A0A087YBJ1_POEFO Loading...

Homeobox protein engrailed-like

AlphaFold DB (A0A3B3VDA9), UniProt , Accession A0A087YBJ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 268 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M36.7Very low44.2Very low218 Ų218154 Ų154100%1.07481%0.805SS**  063.40-58.8174.9-172.100106.2
2E46.5Very low44.1Very low176 Ų176152.6 Ų152.682%0.82281%0.807SS**  60.8136.162.4-63.6152.5117.100109.9
3E45.1Very low43.9Very low198 Ų198151 Ų15193%0.92579%0.792SS**  cis-131.1171.932.6-68.5168.9116.700114.7
4N47Very low43.8Very low154 Ų154153.6 Ų153.682%0.82479%0.786SS**  trans-132.8113.4-179.5168.9101.1000108.3
5D51Low43.4Very low132 Ų132154.1 Ų154.171%0.70678%0.784SS**  trans-159.6168.7164.8-151.4-87.2000113.2
6H48.8Very low43.3Very low180 Ų180156.4 Ų156.483%0.83379%0.791SS**  trans91117170.8-49.793.3000118.8
7G41.3Very low43Very low73 Ų73153.4 Ų153.475%0.75379%0.788SS**  trans146.543.7167.600000114.9
8N38.5Very low43.4Very low138 Ų138150.8 Ų150.874%0.73879%0.793SS**  54.8114.496.4-172.334.3000115.9
9R44.2Very low43.5Very low215 Ų215149.2 Ų149.281%0.81179%0.785SS**  -178.7125.5119.4-98.3179.9165.8144.8-1113.3
10D43.4Very low43.8Very low126 Ų126151.8 Ų151.867%0.67479%0.793SS**  trans45.7119145.2-49.8-56.7000119.4
11A43.8Very low44Very low84 Ų84149.9 Ų149.969%0.69479%0.792SS**  58.3127.760.500000112.2
12V43.3Very low44.5Very low137 Ų137145.7 Ų145.783%0.8377%0.774SS**  cis-166.4168.94.6-98.50000108.1
13E41.6Very low44.7Very low132 Ų132149.1 Ų149.162%0.61778%0.78SS**  cis-153.8-166.40.3-132.8-162.9158.800109.9
14R41.5Very low44.7Very low188 Ų188144 Ų14471%0.70977%0.771SS**  trans11.8158.6143.5-68.1-175.3-155-161.58122.5
15Q38.3Very low44.6Very low160 Ų160144.4 Ų144.475%0.74877%0.771SS**  cis173.3131-14.9171176.1-55.200106.1
16E41.6Very low44.5Very low191 Ų191145.5 Ų145.589%0.89378%0.776SS**  trans157.4155.9165.4-95.3164.2-163.800108
17S39Very low44.2Very low106 Ų106142.4 Ų142.474%0.74177%0.772SS**  cis-156.8154.4-27.952.10000107.2D19S17-D19 PolarHBondContact O-N 3.37Å
18A48.8Very low44.2Very low107 Ų107147.3 Ų147.388%0.88478%0.78SS**  trans-84.7100.8-177.900000111.7
19D47.1Very low44.4Very low120 Ų120148.7 Ų148.764%0.64279%0.787SS**  trans-158.397153.9-146.8-45.1000112.6S17 N22S17-D19 PolarHBondContact O-N 3.37Å; D19-N22 PolarHBondContact OD1-ND2 2.87Å
20E48.2Very low44.1Very low201 Ų201146.9 Ų146.994%0.93979%0.788SS**  trans-139.634.4162.6-144.3166.9177.500111.5
21S49.4Very low44.1Very low112 Ų112144.3 Ų144.378%0.78378%0.784SS**  trans-103.938.9-179.3-167.10000112.3
22N46.1Very low43.9Very low129 Ų129146.9 Ų146.969%0.6979%0.794SS**  trans-137.145.7-172-84-62.4000114.6D19 A24D19-N22 PolarHBondContact OD1-ND2 2.87Å; N22-A24 PolarHBondContact O-N 2.84Å
23R50.2Low43.6Very low249 Ų249143.7 Ų143.794%0.9479%0.788SS**  trans-77.4101.4160.4-87.1-166.1171.3-139.3-2.5110.2I25R23-I25 PolarHBondContact O-N 2.94Å
24A45.5Very low43.9Very low89 Ų89144 Ų14474%0.73679%0.794SS**  trans-51.2129-173.300000114.5N22N22-A24 PolarHBondContact O-N 2.84Å
25I45.8Very low44.1Very low163 Ų163142.6 Ų142.684%0.83680%0.8SS**  trans-81.8113164.9-62.2172.8000107.3R23 P27R23-I25 PolarHBondContact O-N 2.94Å; I25-P27 WeakPolarHBondContact O-CD 3.41Å
26L48.8Very low44.8Very low155 Ų155142.8 Ų142.881%0.81280%0.801SS**  trans-76.9124.5171.6-70175.1000110.1L28L26-L28 PolarHBondContact O-N 2.95Å
27P41.8Very low45.4Very low116 Ų116140.6 Ų140.675%0.75379%0.793SS**  trans-82.496.617532.1-31.4000110I25I25-P27 WeakPolarHBondContact O-CD 3.41Å
28L40.8Very low46.2Very low175 Ų175139.2 Ų139.292%0.91678%0.782SS**PPolyproline II helixtrans-79.5126173.1-162.272.4000110.6L26L26-L28 PolarHBondContact O-N 2.95Å
29L42.5Very low46.6Very low168 Ų168142.6 Ų142.688%0.8878%0.779SS**PPolyproline II helixtrans-67152.7-172.8-130.966.7000113.9
30Q39.3Very low46.9Very low177 Ų177144.7 Ų144.783%0.82778%0.778SS**PPolyproline II helixtrans-81125.6-176.617675.47.900113
31A41.9Very low47.5Very low72 Ų72141.5 Ų141.560%0.59577%0.772SS**  trans38.6140.214700000121.2
32P41.1Very low48.3Very low138 Ų138139.9 Ų139.990%0.89676%0.758SS**  -138.9136.575.536.1-21.1000114.9
33G36.1Very low49.5Very low69 Ų69140.2 Ų140.271%0.71176%0.76SS**  trans-16877.8177.900000111L35G33-L35 PolarHBondContact O-N 3.34Å
34N48.8Very low50.4Low140 Ų140134.8 Ų134.875%0.74974%0.743SS**  trans-72.573.8-177.6-174.913.3000111.8Q36N34-Q36 PolarHBondContact O-N 3.02Å
35L46Very low52Low158 Ų158134.7 Ų134.783%0.82773%0.726SS**  trans-90.692162.3-79.8163.9000108G33 I37G33-L35 PolarHBondContact O-N 3.34Å; L35-I37 PolarHBondContact O-N 3.24Å
36Q51.3Low53.5Low163 Ų163132.7 Ų132.776%0.76272%0.716SS**  trans-54.6110.3165.3-63.1-176.530.600108.1N34 P38N34-Q36 PolarHBondContact O-N 3.02Å; Q36-P38 WeakPolarHBondContact O-CD 3.28Å
37I55.6Low54.9Low145 Ų145130.6 Ų130.674%0.74471%0.705SS**  trans-77.6105.4169.4-60.1168.3000105.5L35 H39L35-I37 PolarHBondContact O-N 3.24Å; I37-H39 PolarHBondContact O-N 3.38Å
38P56.3Low56.5Low78 Ų78127.8 Ų127.851%0.50668%0.684SS.*  trans-65.4127.9177.229-34000107.8Q36 R40Q36-P38 WeakPolarHBondContact O-CD 3.28Å; P38-R40 PolarHBondContact O-N 3.18Å
39H56.1Low58.3Low177 Ų177124 Ų12482%0.81966%0.664SS**  trans-65.374.9178.8-72.9-88.4000111.7I37 V41I37-H39 PolarHBondContact O-N 3.38Å; H39-V41 VanDerWaalsContact C-N 3.29Å; H39-V41 PolarHBondContact O-N 3.41Å
40R53.1Low60.1Low164 Ų164122.3 Ų122.362%0.61966%0.655SS**  trans-75.478.7177.6-80-170.5172.8-118.79111.1P38P38-R40 PolarHBondContact O-N 3.18Å
41V60.5Low62Low134 Ų134120.3 Ų120.381%0.81264%0.64SS**SBendtrans-86.3-22.8162.9-175.20000110.8H39H39-V41 VanDerWaalsContact C-N 3.29Å; H39-V41 PolarHBondContact O-N 3.41Å
42T67.7Low63.8Low79 Ų79122.5 Ų122.549%0.48565%0.648SS.*SBendtrans-145.4172178.174.10000111.1F44T42-F44 PolarHBondContact O-N 2.97Å; T42-F44 PolarHBondContact OG1-N 2.92Å
43N70.3Confident65.4Low136 Ų136119.3 Ų119.373%0.72762%0.623SS**SBendtrans-76.812.6174.5-69.5-29.4000114.2
44F69.6Low67.4Low134 Ų134121.3 Ų121.359%0.58861%0.613SS**  trans-105.1125.9174.2-59.8-81.4000110T42T42-F44 PolarHBondContact O-N 2.97Å; T42-F44 PolarHBondContact OG1-N 2.92Å
45F79.6Confident68.4Low88 Ų88118.1 Ų118.139%0.38661%0.613SS.*  trans-74.9156.1167.9-60.8-88.3000110D47 N48F45-D47 PolarHBondContact O-N 3.41Å; F45-N48 PolarHBondContact N-ND2 3.13Å; F45-N48 WeakPolarHBondContact O-CB 3.5Å; F45-N48 PolarHBondContact O-N 2.92Å; F45-N48 VanDerWaalsContact O-N 3.08Å
46I76Confident69.9Low120 Ų120119.8 Ų119.862%0.61561%0.608SS**Hα-helixtrans-57.8-41.6173.5-62.8172.3000109.3N48 I49 L50I46-N48 PolarHBondContact O-N 2.76Å; I46-I49 PolarHBondContact O-N 3.36Å; I46-L50 HydrophobicContact CG2-CD1 3.81Å; I46-L50 HydrophobicContact CG2-CG 4.36Å; I46-L50 PolarHBondContact O-N 2.66Å
47D77.9Confident70.3Confident111 Ų111120.3 Ų120.359%0.59461%0.608SS**Hα-helixtrans-57.5-33.9177.1-46.2-50.3000112.6F45 I49 L50 R51F45-D47 PolarHBondContact O-N 3.41Å; D47-I49 VanDerWaalsContact C-N 3.28Å; D47-I49 PolarHBondContact O-N 3.02Å; D47-L50 PolarHBondContact O-N 2.81Å; D47-R51 WeakPolarHBondContact O-CG 3.47Å; D47-R51 PolarHBondContact O-N 3.28Å
48N76.6Confident70.6Confident58 Ų58122.3 Ų122.331%0.3161%0.611SS.*Hα-helixtrans-64.7-33177.6-67.7-5.5000112.2F45 I46 F54F45-N48 PolarHBondContact N-ND2 3.13Å; F45-N48 WeakPolarHBondContact O-CB 3.5Å; F45-N48 PolarHBondContact O-N 2.92Å; F45-N48 VanDerWaalsContact O-N 3.08Å; I46-N48 PolarHBondContact O-N 2.76Å; N48-F54 WeakPolarHBondContact O-CD2 3.31Å; N48-F54 WeakPolarHBondContact O-CG 3.25Å
49I77.5Confident70.4Confident96 Ų96125.1 Ų125.149%0.49262%0.622SS.*Hα-helixtrans-81.9-28.4-178.7-57.5174.3000110.7I46 D47 F54I46-I49 PolarHBondContact O-N 3.36Å; D47-I49 VanDerWaalsContact C-N 3.28Å; D47-I49 PolarHBondContact O-N 3.02Å; I49-F54 HydrophobicContact CB-CD1 4.44Å; I49-F54 HydrophobicContact CB-CE1 4.26Å; I49-F54 HydrophobicContact CB-CZ 4.4Å; I49-F54 HydrophobicContact CG1-CE1 4.31Å; I49-F54 HydrophobicContact CG1-CE2 4.35Å; I49-F54 HydrophobicContact CG1-CZ 4Å; I49-F54 HydrophobicContact CG2-CD1 4.06Å; I49-F54 HydrophobicContact CG2-CE1 3.82Å; I49-F54 HydrophobicContact CG2-CZ 4.37Å; I49-F54 WeakPolarHBondContact O-CD1 3.33Å
50L80.9Confident70.2Confident131 Ų131122.1 Ų122.169%0.68662%0.616SS**Hα-helixtrans-84.3-5.7180-66.6174.6000114.1I46 D47I46-L50 HydrophobicContact CG2-CD1 3.81Å; I46-L50 HydrophobicContact CG2-CG 4.36Å; I46-L50 PolarHBondContact O-N 2.66Å; D47-L50 PolarHBondContact O-N 2.81Å
51R80.3Confident69.5Low136 Ų136117.5 Ų117.551%0.51362%0.619SS.*SBendtrans-65.1138.4179.2-49-177.463.7-111.7-0.6110.4D47 D53 F54D47-R51 WeakPolarHBondContact O-CG 3.47Å; D47-R51 PolarHBondContact O-N 3.28Å; R51-D53 WeakPolarHBondContact CB-OD1 3.49Å; R51-D53 IonicContact CZ-OD1 3.32Å; R51-D53 IonicContact CZ-OD2 3.43Å; R51-D53 IonicContact NE-OD1 3.89Å; R51-D53 IonicContact NH1-OD1 2.85Å; R51-D53 PolarHBondContact NH1-OD1 3.29Å; R51-D53 IonicContact NH1-OD2 2.71Å; R51-D53 PolarHBondContact NH1-OD2 2.97Å; R51-D53 IonicContact NH2-OD1 3.85Å; R51-D53 IonicContact NH2-OD2 3.46Å; R51-D53 PolarHBondContact NH2-OD2 3.3Å; R51-D53 PolarHBondContact O-N 3.08Å; R51-F54 VanDerWaalsContact O-CB 3.28Å; R51-F54 WeakPolarHBondContact O-CB 3.5Å; R51-F54 PolarHBondContact O-N 3.46Å
52P78.4Confident68.8Low118 Ų118116 Ų11677%0.76662%0.621SS**THydrogen-bonded Turntrans-60-18.8-179.1-25.934.8000115.5R56P52-R56 PolarHBondContact O-NE 3.44Å
53D74.9Confident67.5Low71 Ų71120.6 Ų120.638%0.3864%0.637SS.*THydrogen-bonded Turntrans-95.7-2.6176.463.7-22.2000113.7R51 G55 R56R51-D53 WeakPolarHBondContact CB-OD1 3.49Å; R51-D53 IonicContact CZ-OD1 3.32Å; R51-D53 IonicContact CZ-OD2 3.43Å; R51-D53 IonicContact NE-OD1 3.89Å; R51-D53 IonicContact NH1-OD1 2.85Å; R51-D53 PolarHBondContact NH1-OD1 3.29Å; R51-D53 IonicContact NH1-OD2 2.71Å; R51-D53 PolarHBondContact NH1-OD2 2.97Å; R51-D53 IonicContact NH2-OD1 3.85Å; R51-D53 IonicContact NH2-OD2 3.46Å; R51-D53 PolarHBondContact NH2-OD2 3.3Å; R51-D53 PolarHBondContact O-N 3.08Å; D53-G55 PolarHBondContact O-N 3.01Å; D53-R56 WeakPolarHBondContact O-CB 3.09Å; D53-R56 PolarHBondContact O-N 3.03Å
