X2JKA0_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JKA0, Species DROME (Drosophila melanogaster, Fruit fly), Gene CG9517, Length 281 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
1M53.7Low55.7Low254 Ų254151.8 Ų151.8100%1.25180%0.795SS**  0109.60-69.2-160.6-70.700108
2G64.4Low55Low81 Ų81151.4 Ų151.484%0.83579%0.786SS**  trans157.497.6-179.600000109.8
3Q67.3Low54.3Low181 Ų181150.2 Ų150.285%0.84677%0.774SS**  trans-79.4151.4-160.6-65.5170.912.700114.6
4E57.1Low53.5Low168 Ų168150.5 Ų150.579%0.78577%0.77SS**  trans-66159.8164.552.9-119.7122.500114.1
5I62.5Low52.7Low159 Ų159150.7 Ų150.782%0.81577%0.766SS**  trans-163.6122.2140.2-86.9130.7000109.6
6S55.9Low51.8Low109 Ų109150.6 Ų150.676%0.76276%0.762SS**  trans-105.6146.1162.5174.20000107.5
7Q54.5Low51.1Low148 Ų148149.7 Ų149.769%0.69275%0.754SS**  trans-173.8123.8152.8-105.7-179.592.700113.8
8Q55Low50.4Low143 Ų143149.6 Ų149.667%0.66875%0.75SS**  trans71.1146.4134.2-68.4178.532.100119.5
9Q48.9Very low49.5Very low158 Ų158150.5 Ų150.574%0.73875%0.752SS**  cis-165.9131.931.9-129.4161.83900108.1
10N46Very low48.8Very low140 Ų140151 Ų15175%0.74975%0.751SS**  54.6136.492.8-113.9-12.8000114.4
11Q47.9Very low48.1Very low129 Ų129149.8 Ų149.860%0.60374%0.744SS**  cis174.4142.738.7-142.7-174.210200105.3
12Q46.7Very low47.4Very low147 Ų147144.6 Ų144.669%0.68772%0.716SS**  161131.893.7-80.2-142.6-17.900112.7
13H46.7Very low46.1Very low135 Ų135149.3 Ų149.363%0.62572%0.717SS**  trans54.3114.5136.5-5597.7000121.8
14Q42.1Very low44.7Very low155 Ų155148 Ų14872%0.72472%0.715SS**  80.8142.869.2-102.7-15967.700115.7
15Q42.1Very low44Very low153 Ų153145.3 Ų145.372%0.71571%0.712SS**  trans96.1107.4162.4-52.4-153.36.600115.6
16H37.5Very low42.7Very low150 Ų150145.2 Ų145.269%0.69471%0.708SS**  64135.890.3-70.4-52.6000110.7
17Q41.1Very low41.9Very low135 Ų135148 Ų14863%0.63171%0.708SS**  cis176.3159.320.6-121.3-177.971.300105.4
18Q38.2Very low41.1Very low147 Ų147150 Ų15069%0.68771%0.714SS**  trans69110145.9-66.7-162.630.400118.8
19H32.9Very low40.5Very low168 Ų168155.1 Ų155.178%0.77873%0.728SS**  76.7133.388.9-91.3-71.5000114.7
20Q36Very low40.1Very low159 Ų159156.6 Ų156.674%0.74374%0.735SS**  trans79.9145.6160.2-42.1-138.887.400114.1
21Q34.6Very low40Very low127 Ų127155 Ų15559%0.59373%0.732SS**  cis-178.6163.1-3.8-113.7-167.960.900104.1
22Q37.7Very low39.7Very low144 Ų144156.9 Ų156.967%0.67374%0.741SS**  trans72.7108.4151.9-70.4172.45000118.3
23Q37.9Very low39.2Very low180 Ų180161.1 Ų161.184%0.84175%0.751SS**  85.4122.182.7-78.1-171.858.500114.7
24L37.6Very low39.1Very low153 Ų153163.2 Ų163.280%0.80176%0.758SS**  trans-7.3158.1160.8-88.680.1000119.7
25P41.7Very low38.9Very low112 Ų112160 Ų16073%0.72775%0.753SS**  cis-152.117349.136.6-12.6000119.3
26H35.9Very low38.9Very low157 Ų157161.8 Ų161.873%0.72776%0.758SS**  trans-17.4144159.2-88.3-89.3000116.8
27H39.4Very low38.8Very low168 Ų168160.3 Ų160.378%0.77877%0.765SS**  -176.5126119.6-76.7-34.7000113.8
28K36.9Very low38.5Very low189 Ų189156.7 Ų156.782%0.82276%0.764SS**  trans30.7125.4140.2-57.3-170.6178.6-177.40119.7
29R42.2Very low38.3Very low251 Ų251157.9 Ų157.995%0.94777%0.773SS**  -175.7154.4105.7-99.3172.6174.3-159-1.5113.6
30Q42Very low38.4Very low190 Ų190154.7 Ų154.789%0.88877%0.77SS**  trans-87.7-179.5-160.9-108.5-163.3-5.200113.7
31P42.7Very low38.4Very low107 Ų107153.1 Ų153.170%0.69577%0.771SS**  trans-94.6154.7-147.238.3-35.1000114.5
32Q41.4Very low38.7Very low168 Ų168152.9 Ų152.979%0.78578%0.778SS**  trans-122.5114.8157.9-88.1-151.6-13.100111.1
33R36.4Very low38.8Very low236 Ų236153 Ų15389%0.89178%0.784SS**  trans-57.4133159.3-64.8168.268.4-169.12.1108.6
34K44.6Very low38.9Very low178 Ų178152.2 Ų152.277%0.77478%0.78SS**  trans-151110.8147.8-98139.6-178.5-177.40108.3
35S37.3Very low39.5Very low88 Ų88149.6 Ų149.662%0.61577%0.772SS**  trans-51.8141162.540.30000111.4
36F42.3Very low39.6Very low190 Ų190151.1 Ų151.183%0.83377%0.773SS**  166.9133.8104.2-94.8-76.4000110.9
37S35.9Very low40Very low120 Ų120153.9 Ų153.984%0.83978%0.779SS**  trans39.3120.7139-156.70000119.7
38G34.6Very low40.6Very low59 Ų59151 Ų15161%0.60877%0.773SS**  trans149.497.6145.800000115.4
39I33.7Very low41Very low172 Ų172148.3 Ų148.388%0.88277%0.774SS**  trans30.6112.1132.50.1177.6000116.7
40S36.2Very low40.9Very low101 Ų101142 Ų14271%0.70676%0.764SS**  168.6127127.546.10000111.5
41T35.1Very low40.9Very low125 Ų125136 Ų13677%0.76774%0.743SS**  trans31.1115.2139.3610000117.6
42T40.8Very low40.6Very low122 Ų122138.5 Ų138.575%0.74875%0.745SS**  trans177.7117.1132.328.20000110.8Q44T42-Q44 PolarHBondContact O-N 3.28Å
43N39.4Very low40.8Very low146 Ų146138.5 Ų138.578%0.78175%0.749SS**  trans31.583.4139.2-59.5-38.4000117.4
44Q42Very low40.7Very low164 Ų164132.8 Ų132.877%0.76675%0.746SS**  trans-148.6134.3147.2-69.9-54.8-22.500109.6T42 I46T42-Q44 PolarHBondContact O-N 3.28Å; Q44-I46 PolarHBondContact O-N 3.11Å
45P50.3Low40.5Very low98 Ų98129.8 Ų129.864%0.63674%0.743SS**  trans-63.2112.4172.924.7-30.3000109.4Y47P45-Y47 HydrophobicContact CB-CD2 4.38Å; P45-Y47 HydrophobicContact CB-CE2 4.22Å; P45-Y47 HydrophobicContact CG-CE2 4.36Å; P45-Y47 PolarHBondContact O-N 3.36Å
46I43.1Very low40.5Very low145 Ų145130.3 Ų130.374%0.74475%0.746SS**  trans-72.892.6170.2-62.4172.3000106.9Q44 T48Q44-I46 PolarHBondContact O-N 3.11Å; I46-T48 HydrophobicContact CG2-CG2 3.66Å; I46-T48 PolarHBondContact O-N 3.14Å; I46-T48 VanDerWaalsContact O-N 3.1Å
47Y43.1Very low40.1Very low215 Ų215127.3 Ų127.384%0.84375%0.749SS**  trans-73.195.9162.7-80.6-84.2000108.2P45P45-Y47 HydrophobicContact CB-CD2 4.38Å; P45-Y47 HydrophobicContact CB-CE2 4.22Å; P45-Y47 HydrophobicContact CG-CE2 4.36Å; P45-Y47 PolarHBondContact O-N 3.36Å
48T53Low40.3Very low107 Ų107126.6 Ų126.666%0.65674%0.744SS**  trans-94.1124.4163.640.80000108.2I46 T50I46-T48 HydrophobicContact CG2-CG2 3.66Å; I46-T48 PolarHBondContact O-N 3.14Å; I46-T48 VanDerWaalsContact O-N 3.1Å; T48-T50 VanDerWaalsContact C-N 3.33Å; T48-T50 PolarHBondContact O-N 3.31Å
49P45.9Very low40.4Very low132 Ų132129 Ų12986%0.85775%0.751SS**  trans-75.292.3174.329.5-29.9000108.2S51P49-S51 PolarHBondContact O-N 3.33Å; P49-S51 VanDerWaalsContact O-N 3.15Å
50T38.7Very low40.8Very low119 Ų119128.2 Ų128.273%0.7375%0.747SS**  trans-76.299.6165.9-166.60000108.4T48T48-T50 VanDerWaalsContact C-N 3.33Å; T48-T50 PolarHBondContact O-N 3.31Å
51S42.4Very low40.9Very low63 Ų63130.6 Ų130.644%0.44175%0.752SS.*  87.8110.6114.683.40000119.2P49P49-S51 PolarHBondContact O-N 3.33Å; P49-S51 VanDerWaalsContact O-N 3.15Å
52H37.1Very low41.3Very low160 Ų160130.7 Ų130.774%0.74175%0.753SS**  trans54.688.9143.351.3-111.7000120.2
53L44.7Very low41.3Very low168 Ų168132.1 Ų132.188%0.8876%0.756SS**  trans-118.495.9147.3-83.5131.9000109.1
54S35.5Very low41.5Very low116 Ų116132.8 Ų132.881%0.81176%0.76SS**  trans-74.5111.1162.3-59.20000108.8
55T39.9Very low41.3Very low116 Ų116136.1 Ų136.171%0.71277%0.767SS**  trans173.2131.1162.1290000106.4
56S37.1Very low41Very low98 Ų98136.2 Ų136.269%0.68577%0.77SS**  cis-161.5136.5-4-76.60000106.1
57S33.9Very low40.8Very low128 Ų128138 Ų13890%0.89578%0.775SS**  trans-1.4113.8152.4-41.10000117.9
58S40.3Very low41Very low104 Ų104134.5 Ų134.573%0.72777%0.77SS**  trans-147.589.6149.258.40000110
59S35.6Very low40.3Very low110 Ų110137.4 Ų137.477%0.76978%0.782SS**  trans21102.6145.2550000117.6
