A0A087YSF2_POEFO Loading...

Protein sprouty homolog 2

AlphaFold DB , UniProt , Accession A0A087YSF2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 326 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
1M33.5Very low39.5Very low227 Ų227146 Ų146100%1.11880%0.801SS**  0101.70-72158.9166.200107.4
2D38.1Very low39.2Very low137 Ų137141.2 Ų141.273%0.73381%0.81SS**  cis-152.11570.2-97.9-63.9000113.5
3S39.7Very low38.9Very low97 Ų97137.1 Ų137.168%0.67882%0.818SS**  trans47.3125.4155.6-63.40000120.1
4R38.9Very low38.5Very low239 Ų239132.4 Ų132.490%0.90281%0.812SS**  51.4143.475.6-79.7-177.2155.6168.2-6.3113.7
5S43.4Very low38.4Very low91 Ų91137.8 Ų137.864%0.63681%0.812SS**  cis170.6135.4-13.8177.90000105.1
6Q46Very low38.1Very low191 Ų191139.3 Ų139.389%0.89381%0.808SS**  trans-155154.3163.4-120.9157.5-5.800112.6
7N39.3Very low37.7Very low131 Ų131135.5 Ų135.570%0.70181%0.805SS**  trans-96.4-160.6-172.7-56.3-12.5000108.2
8D36.8Very low37.5Very low140 Ų140135.4 Ų135.475%0.74981%0.806SS**  cis-154.5163.523.9-81-67.8000111.2
9S40.5Very low37.3Very low122 Ų122137.2 Ų137.285%0.85381%0.81SS**  trans145.6146.6155.6-69.80000110.2
10D39.1Very low37.7Very low167 Ų167136.2 Ų136.289%0.89381%0.808SS**  cis-164.4168.3-28.8-168.75.7000106.5
11G39.4Very low37.4Very low64 Ų64134.7 Ų134.766%0.6680%0.804SS**  trans11891.8156.900000117.9
12G35.7Very low37.3Very low88 Ų88132.7 Ų132.791%0.90780%0.797SS**  62.4129.6128.200000121
13G35.3Very low37.2Very low88 Ų88132.7 Ų132.791%0.90780%0.802SS**  trans-145.1165.2173.100000115.4
14G32.7Very low36.7Very low72 Ų72131.8 Ų131.874%0.74281%0.808SS**  trans142.5155.3174.300000113
15R37Very low36.5Very low213 Ų213128.3 Ų128.380%0.80481%0.806SS**  cis-166.9142.1-8.2-129.2179.6-178.6-145.2-0110.6
16H33.9Very low36Very low162 Ų162128.5 Ų128.575%0.7581%0.813SS**  trans63.4147.3159-54.7-40.3000120.3
17G32.3Very low35.3Very low74 Ų74125.6 Ų125.676%0.76380%0.804SS**  trans159.824162.500000125
18V32.6Very low35Very low134 Ų134127.3 Ų127.381%0.81281%0.81SS**  trans29.4123.7155.3-177.40000121.3
19L34.4Very low34.8Very low169 Ų169124.1 Ų124.189%0.88580%0.803SS**  -161.4157128.4-126.489.1000110.8
20P45.1Very low34.4Very low118 Ų118126.9 Ų126.977%0.76680%0.802SS**  trans-106.3179.5-164.441.3-36.3000116.8
21S31.4Very low33.9Very low105 Ų105125.5 Ų125.573%0.73480%0.795SS**  trans-66.8165.4-171.5-40.50000117.5
22L32.1Very low33.7Very low184 Ų184131.3 Ų131.396%0.96381%0.805SS**  trans-123.1130.7147.3-148.884.3000109.6
23T35.1Very low33.4Very low137 Ų137130.4 Ų130.484%0.8480%0.795SS**  trans-139.7137.3-179.8-49.80000109.1
24G29.1Very low33.2Very low78 Ų78138.8 Ų138.880%0.80480%0.799SS**  trans172.7116.4172.300000114.2
25L36.1Very low33.1Very low166 Ų166139.4 Ų139.487%0.86980%0.798SS**  trans-157.5104.4177.4-164.4174.3000109.5
26A31.9Very low33Very low95 Ų95140.5 Ų140.579%0.78580%0.802SS**  trans-163.299.5174.100000115.1
27N30.8Very low32.8Very low131 Ų131136.4 Ų136.470%0.70179%0.792SS**  39.2132.2121.9-78.93.9000124.8
28M34.3Very low32.6Very low167 Ų167143.9 Ų143.982%0.82380%0.797SS**  trans72153.4149-58.5-51.4129.800119.4
29A33Very low32.6Very low73 Ų73145.4 Ų145.460%0.60380%0.799SS**  cis-170-176.8-20.500000110
30H31.5Very low32.6Very low180 Ų180145.6 Ų145.683%0.83379%0.789SS**  trans69155.2175.5-77.4-91.9000116.9
31D29.3Very low32.3Very low137 Ų137145.2 Ų145.273%0.73379%0.786SS**  cis-164.8159.4-22.5-170.113000109.2