54F77.6Confident66.2Low110 Ų110124.5 Ų124.548%0.48264%0.641SS.*THydrogen-bonded Turntrans-61.6129178.5-171.7-104.9000111.2N48 I49 R51 R56N48-F54 WeakPolarHBondContact O-CD2 3.31Å; N48-F54 WeakPolarHBondContact O-CG 3.25Å; I49-F54 HydrophobicContact CB-CD1 4.44Å; I49-F54 HydrophobicContact CB-CE1 4.26Å; I49-F54 HydrophobicContact CB-CZ 4.4Å; I49-F54 HydrophobicContact CG1-CE1 4.31Å; I49-F54 HydrophobicContact CG1-CE2 4.35Å; I49-F54 HydrophobicContact CG1-CZ 4Å; I49-F54 HydrophobicContact CG2-CD1 4.06Å; I49-F54 HydrophobicContact CG2-CE1 3.82Å; I49-F54 HydrophobicContact CG2-CZ 4.37Å; I49-F54 WeakPolarHBondContact O-CD1 3.33Å; R51-F54 VanDerWaalsContact O-CB 3.28Å; R51-F54 WeakPolarHBondContact O-CB 3.5Å; R51-F54 PolarHBondContact O-N 3.46Å; F54-R56 PolarHBondContact O-N 2.99Å
55G70.1Confident64.5Low74 Ų74125.6 Ų125.676%0.76365%0.654SS**THydrogen-bonded Turntrans76.7-6-173.700000115.4D53 K57D53-G55 PolarHBondContact O-N 3.01Å; G55-K57 PolarHBondContact O-N 3.05Å
56R77.1Confident62.6Low192 Ų192129.1 Ų129.173%0.72567%0.671SS**  trans-8295.8171.7-56.9-170.5-169.2-114.10109.6P52 D53 F54 K58P52-R56 PolarHBondContact O-NE 3.44Å; D53-R56 WeakPolarHBondContact O-CB 3.09Å; D53-R56 PolarHBondContact O-N 3.03Å; F54-R56 PolarHBondContact O-N 2.99Å; R56-K58 PolarHBondContact O-N 3.07Å
57K61Low60.7Low175 Ų175128.8 Ų128.876%0.76168%0.68SS**  trans-55.7119.7167.841.3169.4177.3163.90109.7G55 D59G55-K57 PolarHBondContact O-N 3.05Å; K57-D59 PolarHBondContact O-N 3.48Å
58K60.3Low58.7Low186 Ų186128 Ų12881%0.80968%0.683SS**  trans-8792.5179.4-166.9-176.6-177.3176.50109.1R56 V60R56-K58 PolarHBondContact O-N 3.07Å; K58-V60 VanDerWaalsContact C-N 3.32Å; K58-V60 HydrophobicContact CB-CG2 4.45Å; K58-V60 HydrophobicContact CD-CG2 3.75Å; K58-V60 HydrophobicContact CG-CG2 3.69Å; K58-V60 PolarHBondContact O-N 3.17Å
59D53.9Low57.3Low138 Ų138131.3 Ų131.374%0.73871%0.708SS**  trans-69.289.2169.1-65.9-57.8000108.8K57 G61K57-D59 PolarHBondContact O-N 3.48Å; D59-G61 PolarHBondContact O-N 3.17Å; D59-G61 VanDerWaalsContact O-N 3.1Å
60V51.6Low55.4Low114 Ų114130.9 Ų130.969%0.69172%0.718SS**  trans-80.688.7176.6-172.30000109.2K58K58-V60 VanDerWaalsContact C-N 3.32Å; K58-V60 HydrophobicContact CB-CG2 4.45Å; K58-V60 HydrophobicContact CD-CG2 3.75Å; K58-V60 HydrophobicContact CG-CG2 3.69Å; K58-V60 PolarHBondContact O-N 3.17Å
61G38.6Very low53.1Low66 Ų66130.9 Ų130.968%0.6873%0.729SS**  trans-60.4145.2162.400000111D59D59-G61 PolarHBondContact O-N 3.17Å; D59-G61 VanDerWaalsContact O-N 3.1Å
62A45.6Very low51.1Low104 Ų104136 Ų13686%0.8675%0.749SS**  trans-69.2137.8-175.500000112.6
63H40.4Very low49Very low175 Ų175139.6 Ų139.681%0.8176%0.755SS**  trans-135.5124.6152.2-147.6-78.2000108.4
64R41.5Very low47.1Very low217 Ų217140.8 Ų140.882%0.81977%0.769SS**  trans-81.5146.7165.5-60168.582.7-152.17.2106.8
65D34.3Very low45Very low158 Ų158147.2 Ų147.285%0.84579%0.79SS**  -166.9162.3116.9-93.8-31.6000110.4
66E40.9Very low43.2Very low161 Ų161147.3 Ų147.375%0.75279%0.791SS**  trans-124.3137.9-160.5-175.2-96.8118.500110.8S68E66-S68 PolarHBondContact OE1-N 3.3Å; E66-S68 VanDerWaalsContact OE1-N 3.15Å
67S34.6Very low41.2Very low114 Ų114143.8 Ų143.880%0.79780%0.796SS**  trans-163.5107.1154.160.10000110.6
68S37.3Very low40.7Very low95 Ų95141.5 Ų141.566%0.66480%0.799SS**  trans-76.7168.3163.4-155.80000111E66E66-S68 PolarHBondContact OE1-N 3.3Å; E66-S68 VanDerWaalsContact OE1-N 3.15Å
69P46.6Very low39.3Very low127 Ų127137.3 Ų137.383%0.82580%0.799SS**  -146.8167.886.236.5-17.7000117.2
70A37.1Very low38.5Very low87 Ų87135 Ų13572%0.71980%0.799SS**  trans-59.6162.1-172.300000119.2
71S33.4Very low38.3Very low131 Ų131135.9 Ų135.992%0.91681%0.807SS**  trans-149.4145.5143.4-78.40000110.1
72R38.7Very low38.1Very low244 Ų244141 Ų14192%0.92181%0.813SS**  trans-139.3123.8-164.9169.2-167.5179.4-156.72109.1
73E33.2Very low37.6Very low192 Ų192141.6 Ų141.690%0.89781%0.807SS**  trans-143.8160.9161-166.1145.1100.900111.9
74S34.5Very low37.4Very low97 Ų97141.1 Ų141.168%0.67881%0.805SS**  trans-141.8143.9-160.6174.60000111.4
75R35.3Very low38.1Very low244 Ų244135.7 Ų135.792%0.92180%0.798SS**  trans175.7137159.6-91.1143.7-162.5-104.89107.1
76G30.5Very low38.1Very low77 Ų77135.6 Ų135.679%0.79480%0.802SS**  cis-173.4165.5-700000110.6
77S36.7Very low37.6Very low117 Ų117130.9 Ų130.982%0.81880%0.797SS**  trans-83.3170.3178.6-48.80000113.1
78P49.6Very low37.4Very low127 Ų127131.1 Ų131.183%0.82580%0.799SS**  -132.11419111.810.6000112.6
79A31.5Very low37.2Very low99 Ų99132.9 Ų132.982%0.81881%0.806SS**  90.2131.968.900000113.7
80A36.1Very low36.7Very low89 Ų89133.1 Ų133.174%0.73681%0.805SS**  trans-98.2-172.1-167.100000114
81P47.5Very low37.4Very low132 Ų132134.2 Ų134.286%0.85781%0.805SS**  -134.7171.8112.337.9-28.1000115.9
82Q34.6Very low37.6Very low173 Ų173131.8 Ų131.881%0.80879%0.793SS**  trans-92.3177.4-171.9-57.7165.42100110.5
83T35.1Very low37.2Very low117 Ų117129.1 Ų129.172%0.71879%0.791SS**  cis-168132.749.149.20000114.2
84E35.6Very low37.1Very low165 Ų165122.8 Ų122.877%0.77178%0.777SS**  44.1171122.3-56.8-58.3127.600122.7
85P57.9Low36.9Very low104 Ų104124.6 Ų124.668%0.67578%0.784SS**  -143.6166.3-82.841.2-21.5000116.7
86V32.9Very low36.7Very low155 Ų155118 Ų11894%0.93978%0.775SS**  trans-167.2140.3146.1-172.90000106.7
87G30.3Very low36.9Very low63 Ų63120.7 Ų120.765%0.64978%0.776SS**  cis158.3142.7-600000110.7
88S32.1Very low37.4Very low119 Ų119119.5 Ų119.583%0.83277%0.766SS**  trans60.3146.3169.2-67.60000118.9
89T32.8Very low36.6Very low132 Ų132121.7 Ų121.781%0.8177%0.765SS**  cis-155.3144.3-1.34.80000110.3
90V34.8Very low36.4Very low132 Ų132122.8 Ų122.880%0.876%0.761SS**  trans-86.5-168.3163.8-70.20000109
91P52Low36.1Very low110 Ų110124.5 Ų124.571%0.71476%0.763SS**  cis-146.2-173.45.140.3-17.6000118
92A37.7Very low35.3Very low80 Ų80124.4 Ų124.466%0.66176%0.759SS**  trans63.7156.5136.800000120.3
93E31Very low35.1Very low188 Ų188119.3 Ų119.388%0.87975%0.753SS**  cis-161.7172.8-10-109.5168138.900105.6
94G31.3Very low35.3Very low59 Ų59120.5 Ų120.561%0.60876%0.763SS**  cis146.31616.900000109.9
95T30Very low35Very low134 Ų134122.1 Ų122.182%0.82277%0.768SS**  trans74.6142.7158.9-47.90000115.6
96S30.7Very low33.6Very low107 Ų107126.4 Ų126.475%0.74878%0.776SS**  cis-151.915318.50.70000114.4
97T34.1Very low33.9Very low133 Ų133124.8 Ų124.882%0.81677%0.768SS**  trans-83.3-173.6151.9320000110.6
98P48.9Very low34.1Very low92 Ų92125.9 Ų125.960%0.59777%0.772SS**  cis-136.2-173.63.530.3-5.6000115.5
99H31.4Very low33.9Very low172 Ų172129.8 Ų129.880%0.79677%0.774SS**  165.5138118.8-83.8-66.1000115.9
100T28Very low33.7Very low122 Ų122128.3 Ų128.375%0.74878%0.775SS**  trans-42.3151.3170.440.30000120.2
101V30.1Very low33.6Very low126 Ų126127 Ų12776%0.76478%0.777SS**  178.3134.4114.5139.20000116.1
102T30.9Very low32.5Very low129 Ų129129.3 Ų129.379%0.79178%0.779SS**  trans42.1138.6156.563.70000125.2
103G29.8Very low32Very low66 Ų66132.9 Ų132.968%0.6878%0.782SS**  trans-89.1-168153.400000113.3
104P39Very low31.9Very low142 Ų142127.5 Ų127.592%0.92277%0.765SS**  -144.9-176.3102.838.5-22.9000116
105K30Very low32Very low199 Ų199132.7 Ų132.787%0.86578%0.778SS**  trans-108.2162.2-170.9-65.4171.9170.51720113.9
106K28.1Very low32.2Very low194 Ų194135.7 Ų135.784%0.84378%0.779SS**  trans70.2170.9145.2-98.9-158.9173.6-174.70116.7
107P39.5Very low32.8Very low121 Ų121136.1 Ų136.179%0.78678%0.78SS**  cis-127.417712.441.3-25.1000117.5
108A34.3Very low32.5Very low87 Ų87135.6 Ų135.672%0.71978%0.781SS**  trans-112.8153.3165.700000110.6
109K28.2Very low31.6Very low201 Ų201134.9 Ų134.987%0.87479%0.79SS**  trans-147.3137.5156.4-71.2-169.1175.1-174.10106.4
110A28.7Very low31.6Very low101 Ų101135.7 Ų135.784%0.83580%0.795SS**  cis84.493.126.800000115.1
111A32Very low32Very low103 Ų103135.2 Ų135.285%0.85180%0.797SS**  trans-176157.6144.300000107.6
112E28.2Very low32.3Very low160 Ų160132.1 Ų132.175%0.74879%0.79SS**  cis164.7151-27.6-138-81.393.100104.7
113E28.9Very low32.6Very low155 Ų155133.6 Ų133.672%0.72479%0.793SS**  trans58.1157.6172.7-87.1-153.395.100119.5
114S28.8Very low32.8Very low75 Ų75138.7 Ų138.752%0.52480%0.799SS.*  cis-159.2151.2-16.5-128.80000110.6
115L33.3Very low32.6Very low167 Ų167138 Ų13887%0.87480%0.796SS**  trans63.4140.2148.5-61166.1000123.5
116K33.8Very low33.1Very low198 Ų198135.7 Ų135.786%0.86179%0.793SS**  trans-78.2-173.8168.2-76-178.5171.1178.80111.5
117P42.7Very low33.7Very low116 Ų116132 Ų13275%0.75379%0.792SS**  cis-141.2-177.44.440.2-20000118.2
118S27.9Very low33.9Very low121 Ų121131.1 Ų131.185%0.84679%0.788SS**  trans87.6139.6146.7-147.30000119.8
119G31Very low34.3Very low77 Ų77134.4 Ų134.479%0.79479%0.793SS**  trans159.460-171.700000111.7
120E31.3Very low35.5Very low190 Ų190129.8 Ų129.889%0.88879%0.786SS**  trans-75.9128.9-175.9-173.2178.7114.300112.1
121S36.6Very low36.2Very low112 Ų112132 Ų13278%0.78378%0.784SS**  trans-161.6105.7157.7-151.20000109.6
122G34.7Very low36.9Very low61 Ų61132.7 Ų132.763%0.62978%0.783SS**  trans-109.1104.2-178.700000111.7Q124G122-Q124 PolarHBondContact O-N 3.07Å
123D37Very low38Very low159 Ų159129.7 Ų129.785%0.8578%0.779SS**  trans-90.792.2167.4-78.6-52.5000110.2C125D123-C125 PolarHBondContact O-N 3.37Å
124Q35.1Very low38.9Very low173 Ų173131.5 Ų131.581%0.80879%0.788SS**  trans-80.199.9173.2-61.7174.348.400109.2G122 L126G122-Q124 PolarHBondContact O-N 3.07Å; Q124-L126 PolarHBondContact O-N 3.47Å
125C35.6Very low39.3Very low128 Ų128132.9 Ų132.987%0.86580%0.804SS**  trans-88.7106.8169-158.90000109.4D123 S127D123-C125 PolarHBondContact O-N 3.37Å; C125-S127 PolarHBondContact O-N 2.72Å
126L39.9Very low40Very low151 Ų151130.7 Ų130.779%0.79180%0.803SS**  trans-70.2115.5-175.9-61.7169.4000111.1Q124 S128Q124-L126 PolarHBondContact O-N 3.47Å; L126-S128 PolarHBondContact O-N 3.37Å
