472%0.71973%0.725SS**SBendtrans-143.346-176.500000113.7
230Q46Very low56.5Low187 Ų187106.6 Ų106.687%0.87474%0.737SS**  trans-153.1104148.6-87.5-141.9-4700110.3
231V44.8Very low53.7Low151 Ų151102.8 Ų102.892%0.91574%0.74SS**  trans-55.3134166.9164.50000110.8
232G43.3Very low51Low78 Ų78101.7 Ų101.780%0.80476%0.758SS**  trans82.493.713700000117.1
233G38.3Very low48.5Very low78 Ų78102.7 Ų102.780%0.80478%0.783SS**  trans-177.854.2167.300000112A235G233-A235 PolarHBondContact O-N 3.29Å
234G37.9Very low46.5Very low81 Ų81101.4 Ų101.484%0.83579%0.791SS**  trans-63.6129.2177.800000112
235A44.1Very low44.6Very low98 Ų98102.5 Ų102.581%0.8180%0.802SS**  trans-137101.4157.200000107.2G233G233-A235 PolarHBondContact O-N 3.29Å
236P45.4Very low43.1Very low120 Ų120103.7 Ų103.778%0.77982%0.821SS**  trans-83.7127.8168.731.1-26.1000109.1
237Q44.8Very low41.9Very low190 Ų190103.2 Ų103.289%0.88884%0.837SS**  trans-67.2134155.4-80.4-178.6-2.700108.2
238P48.6Very low41.3Very low135 Ų135106.9 Ų106.988%0.87785%0.854SS**  trans-88.6114.7169.932.1-25.9000109.7
239G37.9Very low40.6Very low76 Ų76105.5 Ų105.578%0.78485%0.85SS**  trans-115.2132.3154.800000107.8
240A39.2Very low39.8Very low106 Ų106105.2 Ų105.288%0.87686%0.856SS**  trans-60.5145.7-165.700000116.7
241A36.4Very low39.7Very low104 Ų104101.9 Ų101.986%0.8685%0.853SS**  172.6133.9122.400000112.4
242G34.4Very low40.2Very low87 Ų87100.6 Ų100.690%0.89785%0.848SS**  trans81.8128.2161.700000115.1
243G35.4Very low40.2Very low83 Ų83100.1 Ų100.186%0.85684%0.843SS**  cis135.5107.21700000108.1
244G35.9Very low41.1Very low90 Ų90102.4 Ų102.493%0.92884%0.844SS**  trans89.5136.6157.600000118.4
245G34.1Very low41.7Very low84 Ų84104.7 Ų104.787%0.86684%0.844SS**  trans130.6105.315700000114.6
246G37.8Very low41.6Very low89 Ų89103 Ų10392%0.91884%0.836SS**  trans-72.9173-176.600000116.3
247G36Very low41.5Very low78 Ų78104.7 Ų104.780%0.80484%0.844SS**  trans171.797.2174.500000111.7
248S44Very low41.4Very low132 Ų13299.2 Ų99.292%0.92384%0.839SS**  trans-49.8141.6170.239.70000114.6
249G36.7Very low41.5Very low81 Ų8197.7 Ų97.784%0.83584%0.837SS**  trans170.8104.6161.400000115.4
250G35Very low42.3Very low81 Ų81101 Ų10184%0.83584%0.836SS**  trans84.197.5141.100000119.7
251S43.4Very low42.9Very low118 Ų118101.6 Ų101.683%0.82583%0.832SS**  trans-64.7166.8145.7-113.30000110.5
252P56Low43.2Very low124 Ų124105.2 Ų105.281%0.80583%0.828SS**  cis-137.4158.13735.6-14.9000116.3
253G43.1Very low43.8Very low68 Ų68109.1 Ų109.170%0.70182%0.823SS**  trans-80.3174.6171.700000113.9
254P57.4Low44.1Very low126 Ų126111.5 Ų111.582%0.81882%0.821SS**  trans-108.7160.3161.435.3-27.5000113.4
255P49.6Very low44.9Very low128 Ų128116 Ų11683%0.83182%0.816SS**  trans-89.1150.2-160.734.8-36.6000115.6
256G41.6Very low45.7Very low63 Ų63117.1 Ų117.165%0.64981%0.807SS**  74.4114.1124.700000121.3