60I42Very low40.4Very low155 Ų155136.5 Ų136.580%0.79577%0.774SS**  trans-117.1109.4150.1-59.6-178.4000106.6T62I60-T62 PolarHBondContact O-N 3.11Å
61N38.3Very low40.7Very low151 Ų151135.8 Ų135.881%0.80777%0.774SS**  trans-63.5119168.9-74.5-19.4000109.2
62T44Very low40.9Very low128 Ų128140.7 Ų140.779%0.78580%0.795SS**  trans-155.9112.7145.39.50000108.8I60 D64I60-T62 PolarHBondContact O-N 3.11Å; T62-D64 PolarHBondContact O-N 2.82Å
63N41.1Very low41.7Very low151 Ų151138.9 Ų138.981%0.80779%0.791SS**  trans-46127159.5-73.5-24.3000108.9
64D43.8Very low42.3Very low161 Ų161135.3 Ų135.386%0.86177%0.773SS**  -167.5120.9128.7-96.3-31.1000111T62 S66T62-D64 PolarHBondContact O-N 2.82Å; D64-S66 PolarHBondContact O-N 3.18Å
65Y37.4Very low43.4Very low233 Ų233136.4 Ų136.491%0.91477%0.769SS**  trans-58.7123.8166.7-83.3-103.7000109.8
66S43.5Very low44.7Very low100 Ų100136.7 Ų136.770%0.69977%0.767SS**  trans-177.7101.1136.4-174.90000109.5D64 N68D64-S66 PolarHBondContact O-N 3.18Å; S66-N68 PolarHBondContact O-N 3.22Å
67H38.5Very low46.5Very low184 Ų184136.7 Ų136.785%0.85276%0.759SS**  trans-66.7120.3154-86.421.1000108
68N47.6Very low48.5Very low141 Ų141134.5 Ų134.575%0.75474%0.735SS**  trans-150.2120.7145.9-102.3-41.8000111.9S66 T70S66-N68 PolarHBondContact O-N 3.22Å; N68-T70 PolarHBondContact O-N 3.04Å
69N39.3Very low50.3Low167 Ų167134.8 Ų134.889%0.89373%0.728SS**  trans-42113.6160.9-94-38.1000110.2
70T47.4Very low52.5Low113 Ų113136.5 Ų136.569%0.69372%0.719SS**  trans-146.689.6162.6-57.60000110.1N68N68-T70 PolarHBondContact O-N 3.04Å
71S45.2Very low54.5Low104 Ų104137.1 Ų137.173%0.72771%0.711SS**  trans27.6100.8137.4-143.30000118N73S71-N73 VanDerWaalsContact C-N 3.31Å; S71-N73 PolarHBondContact O-N 2.96Å
72N47.4Very low56.8Low167 Ų167134.7 Ų134.789%0.89370%0.697SS**SBend43.829.3124.9-109.3-0.4000121.4
73N53.8Low58.8Low122 Ų122136.9 Ų136.965%0.65269%0.691SS**  trans-135.918.4171.7-121.1-30.7000114.3S71 N75S71-N73 VanDerWaalsContact C-N 3.31Å; S71-N73 PolarHBondContact O-N 2.96Å; N73-N75 PolarHBondContact O-N 2.67Å
74N56Low60.9Low93 Ų93134.1 Ų134.150%0.49767%0.673SS.*Hα-helixtrans-76.1-12.8-169-96.4-28.5000115.8N76 N77 Q78N74-N76 VanDerWaalsContact C-N 3.33Å; N74-N76 PolarHBondContact O-N 3Å; N74-N77 PolarHBondContact O-N 3.14Å; N74-Q78 VanDerWaalsContact O-CG 3.26Å; N74-Q78 WeakPolarHBondContact O-CG 3.42Å; N74-Q78 PolarHBondContact O-N 3.1Å
75N59.4Low63Low138 Ų138133.2 Ų133.274%0.73866%0.662SS**Hα-helixtrans-66.2-34.5-178.8-79.5-21.8000112.9N73 N79N73-N75 PolarHBondContact O-N 2.67Å; N75-N79 WeakPolarHBondContact O-CB 3.29Å; N75-N79 PolarHBondContact O-N 3.09Å; N75-N79 VanDerWaalsContact O-N 3.12Å
76N67.4Low65.2Low123 Ų123129.4 Ų129.466%0.65865%0.647SS**Hα-helixtrans-73-37.9176.4-80.8-17.7000112.3N74 N79 Y80N74-N76 VanDerWaalsContact C-N 3.33Å; N74-N76 PolarHBondContact O-N 3Å; N76-N79 PolarHBondContact O-N 3.47Å; N76-Y80 WeakPolarHBondContact O-CB 3.3Å; N76-Y80 PolarHBondContact O-N 3.47Å
77N74.4Confident67Low98 Ų98127.9 Ų127.952%0.52463%0.631SS.*Hα-helixtrans-70.7-35.5177.8-78.2-27.2000112.5N74 Y80 R81N74-N77 PolarHBondContact O-N 3.14Å; N77-Y80 PolarHBondContact O-N 2.76Å; N77-R81 WeakPolarHBondContact O-CB 3.42Å; N77-R81 WeakPolarHBondContact O-CG 3.48Å; N77-R81 PolarHBondContact O-N 3.25Å
78Q75.9Confident69.1Low82 Ų82124.4 Ų124.438%0.38362%0.618SS.*Hα-helixtrans-66.2-43.9172.9-67.2-62.7-24.900111N74 Y80 R81 L82N74-Q78 VanDerWaalsContact O-CG 3.26Å; N74-Q78 WeakPolarHBondContact O-CG 3.42Å; N74-Q78 PolarHBondContact O-N 3.1Å; Q78-Y80 PolarHBondContact O-N 3.36Å; Q78-R81 PolarHBondContact O-N 2.74Å; Q78-L82 WeakPolarHBondContact O-CB 3.42Å; Q78-L82 VanDerWaalsContact O-CG 3.24Å; Q78-L82 WeakPolarHBondContact O-CG 3.4Å; Q78-L82 PolarHBondContact O-N 3.36Å
79N79.1Confident70.9Confident110 Ų110120.8 Ų120.859%0.58860%0.604SS**Hα-helixtrans-61.8-42.9174.3-116.3-68.4000112.2N75 N76 L82 R83N75-N79 WeakPolarHBondContact O-CB 3.29Å; N75-N79 PolarHBondContact O-N 3.09Å; N75-N79 VanDerWaalsContact O-N 3.12Å; N76-N79 PolarHBondContact O-N 3.47Å; N79-L82 PolarHBondContact O-N 2.8Å; N79-R83 VanDerWaalsContact O-CB 3.28Å; N79-R83 WeakPolarHBondContact O-CB 3.42Å; N79-R83 PolarHBondContact O-N 3.22Å
80Y81.5Confident73Confident145 Ų145118.2 Ų118.257%0.56959%0.585SS**Hα-helixtrans-62-45.2176.7-168.7-96.3000111.7N76 N77 Q78 R83 H84N76-Y80 WeakPolarHBondContact O-CB 3.3Å; N76-Y80 PolarHBondContact O-N 3.47Å; N77-Y80 PolarHBondContact O-N 2.76Å; Q78-Y80 PolarHBondContact O-N 3.36Å; Y80-R83 PolarHBondContact O-N 3.13Å; Y80-H84 AromaticContact CD1-CD2 3.56Å; Y80-H84 AromaticContact CE1-CD2 3.17Å; Y80-H84 WeakPolarHBondContact CE1-CD2 3.29Å; Y80-H84 AromaticContact CE1-NE2 3.23Å; Y80-H84 WeakPolarHBondContact CE1-NE2 3.37Å; Y80-H84 AromaticContact CE2-NE2 3.74Å; Y80-H84 AromaticContact CZ-CD2 3.44Å; Y80-H84 VanDerWaalsContact CZ-CD2 3.44Å; Y80-H84 AromaticContact CZ-NE2 3.03Å; Y80-H84 PolarHBondContact O-CD2 3.45Å; Y80-H84 PolarHBondContact O-N 3.48Å; Y80-H84 PolarHBondContact OH-NE2 3.42Å
81R84.4Confident74.4Confident168 Ų168119.2 Ų119.263%0.63458%0.582SS**Hα-helixtrans-60.7-46.1174.2-83.9175.361.2178.1-1.5112.3N77 Q78 H84 K85N77-R81 WeakPolarHBondContact O-CB 3.42Å; N77-R81 WeakPolarHBondContact O-CG 3.48Å; N77-R81 PolarHBondContact O-N 3.25Å; Q78-R81 PolarHBondContact O-N 2.74Å; R81-H84 PolarHBondContact O-N 2.85Å; R81-K85 WeakPolarHBondContact O-CB 3.32Å; R81-K85 PolarHBondContact O-N 3.11Å
82L85.2Confident75.7Confident100 Ų100117.9 Ų117.952%0.52457%0.569SS.*Hα-helixtrans-64.7-42.5179.8-72.8170.1000111.5Q78 N79 K85 Y86Q78-L82 WeakPolarHBondContact O-CB 3.42Å; Q78-L82 VanDerWaalsContact O-CG 3.24Å; Q78-L82 WeakPolarHBondContact O-CG 3.4Å; Q78-L82 PolarHBondContact O-N 3.36Å; N79-L82 PolarHBondContact O-N 2.8Å; L82-K85 PolarHBondContact O-N 2.8Å; L82-Y86 WeakPolarHBondContact O-CB 3.15Å; L82-Y86 PolarHBondContact O-N 3.07Å
83R85.9Confident77Confident175 Ų175116.3 Ų116.366%0.6655%0.552SS**Hα-helixtrans-64.5-41.2177.7-169174.8-176.6-1291.3112.1N79 Y80 Y86 N87N79-R83 VanDerWaalsContact O-CB 3.28Å; N79-R83 WeakPolarHBondContact O-CB 3.42Å; N79-R83 PolarHBondContact O-N 3.22Å; Y80-R83 PolarHBondContact O-N 3.13Å; R83-Y86 PolarHBondContact O-N 3.45Å; R83-N87 WeakPolarHBondContact O-CB 3.41Å; R83-N87 PolarHBondContact O-N 2.94Å; R83-N87 PolarHBondContact O-ND2 3.46Å
84H85.6Confident77.6Confident92 Ų92115 Ų11543%0.42654%0.541SS..Hα-helixtrans-66-42.7173.6-90.9-70.1000112.6Y80 R81 Y86 N87 L88Y80-H84 AromaticContact CD1-CD2 3.56Å; Y80-H84 AromaticContact CE1-CD2 3.17Å; Y80-H84 WeakPolarHBondContact CE1-CD2 3.29Å; Y80-H84 AromaticContact CE1-NE2 3.23Å; Y80-H84 WeakPolarHBondContact CE1-NE2 3.37Å; Y80-H84 AromaticContact CE2-NE2 3.74Å; Y80-H84 AromaticContact CZ-CD2 3.44Å; Y80-H84 VanDerWaalsContact CZ-CD2 3.44Å; Y80-H84 AromaticContact CZ-NE2 3.03Å; Y80-H84 PolarHBondContact O-CD2 3.45Å; Y80-H84 PolarHBondContact O-N 3.48Å; Y80-H84 PolarHBondContact OH-NE2 3.42Å; R81-H84 PolarHBondContact O-N 2.85Å; H84-Y86 VanDerWaalsContact C-N 3.32Å; H84-Y86 PolarHBondContact O-N 2.77Å; H84-N87 PolarHBondContact O-N 3.02Å; H84-L88 WeakPolarHBondContact O-CB 3.37Å; H84-L88 PolarHBondContact O-N 2.9Å
85K87.4Confident78.1Confident142 Ų142120.3 Ų120.362%0.61755%0.554SS**Hα-helixtrans-60.8-42.6175.6-162.6178.884.5173.90111.5R81 L82 S89R81-K85 WeakPolarHBondContact O-CB 3.32Å; R81-K85 PolarHBondContact O-N 3.11Å; L82-K85 PolarHBondContact O-N 2.8Å; K85-S89 WeakPolarHBondContact O-CB 3.45Å; K85-S89 PolarHBondContact O-N 3.3Å; K85-S89 PolarHBondContact O-OG 3.38Å