127S39.7Very low40.5Very low117 Ų117126.7 Ų126.782%0.81880%0.8SS**  trans-73.5105.4161.6-66.20000108.8C125C125-S127 PolarHBondContact O-N 2.72Å
128S45.3Very low40.7Very low101 Ų101128.2 Ų128.271%0.70680%0.801SS**  trans-97.792.5170.5-169.10000109.1L126 S130L126-S128 PolarHBondContact O-N 3.37Å; S128-S130 PolarHBondContact O-N 3.05Å
129D41.6Very low41.8Very low157 Ų157129 Ų12984%0.8480%0.804SS**  trans-67.6120.8159.7-75.6-73.8000107.9
130S52.7Low42.6Very low104 Ų104130.3 Ų130.373%0.72780%0.801SS**  trans-134.196.9172.9-76.30000109.3S128S128-S130 PolarHBondContact O-N 3.05Å
131D44.2Very low43.5Very low147 Ų147129.2 Ų129.279%0.78680%0.797SS**  trans-71.3129.5165173.547.4000110.1
132S47.3Very low44.7Very low118 Ų118129.3 Ų129.383%0.82580%0.798SS**  trans-168.9149.3152.8-89.60000112.2
133S51.4Low45.7Very low96 Ų96134.4 Ų134.467%0.67181%0.806SS**  trans-95.4156.1-164.7-70.50000114.8
134Q47.7Very low46.9Very low193 Ų193131.5 Ų131.590%0.90280%0.795SS**  trans56.1113.5152.9-69.3179.274.900120
135A37.3Very low48.3Very low105 Ų105130 Ų13087%0.86879%0.79SS**  trans-152132.1142.300000110.9
136S46.4Very low50Low121 Ų121130.7 Ų130.785%0.84678%0.784SS**  trans-100.1133178.1-61.40000111.4
137S44.4Very low51.5Low114 Ų114126.5 Ų126.580%0.79776%0.758SS**  trans178156.1143.738.50000113.8
138N48.1Very low53.3Low147 Ų147124.4 Ų124.479%0.78674%0.742SS**  trans67.3107.4170.1-76.4-1.1000120.9
139P49.7Very low54.2Low138 Ų138122.8 Ų122.890%0.89674%0.735SS**  trans-98.577.1153.136.6-27000110.6
140S48.6Very low55.8Low105 Ų105124.4 Ų124.473%0.73473%0.729SS**  trans-137.676171.7-174.50000111
141M50.9Low57Low166 Ų166120.4 Ų120.482%0.81870%0.7SS**SBendtrans-167.8128.2157.3-99.4-62.4-179.400105.5Q143M141-Q143 VanDerWaalsContact C-N 3.34Å; M141-Q143 PolarHBondContact O-N 3.4Å
142S61.1Low58.1Low115 Ų115116 Ų11680%0.80467%0.673SS**  trans-66.891.717640.50000109.8P144S142-P144 VanDerWaalsContact O-CD 3.23Å; S142-P144 WeakPolarHBondContact O-CD 3.43Å
143Q55.2Low59.1Low168 Ų168114.8 Ų114.879%0.78566%0.664SS**  trans-54.9112.9172.9-76.7-69.3-13.500108.5M141 M145M141-Q143 VanDerWaalsContact C-N 3.34Å; M141-Q143 PolarHBondContact O-N 3.4Å; Q143-M145 PolarHBondContact O-N 2.85Å
144P62.6Low59.8Low97 Ų97113.9 Ų113.963%0.6365%0.654SS**  trans-63.2125.4176.426.8-32.4000106.8S142 L146S142-P144 VanDerWaalsContact O-CD 3.23Å; S142-P144 WeakPolarHBondContact O-CD 3.43Å; P144-L146 PolarHBondContact O-N 3.07Å
145M64.4Low60.1Low141 Ų141112.5 Ų112.570%0.69564%0.64SS**  trans-58.596.7-171-164.9171.378.300110.2Q143 W147Q143-M145 PolarHBondContact O-N 2.85Å; M145-W147 HydrophobicContact CE-CH2 4.22Å; M145-W147 HydrophobicContact CE-CZ2 3.9Å; M145-W147 PolarHBondContact O-N 3.3Å; M145-W147 VanDerWaalsContact O-N 3.14Å
146L71.9Confident60.8Low143 Ų143110.6 Ų110.675%0.74961%0.611SS**  trans-81.3104.4-165.1-159.475.8000108.5P144 Y152P144-L146 PolarHBondContact O-N 3.07Å; L146-Y152 HydrophobicContact CD1-CE2 4.37Å; L146-Y152 HydrophobicContact CG-CE2 4.37Å
147W71.1Confident61.4Low63 Ų63105.9 Ų105.924%0.23958%0.578CS.*  trans-59.9149-178.2-66.889.8000111.3M145 A149 V151 Y152M145-W147 HydrophobicContact CE-CH2 4.22Å; M145-W147 HydrophobicContact CE-CZ2 3.9Å; M145-W147 PolarHBondContact O-N 3.3Å; M145-W147 VanDerWaalsContact O-N 3.14Å; W147-A149 PolarHBondContact O-N 3.38Å; W147-V151 HydrophobicContact CB-CB 3.98Å; W147-V151 HydrophobicContact CB-CG1 4.06Å; W147-V151 HydrophobicContact CB-CG2 4.17Å; W147-V151 HydrophobicContact CG-CG1 4.45Å; W147-Y152 HydrophobicContact CB-CD2 4.46Å; W147-Y152 HydrophobicContact CB-CE2 3.75Å; W147-Y152 WeakPolarHBondContact O-CD2 3.18Å; W147-Y152 WeakPolarHBondContact O-CE2 3.45Å
148P77.8Confident61.8Low73 Ų73107.4 Ų107.447%0.47458%0.578SS.*  trans-52141.3178.4-28.936000112.3W150 V151P148-W150 PolarHBondContact O-N 2.81Å; P148-V151 VanDerWaalsContact O-CB 3.32Å; P148-V151 WeakPolarHBondContact O-CB 3.44Å; P148-V151 WeakPolarHBondContact O-CG2 3.38Å; P148-V151 PolarHBondContact O-N 3.25Å
149A63.2Low62.2Low67 Ų67105.5 Ų105.555%0.55456%0.559SS**Hα-helixtrans-52.7-29.3-168.700000115W147 V151 Y152 C153W147-A149 PolarHBondContact O-N 3.38Å; A149-V151 VanDerWaalsContact C-N 3.26Å; A149-V151 PolarHBondContact O-N 2.67Å; A149-Y152 PolarHBondContact O-N 2.81Å; A149-Y152 VanDerWaalsContact O-N 3.15Å; A149-C153 PolarHBondContact O-N 3.12Å; A149-C153 VanDerWaalsContact O-N 3.11Å; A149-C153 PolarHBondContact O-SG 2.91Å
150W76.4Confident62.6Low192 Ų192105.6 Ų105.673%0.72756%0.56SS**Hα-helixtrans-62.1-30.5175.770.7-99.6000113.5P148 Y152 C153P148-W150 PolarHBondContact O-N 2.81Å; W150-Y152 VanDerWaalsContact C-N 3.32Å; W150-C153 PolarHBondContact O-N 3.23Å
151V77.3Confident62.8Low19 Ų19105.9 Ų105.912%0.11556%0.562CS.*Hα-helixtrans-65.8-37175.7-176.20000110.4W147 P148 A149 S157W147-V151 HydrophobicContact CB-CB 3.98Å; W147-V151 HydrophobicContact CB-CG1 4.06Å; W147-V151 HydrophobicContact CB-CG2 4.17Å; W147-V151 HydrophobicContact CG-CG1 4.45Å; P148-V151 VanDerWaalsContact O-CB 3.32Å; P148-V151 WeakPolarHBondContact O-CB 3.44Å; P148-V151 WeakPolarHBondContact O-CG2 3.38Å; P148-V151 PolarHBondContact O-N 3.25Å; A149-V151 VanDerWaalsContact C-N 3.26Å; A149-V151 PolarHBondContact O-N 2.67Å; V151-S157 PolarHBondContact O-OG 3.04Å
152Y67.3Low63Low55 Ų55101.3 Ų101.322%0.21655%0.546CS..Hα-helixtrans-86.2-5.7177.4-64.3-65.2000114.9L146 W147 A149 W150 S157L146-Y152 HydrophobicContact CD1-CE2 4.37Å; L146-Y152 HydrophobicContact CG-CE2 4.37Å; W147-Y152 HydrophobicContact CB-CD2 4.46Å; W147-Y152 HydrophobicContact CB-CE2 3.75Å; W147-Y152 WeakPolarHBondContact O-CD2 3.18Å; W147-Y152 WeakPolarHBondContact O-CE2 3.45Å; A149-Y152 PolarHBondContact O-N 2.81Å; A149-Y152 VanDerWaalsContact O-N 3.15Å; W150-Y152 VanDerWaalsContact C-N 3.32Å; Y152-S157 VanDerWaalsContact C-OG 3.3Å; Y152-S157 WeakPolarHBondContact CA-OG 3.35Å; Y152-S157 PolarHBondContact O-OG 3.34Å
153C68.8Low63Low93 Ų9398.3 Ų98.363%0.62853%0.533SS*.THydrogen-bonded Turntrans-101.17.7176.6-70.30000112.7A149 W150A149-C153 PolarHBondContact O-N 3.12Å; A149-C153 VanDerWaalsContact O-N 3.11Å; A149-C153 PolarHBondContact O-SG 2.91Å; W150-C153 PolarHBondContact O-N 3.23Å
154T66.9Low63.1Low77 Ų7796.7 Ų96.747%0.47254%0.538SS..SBendtrans-81.3158.5175.4-140.10000111.5Y156 S157T154-Y156 PolarHBondContact O-N 3.18Å; T154-S157 WeakPolarHBondContact CG2-OG 3.24Å; T154-S157 PolarHBondContact N-OG 2.91Å; T154-S157 PolarHBondContact O-N 3.11Å; T154-S157 PolarHBondContact O-OG 2.91Å
155R53.9Low62.7Low163 Ų163102.5 Ų102.562%0.61555%0.547SS*.THydrogen-bonded Turntrans-67.79.6-175.673.6-179.1-179.293.2-1.7116
156Y51.7Low62.4Low66 Ų66100.9 Ų100.926%0.25955%0.55SS..THydrogen-bonded Turntrans-137.72.2-172-71.9-65.9000113T154 D158 N254T154-Y156 PolarHBondContact O-N 3.18Å; Y156-D158 PolarHBondContact O-N 3.47Å; Y156-N254 HydrophobicContact CD1-CB 3.89Å; Y156-N254 HydrophobicContact CE1-CB 4.02Å
157S58.4Low61.8Low21 Ų21103.2 Ų103.215%0.14755%0.548CS..  trans-82.5108.1176.3-29.60000108.9V151 Y152 T154 R159V151-S157 PolarHBondContact O-OG 3.04Å; Y152-S157 VanDerWaalsContact C-OG 3.3Å; Y152-S157 WeakPolarHBondContact CA-OG 3.35Å; Y152-S157 PolarHBondContact O-OG 3.34Å; T154-S157 WeakPolarHBondContact CG2-OG 3.24Å; T154-S157 PolarHBondContact N-OG 2.91Å; T154-S157 PolarHBondContact O-N 3.11Å; T154-S157 PolarHBondContact O-OG 2.91Å; S157-R159 VanDerWaalsContact C-N 3.25Å; S157-R159 PolarHBondContact O-N 2.97Å
158D53.4Low61.2Low147 Ų147109.2 Ų109.279%0.78658%0.576SS**  trans-72.686.7169.6-72-44.1000109.1Y156Y156-D158 PolarHBondContact O-N 3.47Å
159R56.8Low60.2Low107 Ų107111.3 Ų111.340%0.40459%0.59SS.*  trans-83.7119.6179.1-161.9169.9-170.9164.3-1.2107.8S157 S161 S162S157-R159 VanDerWaalsContact C-N 3.25Å; S157-R159 PolarHBondContact O-N 2.97Å; R159-S161 PolarHBondContact O-N 3.26Å; R159-S162 PolarHBondContact O-N 3.36Å
160P56.4Low59.9Low139 Ų139117.3 Ų117.390%0.90360%0.603SS**THydrogen-bonded Turntrans-63.6-11.3-17122.9-33.9000115
161S53.2Low58.9Low111 Ų111117.3 Ų117.378%0.77661%0.608SS**THydrogen-bonded Turntrans-98.9-9.8174.5161.80000113.9R159 G163R159-S161 PolarHBondContact O-N 3.26Å; S161-G163 PolarHBondContact O-N 3.06Å; S161-G163 VanDerWaalsContact O-N 3.09Å
162S55Low57.8Low70 Ų70125.9 Ų125.949%0.4964%0.644SS.*  trans-80.890.1173.2-74.20000110.5R159R159-S162 PolarHBondContact O-N 3.36Å
163G61.7Low56.9Low52 Ų52127 Ų12754%0.53666%0.66SS.*  trans-52.8164.9169.800000113.1S161 R165S161-G163 PolarHBondContact O-N 3.06Å; S161-G163 VanDerWaalsContact O-N 3.09Å; G163-R165 PolarHBondContact O-N 2.71Å
164P57.5Low56.2Low135 Ų135128.8 Ų128.888%0.87767%0.668SS**  trans-55.596.9-162.821-33.9000112.7S166P164-S166 VanDerWaalsContact C-N 3.28Å; P164-S166 PolarHBondContact O-N 2.8Å
165R54.9Low55.4Low219 Ų219129.6 Ų129.683%0.82668%0.677SS**  trans-7980.5-173.8-162.8172.7-166.1129.22.9109.8G163 R167G163-R165 PolarHBondContact O-N 2.71Å; R165-R167 PolarHBondContact O-N 3.39Å
166S58.1Low55.4Low107 Ų107131.3 Ų131.375%0.74869%0.689SS**  trans-46.8110177.4-177.80000110.2P164 K168P164-S166 VanDerWaalsContact C-N 3.28Å; P164-S166 PolarHBondContact O-N 2.8Å; S166-K168 VanDerWaalsContact C-N 3.31Å; S166-K168 PolarHBondContact O-N 2.81Å
167R58.9Low55.7Low191 Ų191136 Ų13672%0.72171%0.713SS**  trans-73.489.8178.6-58-177.3100.4108.56.5106.8R165 P169R165-R167 PolarHBondContact O-N 3.39Å; R167-P169 WeakPolarHBondContact O-CD 3.43Å
168K57.5Low55.6Low190 Ų190142.7 Ų142.783%0.82675%0.747SS**  trans-46.2116.3169.4-93.1-178.9175.1172.30107.5S166 K170S166-K168 VanDerWaalsContact C-N 3.31Å; S166-K168 PolarHBondContact O-N 2.81Å; K168-K170 PolarHBondContact O-N 3.16Å
169P57.8Low55.9Low117 Ų117144.7 Ų144.776%0.7675%0.749SS**  trans-58.5131.7-17622.1-32.3000107.6R167 K171R167-P169 WeakPolarHBondContact O-CD 3.43Å; P169-K171 PolarHBondContact O-N 3.22Å
170K56.5Low56.4Low192 Ų192150.7 Ų150.784%0.83577%0.772SS**  trans-65.996.7-170.9-178.2158.7-178.6157.30109.2K168 K172K168-K170 PolarHBondContact O-N 3.16Å; K170-K172 PolarHBondContact O-N 3.06Å