257T43.9Very low46.2Very low155 Ų155118.3 Ų118.395%0.95180%0.802SS**  trans74.1113.613750.50000121
258G42.1Very low46.6Very low75 Ų75125.3 Ų125.377%0.77381%0.805SS**  trans-179.180.2162.500000110.3L260G258-L260 PolarHBondContact O-N 2.87Å
259A51.8Low46.7Very low103 Ų103123.7 Ų123.785%0.85179%0.794SS**  trans-65.8118.3176.300000110.6
260L54.2Low47.1Very low145 Ų145124.3 Ų124.376%0.75979%0.791SS**  trans-136.7125.6160.6-69.2178.8000108.9G258 F262G258-L260 PolarHBondContact O-N 2.87Å; L260-F262 HydrophobicContact CB-CD2 4.4Å; L260-F262 PolarHBondContact O-N 3.22Å; L260-F262 VanDerWaalsContact O-N 3.14Å
261P53.1Low47.4Very low120 Ų120124.8 Ų124.878%0.77979%0.787SS**  trans-84.587.5179.633.7-31.5000109.5
262F41.1Very low47.6Very low179 Ų179126.3 Ų126.379%0.78579%0.786SS**  trans-126.396.6164.4-73.9-76.3000110L260 T264L260-F262 HydrophobicContact CB-CD2 4.4Å; L260-F262 PolarHBondContact O-N 3.22Å; L260-F262 VanDerWaalsContact O-N 3.14Å; F262-T264 PolarHBondContact O-N 3.49Å
263Q46.9Very low47.3Very low170 Ų170127.2 Ų127.279%0.79479%0.789SS**  trans23.891149.7-59.8-70.727.600116.4F265Q263-F265 PolarHBondContact O-N 3.36Å
264T43Very low47.5Very low132 Ų132131.5 Ų131.581%0.8180%0.795SS**  trans-62113157.4-760000108.6F262F262-T264 PolarHBondContact O-N 3.49Å
265F51.8Low47Very low186 Ų186134.4 Ų134.482%0.81680%0.795SS**  trans-59.1137.7163.2-69.6-84.7000109.2Q263 S267Q263-F265 PolarHBondContact O-N 3.36Å; F265-S267 PolarHBondContact O-N 3.2Å
266P52.1Low46.7Very low106 Ų106134 Ų13469%0.68879%0.793SS**  trans-58.2129.7174.1-21.131.2000110.6Y268P266-Y268 PolarHBondContact O-N 3.45Å
267S48.2Very low46.9Very low114 Ų114135 Ų13580%0.79780%0.795SS**  trans-58.4110.3161.6-176.60000107.6F265 S269F265-S267 PolarHBondContact O-N 3.2Å; S267-S269 PolarHBondContact O-N 3.37Å
268Y43Very low47.5Very low225 Ų225132.9 Ų132.988%0.88279%0.793SS**  trans-68.389.8164.8-93.3-88.7000107.3P266 A270P266-Y268 PolarHBondContact O-N 3.45Å; Y268-A270 PolarHBondContact O-N 3.33Å
269S46.1Very low48Very low99 Ų99133.2 Ų133.269%0.69279%0.788SS**  trans-57.8125.6158.3-171.40000107.5S267 A271S267-S269 PolarHBondContact O-N 3.37Å; S269-A271 PolarHBondContact O-N 3.3Å
270A46.6Very low47.9Very low94 Ų94134 Ų13478%0.77779%0.787SS**  trans-58.4103.1177.600000109.2Y268 N272Y268-A270 PolarHBondContact O-N 3.33Å; A270-N272 PolarHBondContact O-N 3.07Å; A270-N272 VanDerWaalsContact O-N 3.08Å
271A40.7Very low47.4Very low90 Ų90136.8 Ų136.874%0.74479%0.794SS**  trans-66.4107.7169.300000108.4S269 V273S269-A271 PolarHBondContact O-N 3.3Å; A271-V273 PolarHBondContact O-N 3.34Å
272N47.7Very low47.2Very low151 Ų151136.8 Ų136.881%0.80779%0.794SS**  trans26.195.5143.5-60.5-31.1000115.7A270 L274A270-N272 PolarHBondContact O-N 3.07Å; A270-N272 VanDerWaalsContact O-N 3.08Å; N272-L274 VanDerWaalsContact C-N 3.33Å; N272-L274 PolarHBondContact O-N 3.22Å