86Y84.9Confident78.1Confident153 Ų153116.8 Ų116.860%0.654%0.541SS*.Hα-helixtrans-64.2-45.3175.8-179.3-98.8000111.9L82 R83 H84 L88 S89 K90L82-Y86 WeakPolarHBondContact O-CB 3.15Å; L82-Y86 PolarHBondContact O-N 3.07Å; R83-Y86 PolarHBondContact O-N 3.45Å; H84-Y86 VanDerWaalsContact C-N 3.32Å; H84-Y86 PolarHBondContact O-N 2.77Å; Y86-L88 PolarHBondContact O-N 3.32Å; Y86-S89 PolarHBondContact O-N 3.48Å; Y86-K90 HydrophobicContact CE1-CD 4.49Å; Y86-K90 WeakPolarHBondContact O-CB 3.26Å; Y86-K90 PolarHBondContact O-N 3.27Å
87N81.5Confident77.6Confident68 Ų68116.8 Ų116.836%0.36454%0.535SS..Hα-helixtrans-62.7-43.1177.3-80.1-21.4000112.5R83 H84 K90 Q91R83-N87 WeakPolarHBondContact O-CB 3.41Å; R83-N87 PolarHBondContact O-N 2.94Å; R83-N87 PolarHBondContact O-ND2 3.46Å; H84-N87 PolarHBondContact O-N 3.02Å; N87-K90 PolarHBondContact O-N 2.9Å; N87-Q91 WeakPolarHBondContact O-CG 3.41Å; N87-Q91 PolarHBondContact O-N 2.97Å
88L82.2Confident76.6Confident111 Ų111117.6 Ų117.658%0.58154%0.538SS*.Hα-helixtrans-63.5-46.2176.5-17064.5000110.6H84 Y86 K90 Q91 T92H84-L88 WeakPolarHBondContact O-CB 3.37Å; H84-L88 PolarHBondContact O-N 2.9Å; Y86-L88 PolarHBondContact O-N 3.32Å; L88-K90 VanDerWaalsContact C-N 3.3Å; L88-K90 PolarHBondContact O-N 3.44Å; L88-Q91 PolarHBondContact O-N 3.02Å; L88-T92 PolarHBondContact O-N 2.88Å; L88-T92 PolarHBondContact O-OG1 2.93Å
89S85Confident75.5Confident66 Ų66116 Ų11646%0.46254%0.539SS..Hα-helixtrans-61.8-37.6177.5-55.10000112.3K85 Y86 T92 Y93K85-S89 WeakPolarHBondContact O-CB 3.45Å; K85-S89 PolarHBondContact O-N 3.3Å; K85-S89 PolarHBondContact O-OG 3.38Å; Y86-S89 PolarHBondContact O-N 3.48Å; S89-T92 PolarHBondContact O-N 3.37Å; S89-Y93 WeakPolarHBondContact O-CB 3.35Å; S89-Y93 PolarHBondContact O-N 3.27Å
90K83.6Confident74.1Confident112 Ų112114.8 Ų114.849%0.48755%0.545SS..Hα-helixtrans-66.9-42.8176.2-165.1-175.1-177.5-162.40111.7Y86 N87 L88 T92 Y93 E94Y86-K90 HydrophobicContact CE1-CD 4.49Å; Y86-K90 WeakPolarHBondContact O-CB 3.26Å; Y86-K90 PolarHBondContact O-N 3.27Å; N87-K90 PolarHBondContact O-N 2.9Å; L88-K90 VanDerWaalsContact C-N 3.3Å; L88-K90 PolarHBondContact O-N 3.44Å; K90-T92 VanDerWaalsContact C-N 3.31Å; K90-T92 PolarHBondContact O-N 3.5Å; K90-Y93 PolarHBondContact O-N 3.3Å; K90-E94 WeakPolarHBondContact O-CG 3.3Å; K90-E94 PolarHBondContact O-N 3.18Å
91Q75.9Confident72.6Confident135 Ų135112.8 Ų112.863%0.63155%0.552SS**Hα-helixtrans-61.8-40.2173.5-74.3-177.9-2.700111.8N87 L88 R95N87-Q91 WeakPolarHBondContact O-CG 3.41Å; N87-Q91 PolarHBondContact O-N 2.97Å; L88-Q91 PolarHBondContact O-N 3.02Å; Q91-R95 WeakPolarHBondContact O-CB 3.44Å; Q91-R95 PolarHBondContact O-N 3.47Å
92T73.7Confident70.8Confident75 Ų75108.3 Ų108.346%0.4655%0.546SS..Hα-helixtrans-66.4-44.1175.6-48.10000111.5L88 S89 K90 E94 R95 S96L88-T92 PolarHBondContact O-N 2.88Å; L88-T92 PolarHBondContact O-OG1 2.93Å; S89-T92 PolarHBondContact O-N 3.37Å; K90-T92 VanDerWaalsContact C-N 3.31Å; K90-T92 PolarHBondContact O-N 3.5Å; T92-E94 PolarHBondContact O-N 3.1Å; T92-R95 PolarHBondContact O-N 3.34Å; T92-S96 VanDerWaalsContact O-CB 3.3Å; T92-S96 WeakPolarHBondContact O-CB 3.39Å; T92-S96 PolarHBondContact O-N 3.42Å; T92-S96 PolarHBondContact O-OG 2.88Å; T92-S96 VanDerWaalsContact O-OG 3.05Å
93Y74.2Confident68.9Low135 Ų135107.7 Ų107.753%0.52956%0.556SS.*Hα-helixtrans-62.1-43.1179.5-177.6-104.6000112.4S89 K90 S96 K97S89-Y93 WeakPolarHBondContact O-CB 3.35Å; S89-Y93 PolarHBondContact O-N 3.27Å; K90-Y93 PolarHBondContact O-N 3.3Å; Y93-S96 PolarHBondContact O-N 3.42Å; Y93-K97 HydrophobicContact CE1-CD 3.93Å; Y93-K97 WeakPolarHBondContact O-CB 3.32Å; Y93-K97 PolarHBondContact O-N 3.15Å; Y93-K97 WeakPolarHBondContact OH-CE 3.43Å
94E65.3Low66.7Low94 Ų94104.4 Ų104.444%0.43956%0.559SS.*Hα-helixtrans-67.3-41175.5-64.6-60.9151.200111.8K90 T92 S96 K97 I98K90-E94 WeakPolarHBondContact O-CG 3.3Å; K90-E94 PolarHBondContact O-N 3.18Å; T92-E94 PolarHBondContact O-N 3.1Å; E94-S96 VanDerWaalsContact C-N 3.35Å; E94-S96 PolarHBondContact O-N 3.06Å; E94-K97 PolarHBondContact O-N 3.06Å; E94-I98 VanDerWaalsContact O-CG1 3.31Å; E94-I98 WeakPolarHBondContact O-CG1 3.34Å; E94-I98 PolarHBondContact O-N 3.44Å; E94-I98 VanDerWaalsContact O-N 3.17Å
95R66.7Low64.8Low204 Ų204105.9 Ų105.977%0.7758%0.575SS**Hα-helixtrans-62.6-40.6173-92.6-172.1166.8-146-2112.3Q91 T92 I98 A99Q91-R95 WeakPolarHBondContact O-CB 3.44Å; Q91-R95 PolarHBondContact O-N 3.47Å; T92-R95 PolarHBondContact O-N 3.34Å; R95-I98 PolarHBondContact O-N 2.98Å; R95-A99 WeakPolarHBondContact O-CB 3.42Å; R95-A99 PolarHBondContact O-N 2.87Å
96S60.1Low62.5Low65 Ų65104.6 Ų104.646%0.45558%0.584SS.*Hα-helixtrans-72.4-32.2179-66.50000112.2T92 Y93 E94 I98 A99 A100T92-S96 VanDerWaalsContact O-CB 3.3Å; T92-S96 WeakPolarHBondContact O-CB 3.39Å; T92-S96 PolarHBondContact O-N 3.42Å; T92-S96 PolarHBondContact O-OG 2.88Å; T92-S96 VanDerWaalsContact O-OG 3.05Å; Y93-S96 PolarHBondContact O-N 3.42Å; E94-S96 VanDerWaalsContact C-N 3.35Å; E94-S96 PolarHBondContact O-N 3.06Å; S96-I98 VanDerWaalsContact C-N 3.32Å; S96-A99 PolarHBondContact O-N 2.79Å; S96-A100 VanDerWaalsContact O-CB 3.23Å; S96-A100 WeakPolarHBondContact O-CB 3.38Å; S96-A100 PolarHBondContact O-N 3.43Å
97K57.5Low60.5Low122 Ų122105.4 Ų105.453%0.5359%0.593SS.*Hα-helixtrans-67.5-32.1173.5-111.2-170.2174.1-172.10113Y93 E94 S101Y93-K97 HydrophobicContact CE1-CD 3.93Å; Y93-K97 WeakPolarHBondContact O-CB 3.32Å; Y93-K97 PolarHBondContact O-N 3.15Å; Y93-K97 WeakPolarHBondContact OH-CE 3.43Å; E94-K97 PolarHBondContact O-N 3.06Å; K97-S101 PolarHBondContact O-OG 3.43Å; K97-S101 VanDerWaalsContact O-OG 3.06Å
98I51.9Low58.6Low115 Ų115106.8 Ų106.859%0.5961%0.608SS**Hα-helixtrans-83.9-34.2176.1-59.2166000110.5E94 R95 S96 S101 S102E94-I98 VanDerWaalsContact O-CG1 3.31Å; E94-I98 WeakPolarHBondContact O-CG1 3.34Å; E94-I98 PolarHBondContact O-N 3.44Å; E94-I98 VanDerWaalsContact O-N 3.17Å; R95-I98 PolarHBondContact O-N 2.98Å; S96-I98 VanDerWaalsContact C-N 3.32Å; I98-S101 PolarHBondContact O-OG 2.88Å; I98-S102 PolarHBondContact O-OG 3.4Å
99A53.5Low56.6Low48 Ų48109.1 Ų109.140%0.39762%0.621SS.*Hα-helixtrans-73.4-30.6176.500000113R95 S96 S101 S102 A103R95-A99 WeakPolarHBondContact O-CB 3.42Å; R95-A99 PolarHBondContact O-N 2.87Å; S96-A99 PolarHBondContact O-N 2.79Å; A99-S101 VanDerWaalsContact C-N 3.27Å; A99-S101 PolarHBondContact O-N 3.39Å; A99-S102 CarbonylContact O-C 3.56Å; A99-S102 PolarHBondContact O-N 3.07Å; A99-A103 WeakPolarHBondContact O-CA 3.22Å; A99-A103 WeakPolarHBondContact O-CB 3.26Å; A99-A103 PolarHBondContact O-N 3.24Å
100A49.7Very low54.7Low86 Ų86112 Ų11271%0.71164%0.636SS**THydrogen-bonded Turntrans-72.5-18.7178.900000113.8S96S96-A100 VanDerWaalsContact O-CB 3.23Å; S96-A100 WeakPolarHBondContact O-CB 3.38Å; S96-A100 PolarHBondContact O-N 3.43Å
101S49.8Very low52.4Low103 Ų103112.8 Ų112.872%0.7265%0.646SS**THydrogen-bonded Turntrans-100.14.8173.334.60000113.4K97 I98 A99K97-S101 PolarHBondContact O-OG 3.43Å; K97-S101 VanDerWaalsContact O-OG 3.06Å; I98-S101 PolarHBondContact O-OG 2.88Å; A99-S101 VanDerWaalsContact C-N 3.27Å; A99-S101 PolarHBondContact O-N 3.39Å
102S47.4Very low51.1Low73 Ų73112 Ų11251%0.5166%0.655SS.*THydrogen-bonded Turntrans-135.31.1176.254.30000114.5I98 A99 S104I98-S102 PolarHBondContact O-OG 3.4Å; A99-S102 CarbonylContact O-C 3.56Å; A99-S102 PolarHBondContact O-N 3.07Å; S102-S104 PolarHBondContact O-N 3.36Å