171K55.5Low57.1Low192 Ų192149.7 Ų149.784%0.83577%0.765SS**  trans-47.5130.1168.5-77.4-169.6175.4-173.80107.4P169 S173P169-K171 PolarHBondContact O-N 3.22Å; K171-S173 PolarHBondContact O-N 3.11Å
172K53.7Low58.3Low199 Ų199156.3 Ų156.387%0.86577%0.773SS**  trans-74.879.3-176.2-166.9161.5-176.3175.50109K170 T174K170-K172 PolarHBondContact O-N 3.06Å; K172-T174 PolarHBondContact O-N 3.41Å; K172-T174 VanDerWaalsContact O-N 3.12Å
173S48.6Very low59.6Low80 Ų80157.6 Ų157.656%0.55978%0.778SS**  trans-55.2115.4173.655.10000108.9K171 S175K171-S173 PolarHBondContact O-N 3.11Å; S173-S175 PolarHBondContact O-N 3.08Å
174T54.7Low61Low130 Ų130159.7 Ų159.780%0.79879%0.79SS**  trans-74.32.1-179.339.20000113.5K172 K176K172-T174 PolarHBondContact O-N 3.41Å; K172-T174 VanDerWaalsContact O-N 3.12Å; T174-K176 PolarHBondContact O-N 3Å
175S48.8Very low62.8Low93 Ų93155.7 Ų155.765%0.6576%0.759SS**  trans-63.590.1172.1-16.90000111.1S173 E177S173-S175 PolarHBondContact O-N 3.08Å; S175-E177 VanDerWaalsContact C-N 3.27Å
176K55.3Low64.8Low200 Ų200148.6 Ų148.687%0.8774%0.74SS**  trans-91.118.3174.5-75.5-177.8178.3173.40113.1T174T174-K176 PolarHBondContact O-N 3Å
177E56.2Low66.6Low165 Ų165147.4 Ų147.477%0.77174%0.737SS**  trans-136.8100.6-166.2-162.1160.9-135.500102.5S175S175-E177 VanDerWaalsContact C-N 3.27Å
178D56.6Low68.4Low160 Ų160145.6 Ų145.686%0.85674%0.737SS**SBend-139.514.467.3-77.4-64.2000115.1R180D178-R180 PolarHBondContact O-N 2.97Å
179K60.5Low70.3Confident189 Ų189138 Ų13882%0.82270%0.704SS**SBendtrans-88.1112.8-177.9-63.2-165179.1-166.80110P181K179-P181 VanDerWaalsContact O-N 3.14Å
180R66.5Low72.2Confident234 Ų234135 Ų13588%0.88368%0.681SS**  trans-35.3120.2173.1-75.3-174.9179.9177.4-0109.8D178 R182D178-R180 PolarHBondContact O-N 2.97Å; R180-R182 PolarHBondContact O-N 3.31Å
181P71.5Confident74.1Confident118 Ų118131.5 Ų131.577%0.76667%0.668SS**  trans-58.5134.2-172.121.7-32.5000110K179 T183K179-P181 VanDerWaalsContact O-N 3.14Å; P181-T183 PolarHBondContact O-N 3.36Å
182R78.5Confident76.1Confident250 Ų250125.4 Ų125.494%0.94364%0.64SS**  trans-69.5105.1177.2-76179.9172.6161.5-3.8108.8R180 A184R180-R182 PolarHBondContact O-N 3.31Å; R182-A184 PolarHBondContact O-N 3.3Å
183T83.1Confident78.2Confident97 Ų97116 Ų11660%0.59560%0.599SS**PPolyproline II helixtrans-65.2117.3171.657.40000109.5P181P181-T183 PolarHBondContact O-N 3.36Å
184A90.6Very high80.6Confident95 Ų95116 Ų11679%0.78559%0.589SS**PPolyproline II helixtrans-86.1143.4167.800000109.6R182R182-A184 PolarHBondContact O-N 3.3Å
185F95.1Very high82.6Confident51 Ų51112.4 Ų112.422%0.22457%0.569CS.*PPolyproline II helixtrans-83.4148.4171.5-57.8-57.4000110.2Q189 L190 L217 Q221 W225F185-Q189 HydrophobicContact CB-CB 4.23Å; F185-L190 HydrophobicContact CB-CD2 3.99Å; F185-L190 HydrophobicContact CB-CG 3.94Å; F185-L190 HydrophobicContact CD2-CD2 4.14Å; F185-L217 HydrophobicContact CD1-CD1 3.68Å; F185-L217 HydrophobicContact CD1-CD2 3.83Å; F185-L217 HydrophobicContact CD1-CG 4.44Å; F185-L217 HydrophobicContact CE1-CD1 3.77Å; F185-L217 HydrophobicContact CE1-CD2 3.85Å; F185-L217 HydrophobicContact CE1-CG 4.43Å; F185-Q221 HydrophobicContact CE1-CB 4Å; F185-Q221 HydrophobicContact CE1-CG 4.49Å; F185-Q221 HydrophobicContact CZ-CB 3.93Å; F185-W225 AromaticContact CD2-CD1 3.78Å; F185-W225 HydrophobicContact CE2-CB 4.32Å; F185-W225 AromaticContact CE2-CD1 3.67Å; F185-W225 HydrophobicContact CE2-CG 4.37Å
186T96.8Very high84.9Confident71 Ų71108.8 Ų108.844%0.43654%0.542SS..PPolyproline II helixtrans-67.7162.8175.772.80000111.2E188 Q189 L190T186-E188 VanDerWaalsContact C-N 3.28Å; T186-E188 PolarHBondContact O-N 3.22Å; T186-Q189 PolarHBondContact O-N 2.99Å; T186-Q189 WeakPolarHBondContact OG1-CB 3.39Å; T186-Q189 VanDerWaalsContact OG1-CG 3.28Å; T186-Q189 WeakPolarHBondContact OG1-CG 3.27Å; T186-Q189 PolarHBondContact OG1-N 3.24Å; T186-L190 WeakPolarHBondContact O-CG 3.29Å; T186-L190 PolarHBondContact O-N 2.79Å
187A95.9Very high86.9Confident82 Ų8299.6 Ų99.668%0.67850%0.501SS*.Hα-helixtrans-58.8-41.4177.300000111.9L190 Q191A187-L190 PolarHBondContact O-N 3.33Å; A187-Q191 WeakPolarHBondContact O-CG 3.43Å; A187-Q191 PolarHBondContact O-N 2.9Å
188E96.6Very high88.8Confident153 Ų15398 Ų9872%0.71549%0.494SS*.Hα-helixtrans-63.4-50.5177.1-175.3-175.5-179.300112.4T186 L190 Q191 R192T186-E188 VanDerWaalsContact C-N 3.28Å; T186-E188 PolarHBondContact O-N 3.22Å; E188-L190 PolarHBondContact O-N 2.79Å; E188-Q191 WeakPolarHBondContact O-CA 3.37Å; E188-Q191 WeakPolarHBondContact O-CB 3.3Å; E188-Q191 PolarHBondContact O-N 3.02Å; E188-R192 PolarHBondContact O-N 3.4Å
189Q97.1Very high90.7Very high31 Ų3195.8 Ų95.815%0.14549%0.487CS..Hα-helixtrans-53.9-43.1174.1-73.4171.2-18.100111F185 T186 L193 L215 L217F185-Q189 HydrophobicContact CB-CB 4.23Å; T186-Q189 PolarHBondContact O-N 2.99Å; T186-Q189 WeakPolarHBondContact OG1-CB 3.39Å; T186-Q189 VanDerWaalsContact OG1-CG 3.28Å; T186-Q189 WeakPolarHBondContact OG1-CG 3.27Å; T186-Q189 PolarHBondContact OG1-N 3.24Å; Q189-L193 WeakPolarHBondContact O-CB 3.34Å; Q189-L193 WeakPolarHBondContact O-CD1 3.14Å; Q189-L193 WeakPolarHBondContact O-CG 3.46Å; Q189-L193 PolarHBondContact O-N 3.12Å; Q189-L215 HydrophobicContact CG-CB 4.27Å; Q189-L215 HydrophobicContact CG-CD2 4.16Å; Q189-L215 PolarHBondContact NE2-O 2.91Å; Q189-L217 HydrophobicContact CB-CD1 4.43Å; Q189-L217 HydrophobicContact CG-CD1 4.28Å
190L97.3Very high92.4Very high53 Ų5390.1 Ų90.128%0.27747%0.465SS..Hα-helixtrans-67.3-32.8176.1-70174.2000113.4F185 T186 A187 E188 K194 W225F185-L190 HydrophobicContact CB-CD2 3.99Å; F185-L190 HydrophobicContact CB-CG 3.94Å; F185-L190 HydrophobicContact CD2-CD2 4.14Å; T186-L190 WeakPolarHBondContact O-CG 3.29Å; T186-L190 PolarHBondContact O-N 2.79Å; A187-L190 PolarHBondContact O-N 3.33Å; E188-L190 PolarHBondContact O-N 2.79Å; L190-K194 WeakPolarHBondContact O-CB 3.39Å; L190-K194 VanDerWaalsContact O-CD 3.31Å; L190-K194 WeakPolarHBondContact O-CD 3.46Å; L190-K194 WeakPolarHBondContact O-CG 3.25Å; L190-K194 PolarHBondContact O-N 3.43Å; L190-K194 VanDerWaalsContact O-N 3.08Å; L190-W225 VanDerWaalsContact CD2-NE1 3.31Å
191Q97.8Very high93.8Very high119 Ų11984.8 Ų84.856%0.55645%0.445SS*.Hα-helixtrans-68-49.3174.6-70.8-65.415.300111.1A187 E188 L193 K194 S195A187-Q191 WeakPolarHBondContact O-CG 3.43Å; A187-Q191 PolarHBondContact O-N 2.9Å; E188-Q191 WeakPolarHBondContact O-CA 3.37Å; E188-Q191 WeakPolarHBondContact O-CB 3.3Å; E188-Q191 PolarHBondContact O-N 3.02Å; Q191-L193 PolarHBondContact O-N 2.98Å; Q191-K194 WeakPolarHBondContact O-CB 3.33Å; Q191-K194 PolarHBondContact O-N 3.44Å; Q191-K194 VanDerWaalsContact O-N 3.13Å; Q191-S195 PolarHBondContact O-N 3.46Å
192R97.6Very high95Very high64 Ų6486 Ų8624%0.24244%0.435CS..Hα-helixtrans-59.6-44.5178.3-174.368-174105.214.8112.1E188 K194 S195 E196 L211 E214 L215E188-R192 PolarHBondContact O-N 3.4Å; R192-K194 PolarHBondContact O-N 2.84Å; R192-S195 PolarHBondContact O-N 3.35Å; R192-E196 IonicContact NH2-OE1 3.18Å; R192-E196 PolarHBondContact O-N 2.87Å; R192-L211 HydrophobicContact CG-CD2 4.23Å; R192-E214 IonicContact CZ-OE2 2.66Å; R192-E214 IonicContact NE-OE2 2.76Å; R192-E214 PolarHBondContact NE-OE2 3.19Å; R192-E214 IonicContact NH2-OE1 3.99Å; R192-E214 PolarHBondContact NH2-OE1 2.84Å; R192-E214 IonicContact NH2-OE2 3.37Å; R192-E214 PolarHBondContact NH2-OE2 3.25Å; R192-L215 HydrophobicContact CB-CD1 4.28Å; R192-L215 HydrophobicContact CB-CD2 3.83Å; R192-L215 HydrophobicContact CG-CD1 4.22Å; R192-L215 HydrophobicContact CG-CD2 3.87Å; R192-L215 HydrophobicContact CG-CG 4.31Å
193L97.8Very high95.8Very high0 Ų075.9 Ų75.90%040%0.4CS..Hα-helixtrans-63.6-36.2175.4-70.4168.7000112.8Q189 Q191 F197 L215 L217 I222 W225 F226Q189-L193 WeakPolarHBondContact O-CB 3.34Å; Q189-L193 WeakPolarHBondContact O-CD1 3.14Å; Q189-L193 WeakPolarHBondContact O-CG 3.46Å; Q189-L193 PolarHBondContact O-N 3.12Å; Q191-L193 PolarHBondContact O-N 2.98Å; L193-F197 VanDerWaalsContact O-CB 3.24Å; L193-F197 WeakPolarHBondContact O-CB 3.48Å; L193-F197 PolarHBondContact O-N 3.42Å; L193-L215 HydrophobicContact CD1-CD1 4.37Å; L193-L215 HydrophobicContact CD2-CD1 3.93Å; L193-L215 HydrophobicContact CG-CD1 3.76Å; L193-L217 HydrophobicContact CD1-CD1 4.5Å; L193-I222 HydrophobicContact CD2-CG1 4.33Å; L193-I222 HydrophobicContact CD2-CG2 4.07Å; L193-W225 VanDerWaalsContact C-CH2 3.49Å; L193-W225 HydrophobicContact CB-CD2 4.11Å; L193-W225 HydrophobicContact CB-CE3 4.09Å; L193-W225 HydrophobicContact CB-CH2 3.75Å; L193-W225 HydrophobicContact CB-CZ2 3.74Å; L193-W225 HydrophobicContact CB-CZ3 3.93Å; L193-W225 HydrophobicContact CD1-CD2 4.06Å; L193-W225 HydrophobicContact CD1-CG 4.04Å; L193-W225 WeakPolarHBondContact O-CH2 3.49Å; L193-W225 WeakPolarHBondContact O-CZ3 3.48Å; L193-F226 HydrophobicContact CD2-CE2 3.93Å
194K97.5Very high96.5Very high82 Ų8275.3 Ų75.336%0.35740%0.396SS..Hα-helixtrans-67.3-42.7173.7-73.8163.6-163.8170.30111.9L190 Q191 R192 F197 Q198 W225L190-K194 WeakPolarHBondContact O-CB 3.39Å; L190-K194 VanDerWaalsContact O-CD 3.31Å; L190-K194 WeakPolarHBondContact O-CD 3.46Å; L190-K194 WeakPolarHBondContact O-CG 3.25Å; L190-K194 PolarHBondContact O-N 3.43Å; L190-K194 VanDerWaalsContact O-N 3.08Å; Q191-K194 WeakPolarHBondContact O-CB 3.33Å; Q191-K194 PolarHBondContact O-N 3.44Å; Q191-K194 VanDerWaalsContact O-N 3.13Å; R192-K194 PolarHBondContact O-N 2.84Å; K194-F197 PolarHBondContact O-N 2.86Å; K194-Q198 WeakPolarHBondContact O-CG 3.46Å; K194-Q198 PolarHBondContact O-N 3.01Å; K194-W225 HydrophobicContact CG-CH2 4.42Å; K194-W225 HydrophobicContact CG-CZ2 4.33Å
195S97.4Very high96.8Very high53 Ų5376.4 Ų76.437%0.37139%0.385SS..Hα-helixtrans-59.2-52.3177.5165.90000110.6Q191 R192 F197 Q198 T199Q191-S195 PolarHBondContact O-N 3.46Å; R192-S195 PolarHBondContact O-N 3.35Å; S195-F197 VanDerWaalsContact C-N 3.32Å; S195-F197 PolarHBondContact O-N 3.42Å; S195-Q198 WeakPolarHBondContact O-CB 3.4Å; S195-Q198 PolarHBondContact O-N 2.83Å; S195-T199 PolarHBondContact O-N 3.28Å; S195-T199 PolarHBondContact O-OG1 2.9Å