273V48.8Very low47.6Very low142 Ų142136 Ų13686%0.86180%0.797SS**  trans-70.297.7156.4-158.30000106.2A271 F275A271-V273 PolarHBondContact O-N 3.34Å; V273-F275 PolarHBondContact O-N 3.41Å; V273-F275 VanDerWaalsContact O-N 3.09Å
274L47.8Very low47.6Very low158 Ų158134.2 Ų134.283%0.82780%0.798SS**  trans-65.8108.1169.6-148.778.6000106.9N272 P276N272-L274 VanDerWaalsContact C-N 3.33Å; N272-L274 PolarHBondContact O-N 3.22Å; L274-P276 VanDerWaalsContact O-CD 3.28Å; L274-P276 WeakPolarHBondContact O-CD 3.41Å
275F46.5Very low47.5Very low188 Ų188131.2 Ų131.283%0.82579%0.786SS**  trans-70.7117.8170.7-144.9-89.4000107.5V273 A277V273-F275 PolarHBondContact O-N 3.41Å; V273-F275 VanDerWaalsContact O-N 3.09Å; F275-A277 PolarHBondContact O-N 3.14Å
276P44.6Very low47.6Very low120 Ų120127.4 Ų127.478%0.77979%0.789SS**  trans-74.8109.4163.8-10.728.7000107.2L274L274-P276 VanDerWaalsContact O-CD 3.28Å; L274-P276 WeakPolarHBondContact O-CD 3.41Å
277A46.1Very low47.3Very low83 Ų83130.9 Ų130.969%0.68679%0.793SS**  trans-55.1148.316400000109.9F275 A279F275-A277 PolarHBondContact O-N 3.14Å; A277-A279 PolarHBondContact O-N 3.28Å
278A54.9Low47.3Very low111 Ų111131.8 Ų131.892%0.91780%0.797SS**  trans-45.4111.8179.100000112.1
279A52.3Low48.1Very low81 Ų81124.8 Ų124.867%0.66979%0.793SS**  trans-107116.4165.100000107.7A277 F281A277-A279 PolarHBondContact O-N 3.28Å; A279-F281 PolarHBondContact O-N 3.09Å
280S51Low48.4Very low119 Ų119124.3 Ų124.383%0.83279%0.79SS**PPolyproline II helixtrans-50.1122.4171.4-56.60000110.1P282S280-P282 VanDerWaalsContact O-CD 3.3Å; S280-P282 WeakPolarHBondContact O-CD 3.28Å
281F42.9Very low49.1Very low204 Ų204126 Ų12690%0.89579%0.792SS**PPolyproline II helixtrans-71.9121.1173.3-75-83.1000109.7A279A279-F281 PolarHBondContact O-N 3.09Å
282P49.8Very low49.9Very low120 Ų120130.6 Ų130.678%0.77980%0.796SS**PPolyproline II helixtrans-73.5134.8166.929.7-31.4000110.2S280S280-P282 VanDerWaalsContact O-CD 3.3Å; S280-P282 WeakPolarHBondContact O-CD 3.28Å
283L48.8Very low50.6Low164 Ų164127.6 Ų127.686%0.85979%0.792SS**PPolyproline II helixtrans-56.6152.7161.2-99.3131.1000111.1
284T46.1Very low51.2Low132 Ų132126.3 Ų126.381%0.8179%0.787SS**  trans80110.1159.9-66.10000117.5
285A42.7Very low51.8Low69 Ų69128.5 Ų128.557%0.5779%0.79SS**  169.4120.2107.200000110F287A285-F287 HydrophobicContact CB-CD2 4.41Å; A285-F287 HydrophobicContact CB-CE2 4.13Å; A285-F287 PolarHBondContact O-N 3.08Å
286A53.1Low52.5Low105 Ų105127.2 Ų127.287%0.86879%0.791SS**  trans-65.8118.3170.200000109.8
287F45.3Very low52.7Low179 Ų179124.7 Ų124.779%0.78579%0.787SS**  trans-110.8134.5164.1-81.7-81.7000109.5A285 G289A285-F287 HydrophobicContact CB-CD2 4.41Å; A285-F287 HydrophobicContact CB-CE2 4.13Å; A285-F287 PolarHBondContact O-N 3.08Å; F287-G289 PolarHBondContact O-N 3.47Å