103A44.5Very low49.5Very low88 Ų88115.5 Ų115.573%0.72767%0.666SS**  trans-8457.8175.400000111.6A99A99-A103 WeakPolarHBondContact O-CA 3.22Å; A99-A103 WeakPolarHBondContact O-CB 3.26Å; A99-A103 PolarHBondContact O-N 3.24Å
104S40.6Very low47.8Very low105 Ų105119.5 Ų119.573%0.73468%0.682SS**  trans-119.763.5164.659.30000108.2S102S102-S104 PolarHBondContact O-N 3.36Å
105T45.3Very low46.5Very low123 Ų123119.6 Ų119.676%0.75570%0.698SS**  trans-153.572.6163.7-33.30000109.6
106S39Very low45.4Very low115 Ų115119 Ų11980%0.80470%0.701SS**  trans-72.4121.7146.5-55.40000106.7
107Q44.1Very low44.5Very low171 Ų171122.7 Ų122.780%0.79972%0.715SS**  trans172.197.4154.8-98.5165-9.900107
108S41.6Very low43.8Very low97 Ų97125.2 Ų125.268%0.67874%0.735SS**  68.2114.190.363.20000112.3T110S108-T110 PolarHBondContact O-N 2.91Å
109D39.8Very low43.3Very low160 Ų160127 Ų12786%0.85675%0.745SS**  trans-39.5116.7166.4-57.6-68.3000111.7
110T44.5Very low42.5Very low126 Ų126132 Ų13277%0.77376%0.76SS**  trans172.1103.8142.142.30000109.4S108S108-T110 PolarHBondContact O-N 2.91Å
111D35Very low42.3Very low129 Ų129137.8 Ų137.869%0.6976%0.763SS**  23.8109.8125.4-162.715.2000117.1H113D111-H113 IonicContact OD1-CD2 3.73Å; D111-H113 IonicContact OD1-NE2 3.86Å
112S49.5Very low41.9Very low119 Ų119137.3 Ų137.383%0.83276%0.76SS**  trans-179.6104.6140.6-82.40000111.4
113H39.2Very low41.4Very low147 Ų147138.9 Ų138.968%0.68177%0.771SS**  trans-30.7154.4162.4-62-90.9000117.4D111D111-H113 IonicContact OD1-CD2 3.73Å; D111-H113 IonicContact OD1-NE2 3.86Å
114Y39.7Very low41.2Very low220 Ų220140 Ų14086%0.86377%0.773SS**  trans96.489.7164.3-59.1-81.9000117.1
115A37.8Very low41.3Very low96 Ų96143.8 Ų143.879%0.79378%0.78SS**  trans-9.2147.3136.900000116.8
116K43Very low40.8Very low190 Ų190142.3 Ų142.383%0.82677%0.774SS**  171.3113.4110.5-169162.2-179.2179.10112.4
117L41.7Very low40.9Very low144 Ų144142.2 Ų142.275%0.75477%0.774SS**  trans27.9122.3137.7-59.6163.5000118.5
118N43Very low40.8Very low175 Ų175141.6 Ų141.694%0.93678%0.776SS**  -154.3125.9117.7-100.9-22.7000113.2
119L39.7Very low40.9Very low152 Ų152141.5 Ų141.580%0.79678%0.775SS**  trans-83.6166.4-179.3-159.168.9000109.1
120Q37.8Very low40.7Very low153 Ų153137.5 Ų137.572%0.71577%0.772SS**  trans107.8123.5138.7-131.1-171.9-47.300118.1
121R46Very low40.6Very low207 Ų207138.5 Ų138.578%0.78177%0.771SS**  trans89.2135.9147.7-44.6-176.587-171.41.8117.1
122S41.1Very low40.7Very low93 Ų93142.5 Ų142.565%0.6578%0.778SS**  cis-171.1130.7-8.5-93.40000107.4
123S37.5Very low40.3Very low106 Ų106143.4 Ų143.474%0.74177%0.773SS**  trans2.7129.7143.152.70000120.4
124S39.3Very low40.6Very low112 Ų112141.5 Ų141.578%0.78378%0.777SS**  trans-178.2110.9137.1-82.80000108.6
125Q42.6Very low40.7Very low185 Ų185134.7 Ų134.786%0.86476%0.761SS**  45.7133.992.1-80.5-173.7-4.100113.4
126S36Very low40.6Very low92 Ų92136 Ų13664%0.64376%0.763SS**  cis177.2152.2-8.541.10000105.8
127S40.2Very low40.4Very low113 Ų113135.3 Ų135.379%0.7976%0.762SS**  trans75.2129.3152-49.10000120.1
128D40.9Very low40Very low157 Ų157134.4 Ų134.484%0.8477%0.767SS**  trans94.2148.2134-153.718.3000118.7
129S45Very low39.8Very low96 Ų96130.9 Ų130.967%0.67176%0.756SS**  trans77.6107.6175.365.20000117.9
130G35.2Very low39.6Very low76 Ų76129 Ų12978%0.78476%0.755SS**  trans-72.1157.4174.700000113.6
131I41.8Very low39.9Very low146 Ų146129.5 Ų129.575%0.74976%0.761SS**  trans-143.3113.4163-69.8105.5000108.4
132Y38.8Very low39.5Very low214 Ų214124.4 Ų124.484%0.83976%0.757SS**  trans35.1122.6133.1-74.8-103.3000120.7
133N39.9Very low39.5Very low137 Ų137125.1 Ų125.173%0.73376%0.762SS**  19.8111.7126.5-168.613.3000117.9
134S44.7Very low40Very low108 Ų108127.4 Ų127.476%0.75577%0.765SS**  trans-15092.5148.937.70000107.5
135S43.6Very low40Very low76 Ų76127.2 Ų127.253%0.53176%0.763SS.*  54.2102.994.8-66.40000113.8
136C34.3Very low39.9Very low125 Ų125122.6 Ų122.685%0.84576%0.756SS**  trans13107146.547.50000118.5
137H40.2Very low40.3Very low174 Ų174124.7 Ų124.781%0.80677%0.765SS**  trans-106.191157.6-80-73.6000110.4
138C32.9Very low40.1Very low126 Ų126124.8 Ų124.885%0.85177%0.766SS**  trans-87.894151.7-89.10000107.4S140C138-S140 PolarHBondContact O-N 3.39Å
139S38.4Very low40.2Very low101 Ų101122.5 Ų122.571%0.70676%0.762SS**  trans-84.199.5168.2-63.90000108.8
140S36.3Very low39.9Very low111 Ų111123.9 Ų123.978%0.77677%0.772SS**  trans-61.5129.5162.1-57.20000110C138C138-S140 PolarHBondContact O-N 3.39Å
141I43.2Very low40.2Very low164 Ų164124.4 Ų124.484%0.84177%0.769SS**  trans-121.7114.3157.6-64.3175.7000106.7
142S36.7Very low40Very low101 Ų101122.4 Ų122.471%0.70677%0.768SS**  trans-58.6171.5179-52.10000114
143S42.6Very low39.8Very low108 Ų108117.3 Ų117.376%0.75576%0.764SS**  trans89.6120.1-176.869.90000111.5
144I47Very low40Very low154 Ų154115.8 Ų115.879%0.7976%0.764SS**  cis-166.9122.746.8-3.4173.4000108.6
145S39.1Very low39.9Very low108 Ų108122.1 Ų122.176%0.75577%0.771SS**  trans56.8120.8133.5-45.40000123.7
146A40.1Very low39.8Very low87 Ų87123.5 Ų123.572%0.71978%0.781SS**  trans78.3107.3130.200000119.9
147V44.6Very low40Very low136 Ų136122.4 Ų122.482%0.82478%0.775SS**  169.893.595-73.70000107.5
148S36.7Very low39.9Very low116 Ų116119.4 Ų119.481%0.81177%0.773SS**  45.3113.597.5-63.20000116
149S43.2Very low40Very low109 Ų109118.6 Ų118.676%0.76277%0.769SS**  trans143.9103.6136.9-60.50000109.7
150S38.5Very low40Very low124 Ų124118.5 Ų118.587%0.86777%0.768SS**  64.212895.5-52.90000111.6
151A42.7Very low40.1Very low87 Ų87118 Ų11872%0.71977%0.765SS**  cis-166.3147.722.300000109.6
152S35.6Very low40.1Very low105 Ų105122.2 Ų122.273%0.73477%0.77SS**  28.8129.2129.9-32.50000121.4
153S36.6Very low40.2Very low107 Ų107120.7 Ų120.775%0.74877%0.77SS**  91.7138.7125.768.70000121.6
154S42.6Very low40.3Very low105 Ų105121.6 Ų121.673%0.73478%0.775SS**  trans93.894.1155.7-410000115.2
155R44.2Very low40.6Very low240 Ų240120 Ų12091%0.90677%0.774SS**  59.7124.888-73.2-174.1170.6175.3-2.3114.1
156S40.7Very low40.7Very low105 Ų105120.1 Ų120.173%0.73478%0.775SS**  trans108.5112.6143.4-510000118.6
157S38.9Very low41.2Very low103 Ų103120.5 Ų120.572%0.7277%0.773SS**  74.5107.7127.8-42.80000120.6
158S36.8Very low41.6Very low110 Ų110120.6 Ų120.677%0.76977%0.774SS**  44.7109.5129.157.20000119
159S35.3Very low42.3Very low109 Ų109120.3 Ų120.376%0.76277%0.767SS**  166.6157.7110.561.20000110.3
160S39.7Very low42.6Very low99 Ų99119.5 Ų119.569%0.69276%0.761SS**  trans83.192.9153.3-50.30000116.9
161S38.2Very low43.3Very low101 Ų101118.6 Ų118.671%0.70676%0.755SS**  20.9111.7121.960.30000116.1
162R43.4Very low43.9Very low253 Ų253123.2 Ų123.296%0.95576%0.759SS**  trans164.8131.9139.3-91.9153171.9-135.2-4.4110
163G37.8Very low44.7Very low69 Ų69122.2 Ų122.271%0.71175%0.752SS**  trans103.789.3149.700000114.7P165G163-P165 WeakPolarHBondContact O-CD 3.48Å
164C45.5Very low45.8Very low126 Ų126121.1 Ų121.185%0.85174%0.737SS**  trans-52.4121.5147-54.80000107.8S166C164-S166 VanDerWaalsContact C-N 3.27Å; C164-S166 PolarHBondContact O-N 3.26Å
165P51.6Low47.2Very low120 Ų120125.7 Ų125.778%0.77974%0.738SS**  trans-73.197159.329.9-26.7000105.6G163 S167G163-P165 WeakPolarHBondContact O-CD 3.48Å; P165-S167 PolarHBondContact O-N 3.1Å
166S43Very low49Very low111 Ų111117.4 Ų117.478%0.77672%0.717SS**  trans-59.495.2151.8-179.30000104.9C164 V168C164-S166 VanDerWaalsContact C-N 3.27Å; C164-S166 PolarHBondContact O-N 3.26Å; S166-V168 PolarHBondContact O-N 2.98Å