196E97.4Very high96.9Very high18 Ų1880.5 Ų80.58%0.08441%0.405CS..Hα-helixtrans-63.2-38.4175.1-95.4-59160.800112.8R192 Q198 T199 N200 R207 L211 F226R192-E196 IonicContact NH2-OE1 3.18Å; R192-E196 PolarHBondContact O-N 2.87Å; E196-Q198 PolarHBondContact O-N 3.46Å; E196-T199 PolarHBondContact O-N 3.4Å; E196-T199 VanDerWaalsContact O-N 3.16Å; E196-N200 PolarHBondContact O-N 3.02Å; E196-R207 IonicContact OE1-CZ 3.14Å; E196-R207 IonicContact OE1-NE 2.67Å; E196-R207 PolarHBondContact OE1-NE 3.02Å; E196-R207 IonicContact OE1-NH2 2.72Å; E196-R207 PolarHBondContact OE1-NH2 3.14Å; E196-L211 HydrophobicContact CB-CD1 4.21Å; E196-L211 HydrophobicContact CG-CD1 4.07Å; E196-L211 HydrophobicContact CG-CD2 3.99Å; E196-L211 HydrophobicContact CG-CG 4.44Å; E196-F226 HydrophobicContact CB-CZ 4.3Å
197F97.3Very high96.9Very high6 Ų680.4 Ų80.43%0.02640%0.397CS..Hα-helixtrans-60.9-30.2175.5-168.8-90.8000112.8L193 K194 S195 N200 R201 W225 F226 K229 R230 I233L193-F197 VanDerWaalsContact O-CB 3.24Å; L193-F197 WeakPolarHBondContact O-CB 3.48Å; L193-F197 PolarHBondContact O-N 3.42Å; K194-F197 PolarHBondContact O-N 2.86Å; S195-F197 VanDerWaalsContact C-N 3.32Å; S195-F197 PolarHBondContact O-N 3.42Å; F197-N200 WeakPolarHBondContact CA-O 3.33Å; F197-R201 HydrophobicContact CE2-CB 4.35Å; F197-R201 HydrophobicContact CZ-CB 4.26Å; F197-R201 HydrophobicContact CZ-CG 4.4Å; F197-R201 VanDerWaalsContact O-CD 3.28Å; F197-R201 WeakPolarHBondContact O-CD 3.39Å; F197-R201 PolarHBondContact O-NE 3.16Å; F197-W225 HydrophobicContact CB-CH2 4.1Å; F197-W225 HydrophobicContact CB-CZ3 3.93Å; F197-W225 HydrophobicContact CD2-CZ3 4.08Å; F197-W225 HydrophobicContact CG-CZ3 4.2Å; F197-F226 HydrophobicContact CB-CE1 4.21Å; F197-F226 HydrophobicContact CB-CZ 4.25Å; F197-F226 AromaticContact CD2-CD1 3.68Å; F197-F226 HydrophobicContact CD2-CD1 3.68Å; F197-F226 AromaticContact CD2-CE1 3.63Å; F197-F226 HydrophobicContact CD2-CE1 3.63Å; F197-F226 HydrophobicContact CD2-CG 4.43Å; F197-F226 HydrophobicContact CD2-CZ 4.34Å; F197-F226 HydrophobicContact CE2-CD1 4.19Å; F197-F226 HydrophobicContact CG-CE1 4.41Å; F197-K229 HydrophobicContact CD1-CD 4.33Å; F197-K229 VanDerWaalsContact CD1-CE 3.49Å; F197-K229 HydrophobicContact CD1-CG 3.76Å; F197-K229 HydrophobicContact CD2-CB 4.2Å; F197-K229 HydrophobicContact CD2-CG 3.57Å; F197-K229 HydrophobicContact CE1-CD 4.32Å; F197-K229 HydrophobicContact CE1-CG 3.65Å; F197-K229 HydrophobicContact CE2-CB 3.97Å; F197-K229 HydrophobicContact CE2-CG 3.46Å; F197-K229 VanDerWaalsContact CE2-CG 3.46Å; F197-K229 HydrophobicContact CG-CG 3.73Å; F197-K229 HydrophobicContact CZ-CB 4.34Å; F197-K229 HydrophobicContact CZ-CG 3.5Å; F197-R230 HydrophobicContact CE2-CG 3.84Å; F197-R230 HydrophobicContact CZ-CG 3.99Å; F197-I233 HydrophobicContact CE1-CD1 3.35Å; F197-I233 HydrophobicContact CZ-CD1 3.62Å
198Q96.8Very high97Very high133 Ų13378.7 Ų78.762%0.62137%0.373SS*.Hα-helixtrans-66.8-48.6174.8-73.4163.2-9.700110.5K194 S195 E196 R201K194-Q198 WeakPolarHBondContact O-CG 3.46Å; K194-Q198 PolarHBondContact O-N 3.01Å; S195-Q198 WeakPolarHBondContact O-CB 3.4Å; S195-Q198 PolarHBondContact O-N 2.83Å; E196-Q198 PolarHBondContact O-N 3.46Å; Q198-R201 PolarHBondContact O-NH2 3.4Å
199T95.9Very high97.1Very high113 Ų11375.2 Ų75.269%0.69336%0.356SS*.Hα-helixtrans-61.8-50.8176.7-50.50000112.4S195 E196S195-T199 PolarHBondContact O-N 3.28Å; S195-T199 PolarHBondContact O-OG1 2.9Å; E196-T199 PolarHBondContact O-N 3.4Å; E196-T199 VanDerWaalsContact O-N 3.16Å
200N95Very high97.1Very high69 Ų6976.7 Ų76.737%0.36937%0.365SS..  trans-140.2125.3-178.8-168.6-13.3000112.1E196 F197 Y202E196-N200 PolarHBondContact O-N 3.02Å; F197-N200 WeakPolarHBondContact CA-O 3.33Å; N200-Y202 VanDerWaalsContact C-N 3.26Å; N200-Y202 PolarHBondContact ND2-O 2.86Å; N200-Y202 PolarHBondContact O-N 3.46Å; N200-Y202 PolarHBondContact OD1-N 2.89Å; N200-Y202 PolarHBondContact OD1-O 2.92Å
201R95.8Very high97.1Very high122 Ų12274.2 Ų74.246%0.4635%0.352SS..SBendtrans-75.4-14.3179.5-52.1-65.5140.9962.3113F197 Q198 R230F197-R201 HydrophobicContact CE2-CB 4.35Å; F197-R201 HydrophobicContact CZ-CB 4.26Å; F197-R201 HydrophobicContact CZ-CG 4.4Å; F197-R201 VanDerWaalsContact O-CD 3.28Å; F197-R201 WeakPolarHBondContact O-CD 3.39Å; F197-R201 PolarHBondContact O-NE 3.16Å; Q198-R201 PolarHBondContact O-NH2 3.4Å; R201-R230 VanDerWaalsContact O-CD 3.32Å; R201-R230 WeakPolarHBondContact O-CD 3.37Å
202Y96.9Very high97.1Very high143 Ų14369.2 Ų69.256%0.56133%0.331SS*.SBendtrans-134.5116.2-174.4-67.4-104000110.5N200 R230N200-Y202 VanDerWaalsContact C-N 3.26Å; N200-Y202 PolarHBondContact ND2-O 2.86Å; N200-Y202 PolarHBondContact O-N 3.46Å; N200-Y202 PolarHBondContact OD1-N 2.89Å; N200-Y202 PolarHBondContact OD1-O 2.92Å; Y202-R230 VanDerWaalsContact CE1-CZ 3.44Å
203L96Very high97.1Very high39 Ų3973.6 Ų73.620%0.20435%0.354CS..  trans-78.3136177.3-66.7175.3000112.1R207 R208 L211 I222 F226L203-R207 HydrophobicContact CD2-CB 4.19Å; L203-R207 HydrophobicContact CD2-CG 3.84Å; L203-R208 HydrophobicContact CB-CB 4.28Å; L203-R208 HydrophobicContact CD1-CB 4.2Å; L203-R208 HydrophobicContact CD1-CG 4.38Å; L203-L211 HydrophobicContact CD1-CD1 3.88Å; L203-L211 HydrophobicContact CD2-CD1 3.72Å; L203-L211 HydrophobicContact CG-CD1 4.48Å; L203-I222 HydrophobicContact CD1-CG2 3.39Å; L203-F226 HydrophobicContact CD1-CD1 4.19Å; L203-F226 HydrophobicContact CD1-CD2 3.57Å; L203-F226 HydrophobicContact CD1-CE1 4.1Å; L203-F226 HydrophobicContact CD1-CE2 3.51Å; L203-F226 HydrophobicContact CD1-CG 3.95Å; L203-F226 HydrophobicContact CD1-CZ 3.78Å; L203-F226 HydrophobicContact CD2-CE1 3.93Å; L203-F226 HydrophobicContact CD2-CE2 4.36Å; L203-F226 HydrophobicContact CD2-CZ 3.79Å; L203-F226 HydrophobicContact CG-CD1 3.84Å; L203-F226 HydrophobicContact CG-CD2 4.15Å; L203-F226 HydrophobicContact CG-CE1 3.62Å; L203-F226 HydrophobicContact CG-CE2 3.98Å; L203-F226 HydrophobicContact CG-CG 4.11Å; L203-F226 HydrophobicContact CG-CZ 3.71Å
204T97.5Very high97.1Very high84 Ų8478.1 Ų78.152%0.51538%0.376SS..  trans-70.9165.8158.460.60000110.5R207 R208T204-R207 PolarHBondContact O-N 3.37Å; T204-R207 WeakPolarHBondContact OG1-CB 3.47Å; T204-R207 PolarHBondContact OG1-N 2.92Å; T204-R208 VanDerWaalsContact O-CB 3.31Å; T204-R208 WeakPolarHBondContact O-CB 3.5Å; T204-R208 PolarHBondContact O-N 3.49Å
205E97.3Very high97Very high118 Ų11875.2 Ų75.255%0.55136%0.364SS*.Hα-helixtrans-55.5-55.4174.6-172.3123-93.900112.2R207 R208 Q209E205-R207 PolarHBondContact O-N 2.95Å; E205-R208 WeakPolarHBondContact O-CB 3.42Å; E205-R208 PolarHBondContact O-N 2.66Å; E205-R208 VanDerWaalsContact O-N 3.11Å; E205-R208 IonicContact OE1-CZ 3.17Å; E205-R208 IonicContact OE1-NH1 2.91Å; E205-R208 PolarHBondContact OE1-NH1 2.65Å; E205-R208 VanDerWaalsContact OE1-NH1 3.14Å; E205-R208 IonicContact OE1-NH2 3.82Å; E205-R208 PolarHBondContact OE1-NH2 2.95Å; E205-Q209 PolarHBondContact O-N 3.37Å
206Q97.4Very high97Very high138 Ų13876 Ų7665%0.64538%0.38SS*.Hα-helixtrans-59.3-42.5-179.6-168.6-179.212.200112.4R208 Q209 N210Q206-R208 VanDerWaalsContact C-N 3.31Å; Q206-R208 PolarHBondContact O-N 2.71Å; Q206-Q209 PolarHBondContact O-N 2.75Å; Q206-N210 PolarHBondContact O-N 3.49Å; Q206-N210 PolarHBondContact O-OD1 2.87Å
207R97.4Very high96.9Very high68 Ų6876 Ų7626%0.25738%0.381SS..Hα-helixtrans-69.1-31.6178.6-166.157.1175.1152-19.1112.3E196 L203 T204 E205 L211 E214E196-R207 IonicContact OE1-CZ 3.14Å; E196-R207 IonicContact OE1-NE 2.67Å; E196-R207 PolarHBondContact OE1-NE 3.02Å; E196-R207 IonicContact OE1-NH2 2.72Å; E196-R207 PolarHBondContact OE1-NH2 3.14Å; L203-R207 HydrophobicContact CD2-CB 4.19Å; L203-R207 HydrophobicContact CD2-CG 3.84Å; T204-R207 PolarHBondContact O-N 3.37Å; T204-R207 WeakPolarHBondContact OG1-CB 3.47Å; T204-R207 PolarHBondContact OG1-N 2.92Å; E205-R207 PolarHBondContact O-N 2.95Å; R207-L211 WeakPolarHBondContact O-CB 3.4Å; R207-L211 WeakPolarHBondContact O-CG 3.37Å; R207-L211 PolarHBondContact O-N 2.97Å; R207-E214 IonicContact CZ-OE1 3.09Å; R207-E214 IonicContact NH1-OE1 2.66Å; R207-E214 PolarHBondContact NH1-OE1 2.97Å
208R98.1Very high96.9Very high47 Ų4781.1 Ų81.118%0.17741%0.409CS..Hα-helixtrans-67.6-39.8174.2-173.7-174.272.7-133.25.9111.9L203 T204 E205 Q206 A212 E219 I222L203-R208 HydrophobicContact CB-CB 4.28Å; L203-R208 HydrophobicContact CD1-CB 4.2Å; L203-R208 HydrophobicContact CD1-CG 4.38Å; T204-R208 VanDerWaalsContact O-CB 3.31Å; T204-R208 WeakPolarHBondContact O-CB 3.5Å; T204-R208 PolarHBondContact O-N 3.49Å; E205-R208 WeakPolarHBondContact O-CB 3.42Å; E205-R208 PolarHBondContact O-N 2.66Å; E205-R208 VanDerWaalsContact O-N 3.11Å; E205-R208 IonicContact OE1-CZ 3.17Å; E205-R208 IonicContact OE1-NH1 2.91Å; E205-R208 PolarHBondContact OE1-NH1 2.65Å; E205-R208 VanDerWaalsContact OE1-NH1 3.14Å; E205-R208 IonicContact OE1-NH2 3.82Å; E205-R208 PolarHBondContact OE1-NH2 2.95Å; Q206-R208 VanDerWaalsContact C-N 3.31Å; Q206-R208 PolarHBondContact O-N 2.71Å; R208-A212 WeakPolarHBondContact O-CB 3.5Å; R208-A212 PolarHBondContact O-N 3.42Å; R208-E219 HydrophobicContact CG-CB 4.11Å; R208-E219 HydrophobicContact CG-CG 4.37Å; R208-E219 IonicContact CZ-OE2 2.71Å; R208-E219 IonicContact NE-OE2 2.65Å; R208-E219 PolarHBondContact NE-OE2 3.3Å; R208-E219 IonicContact NH2-OE2 3.33Å; R208-E219 PolarHBondContact NH2-OE2 3.09Å; R208-I222 HydrophobicContact CG-CG2 4.33Å
209Q98.1Very high96.9Very high80 Ų8077.8 Ų77.837%0.37439%0.393SS..Hα-helixtrans-64.8-47.6173.7-73.5172.6-21.600111.8E205 Q206 L211 A212 Q213 E219E205-Q209 PolarHBondContact O-N 3.37Å; Q206-Q209 PolarHBondContact O-N 2.75Å; Q209-L211 VanDerWaalsContact C-N 3.34Å; Q209-L211 PolarHBondContact O-N 3.27Å; Q209-A212 WeakPolarHBondContact O-CB 3.39Å; Q209-A212 PolarHBondContact O-N 2.84Å; Q209-A212 VanDerWaalsContact O-N 3.08Å; Q209-Q213 PolarHBondContact O-N 2.79Å; Q209-Q213 VanDerWaalsContact O-N 3.07Å; Q209-E219 VanDerWaalsContact CG-CD 3.49Å; Q209-E219 HydrophobicContact CG-CG 4.41Å; Q209-E219 WeakPolarHBondContact CG-OE2 3.31Å