288P49Very low53.1Low133 Ų133127 Ų12786%0.86480%0.795SS**THydrogen-bonded Turntrans-79.1120.4-177.832.3-30.2000109
289G58.9Low53.1Low78 Ų78126 Ų12680%0.80478%0.781SS**THydrogen-bonded Turntrans144.22173.900000116.9F287F287-G289 PolarHBondContact O-N 3.47Å
290S52.7Low53.1Low90 Ų90132.1 Ų132.163%0.62979%0.788SS**  trans-80.7129.4174.4-175.10000111.4F292S290-F292 PolarHBondContact O-N 3.04Å
291P60.8Low53Low128 Ų128134.8 Ų134.883%0.83179%0.793SS**SBendtrans-776.5179.731.5-35.2000114.2A293P291-A293 PolarHBondContact O-N 2.87Å
292F59Low53.9Low188 Ų188130.7 Ų130.783%0.82579%0.785SS**  trans-9185.2170.6-96.1-90.6000110.1S290 P294S290-F292 PolarHBondContact O-N 3.04Å; F292-P294 WeakPolarHBondContact O-CD 3.3Å
293A60.5Low54.4Low88 Ų88130.5 Ų130.573%0.72778%0.783SS**  trans-71.2124.116500000109.5P291 F295P291-A293 PolarHBondContact O-N 2.87Å; A293-F295 PolarHBondContact O-N 2.92Å
294P63.3Low54.4Low114 Ų114132 Ų13274%0.7478%0.783SS**  trans-72114.8164.928.2-30.4000108.9F292 L296F292-P294 WeakPolarHBondContact O-CD 3.3Å; P294-L296 PolarHBondContact O-N 3.06Å
295F60.2Low54.9Low205 Ų205137.3 Ų137.390%0.89979%0.79SS**  trans-72.960.3172.1-174.6-99.5000110.9A293A293-F295 PolarHBondContact O-N 2.92Å
296L61.4Low55.5Low160 Ų160137.4 Ų137.484%0.83879%0.791SS**  trans-140.689171.1-76.2168000107.9P294P294-L296 PolarHBondContact O-N 3.06Å
297G48.3Very low56Low68 Ų68138.5 Ų138.570%0.70179%0.789SS**  trans-68.613517000000110.4S299G297-S299 PolarHBondContact O-N 3.2Å
298P54.9Low56.4Low130 Ų130138.2 Ų138.284%0.84479%0.79SS**  trans-83.7101.4171.732.5-27.1000107.4
299S53.9Low56.5Low91 Ų91142.8 Ų142.864%0.63681%0.806SS**  trans-141.5123.9169.5-58.40000108.8G297G297-S299 PolarHBondContact O-N 3.2Å
300Y53.7Low56.4Low209 Ų209146.1 Ų146.182%0.8281%0.806SS**  trans87.262.6170.5-50-76.3000117.1
301L48.1Very low56.6Low176 Ų176149 Ų14992%0.92182%0.815SS**  trans-104.596.1142.8-134.186.4000107.7
302T62.4Low56.4Low118 Ų118150.2 Ų150.272%0.72482%0.815SS**  trans-114.7116.4168.150.50000108.1
303P59.2Low56.2Low116 Ų116147.9 Ų147.975%0.75381%0.814SS**  trans-99.9103.2161.232.6-21.4000108.1
304F48.2Very low56Low195 Ų195151.7 Ų151.786%0.85582%0.819SS**  trans-141.676.7166.4-122.2-87.8000108.9
305Y57.8Low55.5Low243 Ų243154.2 Ų154.295%0.95383%0.825SS**  trans-92106.9154-102.2-88.3000106.8
306A54.9Low55.1Low72 Ų72150.6 Ų150.660%0.59582%0.819SS**  trans-106.3140.1156.100000107.4
307P64.5Low54.7Low127 Ų127149.8 Ų149.883%0.82582%0.818SS**  trans-82.4144.9-174.433.8-32.4000110.8
308H52.1Low55.2Low173 Ų173156.7 Ų156.780%0.80183%0.828SS**  trans-126118.2164.7-152.7-84.4000108.7
309L52.7Low55.2Low230 Ų230159.1 Ų159.1100%1.20483%0.826SS**  trans68.40169.9-67160.3000118.1

Retrieved 309 of 309 residues in 49.8 ms (Link to these results)