167S50.3Low51Low96 Ų96116.3 Ų116.367%0.67170%0.703SS**  trans-68.3105.9177.365.10000106.4P165 V169P165-S167 PolarHBondContact O-N 3.1Å; S167-V169 VanDerWaalsContact C-N 3.34Å; S167-V169 PolarHBondContact O-N 3.4Å
168V52.2Low53.2Low138 Ų138115.6 Ų115.684%0.83669%0.691SS**  trans-45.5103.9163-105.10000107.3S166 S170S166-V168 PolarHBondContact O-N 2.98Å; V168-S170 PolarHBondContact O-N 3.34Å
169V50.9Low55.6Low109 Ų109117.9 Ų117.966%0.66169%0.687SS**  trans-55.6101.9173.2-81.80000107.8S167 S171S167-V169 VanDerWaalsContact C-N 3.34Å; S167-V169 PolarHBondContact O-N 3.4Å; V169-S171 PolarHBondContact O-N 3.35Å
170S49.2Very low58.2Low92 Ų92118.3 Ų118.364%0.64368%0.677SS**  trans-61.1107.6168.4-175.30000107.4V168 K172V168-S170 PolarHBondContact O-N 3.34Å; S170-K172 PolarHBondContact O-N 2.95Å
171S54.7Low60.7Low106 Ų106120.3 Ų120.374%0.74167%0.673SS**  trans-66.133-177.2-57.30000114.7V169V169-S171 PolarHBondContact O-N 3.35Å
172K54Low63.3Low184 Ų184121.9 Ų121.980%0.867%0.669SS**SBendtrans-113.595.8-178.9-71.1177.8174.5177.10109.2S170S170-K172 PolarHBondContact O-N 2.95Å
173S53.9Low65.7Low84 Ų84117.4 Ų117.459%0.58765%0.653SS**  trans6971.7175.3-158.30000117.1R175 S176S173-R175 PolarHBondContact O-N 2.95Å; S173-R175 VanDerWaalsContact O-N 3.08Å; S173-S176 PolarHBondContact O-N 2.87Å
174N60Low68.4Low83 Ų83119 Ų11944%0.44465%0.645SS.*Hα-helixtrans-56.9-20.5171-75.5-59.2000114.1S176 L177 D178N174-S176 PolarHBondContact O-N 3.15Å; N174-S176 VanDerWaalsContact O-N 3.13Å; N174-L177 PolarHBondContact O-N 3.1Å; N174-L177 VanDerWaalsContact O-N 3.13Å; N174-D178 VanDerWaalsContact O-CG 3.28Å; N174-D178 PolarHBondContact O-N 3.45Å; N174-D178 VanDerWaalsContact O-OD2 3.09Å
175R70Confident70.7Confident201 Ų201116.7 Ų116.776%0.75863%0.63SS**Hα-helixtrans-57.6-30.8179.3-72.1-175.7179.7174.70.6113.4S173 K179S173-R175 PolarHBondContact O-N 2.95Å; S173-R175 VanDerWaalsContact O-N 3.08Å; R175-K179 WeakPolarHBondContact O-CB 3.35Å; R175-K179 VanDerWaalsContact O-CG 3.24Å; R175-K179 WeakPolarHBondContact O-CG 3.21Å; R175-K179 PolarHBondContact O-N 3.38Å
176S82.9Confident72.9Confident66 Ų66115.7 Ų115.746%0.46262%0.615SS.*Hα-helixtrans-74.4-45.2177.6-1700000111.6S173 N174 D178 K179 Q180S173-S176 PolarHBondContact O-N 2.87Å; N174-S176 PolarHBondContact O-N 3.15Å; N174-S176 VanDerWaalsContact O-N 3.13Å; S176-D178 PolarHBondContact O-N 2.87Å; S176-K179 PolarHBondContact O-N 3.4Å; S176-Q180 WeakPolarHBondContact O-CG 3.24Å; S176-Q180 PolarHBondContact O-N 3Å
177L83.8Confident75.4Confident82 Ų82115.1 Ų115.143%0.42960%0.6SS.*Hα-helixtrans-65.4-39.3178.6-69176.5000111.7N174 Q180 K181N174-L177 PolarHBondContact O-N 3.1Å; N174-L177 VanDerWaalsContact O-N 3.13Å; L177-Q180 PolarHBondContact O-N 2.86Å; L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 VanDerWaalsContact O-CG 3.32Å; L177-K181 WeakPolarHBondContact O-CG 3.38Å; L177-K181 PolarHBondContact O-N 3.4Å
178D84.7Confident77.5Confident89 Ų89115.4 Ų115.448%0.47659%0.593SS.*Hα-helixtrans-64.4-40.7176-66-35.2000111.4N174 S176 K181 H182N174-D178 VanDerWaalsContact O-CG 3.28Å; N174-D178 PolarHBondContact O-N 3.45Å; N174-D178 VanDerWaalsContact O-OD2 3.09Å; S176-D178 PolarHBondContact O-N 2.87Å; D178-K181 PolarHBondContact O-N 3.49Å; D178-H182 WeakPolarHBondContact O-CB 3.38Å; D178-H182 PolarHBondContact O-N 3.36Å
179K87.5Confident79.5Confident157 Ų157116.3 Ų116.368%0.68358%0.583SS**Hα-helixtrans-62-43.5173.3-77.8177.3-179.5-170.20112R175 S176 H182 Y183R175-K179 WeakPolarHBondContact O-CB 3.35Å; R175-K179 VanDerWaalsContact O-CG 3.24Å; R175-K179 WeakPolarHBondContact O-CG 3.21Å; R175-K179 PolarHBondContact O-N 3.38Å; S176-K179 PolarHBondContact O-N 3.4Å; K179-H182 PolarHBondContact O-N 2.85Å; K179-Y183 VanDerWaalsContact O-CB 3.22Å; K179-Y183 WeakPolarHBondContact O-CB 3.26Å; K179-Y183 PolarHBondContact O-N 2.92Å
180Q89.7Confident81.6Confident119 Ų119114.5 Ų114.556%0.55657%0.569SS**Hα-helixtrans-65.8-43.8177.7-72.1177.6-5.700112.1S176 L177 Y183 L184S176-Q180 WeakPolarHBondContact O-CG 3.24Å; S176-Q180 PolarHBondContact O-N 3Å; L177-Q180 PolarHBondContact O-N 2.86Å; Q180-Y183 PolarHBondContact O-N 3.05Å; Q180-L184 WeakPolarHBondContact O-CB 3.49Å; Q180-L184 PolarHBondContact O-N 2.89Å
181K92.1Very high83.8Confident141 Ų141115.8 Ų115.861%0.61356%0.563SS**Hα-helixtrans-62.7-44.9175.3-73.9176.7-179.6179.20111.7L177 D178 L184 S185L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 VanDerWaalsContact O-CG 3.32Å; L177-K181 WeakPolarHBondContact O-CG 3.38Å; L177-K181 PolarHBondContact O-N 3.4Å; D178-K181 PolarHBondContact O-N 3.49Å; K181-L184 PolarHBondContact O-N 2.84Å; K181-S185 WeakPolarHBondContact O-CB 3.24Å; K181-S185 PolarHBondContact O-N 3.5Å
182H92.8Very high85.8Confident133 Ų133113.3 Ų113.362%0.61655%0.545SS*.Hα-helixtrans-63.3-44.8176.8-177.569.1000111.5D178 K179 L184 S185 H186D178-H182 WeakPolarHBondContact O-CB 3.38Å; D178-H182 PolarHBondContact O-N 3.36Å; K179-H182 PolarHBondContact O-N 2.85Å; H182-L184 PolarHBondContact O-N 3.49Å; H182-S185 PolarHBondContact O-N 2.97Å; H182-H186 VanDerWaalsContact O-CB 3.26Å; H182-H186 WeakPolarHBondContact O-CB 3.23Å; H182-H186 PolarHBondContact O-N 2.87Å
183Y92.7Very high87.8Confident160 Ų160110.7 Ų110.763%0.62753%0.531SS*.Hα-helixtrans-59.1-47.1175.4-179-94.8000111.7K179 Q180 H186 H187K179-Y183 VanDerWaalsContact O-CB 3.22Å; K179-Y183 WeakPolarHBondContact O-CB 3.26Å; K179-Y183 PolarHBondContact O-N 2.92Å; Q180-Y183 PolarHBondContact O-N 3.05Å; Y183-H186 PolarHBondContact O-N 3.03Å; Y183-H187 VanDerWaalsContact O-CB 3.3Å; Y183-H187 WeakPolarHBondContact O-CB 3.35Å; Y183-H187 PolarHBondContact O-N 3.13Å
184L95.6Very high89.8Confident102 Ų102111.3 Ų111.353%0.53453%0.528SS..Hα-helixtrans-63.3-46177.9-178.161.8000111.8Q180 K181 H182 H186 H187 L188Q180-L184 WeakPolarHBondContact O-CB 3.49Å; Q180-L184 PolarHBondContact O-N 2.89Å; K181-L184 PolarHBondContact O-N 2.84Å; H182-L184 PolarHBondContact O-N 3.49Å; L184-H186 VanDerWaalsContact C-N 3.32Å; L184-H186 PolarHBondContact O-N 2.9Å; L184-H187 PolarHBondContact O-N 3.29Å; L184-L188 HydrophobicContact CD1-CD1 4.39Å; L184-L188 HydrophobicContact CD1-CG 4.3Å; L184-L188 HydrophobicContact CG-CD1 4.22Å; L184-L188 WeakPolarHBondContact O-CG 3.42Å; L184-L188 PolarHBondContact O-N 2.84Å
185S93.9Very high91.4Very high78 Ų78111.4 Ų111.455%0.54553%0.528SS..Hα-helixtrans-59.8-43.2176.8-176.20000111.7K181 H182 Y189K181-S185 WeakPolarHBondContact O-CB 3.24Å; K181-S185 PolarHBondContact O-N 3.5Å; H182-S185 PolarHBondContact O-N 2.97Å; S185-Y189 WeakPolarHBondContact O-CB 3.38Å; S185-Y189 PolarHBondContact O-N 3.28Å
186H96.1Very high92.5Very high99 Ų99107.2 Ų107.246%0.45852%0.52SS..Hα-helixtrans-67.3-39.2177.6-173.6-100.7000111.6H182 Y183 L184 Y189 I190H182-H186 VanDerWaalsContact O-CB 3.26Å; H182-H186 WeakPolarHBondContact O-CB 3.23Å; H182-H186 PolarHBondContact O-N 2.87Å; Y183-H186 PolarHBondContact O-N 3.03Å; L184-H186 VanDerWaalsContact C-N 3.32Å; L184-H186 PolarHBondContact O-N 2.9Å; H186-Y189 PolarHBondContact O-N 3.13Å; H186-I190 WeakPolarHBondContact CE1-CD1 3.33Å; H186-I190 WeakPolarHBondContact ND1-CD1 3.45Å; H186-I190 WeakPolarHBondContact O-CG1 3.49Å; H186-I190 PolarHBondContact O-N 3.35Å
187H95.8Very high93Very high99 Ų99107.9 Ų107.946%0.45852%0.518SS..Hα-helixtrans-66.5-42.4177.2-166.676.7000112.2Y183 L184 I190 K191Y183-H187 VanDerWaalsContact O-CB 3.3Å; Y183-H187 WeakPolarHBondContact O-CB 3.35Å; Y183-H187 PolarHBondContact O-N 3.13Å; L184-H187 PolarHBondContact O-N 3.29Å; H187-I190 PolarHBondContact O-N 3.26Å; H187-K191 WeakPolarHBondContact O-CB 3.42Å; H187-K191 PolarHBondContact O-N 2.77Å