210N97.7Very high96.9Very high62 Ų6275.9 Ų75.933%0.33238%0.384SS..Hα-helixtrans-59.3-45.6177-66.16.7000111.1Q206 A212 Q213 E214Q206-N210 PolarHBondContact O-N 3.49Å; Q206-N210 PolarHBondContact O-OD1 2.87Å; N210-A212 VanDerWaalsContact C-N 3.3Å; N210-A212 PolarHBondContact O-N 3.27Å; N210-Q213 PolarHBondContact O-N 3.03Å; N210-E214 WeakPolarHBondContact O-CB 3.21Å; N210-E214 VanDerWaalsContact O-CG 3.27Å; N210-E214 WeakPolarHBondContact O-CG 3.39Å; N210-E214 PolarHBondContact O-N 3.37Å
211L97.3Very high97Very high0 Ų074.6 Ų74.60%038%0.376CS..Hα-helixtrans-64.9-30175.6-75.1171.8000113.8R192 E196 L203 R207 Q209 L215 I222R192-L211 HydrophobicContact CG-CD2 4.23Å; E196-L211 HydrophobicContact CB-CD1 4.21Å; E196-L211 HydrophobicContact CG-CD1 4.07Å; E196-L211 HydrophobicContact CG-CD2 3.99Å; E196-L211 HydrophobicContact CG-CG 4.44Å; L203-L211 HydrophobicContact CD1-CD1 3.88Å; L203-L211 HydrophobicContact CD2-CD1 3.72Å; L203-L211 HydrophobicContact CG-CD1 4.48Å; R207-L211 WeakPolarHBondContact O-CB 3.4Å; R207-L211 WeakPolarHBondContact O-CG 3.37Å; R207-L211 PolarHBondContact O-N 2.97Å; Q209-L211 VanDerWaalsContact C-N 3.34Å; Q209-L211 PolarHBondContact O-N 3.27Å; L211-L215 VanDerWaalsContact O-CB 3.29Å; L211-L215 WeakPolarHBondContact O-CB 3.44Å; L211-L215 WeakPolarHBondContact O-CG 3.28Å; L211-L215 PolarHBondContact O-N 3.11Å; L211-L215 VanDerWaalsContact O-N 3.17Å; L211-I222 VanDerWaalsContact C-CD1 3.44Å; L211-I222 HydrophobicContact CB-CD1 3.8Å; L211-I222 HydrophobicContact CD1-CG2 4.47Å
212A97.6Very high97Very high14 Ų1468.8 Ų68.812%0.11635%0.354CS..Hα-helixtrans-65.3-44.9175.300000111.1R208 Q209 N210 G216 L217 E219 I222R208-A212 WeakPolarHBondContact O-CB 3.5Å; R208-A212 PolarHBondContact O-N 3.42Å; Q209-A212 WeakPolarHBondContact O-CB 3.39Å; Q209-A212 PolarHBondContact O-N 2.84Å; Q209-A212 VanDerWaalsContact O-N 3.08Å; N210-A212 VanDerWaalsContact C-N 3.3Å; N210-A212 PolarHBondContact O-N 3.27Å; A212-G216 PolarHBondContact O-N 3.22Å; A212-G216 VanDerWaalsContact O-N 3.07Å; A212-L217 CarbonylContact C-O 3.6Å; A212-L217 VanDerWaalsContact CA-O 3.25Å; A212-L217 WeakPolarHBondContact CA-O 3.32Å; A212-L217 WeakPolarHBondContact CB-O 3.34Å; A212-L217 PolarHBondContact O-N 3.19Å; A212-E219 HydrophobicContact CB-CG 3.79Å; A212-I222 VanDerWaalsContact CA-CD1 3.45Å; A212-I222 HydrophobicContact CB-CD1 3.94Å; A212-I222 VanDerWaalsContact N-CD1 3.3Å
213Q97.5Very high97Very high156 Ų15667.3 Ų67.373%0.72935%0.35SS*.Hα-helixtrans-67.6-49.7175.6-66.1175.1-8.200111.7Q209 N210 L215 G216Q209-Q213 PolarHBondContact O-N 2.79Å; Q209-Q213 VanDerWaalsContact O-N 3.07Å; N210-Q213 PolarHBondContact O-N 3.03Å; Q213-L215 PolarHBondContact O-N 3.4Å; Q213-L215 VanDerWaalsContact O-N 3.17Å; Q213-G216 PolarHBondContact O-N 2.84Å
214E96.7Very high97.1Very high95 Ų9569.3 Ų69.344%0.44436%0.361SS..Hα-helixtrans-55.3-32.8178.5-75.2175.1-143.200113R192 R207 N210R192-E214 IonicContact CZ-OE2 2.66Å; R192-E214 IonicContact NE-OE2 2.76Å; R192-E214 PolarHBondContact NE-OE2 3.19Å; R192-E214 IonicContact NH2-OE1 3.99Å; R192-E214 PolarHBondContact NH2-OE1 2.84Å; R192-E214 IonicContact NH2-OE2 3.37Å; R192-E214 PolarHBondContact NH2-OE2 3.25Å; R207-E214 IonicContact CZ-OE1 3.09Å; R207-E214 IonicContact NH1-OE1 2.66Å; R207-E214 PolarHBondContact NH1-OE1 2.97Å; N210-E214 WeakPolarHBondContact O-CB 3.21Å; N210-E214 VanDerWaalsContact O-CG 3.27Å; N210-E214 WeakPolarHBondContact O-CG 3.39Å; N210-E214 PolarHBondContact O-N 3.37Å
215L96.1Very high97.1Very high22 Ų2266.8 Ų66.812%0.11534%0.342CS..Hα-helixtrans-110.4-3.6-171.6-64.9-177.6000115.4Q189 R192 L193 L211 Q213 L217Q189-L215 HydrophobicContact CG-CB 4.27Å; Q189-L215 HydrophobicContact CG-CD2 4.16Å; Q189-L215 PolarHBondContact NE2-O 2.91Å; R192-L215 HydrophobicContact CB-CD1 4.28Å; R192-L215 HydrophobicContact CB-CD2 3.83Å; R192-L215 HydrophobicContact CG-CD1 4.22Å; R192-L215 HydrophobicContact CG-CD2 3.87Å; R192-L215 HydrophobicContact CG-CG 4.31Å; L193-L215 HydrophobicContact CD1-CD1 4.37Å; L193-L215 HydrophobicContact CD2-CD1 3.93Å; L193-L215 HydrophobicContact CG-CD1 3.76Å; L211-L215 VanDerWaalsContact O-CB 3.29Å; L211-L215 WeakPolarHBondContact O-CB 3.44Å; L211-L215 WeakPolarHBondContact O-CG 3.28Å; L211-L215 PolarHBondContact O-N 3.11Å; L211-L215 VanDerWaalsContact O-N 3.17Å; Q213-L215 PolarHBondContact O-N 3.4Å; Q213-L215 VanDerWaalsContact O-N 3.17Å; L215-L217 VanDerWaalsContact C-N 3.28Å; L215-L217 HydrophobicContact CB-CB 4.39Å; L215-L217 HydrophobicContact CB-CD1 4.04Å; L215-L217 HydrophobicContact CB-CG 4Å; L215-L217 HydrophobicContact CD1-CD1 4.33Å; L215-L217 PolarHBondContact O-N 3.23Å
216G96.5Very high97.1Very high69 Ų6961.5 Ų61.571%0.71132%0.317SS*.THydrogen-bonded Turntrans61.235.2-172.500000113.1A212 Q213A212-G216 PolarHBondContact O-N 3.22Å; A212-G216 VanDerWaalsContact O-N 3.07Å; Q213-G216 PolarHBondContact O-N 2.84Å
217L95.9Very high97.1Very high19 Ų1959.4 Ų59.410%0.09931%0.307CS..  trans-118.8150.4-175.8-68.3-178.9000111.4F185 Q189 L193 A212 L215 I222F185-L217 HydrophobicContact CD1-CD1 3.68Å; F185-L217 HydrophobicContact CD1-CD2 3.83Å; F185-L217 HydrophobicContact CD1-CG 4.44Å; F185-L217 HydrophobicContact CE1-CD1 3.77Å; F185-L217 HydrophobicContact CE1-CD2 3.85Å; F185-L217 HydrophobicContact CE1-CG 4.43Å; Q189-L217 HydrophobicContact CB-CD1 4.43Å; Q189-L217 HydrophobicContact CG-CD1 4.28Å; L193-L217 HydrophobicContact CD1-CD1 4.5Å; A212-L217 CarbonylContact C-O 3.6Å; A212-L217 VanDerWaalsContact CA-O 3.25Å; A212-L217 WeakPolarHBondContact CA-O 3.32Å; A212-L217 WeakPolarHBondContact CB-O 3.34Å; A212-L217 PolarHBondContact O-N 3.19Å; L215-L217 VanDerWaalsContact C-N 3.28Å; L215-L217 HydrophobicContact CB-CB 4.39Å; L215-L217 HydrophobicContact CB-CD1 4.04Å; L215-L217 HydrophobicContact CB-CG 4Å; L215-L217 HydrophobicContact CD1-CD1 4.33Å; L215-L217 PolarHBondContact O-N 3.23Å; L217-I222 HydrophobicContact CB-CD1 4.29Å; L217-I222 HydrophobicContact CB-CG1 4.25Å
218N96.8Very high97.1Very high113 Ų11361.1 Ų61.160%0.60432%0.321SS*.  trans-69.5141.2172.8-65.5-88.3000110.6S220 Q221 I222N218-S220 PolarHBondContact O-N 3Å; N218-Q221 HydrophobicContact CB-CG 4.23Å; N218-Q221 PolarHBondContact ND2-OE1 3.06Å; N218-Q221 WeakPolarHBondContact O-CA 3.34Å; N218-Q221 WeakPolarHBondContact O-CB 3.43Å; N218-Q221 PolarHBondContact O-N 3.29Å; N218-I222 PolarHBondContact O-N 3.18Å
219E97.3Very high97Very high63 Ų6362.3 Ų62.329%0.29433%0.328SS..Hα-helixtrans-51.6-35.7175.2-67.8-171-11700113.3R208 Q209 A212 I222 K223R208-E219 HydrophobicContact CG-CB 4.11Å; R208-E219 HydrophobicContact CG-CG 4.37Å; R208-E219 IonicContact CZ-OE2 2.71Å; R208-E219 IonicContact NE-OE2 2.65Å; R208-E219 PolarHBondContact NE-OE2 3.3Å; R208-E219 IonicContact NH2-OE2 3.33Å; R208-E219 PolarHBondContact NH2-OE2 3.09Å; Q209-E219 VanDerWaalsContact CG-CD 3.49Å; Q209-E219 HydrophobicContact CG-CG 4.41Å; Q209-E219 WeakPolarHBondContact CG-OE2 3.31Å; A212-E219 HydrophobicContact CB-CG 3.79Å; E219-I222 PolarHBondContact O-N 3.26Å; E219-K223 WeakPolarHBondContact O-CB 3.36Å; E219-K223 PolarHBondContact O-N 2.92Å
220S96.4Very high96.9Very high73 Ų7362.4 Ų62.451%0.5133%0.325SS..Hα-helixtrans-63.7-39.4175.7-172.40000112.5N218 I222 K223 I224N218-S220 PolarHBondContact O-N 3Å; S220-I222 VanDerWaalsContact C-N 3.35Å; S220-I222 PolarHBondContact O-N 2.94Å; S220-K223 PolarHBondContact O-N 3.47Å; S220-I224 WeakPolarHBondContact O-CB 3.48Å; S220-I224 WeakPolarHBondContact O-CD1 3.28Å; S220-I224 WeakPolarHBondContact O-CG1 3.32Å; S220-I224 PolarHBondContact O-N 2.86Å
221Q96.3Very high96.8Very high41 Ų4161.6 Ų61.619%0.19233%0.326CS..Hα-helixtrans-64.3-41.3176.4-71.5170.8-65.100110.9F185 N218 I224 W225F185-Q221 HydrophobicContact CE1-CB 4Å; F185-Q221 HydrophobicContact CE1-CG 4.49Å; F185-Q221 HydrophobicContact CZ-CB 3.93Å; N218-Q221 HydrophobicContact CB-CG 4.23Å; N218-Q221 PolarHBondContact ND2-OE1 3.06Å; N218-Q221 WeakPolarHBondContact O-CA 3.34Å; N218-Q221 WeakPolarHBondContact O-CB 3.43Å; N218-Q221 PolarHBondContact O-N 3.29Å; Q221-I224 PolarHBondContact O-N 3.5Å; Q221-W225 WeakPolarHBondContact O-CB 3.45Å; Q221-W225 PolarHBondContact O-N 3.14Å
222I97Very high96.6Very high0 Ų069.2 Ų69.20%036%0.36CS..Hα-helixtrans-66.2-46.4175.8-62.4172.9000110.6L193 L203 R208 L211 A212 L217 N218 E219 S220 I224 W225 F226L193-I222 HydrophobicContact CD2-CG1 4.33Å; L193-I222 HydrophobicContact CD2-CG2 4.07Å; L203-I222 HydrophobicContact CD1-CG2 3.39Å; R208-I222 HydrophobicContact CG-CG2 4.33Å; L211-I222 VanDerWaalsContact C-CD1 3.44Å; L211-I222 HydrophobicContact CB-CD1 3.8Å; L211-I222 HydrophobicContact CD1-CG2 4.47Å; A212-I222 VanDerWaalsContact CA-CD1 3.45Å; A212-I222 HydrophobicContact CB-CD1 3.94Å; A212-I222 VanDerWaalsContact N-CD1 3.3Å; L217-I222 HydrophobicContact CB-CD1 4.29Å; L217-I222 HydrophobicContact CB-CG1 4.25Å; N218-I222 PolarHBondContact O-N 3.18Å; E219-I222 PolarHBondContact O-N 3.26Å; S220-I222 VanDerWaalsContact C-N 3.35Å; S220-I222 PolarHBondContact O-N 2.94Å; I222-I224 VanDerWaalsContact C-N 3.34Å; I222-I224 PolarHBondContact O-N 3.09Å; I222-W225 PolarHBondContact O-N 2.89Å; I222-W225 VanDerWaalsContact O-N 3.16Å; I222-F226 HydrophobicContact CG2-CD2 3.99Å; I222-F226 HydrophobicContact CG2-CE2 4.14Å; I222-F226 WeakPolarHBondContact O-CD2 3.4Å; I222-F226 PolarHBondContact O-N 3.38Å
223K96.9Very high96.3Very high112 Ų11272.2 Ų72.249%0.48737%0.373SS..Hα-helixtrans-55.2-47.5174.9-178.5176.6-179.91760111.6E219 S220 F226 Q227E219-K223 WeakPolarHBondContact O-CB 3.36Å; E219-K223 PolarHBondContact O-N 2.92Å; S220-K223 PolarHBondContact O-N 3.47Å; K223-F226 PolarHBondContact O-N 3.31Å; K223-Q227 VanDerWaalsContact O-CG 3.28Å; K223-Q227 WeakPolarHBondContact O-CG 3.27Å; K223-Q227 PolarHBondContact O-N 3.49Å
224I96.8Very high96Very high82 Ų8272.2 Ų72.242%0.42137%0.371SS..Hα-helixtrans-64.2-41.8176.9-70.4164.5000111S220 Q221 I222 Q227 N228S220-I224 WeakPolarHBondContact O-CB 3.48Å; S220-I224 WeakPolarHBondContact O-CD1 3.28Å; S220-I224 WeakPolarHBondContact O-CG1 3.32Å; S220-I224 PolarHBondContact O-N 2.86Å; Q221-I224 PolarHBondContact O-N 3.5Å; I222-I224 VanDerWaalsContact C-N 3.34Å; I222-I224 PolarHBondContact O-N 3.09Å; I224-Q227 PolarHBondContact O-N 2.63Å; I224-N228 WeakPolarHBondContact CG2-ND2 3.35Å; I224-N228 WeakPolarHBondContact O-CB 3.48Å; I224-N228 PolarHBondContact O-N 3.32Å; I224-N228 PolarHBondContact O-ND2 2.88Å
225W97.3Very high95.5Very high31 Ų3176.4 Ų76.412%0.11739%0.387CS..Hα-helixtrans-61.8-46.7177.1-172.4102.1000111.6F185 L190 L193 K194 F197 Q221 I222 Q227 N228 K229F185-W225 AromaticContact CD2-CD1 3.78Å; F185-W225 HydrophobicContact CE2-CB 4.32Å; F185-W225 AromaticContact CE2-CD1 3.67Å; F185-W225 HydrophobicContact CE2-CG 4.37Å; L190-W225 VanDerWaalsContact CD2-NE1 3.31Å; L193-W225 VanDerWaalsContact C-CH2 3.49Å; L193-W225 HydrophobicContact CB-CD2 4.11Å; L193-W225 HydrophobicContact CB-CE3 4.09Å; L193-W225 HydrophobicContact CB-CH2 3.75Å; L193-W225 HydrophobicContact CB-CZ2 3.74Å; L193-W225 HydrophobicContact CB-CZ3 3.93Å; L193-W225 HydrophobicContact CD1-CD2 4.06Å; L193-W225 HydrophobicContact CD1-CG 4.04Å; L193-W225 WeakPolarHBondContact O-CH2 3.49Å; L193-W225 WeakPolarHBondContact O-CZ3 3.48Å; K194-W225 HydrophobicContact CG-CH2 4.42Å; K194-W225 HydrophobicContact CG-CZ2 4.33Å; F197-W225 HydrophobicContact CB-CH2 4.1Å; F197-W225 HydrophobicContact CB-CZ3 3.93Å; F197-W225 HydrophobicContact CD2-CZ3 4.08Å; F197-W225 HydrophobicContact CG-CZ3 4.2Å; Q221-W225 WeakPolarHBondContact O-CB 3.45Å; Q221-W225 PolarHBondContact O-N 3.14Å; I222-W225 PolarHBondContact O-N 2.89Å; I222-W225 VanDerWaalsContact O-N 3.16Å; W225-Q227 PolarHBondContact O-N 3.11Å; W225-N228 PolarHBondContact O-N 3.04Å; W225-K229 HydrophobicContact CE3-CB 4.15Å; W225-K229 HydrophobicContact CH2-CB 4.38Å; W225-K229 HydrophobicContact CH2-CD 4.25Å; W225-K229 HydrophobicContact CH2-CG 4.08Å; W225-K229 HydrophobicContact CZ3-CB 4.01Å; W225-K229 HydrophobicContact CZ3-CG 4Å; W225-K229 VanDerWaalsContact O-CB 3.3Å; W225-K229 WeakPolarHBondContact O-CB 3.4Å; W225-K229 PolarHBondContact O-N 3.42Å
226F98.1Very high94.9Very high7 Ų779.3 Ų79.33%0.03142%0.415CS..Hα-helixtrans-64.2-38.6177.8-91.3-105.1000112.4L193 E196 F197 L203 I222 K223 R230L193-F226 HydrophobicContact CD2-CE2 3.93Å; E196-F226 HydrophobicContact CB-CZ 4.3Å; F197-F226 HydrophobicContact CB-CE1 4.21Å; F197-F226 HydrophobicContact CB-CZ 4.25Å; F197-F226 AromaticContact CD2-CD1 3.68Å; F197-F226 HydrophobicContact CD2-CD1 3.68Å; F197-F226 AromaticContact CD2-CE1 3.63Å; F197-F226 HydrophobicContact CD2-CE1 3.63Å; F197-F226 HydrophobicContact CD2-CG 4.43Å; F197-F226 HydrophobicContact CD2-CZ 4.34Å; F197-F226 HydrophobicContact CE2-CD1 4.19Å; F197-F226 HydrophobicContact CG-CE1 4.41Å; L203-F226 HydrophobicContact CD1-CD1 4.19Å; L203-F226 HydrophobicContact CD1-CD2 3.57Å; L203-F226 HydrophobicContact CD1-CE1 4.1Å; L203-F226 HydrophobicContact CD1-CE2 3.51Å; L203-F226 HydrophobicContact CD1-CG 3.95Å; L203-F226 HydrophobicContact CD1-CZ 3.78Å; L203-F226 HydrophobicContact CD2-CE1 3.93Å; L203-F226 HydrophobicContact CD2-CE2 4.36Å; L203-F226 HydrophobicContact CD2-CZ 3.79Å; L203-F226 HydrophobicContact CG-CD1 3.84Å; L203-F226 HydrophobicContact CG-CD2 4.15Å; L203-F226 HydrophobicContact CG-CE1 3.62Å; L203-F226 HydrophobicContact CG-CE2 3.98Å; L203-F226 HydrophobicContact CG-CG 4.11Å; L203-F226 HydrophobicContact CG-CZ 3.71Å; I222-F226 HydrophobicContact CG2-CD2 3.99Å; I222-F226 HydrophobicContact CG2-CE2 4.14Å; I222-F226 WeakPolarHBondContact O-CD2 3.4Å; I222-F226 PolarHBondContact O-N 3.38Å; K223-F226 PolarHBondContact O-N 3.31Å; F226-R230 PolarHBondContact O-N 3.43Å
227Q97.7Very high94.1Very high93 Ų9380.3 Ų80.344%0.43541%0.411SS..Hα-helixtrans-62.3-49.3172.4-73.1174.610.900111.7K223 I224 W225 K229 R230 A231K223-Q227 VanDerWaalsContact O-CG 3.28Å; K223-Q227 WeakPolarHBondContact O-CG 3.27Å; K223-Q227 PolarHBondContact O-N 3.49Å; I224-Q227 PolarHBondContact O-N 2.63Å; W225-Q227 PolarHBondContact O-N 3.11Å; Q227-K229 VanDerWaalsContact C-N 3.33Å; Q227-K229 PolarHBondContact O-N 2.92Å; Q227-R230 PolarHBondContact O-N 2.84Å; Q227-A231 VanDerWaalsContact O-CB 3.32Å; Q227-A231 WeakPolarHBondContact O-CB 3.22Å; Q227-A231 PolarHBondContact O-N 2.97Å
228N96.9Very high92.6Very high105 Ų10582 Ų8256%0.56143%0.432SS*.Hα-helixtrans-61.4-39.6177.7-77.3-34.7000112.3I224 W225 A231 K232I224-N228 WeakPolarHBondContact CG2-ND2 3.35Å; I224-N228 WeakPolarHBondContact O-CB 3.48Å; I224-N228 PolarHBondContact O-N 3.32Å; I224-N228 PolarHBondContact O-ND2 2.88Å; W225-N228 PolarHBondContact O-N 3.04Å; N228-A231 PolarHBondContact O-N 3.15Å; N228-K232 WeakPolarHBondContact O-CB 3.4Å; N228-K232 PolarHBondContact O-N 3.29Å
229K96.4Very high91.3Very high72 Ų7282.6 Ų82.631%0.31344%0.44SS..Hα-helixtrans-64.9-46.6177.3-17865.6175.1179.70111.6F197 W225 Q227 K232 I233F197-K229 HydrophobicContact CD1-CD 4.33Å; F197-K229 VanDerWaalsContact CD1-CE 3.49Å; F197-K229 HydrophobicContact CD1-CG 3.76Å; F197-K229 HydrophobicContact CD2-CB 4.2Å; F197-K229 HydrophobicContact CD2-CG 3.57Å; F197-K229 HydrophobicContact CE1-CD 4.32Å; F197-K229 HydrophobicContact CE1-CG 3.65Å; F197-K229 HydrophobicContact CE2-CB 3.97Å; F197-K229 HydrophobicContact CE2-CG 3.46Å; F197-K229 VanDerWaalsContact CE2-CG 3.46Å; F197-K229 HydrophobicContact CG-CG 3.73Å; F197-K229 HydrophobicContact CZ-CB 4.34Å; F197-K229 HydrophobicContact CZ-CG 3.5Å; W225-K229 HydrophobicContact CE3-CB 4.15Å; W225-K229 HydrophobicContact CH2-CB 4.38Å; W225-K229 HydrophobicContact CH2-CD 4.25Å; W225-K229 HydrophobicContact CH2-CG 4.08Å; W225-K229 HydrophobicContact CZ3-CB 4.01Å; W225-K229 HydrophobicContact CZ3-CG 4Å; W225-K229 VanDerWaalsContact O-CB 3.3Å; W225-K229 WeakPolarHBondContact O-CB 3.4Å; W225-K229 PolarHBondContact O-N 3.42Å; Q227-K229 VanDerWaalsContact C-N 3.33Å; Q227-K229 PolarHBondContact O-N 2.92Å; K229-K232 PolarHBondContact O-N 3.46Å; K229-I233 WeakPolarHBondContact O-CG1 3.41Å; K229-I233 PolarHBondContact O-N 2.83Å; K229-I233 VanDerWaalsContact O-N 3.12Å
230R96.4Very high90Very high82 Ų8287.6 Ų87.631%0.30946%0.461SS..Hα-helixtrans-62.8-42.6172.8-74.6-169.1-74131.5-3.8112.2F197 R201 Y202 F226 Q227 K232 I233 K234F197-R230 HydrophobicContact CE2-CG 3.84Å; F197-R230 HydrophobicContact CZ-CG 3.99Å; R201-R230 VanDerWaalsContact O-CD 3.32Å; R201-R230 WeakPolarHBondContact O-CD 3.37Å; Y202-R230 VanDerWaalsContact CE1-CZ 3.44Å; F226-R230 PolarHBondContact O-N 3.43Å; Q227-R230 PolarHBondContact O-N 2.84Å; R230-K232 PolarHBondContact O-N 3.1Å; R230-I233 PolarHBondContact O-N 2.91Å; R230-K234 PolarHBondContact O-N 3.44Å
231A94.6Very high89.1Confident44 Ų4489.4 Ų89.436%0.36447%0.465SS..Hα-helixtrans-62.4-40.617700000112.3Q227 N228 K234 K235Q227-A231 VanDerWaalsContact O-CB 3.32Å; Q227-A231 WeakPolarHBondContact O-CB 3.22Å; Q227-A231 PolarHBondContact O-N 2.97Å; N228-A231 PolarHBondContact O-N 3.15Å; A231-K234 PolarHBondContact O-N 3.35Å; A231-K235 WeakPolarHBondContact O-CB 3.44Å; A231-K235 WeakPolarHBondContact O-CG 3.32Å; A231-K235 PolarHBondContact O-N 3.21Å
232K93.1Very high88.2Confident161 Ų16191.9 Ų91.970%0.749%0.487SS*.Hα-helixtrans-62.2-42.3174.5-174.4173.7179.71760111.7N228 K229 R230 K235 A236N228-K232 WeakPolarHBondContact O-CB 3.4Å; N228-K232 PolarHBondContact O-N 3.29Å; K229-K232 PolarHBondContact O-N 3.46Å; R230-K232 PolarHBondContact O-N 3.1Å; K232-K235 PolarHBondContact O-N 2.95Å; K232-A236 WeakPolarHBondContact O-CB 3.33Å; K232-A236 PolarHBondContact O-N 3.2Å
233I91.6Very high87.4Confident76 Ų7696.3 Ų96.339%0.3951%0.51SS..Hα-helixtrans-66.5-46.5176.3-69.1166.2000110.9F197 K229 R230 K235 A236 S237F197-I233 HydrophobicContact CE1-CD1 3.35Å; F197-I233 HydrophobicContact CZ-CD1 3.62Å; K229-I233 WeakPolarHBondContact O-CG1 3.41Å; K229-I233 PolarHBondContact O-N 2.83Å; K229-I233 VanDerWaalsContact O-N 3.12Å; R230-I233 PolarHBondContact O-N 2.91Å; I233-K235 VanDerWaalsContact C-N 3.26Å; I233-K235 PolarHBondContact O-N 3.29Å; I233-A236 CarbonylContact O-C 3.57Å; I233-A236 WeakPolarHBondContact O-CA 3.28Å; I233-A236 PolarHBondContact O-N 2.96Å; I233-S237 WeakPolarHBondContact O-CB 3.16Å; I233-S237 PolarHBondContact O-N 3.29Å
234K90.6Very high86.5Confident157 Ų15792 Ų9268%0.68350%0.496SS*.Hα-helixtrans-57.2-39.6176.2-170.3174.271.61660112.1R230 A231R230-K234 PolarHBondContact O-N 3.44Å; A231-K234 PolarHBondContact O-N 3.35Å
235K86.3Confident85.7Confident182 Ų18292.5 Ų92.579%0.79150%0.499SS*.Hα-helixtrans-68.4-31.8174.1-74.4-178.366173.90113.7A231 K232 I233A231-K235 WeakPolarHBondContact O-CB 3.44Å; A231-K235 WeakPolarHBondContact O-CG 3.32Å; A231-K235 PolarHBondContact O-N 3.21Å; K232-K235 PolarHBondContact O-N 2.95Å; I233-K235 VanDerWaalsContact C-N 3.26Å; I233-K235 PolarHBondContact O-N 3.29Å
236A83.5Confident85Confident84 Ų8495.4 Ų95.469%0.69451%0.513SS*.Hα-helixtrans-79.3-28.4176.900000112.7K232 I233 G238K232-A236 WeakPolarHBondContact O-CB 3.33Å; K232-A236 PolarHBondContact O-N 3.2Å; I233-A236 CarbonylContact O-C 3.57Å; I233-A236 WeakPolarHBondContact O-CA 3.28Å; I233-A236 PolarHBondContact O-N 2.96Å; A236-G238 PolarHBondContact O-N 2.9Å
237S80.3Confident84.3Confident90 Ų9096.4 Ų96.463%0.62952%0.519SS*.THydrogen-bonded Turntrans-73.124.5-176-163.40000115.2I233 T239I233-S237 WeakPolarHBondContact O-CB 3.16Å; I233-S237 PolarHBondContact O-N 3.29Å; S237-T239 PolarHBondContact O-N 3.14Å
238G64.4Low83.6Confident53 Ų5396 Ų9655%0.54652%0.518SS..THydrogen-bonded Turntrans84.2-6.715900000118.3A236 K240A236-G238 PolarHBondContact O-N 2.9Å; G238-K240 PolarHBondContact O-N 2.74Å
239T69.6Low82.7Confident126 Ų12695.3 Ų95.377%0.77353%0.527SS*.  trans-70.877.3168.5-42.10000110S237 N241S237-T239 PolarHBondContact O-N 3.14Å; T239-N241 PolarHBondContact O-N 3.19Å