188L95.5Very high93.4Very high101 Ų101109.1 Ų109.153%0.52952%0.521SS..Hα-helixtrans-64.9-39.1174.5-70.1175.9000112L184 K191 S192L184-L188 HydrophobicContact CD1-CD1 4.39Å; L184-L188 HydrophobicContact CD1-CG 4.3Å; L184-L188 HydrophobicContact CG-CD1 4.22Å; L184-L188 WeakPolarHBondContact O-CG 3.42Å; L184-L188 PolarHBondContact O-N 2.84Å; L188-K191 PolarHBondContact O-N 3.08Å; L188-S192 PolarHBondContact O-N 2.81Å; L188-S192 PolarHBondContact O-OG 3.33Å
189Y94.8Very high93.8Very high158 Ų158109.7 Ų109.762%0.6252%0.521SS*.Hα-helixtrans-59.4-51.1173.5174.8-99.1000111.4S185 H186 K191 S192 Y193S185-Y189 WeakPolarHBondContact O-CB 3.38Å; S185-Y189 PolarHBondContact O-N 3.28Å; H186-Y189 PolarHBondContact O-N 3.13Å; Y189-K191 VanDerWaalsContact C-N 3.32Å; Y189-K191 PolarHBondContact O-N 3.06Å; Y189-S192 PolarHBondContact O-N 3.34Å; Y189-S192 PolarHBondContact O-OG 3.38Å; Y189-Y193 PolarHBondContact O-N 2.87Å; Y189-Y193 VanDerWaalsContact O-N 3.1Å
190I94.6Very high94Very high71 Ų71106.6 Ų106.636%0.36451%0.512SS..Hα-helixtrans-58.1-45.8176.4-69.6167.3000110.8H186 H187 S192 Y193 L194H186-I190 WeakPolarHBondContact CE1-CD1 3.33Å; H186-I190 WeakPolarHBondContact ND1-CD1 3.45Å; H186-I190 WeakPolarHBondContact O-CG1 3.49Å; H186-I190 PolarHBondContact O-N 3.35Å; H187-I190 PolarHBondContact O-N 3.26Å; I190-S192 PolarHBondContact O-N 2.97Å; I190-Y193 PolarHBondContact O-N 3.36Å; I190-L194 HydrophobicContact CG2-CD1 4.07Å; I190-L194 HydrophobicContact CG2-CG 4.44Å; I190-L194 WeakPolarHBondContact O-CG 3.28Å; I190-L194 PolarHBondContact O-N 3.35Å
191K95.8Very high94Very high118 Ų118106 Ų10651%0.51351%0.509SS..Hα-helixtrans-59.8-48.7-179.8-172.4172.9-179.1176.40111.7H187 L188 Y189 Y193 L194 D195H187-K191 WeakPolarHBondContact O-CB 3.42Å; H187-K191 PolarHBondContact O-N 2.77Å; L188-K191 PolarHBondContact O-N 3.08Å; Y189-K191 VanDerWaalsContact C-N 3.32Å; Y189-K191 PolarHBondContact O-N 3.06Å; K191-Y193 VanDerWaalsContact C-N 3.27Å; K191-Y193 PolarHBondContact O-N 3.4Å; K191-L194 PolarHBondContact O-N 3.4Å; K191-L194 VanDerWaalsContact O-N 3.15Å; K191-D195 VanDerWaalsContact O-CG 3.23Å; K191-D195 PolarHBondContact O-N 3.48Å
192S95.7Very high93.9Very high54 Ų54104.6 Ų104.638%0.37850%0.5SS..Hα-helixtrans-60.2-36.6178.369.30000113.1L188 Y189 I190 D195 I196L188-S192 PolarHBondContact O-N 2.81Å; L188-S192 PolarHBondContact O-OG 3.33Å; Y189-S192 PolarHBondContact O-N 3.34Å; Y189-S192 PolarHBondContact O-OG 3.38Å; I190-S192 PolarHBondContact O-N 2.97Å; S192-D195 PolarHBondContact O-N 3.46Å; S192-I196 WeakPolarHBondContact O-CD1 3.37Å; S192-I196 VanDerWaalsContact O-CG1 3.26Å; S192-I196 WeakPolarHBondContact O-CG1 3.48Å; S192-I196 PolarHBondContact O-N 3.42Å
193Y95.2Very high93.6Very high130 Ų13099.6 Ų99.651%0.5148%0.482SS..Hα-helixtrans-66.2-42.9176.7178.5-105000111.7Y189 I190 K191 I196 L197Y189-Y193 PolarHBondContact O-N 2.87Å; Y189-Y193 VanDerWaalsContact O-N 3.1Å; I190-Y193 PolarHBondContact O-N 3.36Å; K191-Y193 VanDerWaalsContact C-N 3.27Å; K191-Y193 PolarHBondContact O-N 3.4Å; Y193-I196 PolarHBondContact O-N 3.12Å; Y193-L197 HydrophobicContact CD1-CD1 3.98Å; Y193-L197 HydrophobicContact CE1-CD1 3.41Å; Y193-L197 VanDerWaalsContact CE1-CD1 3.41Å; Y193-L197 HydrophobicContact CE1-CG 4.21Å; Y193-L197 WeakPolarHBondContact O-CG 3.44Å; Y193-L197 PolarHBondContact O-N 3.48Å; Y193-L197 VanDerWaalsContact O-N 3.1Å
194L95.7Very high93.2Very high97 Ų9797.6 Ų97.651%0.50847%0.473SS..Hα-helixtrans-66-41.1176-66.4176.4000111.9I190 K191 I196 L197 E198I190-L194 HydrophobicContact CG2-CD1 4.07Å; I190-L194 HydrophobicContact CG2-CG 4.44Å; I190-L194 WeakPolarHBondContact O-CG 3.28Å; I190-L194 PolarHBondContact O-N 3.35Å; K191-L194 PolarHBondContact O-N 3.4Å; K191-L194 VanDerWaalsContact O-N 3.15Å; L194-I196 VanDerWaalsContact C-N 3.31Å; L194-I196 PolarHBondContact O-N 3.43Å; L194-L197 PolarHBondContact O-N 2.89Å; L194-E198 PolarHBondContact O-N 2.9Å
195D95.1Very high92.5Very high84 Ų8495.5 Ų95.545%0.44947%0.47SS..Hα-helixtrans-60.1-41.5176.6-65.7-14.8000111K191 S192 E198 E199K191-D195 VanDerWaalsContact O-CG 3.23Å; K191-D195 PolarHBondContact O-N 3.48Å; S192-D195 PolarHBondContact O-N 3.46Å; D195-E198 PolarHBondContact O-N 2.87Å; D195-E199 WeakPolarHBondContact O-CB 3.42Å; D195-E199 PolarHBondContact O-N 3.32Å
196I91.6Very high91.7Very high114 Ų11497.8 Ų97.859%0.58547%0.472SS*.Hα-helixtrans-64.6-42.2175.6-68.4163.4000111.3S192 Y193 L194 E199 D200S192-I196 WeakPolarHBondContact O-CD1 3.37Å; S192-I196 VanDerWaalsContact O-CG1 3.26Å; S192-I196 WeakPolarHBondContact O-CG1 3.48Å; S192-I196 PolarHBondContact O-N 3.42Å; Y193-I196 PolarHBondContact O-N 3.12Å; L194-I196 VanDerWaalsContact C-N 3.31Å; L194-I196 PolarHBondContact O-N 3.43Å; I196-E199 PolarHBondContact O-N 2.92Å; I196-D200 WeakPolarHBondContact O-CB 3.42Å; I196-D200 PolarHBondContact O-N 3Å
197L93.9Very high90.2Very high80 Ų80100.9 Ų100.942%0.41949%0.485SS..Hα-helixtrans-66.6-38.7178.1-71.4179.6000112.3Y193 L194 D200 E201Y193-L197 HydrophobicContact CD1-CD1 3.98Å; Y193-L197 HydrophobicContact CE1-CD1 3.41Å; Y193-L197 VanDerWaalsContact CE1-CD1 3.41Å; Y193-L197 HydrophobicContact CE1-CG 4.21Å; Y193-L197 WeakPolarHBondContact O-CG 3.44Å; Y193-L197 PolarHBondContact O-N 3.48Å; Y193-L197 VanDerWaalsContact O-N 3.1Å; L194-L197 PolarHBondContact O-N 2.89Å; L197-D200 PolarHBondContact O-N 3.45Å; L197-E201 PolarHBondContact O-N 2.88Å
198E93.1Very high88.5Confident108 Ų108103.7 Ų103.751%0.50550%0.495SS..Hα-helixtrans-65-45.1175.6-171.2-171.2150.700111L194 D195 E201 R202L194-E198 PolarHBondContact O-N 2.9Å; D195-E198 PolarHBondContact O-N 2.87Å; E198-E201 PolarHBondContact O-N 2.96Å; E198-R202 WeakPolarHBondContact O-CB 3.41Å; E198-R202 PolarHBondContact O-N 2.72Å; E198-R202 IonicContact OE1-CZ 3.76Å; E198-R202 IonicContact OE1-NH1 3.99Å; E198-R202 IonicContact OE1-NH2 2.77Å; E198-R202 PolarHBondContact OE1-NH2 3.22Å
199E92.4Very high86.7Confident101 Ų101103.3 Ų103.347%0.47250%0.501SS..Hα-helixtrans-65.6-37.8176.9-171.157.9-148.900111.9D195 I196 R202 A203D195-E199 WeakPolarHBondContact O-CB 3.42Å; D195-E199 PolarHBondContact O-N 3.32Å; I196-E199 PolarHBondContact O-N 2.92Å; E199-R202 PolarHBondContact O-N 3.45Å; E199-R202 IonicContact OE2-CZ 3.81Å; E199-R202 IonicContact OE2-NH1 2.74Å; E199-R202 PolarHBondContact OE2-NH1 2.93Å; E199-A203 VanDerWaalsContact O-CB 3.29Å; E199-A203 WeakPolarHBondContact O-CB 3.05Å; E199-A203 PolarHBondContact O-N 3.36Å
200D92.4Very high85Confident91 Ų9198.9 Ų98.949%0.48750%0.498SS..Hα-helixtrans-63.7-41.1174.4-172.160.8000111.7I196 L197 A203 R204I196-D200 WeakPolarHBondContact O-CB 3.42Å; I196-D200 PolarHBondContact O-N 3Å; L197-D200 PolarHBondContact O-N 3.45Å; D200-A203 PolarHBondContact O-N 3.36Å; D200-R204 WeakPolarHBondContact O-CB 3.3Å; D200-R204 VanDerWaalsContact O-CG 3.29Å; D200-R204 WeakPolarHBondContact O-CG 3.41Å; D200-R204 PolarHBondContact O-N 3.35Å
201E89.9Confident83.3Confident106 Ų106106 Ų10650%0.49552%0.52SS..Hα-helixtrans-68.8-39.6176.2-173.256.8-15700111.8L197 E198 R204 A205L197-E201 PolarHBondContact O-N 2.88Å; E198-E201 PolarHBondContact O-N 2.96Å; E201-R204 PolarHBondContact O-N 3.5Å; E201-R204 IonicContact OE2-NE 3.27Å; E201-R204 PolarHBondContact OE2-NE 2.89Å; E201-A205 PolarHBondContact O-N 3.41Å