240K69.8Low82.1Confident169 Ų16995.8 Ų95.874%0.73553%0.53SS*.  trans-53.7125.5170.1-62.4174-172.6174.70106.8G238 S242G238-K240 PolarHBondContact O-N 2.74Å; K240-S242 PolarHBondContact O-N 3.32Å
241N77.8Confident81.5Confident111 Ų11194 Ų9459%0.59454%0.538SS*.  trans-65.3109.1179-173.5-18.6000107.7T239 L243 A244 L245T239-N241 PolarHBondContact O-N 3.19Å; N241-L243 PolarHBondContact O-N 2.87Å; N241-L243 PolarHBondContact OD1-N 3.31Å; N241-A244 HydrophobicContact CB-CB 4.04Å; N241-A244 WeakPolarHBondContact O-CA 3.49Å; N241-A244 WeakPolarHBondContact O-CB 2.97Å; N241-A244 PolarHBondContact O-N 2.9Å; N241-L245 PolarHBondContact O-N 3Å
242S78.4Confident80.9Confident93 Ų9394.3 Ų94.365%0.6553%0.533SS*.Hα-helixtrans-55.9-37.7-171.7-173.40000111.9K240 A244 L245 H246K240-S242 PolarHBondContact O-N 3.32Å; S242-A244 PolarHBondContact O-N 2.95Å; S242-L245 WeakPolarHBondContact O-CB 3.44Å; S242-L245 PolarHBondContact O-N 3.37Å; S242-L245 VanDerWaalsContact O-N 3.14Å; S242-H246 PolarHBondContact O-N 3.08Å
243L80.3Confident80.2Confident92 Ų9291.2 Ų91.248%0.48252%0.518SS..Hα-helixtrans-60.7-41.3173179.462.4000112.5N241 L245 H246 L247N241-L243 PolarHBondContact O-N 2.87Å; N241-L243 PolarHBondContact OD1-N 3.31Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 3.35Å; L243-H246 PolarHBondContact O-N 3.43Å; L243-L247 HydrophobicContact CD1-CD1 4.06Å; L243-L247 HydrophobicContact CD1-CG 4.2Å; L243-L247 HydrophobicContact CG-CD1 3.94Å; L243-L247 HydrophobicContact CG-CG 4.48Å; L243-L247 WeakPolarHBondContact O-CB 3.35Å; L243-L247 VanDerWaalsContact O-CG 3.22Å; L243-L247 WeakPolarHBondContact O-CG 3.23Å; L243-L247 PolarHBondContact O-N 2.69Å
244A76.6Confident79Confident23 Ų2391.3 Ų91.319%0.1952%0.519CS..Hα-helixtrans-67-34.9175.900000111.6N241 S242 M248 Y253N241-A244 HydrophobicContact CB-CB 4.04Å; N241-A244 WeakPolarHBondContact O-CA 3.49Å; N241-A244 WeakPolarHBondContact O-CB 2.97Å; N241-A244 PolarHBondContact O-N 2.9Å; S242-A244 PolarHBondContact O-N 2.95Å; A244-M248 WeakPolarHBondContact O-CB 3.04Å; A244-M248 VanDerWaalsContact O-CG 3.27Å; A244-M248 WeakPolarHBondContact O-CG 3.07Å; A244-M248 PolarHBondContact O-N 3.2Å; A244-Y253 HydrophobicContact CB-CE1 4.41Å
245L80.9Confident77.7Confident92 Ų9288.7 Ų88.748%0.48251%0.509SS..Hα-helixtrans-67.4-42.9174.6-174.660000112N241 S242 L243 M248 A249N241-L245 PolarHBondContact O-N 3Å; S242-L245 WeakPolarHBondContact O-CB 3.44Å; S242-L245 PolarHBondContact O-N 3.37Å; S242-L245 VanDerWaalsContact O-N 3.14Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 3.35Å; L245-M248 HydrophobicContact CB-CE 4.37Å; L245-M248 HydrophobicContact CD1-CE 3.85Å; L245-M248 PolarHBondContact O-N 3.4Å; L245-A249 PolarHBondContact O-N 3.46Å
246H82.6Confident76.3Confident91 Ų9184.1 Ų84.142%0.42151%0.505SS..Hα-helixtrans-62.2-44.5174.5-172.480.2000112.1S242 L243 M248 A249 Q250S242-H246 PolarHBondContact O-N 3.08Å; L243-H246 PolarHBondContact O-N 3.43Å; H246-M248 VanDerWaalsContact C-N 3.34Å; H246-M248 PolarHBondContact O-N 3.32Å; H246-A249 PolarHBondContact O-N 2.71Å; H246-Q250 PolarHBondContact NE2-NE2 3.19Å; H246-Q250 PolarHBondContact O-N 2.85Å
247L83.4Confident74.7Confident29 Ų2984.8 Ų84.815%0.15250%0.5CS..Hα-helixtrans-69-28.4176.2-67.3168.3000113L243 G251 L252 Y253L243-L247 HydrophobicContact CD1-CD1 4.06Å; L243-L247 HydrophobicContact CD1-CG 4.2Å; L243-L247 HydrophobicContact CG-CD1 3.94Å; L243-L247 HydrophobicContact CG-CG 4.48Å; L243-L247 WeakPolarHBondContact O-CB 3.35Å; L243-L247 VanDerWaalsContact O-CG 3.22Å; L243-L247 WeakPolarHBondContact O-CG 3.23Å; L243-L247 PolarHBondContact O-N 2.69Å; L247-G251 PolarHBondContact O-N 3.31Å; L247-L252 HydrophobicContact CD2-CB 4.08Å; L247-L252 HydrophobicContact CD2-CD1 4.06Å; L247-L252 PolarHBondContact O-N 3.15Å; L247-Y253 PolarHBondContact O-N 3.32Å; L247-Y253 VanDerWaalsContact O-N 3.09Å
248M81.8Confident73.1Confident84 Ų8486 Ų8641%0.41450%0.504SS..Hα-helixtrans-66.5-45.9169-77-174.7-62.500111A244 L245 H246 Q250 G251 Y253 H255A244-M248 WeakPolarHBondContact O-CB 3.04Å; A244-M248 VanDerWaalsContact O-CG 3.27Å; A244-M248 WeakPolarHBondContact O-CG 3.07Å; A244-M248 PolarHBondContact O-N 3.2Å; L245-M248 HydrophobicContact CB-CE 4.37Å; L245-M248 HydrophobicContact CD1-CE 3.85Å; L245-M248 PolarHBondContact O-N 3.4Å; H246-M248 VanDerWaalsContact C-N 3.34Å; H246-M248 PolarHBondContact O-N 3.32Å; M248-Q250 PolarHBondContact O-N 3.03Å; M248-G251 PolarHBondContact O-N 3.22Å; M248-Y253 HydrophobicContact CG-CD1 3.7Å; M248-Y253 WeakPolarHBondContact CG-O 3.09Å; M248-Y253 HydrophobicContact SD-CD1 4.32Å; M248-H255 HydrophobicContact SD-CB 4.11Å
249A78.9Confident72.1Confident91 Ų9189.3 Ų89.375%0.75251%0.514SS*.Hα-helixtrans-62.4-29.717800000113.1L245 H246 G251L245-A249 PolarHBondContact O-N 3.46Å; H246-A249 PolarHBondContact O-N 2.71Å; A249-G251 VanDerWaalsContact C-N 3.35Å
250Q84.6Confident70.6Confident81 Ų8187.6 Ų87.638%0.37951%0.507SS..THydrogen-bonded Turntrans-85.92.2174.6-70.8175.3-15.900114.2H246 M248 L252H246-Q250 PolarHBondContact NE2-NE2 3.19Å; H246-Q250 PolarHBondContact O-N 2.85Å; M248-Q250 PolarHBondContact O-N 3.03Å; Q250-L252 HydrophobicContact CB-CD1 4.17Å; Q250-L252 HydrophobicContact CB-CG 4.11Å; Q250-L252 PolarHBondContact O-N 3.24Å; Q250-L252 VanDerWaalsContact O-N 3.11Å
251G83.6Confident69.3Low46 Ų4687.2 Ų87.247%0.47451%0.505SS..THydrogen-bonded Turntrans70.7-2-176.400000115.3L247 M248 A249 Y253L247-G251 PolarHBondContact O-N 3.31Å; M248-G251 PolarHBondContact O-N 3.22Å; A249-G251 VanDerWaalsContact C-N 3.35Å; G251-Y253 VanDerWaalsContact C-N 3.3Å; G251-Y253 PolarHBondContact O-N 3.3Å
252L80.9Confident67.7Low50 Ų5088.2 Ų88.226%0.26251%0.511SS..  trans-78.2-10-176.7-62.6177.4000113.8L247 Q250L247-L252 HydrophobicContact CD2-CB 4.08Å; L247-L252 HydrophobicContact CD2-CD1 4.06Å; L247-L252 PolarHBondContact O-N 3.15Å; Q250-L252 HydrophobicContact CB-CD1 4.17Å; Q250-L252 HydrophobicContact CB-CG 4.11Å; Q250-L252 PolarHBondContact O-N 3.24Å; Q250-L252 VanDerWaalsContact O-N 3.11Å
253Y77.6Confident66.2Low96 Ų9690.5 Ų90.538%0.37651%0.511SS..  trans-133100.6-179.7-173.4-100.8000112.7A244 L247 M248 G251 H255A244-Y253 HydrophobicContact CB-CE1 4.41Å; L247-Y253 PolarHBondContact O-N 3.32Å; L247-Y253 VanDerWaalsContact O-N 3.09Å; M248-Y253 HydrophobicContact CG-CD1 3.7Å; M248-Y253 WeakPolarHBondContact CG-O 3.09Å; M248-Y253 HydrophobicContact SD-CD1 4.32Å; G251-Y253 VanDerWaalsContact C-N 3.3Å; G251-Y253 PolarHBondContact O-N 3.3Å; Y253-H255 HydrophobicContact CD1-CB 4.3Å; Y253-H255 HydrophobicContact CE1-CB 3.93Å; Y253-H255 AromaticContact CE1-CD2 3.83Å; Y253-H255 PolarHBondContact O-N 3.48Å
254N66.9Low64.9Low78 Ų7894.6 Ų94.642%0.41753%0.525SS..  trans-84.4101177-92.9-74.2000112.1Y156 A256Y156-N254 HydrophobicContact CD1-CB 3.89Å; Y156-N254 HydrophobicContact CE1-CB 4.02Å; N254-A256 VanDerWaalsContact C-N 3.26Å; N254-A256 PolarHBondContact O-N 3.25Å
255H64.1Low63.7Low101 Ų10198.7 Ų98.747%0.46855%0.552SS.*  trans-90.439.2172.8-160.9-79.3000112.6M248 Y253 T257M248-H255 HydrophobicContact SD-CB 4.11Å; Y253-H255 HydrophobicContact CD1-CB 4.3Å; Y253-H255 HydrophobicContact CE1-CB 3.93Å; Y253-H255 AromaticContact CE1-CD2 3.83Å; Y253-H255 PolarHBondContact O-N 3.48Å; H255-T257 PolarHBondContact O-N 3.32Å
256A56.5Low62.2Low87 Ų87100.5 Ų100.572%0.71956%0.562SS**  trans-72.744.317900000113.6N254N254-A256 VanDerWaalsContact C-N 3.26Å; N254-A256 PolarHBondContact O-N 3.25Å
257T50.3Low60.9Low97 Ų97101.5 Ų101.560%0.59558%0.579SS**  trans-120.427.1167.569.50000111H255 T259H255-T257 PolarHBondContact O-N 3.32Å; T257-T259 VanDerWaalsContact C-N 3.34Å; T257-T259 PolarHBondContact O-N 2.86Å; T257-T259 VanDerWaalsContact O-N 3.11Å
258V45.3Very low59.4Low115 Ų115111.6 Ų111.670%0.69763%0.634SS**  trans-65.3104.5154.4-1800000105S260V258-S260 PolarHBondContact O-N 2.98Å
259T43.5Very low58.2Low123 Ų123113 Ų11376%0.75565%0.645SS**  trans-59.7117.5160.746.20000106.1T257 K261T257-T259 VanDerWaalsContact C-N 3.34Å; T257-T259 PolarHBondContact O-N 2.86Å; T257-T259 VanDerWaalsContact O-N 3.11Å; T259-K261 VanDerWaalsContact C-N 3.32Å; T259-K261 PolarHBondContact O-N 3.48Å
260S38.8Very low57.2Low90 Ų90114.2 Ų114.263%0.62964%0.639SS**  trans-52.4100.5169.5-34.20000107.7V258 D262V258-S260 PolarHBondContact O-N 2.98Å; S260-D262 VanDerWaalsContact CB-OD2 3.25Å; S260-D262 WeakPolarHBondContact CB-OD2 3.48Å; S260-D262 PolarHBondContact O-N 3.46Å
261K43.6Very low55.6Low161 Ų161116 Ų11670%0.765%0.654SS**  trans-87.882.1154.3-175.3173178.8-88.80102.8T259 E263T259-K261 VanDerWaalsContact C-N 3.32Å; T259-K261 PolarHBondContact O-N 3.48Å; K261-E263 IonicContact NZ-OE1 2.81Å; K261-E263 PolarHBondContact NZ-OE1 3.42Å; K261-E263 PolarHBondContact O-N 3.06Å
262D43.4Very low54Low133 Ų133120.1 Ų120.171%0.71166%0.664SS**  trans-59.7110175.7-65.9-62.7000106.8S260 K264S260-D262 VanDerWaalsContact CB-OD2 3.25Å; S260-D262 WeakPolarHBondContact CB-OD2 3.48Å; S260-D262 PolarHBondContact O-N 3.46Å; D262-K264 PolarHBondContact O-N 2.84Å
263E47.6Very low52.3Low140 Ų140124.5 Ų124.565%0.65469%0.689SS**  trans-70.184.3169.9-65.9-71.1118.200106.3K261 S265K261-E263 IonicContact NZ-OE1 2.81Å; K261-E263 PolarHBondContact NZ-OE1 3.42Å; K261-E263 PolarHBondContact O-N 3.06Å; E263-S265 PolarHBondContact O-N 3.22Å
264K51.3Low50.6Low178 Ų178126.4 Ų126.477%0.77471%0.71SS**  trans-70.674.5163.9-174.8-179.3167.487.80107.4D262 D266D262-K264 PolarHBondContact O-N 2.84Å; K264-D266 PolarHBondContact O-N 3.23Å
265S51Low49.5Very low109 Ų109129.9 Ų129.976%0.76273%0.731SS**  trans-69.9112.1160.847.80000107.3E263E263-S265 PolarHBondContact O-N 3.22Å
266D50.2Low48.3Very low131 Ų131132.1 Ų132.170%0.70175%0.751SS**  trans-65.3163178.9-130.3-119.4000111.4K264K264-D266 PolarHBondContact O-N 3.23Å
267S56.5Low47.6Very low111 Ų111135.8 Ų135.878%0.77675%0.754SS**  trans-66154.2179.6-71.20000113.3
268D50.2Low47.4Very low242 Ų242139.4 Ų139.4100%1.29477%0.768SS**  trans-111.20141-157.5-111.9000106.6

Retrieved 268 of 268 residues in 72.2 ms (Link to these results)