202R89.7Confident81.5Confident113 Ų113106.8 Ų106.843%0.42654%0.537SS..Hα-helixtrans-58.4-48.2171.5-175.8-178.9-71.61226110.4E198 E199 R204 A205 H206E198-R202 WeakPolarHBondContact O-CB 3.41Å; E198-R202 PolarHBondContact O-N 2.72Å; E198-R202 IonicContact OE1-CZ 3.76Å; E198-R202 IonicContact OE1-NH1 3.99Å; E198-R202 IonicContact OE1-NH2 2.77Å; E198-R202 PolarHBondContact OE1-NH2 3.22Å; E199-R202 PolarHBondContact O-N 3.45Å; E199-R202 IonicContact OE2-CZ 3.81Å; E199-R202 IonicContact OE2-NH1 2.74Å; E199-R202 PolarHBondContact OE2-NH1 2.93Å; R202-R204 PolarHBondContact O-N 2.97Å; R202-A205 WeakPolarHBondContact O-CB 3.42Å; R202-A205 PolarHBondContact O-N 2.84Å; R202-H206 PolarHBondContact O-CD2 3.47Å; R202-H206 PolarHBondContact O-N 3.36Å; R202-H206 VanDerWaalsContact O-N 3.13Å
203A86.4Confident79.7Confident28 Ų28105.8 Ų105.823%0.23154%0.535CS..Hα-helixtrans-61.3-43.9176.700000111.8E199 D200 A205 H206 F207E199-A203 VanDerWaalsContact O-CB 3.29Å; E199-A203 WeakPolarHBondContact O-CB 3.05Å; E199-A203 PolarHBondContact O-N 3.36Å; D200-A203 PolarHBondContact O-N 3.36Å; A203-A205 VanDerWaalsContact C-N 3.3Å; A203-A205 PolarHBondContact O-N 2.87Å; A203-H206 WeakPolarHBondContact O-CB 3.49Å; A203-H206 PolarHBondContact O-N 3.28Å; A203-H206 VanDerWaalsContact O-N 3.11Å; A203-F207 HydrophobicContact CB-CD2 4.48Å; A203-F207 HydrophobicContact CB-CE2 4.49Å; A203-F207 WeakPolarHBondContact O-CD2 3.19Å; A203-F207 PolarHBondContact O-N 3.38Å
204R84Confident77.8Confident117 Ų117103.2 Ų103.244%0.44255%0.548SS..Hα-helixtrans-59.8-38175.2-80.1172.253.178.4-0.2112.6D200 E201 R202 F207 K208D200-R204 WeakPolarHBondContact O-CB 3.3Å; D200-R204 VanDerWaalsContact O-CG 3.29Å; D200-R204 WeakPolarHBondContact O-CG 3.41Å; D200-R204 PolarHBondContact O-N 3.35Å; E201-R204 PolarHBondContact O-N 3.5Å; E201-R204 IonicContact OE2-NE 3.27Å; E201-R204 PolarHBondContact OE2-NE 2.89Å; R202-R204 PolarHBondContact O-N 2.97Å; R204-F207 PolarHBondContact O-N 2.77Å; R204-K208 PolarHBondContact O-N 3.47Å
205A80.3Confident76.2Confident58 Ų58105.5 Ų105.548%0.47956%0.559SS.*Hα-helixtrans-63.2-42.8174.100000111.4E201 R202 A203 K208 S209E201-A205 PolarHBondContact O-N 3.41Å; R202-A205 WeakPolarHBondContact O-CB 3.42Å; R202-A205 PolarHBondContact O-N 2.84Å; A203-A205 VanDerWaalsContact C-N 3.3Å; A203-A205 PolarHBondContact O-N 2.87Å; A205-K208 PolarHBondContact O-N 3.06Å; A205-S209 PolarHBondContact O-N 3Å
206H77.7Confident74.7Confident126 Ų126112.1 Ų112.158%0.58358%0.578SS**Hα-helixtrans-64.6-43174.1-73.3-73.3000112.5R202 A203 K208 S209 A210R202-H206 PolarHBondContact O-CD2 3.47Å; R202-H206 PolarHBondContact O-N 3.36Å; R202-H206 VanDerWaalsContact O-N 3.13Å; A203-H206 WeakPolarHBondContact O-CB 3.49Å; A203-H206 PolarHBondContact O-N 3.28Å; A203-H206 VanDerWaalsContact O-N 3.11Å; H206-K208 VanDerWaalsContact C-N 3.31Å; H206-K208 PolarHBondContact O-N 2.94Å; H206-S209 PolarHBondContact O-N 3.47Å; H206-S209 VanDerWaalsContact O-N 3.09Å; H206-S209 PolarHBondContact O-OG 3.35Å; H206-A210 PolarHBondContact O-N 3.05Å
207F64.2Low73.3Confident165 Ų165114.2 Ų114.272%0.72459%0.59SS**Hα-helixtrans-65.8-29.6178.8-81.5-69.4000113.5A203 R204 S209 A210A203-F207 HydrophobicContact CB-CD2 4.48Å; A203-F207 HydrophobicContact CB-CE2 4.49Å; A203-F207 WeakPolarHBondContact O-CD2 3.19Å; A203-F207 PolarHBondContact O-N 3.38Å; R204-F207 PolarHBondContact O-N 2.77Å; F207-S209 VanDerWaalsContact C-N 3.3Å; F207-A210 PolarHBondContact O-N 3.28Å
208K60.2Low71.6Confident157 Ų157118.3 Ų118.368%0.68360%0.601SS**Hα-helixtrans-71.3-23.8172.9-76.8-179.4179.4178.50113.5R204 A205 H206R204-K208 PolarHBondContact O-N 3.47Å; A205-K208 PolarHBondContact O-N 3.06Å; H206-K208 VanDerWaalsContact C-N 3.31Å; H206-K208 PolarHBondContact O-N 2.94Å
209S58Low70.2Confident93 Ų93118.9 Ų118.965%0.6561%0.612SS**Hα-helixtrans-79.4-19.5177.174.90000113.3A205 H206 F207 R211A205-S209 PolarHBondContact O-N 3Å; H206-S209 PolarHBondContact O-N 3.47Å; H206-S209 VanDerWaalsContact O-N 3.09Å; H206-S209 PolarHBondContact O-OG 3.35Å; F207-S209 VanDerWaalsContact C-N 3.3Å; S209-R211 PolarHBondContact O-N 2.85Å
210A58.5Low68.9Low66 Ų66116.7 Ų116.755%0.54561%0.607SS.*SBendtrans-74.194.5170.600000109.3H206 F207H206-A210 PolarHBondContact O-N 3.05Å; F207-A210 PolarHBondContact O-N 3.28Å
211R58.8Low67.6Low220 Ų220121.4 Ų121.483%0.8362%0.623SS**  trans-37.6124.5179.6-157.5174.9-177.2140.6-1.2111.4S209 G213S209-R211 PolarHBondContact O-N 2.85Å; R211-G213 VanDerWaalsContact C-N 3.3Å; R211-G213 PolarHBondContact O-N 3.47Å
212P58.9Low66.4Low135 Ų135123.2 Ų123.288%0.87763%0.634SS**THydrogen-bonded Turntrans-6291.4172-16.528.3000109
213G57.7Low64.8Low32 Ų32125.5 Ų125.533%0.3366%0.655SS.*THydrogen-bonded Turntrans161.3-6.5-171.500000116.8R211 I215 R216R211-G213 VanDerWaalsContact C-N 3.3Å; R211-G213 PolarHBondContact O-N 3.47Å; G213-I215 PolarHBondContact O-N 3.03Å; G213-R216 PolarHBondContact O-N 2.86Å
214G55.9Low63.2Low76 Ų76128.4 Ų128.478%0.78468%0.678SS**THydrogen-bonded Turntrans-57.8-15.8-174.700000117
215I60.6Low61.5Low146 Ų146128.3 Ų128.375%0.74970%0.695SS**THydrogen-bonded Turntrans-106-9.3177.162.8158.2000114.4G213 N217 Y218G213-I215 PolarHBondContact O-N 3.03Å; I215-N217 PolarHBondContact O-N 2.79Å; I215-Y218 PolarHBondContact O-N 3.37Å
216R65.1Low60.1Low223 Ų223128.1 Ų128.184%0.84270%0.699SS**THydrogen-bonded Turntrans-74.9-9-172.4-72.5-175.8175.7-131.70.2113.9G213G213-R216 PolarHBondContact O-N 2.86Å
217N61.4Low58.8Low158 Ų158130.8 Ų130.885%0.84571%0.712SS**THydrogen-bonded Turntrans-112.711.6173.3-62.4-23.2000112.9I215 T219I215-N217 PolarHBondContact O-N 2.79Å; N217-T219 PolarHBondContact O-N 3.23Å
218Y58.6Low57.9Low166 Ų166128 Ų12865%0.65171%0.713SS**  trans-8795.8172.1-171.4-98.1000109I215 P220I215-Y218 PolarHBondContact O-N 3.37Å; Y218-P220 HydrophobicContact CD1-CB 4.41Å; Y218-P220 HydrophobicContact CD1-CG 4Å; Y218-P220 HydrophobicContact CE1-CB 3.87Å; Y218-P220 HydrophobicContact CE1-CG 3.92Å; Y218-P220 VanDerWaalsContact O-CD 3.3Å; Y218-P220 WeakPolarHBondContact O-CD 3.31Å
219T63.5Low57.2Low120 Ų120125 Ų12574%0.73671%0.712SS**  trans-78.7111.6160.5-52.20000107N217 K221N217-T219 PolarHBondContact O-N 3.23Å; T219-K221 PolarHBondContact O-N 3.47Å; T219-K221 VanDerWaalsContact O-N 3.14Å
220P65.4Low56.5Low55 Ų55128.2 Ų128.236%0.35772%0.721SS.*  trans-60122.3174.9-15.829000108.4Y218 I222Y218-P220 HydrophobicContact CD1-CB 4.41Å; Y218-P220 HydrophobicContact CD1-CG 4Å; Y218-P220 HydrophobicContact CE1-CB 3.87Å; Y218-P220 HydrophobicContact CE1-CG 3.92Å; Y218-P220 VanDerWaalsContact O-CD 3.3Å; Y218-P220 WeakPolarHBondContact O-CD 3.31Å; P220-I222 HydrophobicContact CB-CG1 4.21Å; P220-I222 PolarHBondContact O-N 2.86Å
221K65.1Low56Low189 Ų189131.4 Ų131.482%0.82274%0.739SS**THydrogen-bonded Turntrans-61.34.5178.8-72.5-175.5171.4-178.80114.7T219T219-K221 PolarHBondContact O-N 3.47Å; T219-K221 VanDerWaalsContact O-N 3.14Å
222I63.8Low55.3Low144 Ų144124 Ų12474%0.73873%0.731SS**THydrogen-bonded Turntrans-94.4-6.9-170-22.6177.8000112.6P220P220-I222 HydrophobicContact CB-CG1 4.21Å; P220-I222 PolarHBondContact O-N 2.86Å
223L57.7Low54.7Low162 Ų162125 Ų12585%0.84873%0.729SS**SBendtrans-108.76.5-177.6-62.2179.5000114.7
224A51.1Low54.1Low88 Ų88129.1 Ų129.173%0.72775%0.753SS**SBendtrans-110.323.5-178.900000113.6
225S49.2Very low53.8Low115 Ų115130.8 Ų130.880%0.80475%0.752SS**  trans-125.449.4176.7-53.90000110.7
226G51.3Low53.1Low54 Ų54129.6 Ų129.656%0.55775%0.752SS**SBendtrans-90.5133.6148.500000106.7
227E50.5Low52.3Low183 Ų183127 Ų12786%0.85576%0.755SS**SBendtrans63.3120.3158.555.8-164.4134.800119.5
228S45.5Very low51.7Low105 Ų105126.1 Ų126.173%0.73476%0.755SS**  trans97.392.4152.3-47.70000117.7
229S43.6Very low51.1Low95 Ų95122.2 Ų122.266%0.66476%0.758SS**  71.5115.7125.963.20000120.3
230L44.2Very low50.6Low161 Ų161125 Ų12584%0.84377%0.767SS**  54.1123.4124.3-70.6114.8000118.2
231S47.5Very low49.7Very low132 Ų132127.1 Ų127.192%0.92378%0.783SS**  trans73131.4171.780.20000113.4
232G44.3Very low48.9Very low64 Ų64123.7 Ų123.766%0.6678%0.783SS**  cis164.5162.514.200000105.2
233N46.6Very low48.2Very low158 Ų158121.7 Ų121.785%0.84578%0.782SS**  trans8376.3171.9-65.937000117.4
234S45.1Very low47.9Very low118 Ų118118.4 Ų118.483%0.82578%0.778SS**  20.7100.4108-175.30000117
235S50.6Low47.9Very low110 Ų110119.9 Ų119.977%0.76978%0.78SS**  trans-144.6113.7144.961.40000109.1
236T45Very low47.7Very low122 Ų122119.3 Ų119.375%0.74878%0.782SS**  trans-47.2123.2179.747.70000113.9
237N47.4Very low47.5Very low167 Ų167123 Ų12389%0.89379%0.785SS**  trans-149.190.5149.1-91.5-22.6000107.4A239N237-A239 PolarHBondContact O-N 3.44Å; N237-A239 VanDerWaalsContact O-N 3.11Å
238T49.2Very low47Very low140 Ų140119.9 Ų119.986%0.85978%0.782SS**  trans-63.6103.2176.224.10000111
239A46.9Very low47.3Very low85 Ų85125.1 Ų125.170%0.70279%0.787SS**  trans29.397137.400000118.6N237 S241N237-A239 PolarHBondContact O-N 3.44Å; N237-A239 VanDerWaalsContact O-N 3.11Å; A239-S241 VanDerWaalsContact C-N 3.33Å; A239-S241 PolarHBondContact O-N 3.17Å
240L53.2Low47.2Very low179 Ų179123.4 Ų123.494%0.93779%0.785SS**  trans-83.984.1143.6-67.6173.6000107.6S242L240-S242 PolarHBondContact O-N 2.99Å
241S45.9Very low47.2Very low99 Ų99122.6 Ų122.669%0.69279%0.789SS**  trans-82.994.9167.2-168.60000108A239 S243A239-S241 VanDerWaalsContact C-N 3.33Å; A239-S241 PolarHBondContact O-N 3.17Å; S241-S243 PolarHBondContact O-N 3.38Å; S241-S243 VanDerWaalsContact O-N 3.11Å
242S48.9Very low47Very low117 Ų117119.5 Ų119.582%0.81878%0.778SS**  trans-80.276167.741.60000109.3L240 A244L240-S242 PolarHBondContact O-N 2.99Å; S242-A244 PolarHBondContact O-N 2.71Å; S242-A244 VanDerWaalsContact O-N 3.14Å
243S48.3Very low47.4Very low102 Ų102126.4 Ų126.471%0.71379%0.79SS**  trans-69.8100160.147.80000108.5S241 P245S241-S243 PolarHBondContact O-N 3.38Å; S241-S243 VanDerWaalsContact O-N 3.11Å; S243-P245 WeakPolarHBondContact O-CD 3.23Å
244A51.5Low47.1Very low92 Ų92129.9 Ų129.976%0.7679%0.791SS**  trans-77.2120.516800000109.1S242 A246S242-A244 PolarHBondContact O-N 2.71Å; S242-A244 VanDerWaalsContact O-N 3.14Å; A244-A246 PolarHBondContact O-N 3.37Å
245P51.8Low47.1Very low119 Ų119131.1 Ų131.177%0.77379%0.794SS**  trans-76.7110.4166.529.3-27.1000108S243 H247S243-P245 WeakPolarHBondContact O-CD 3.23Å; P245-H247 PolarHBondContact O-N 3.2Å
246A43.8Very low47Very low104 Ų104131.8 Ų131.886%0.8679%0.793SS**  trans-62.1101.7160.500000108A244A244-A246 PolarHBondContact O-N 3.37Å
247H46.6Very low47.2Very low130 Ų130133.1 Ų133.160%0.60280%0.801SS**  trans-12798.1169.5-167-76000109.8P245 Y249P245-H247 PolarHBondContact O-N 3.2Å; H247-Y249 AromaticContact ND1-CD2 3.6Å; H247-Y249 AromaticContact ND1-CE2 3.4Å; H247-Y249 WeakPolarHBondContact ND1-CE2 3.17Å; H247-Y249 AromaticContact ND1-CZ 3.88Å; H247-Y249 PolarHBondContact O-N 2.95Å
248C41.8Very low46.9Very low119 Ų119128.6 Ų128.680%0.80479%0.794SS**  trans-58115.7169.4-640000110.1
249Y50.1Low46.6Very low215 Ų215124.8 Ų124.884%0.84378%0.782SS**  trans-9391.1160.6-82.9-86.2000108.8H247H247-Y249 AromaticContact ND1-CD2 3.6Å; H247-Y249 AromaticContact ND1-CE2 3.4Å; H247-Y249 WeakPolarHBondContact ND1-CE2 3.17Å; H247-Y249 AromaticContact ND1-CZ 3.88Å; H247-Y249 PolarHBondContact O-N 2.95Å
250G42.7Very low46.5Very low59 Ų59127.6 Ų127.661%0.60879%0.791SS**  trans-99.4143.2156.900000109.2G252G250-G252 PolarHBondContact O-N 3.46Å
251P44.5Very low45.8Very low143 Ų143124.8 Ų124.893%0.92979%0.786SS**  trans-81.5120.9-165.932.1-32000111.2
252G43.8Very low45.6Very low67 Ų67123.7 Ų123.769%0.69179%0.79SS**  trans-167.195.7-179.800000114.6G250G250-G252 PolarHBondContact O-N 3.46Å
253K51.5Low45.5Very low209 Ų209124.1 Ų124.191%0.90979%0.793SS**  trans45.1106.9147.8-50.4-161.7-178.4-175.60118.8T255K253-T255 PolarHBondContact O-N 3.5Å
254R41.1Very low45.2Very low232 Ų232123.4 Ų123.488%0.87580%0.802SS**  trans-49.3126.6160.7-66.4169.281-137.29.3111.3
255T45.1Very low44.6Very low144 Ų144122.4 Ų122.488%0.88380%0.801SS**  trans-145.5140.7137.644.40000109.3K253K253-T255 PolarHBondContact O-N 3.5Å
256T46.8Very low44.2Very low123 Ų123122 Ų12276%0.75581%0.807SS**  trans-96.5124-159.9-47.40000110.7
257V49.8Very low44.3Very low150 Ų150121.8 Ų121.891%0.90981%0.806SS**  trans-152.3102.8150.7-136.50000109.1
258G41.7Very low43.9Very low72 Ų72119.3 Ų119.374%0.74282%0.816SS**  trans-78.9162.4154.300000108.4
259G43Very low44.1Very low60 Ų60117.7 Ų117.762%0.61981%0.811SS**  cis165.5170.28.100000106.9
260T43.6Very low43.7Very low144 Ų144114.6 Ų114.688%0.88381%0.814SS**  trans68.3137.9160.354.40000116.6
261S40Very low43.7Very low120 Ų120114.8 Ų114.884%0.83982%0.817SS**  cis-179.4160.323.626.40000110.6
262G42.1Very low43.8Very low76 Ų76115.1 Ų115.178%0.78482%0.816SS**  trans119.2134.2153.100000114.2
263S46.4Very low43.6Very low126 Ų126115.7 Ų115.788%0.88182%0.822SS**  cis-178.1146.73.749.60000109.5
264G41Very low43.4Very low87 Ų87109.9 Ų109.990%0.89781%0.813SS**  trans94.6130.6152.300000116.4
265G39.1Very low43.7Very low71 Ų71108.1 Ų108.173%0.73282%0.815SS**  cis172.7148.1-0.300000110.7
266A44.6Very low43.7Very low110 Ų110105 Ų10591%0.90981%0.811SS**  trans53.6146.8144.200000121
267A44.2Very low44.1Very low100 Ų100106 Ų10683%0.82682%0.817SS**  cis-174.8150.6-8.900000109.2
268G39.5Very low44.4Very low79 Ų79104.9 Ų104.981%0.81481%0.806SS**  trans85.9148.6147.300000118
269A45Very low44.9Very low85 Ų85107.1 Ų107.170%0.70281%0.807SS**  cis-173.6145.6-14.300000107.2
270T41.7Very low45.6Very low149 Ų149115.1 Ų115.191%0.91482%0.819SS**  trans60.7135.5147.747.30000119.4
271G42.3Very low46Very low64 Ų64120 Ų12066%0.6684%0.837SS**  cis172.4163.47.200000111.4
272T48Very low46.3Very low149 Ų149120.1 Ų120.191%0.91484%0.837SS**  trans71115148.1580000123
273G39.3Very low46.5Very low79 Ų79122.4 Ų122.481%0.81484%0.84SS**  trans94142.5131.100000115.8
274A46.9Very low46.5Very low87 Ų87122.2 Ų122.272%0.71984%0.838SS**  cis-178.6148.7-9.300000105.2
275Q48Very low46.8Very low196 Ų196124.2 Ų124.292%0.91683%0.834SS**  trans77.2107.8156.1-66.8172.9-3.700119.4
276G44.8Very low47.3Very low77 Ų77127.6 Ų127.679%0.79484%0.841SS**  trans-96.6142.3158.900000112
277T56.1Low47.5Very low144 Ų144128.7 Ų128.788%0.88384%0.836SS**  trans-163.1135.7160.244.90000102.3
278D54.1Low47.7Very low127 Ų127130.8 Ų130.868%0.67984%0.837SS**  cis-170.2140.413.4172-3.7000103.4W280D278-W280 PolarHBondContact O-N 3.27Å
279P52.2Low48.4Very low119 Ų119134.8 Ų134.877%0.77384%0.839SS**  trans-88.389.4-176.934.5-33.9000112.6
280W58.1Low48.7Very low228 Ų228138.9 Ų138.986%0.86485%0.85SS**  trans-142.2141.5155.5-77.976.9000108.3D278D278-W280 PolarHBondContact O-N 3.27Å
281I52.3Low49.3Very low248 Ų248138 Ų138100%1.27284%0.844SS**  trans99.30-178-53.4163.7000113.7

Retrieved 281 of 281 residues in 49.5 ms (Link to these results)