32E34.3Very low32.6Very low187 Ų187148.4 Ų148.487%0.87479%0.789SS**  trans161.5127.9157-99.4-82.292.900109.4
33G29.7Very low33.2Very low68 Ų68144.2 Ų144.270%0.70177%0.771SS**  trans-127.2139.4-176.300000114
34R29.9Very low33.8Very low264 Ų264142.9 Ų142.9100%0.99677%0.765SS**  trans-142.1146.2164-147.2162.6-1671405.3112.5
35A30.8Very low34.9Very low86 Ų86144.3 Ų144.371%0.71176%0.76SS**  trans-117.7174.8-158.900000114.1
36R35.8Very low35.7Very low235 Ų235143.4 Ų143.489%0.88776%0.761SS**  trans83.2139.4170.3-50169.373.3171.35.7114.8
37S29.9Very low36.9Very low77 Ų77143.7 Ų143.754%0.53875%0.749SS.*  cis-173.1160.2-16.842.60000110.7
38W28Very low38Very low230 Ų230141 Ų14187%0.87174%0.74SS**  trans99.4138.4157.8-56.1122.6000120.6
39L33Very low39Very low166 Ų166140 Ų14087%0.86974%0.738SS**  trans68.3104.3155.8-65.8160.6000119.4
40R34.3Very low40Very low174 Ų174142.1 Ų142.166%0.65774%0.739SS**  trans-108.7120.4158174.2179.4-173-152.20.4109.9T43R40-T43 PolarHBondContact NH2-O 3.03Å; R40-T43 PolarHBondContact NH2-OG1 2.97Å
41P38.4Very low41.1Very low109 Ų109138.5 Ų138.571%0.70872%0.722SS**PPolyproline II helixtrans-81.6156.9150.6-1834000111.5T43P41-T43 PolarHBondContact O-N 3.29Å
42H37.7Very low42.3Very low172 Ų172137.4 Ų137.480%0.79672%0.715SS**PPolyproline II helixtrans-82119.9-164.2-63.8-104.2000113.6
43T45Very low43.3Very low97 Ų97138.9 Ų138.960%0.59571%0.713SS**PPolyproline II helixtrans-83.1129.3152.140.30000109.3R40 P41R40-T43 PolarHBondContact NH2-O 3.03Å; R40-T43 PolarHBondContact NH2-OG1 2.97Å; P41-T43 PolarHBondContact O-N 3.29Å
44P48.1Very low44.4Very low108 Ų108143 Ų14370%0.70172%0.717SS**PPolyproline II helixtrans-67.4148.1173.229.2-34.1000110.4V46P44-V46 PolarHBondContact O-N 2.89Å
45P52.3Low45.2Very low109 Ų109135 Ų13571%0.70870%0.701SS**PPolyproline II helixtrans-71.2124.4178.829.3-33.3000110.6L47P45-L47 PolarHBondContact O-N 2.94Å
46V51.3Low46Very low146 Ų146134.1 Ų134.189%0.88570%0.701SS**  trans-72.1114.6165-179.40000107.2P44P44-V46 PolarHBondContact O-N 2.89Å
47L56.9Low46.6Very low102 Ų102125.9 Ų125.953%0.53469%0.689SS.*  trans-72.4151.5180-57.4-177.8000110.9P45P45-L47 PolarHBondContact O-N 2.94Å
48S55.2Low47.5Very low75 Ų75127.1 Ų127.152%0.52470%0.697SS.*  trans-71.8154.5-179.653.20000112.1D50 Q51S48-D50 PolarHBondContact O-N 3.16Å; S48-D50 VanDerWaalsContact O-N 3.1Å; S48-Q51 WeakPolarHBondContact O-CB 3.28Å; S48-Q51 PolarHBondContact O-N 3.14Å
49L55.1Low48.5Very low146 Ų146121.2 Ų121.276%0.76468%0.683SS**G310 helixtrans-58.1-30.3-170.1-134.575.6000113.9Q51 I52L49-Q51 VanDerWaalsContact C-N 3.32Å; L49-Q51 PolarHBondContact O-N 2.88Å; L49-I52 HydrophobicContact CD1-CD1 4.22Å; L49-I52 WeakPolarHBondContact O-CB 3.13Å; L49-I52 PolarHBondContact O-N 2.88Å
50D53.1Low49.5Very low117 Ų117121.7 Ų121.763%0.62668%0.681SS**G310 helixtrans-70.6-27.9-179.9-57.4-59.9000113S48 I52 R53S48-D50 PolarHBondContact O-N 3.16Å; S48-D50 VanDerWaalsContact O-N 3.1Å; D50-I52 PolarHBondContact O-N 3.43Å; D50-R53 PolarHBondContact O-N 2.04Å; D50-R53 VanDerWaalsContact O-N 3.14Å
51Q54.9Low50.3Low103 Ų103124.5 Ų124.548%0.48169%0.693SS.*G310 helixtrans-70.3-23.7179.1-155.2163.513.400111.9S48 L49 R53S48-Q51 WeakPolarHBondContact O-CB 3.28Å; S48-Q51 PolarHBondContact O-N 3.14Å; L49-Q51 VanDerWaalsContact C-N 3.32Å; L49-Q51 PolarHBondContact O-N 2.88Å; Q51-R53 VanDerWaalsContact C-N 3.28Å; Q51-R53 PolarHBondContact O-N 3.26Å
52I54.6Low51Low115 Ų115124.7 Ų124.759%0.5969%0.692SS**G310 helixtrans-68-27.7174-52.3176.1000111.2L49 D50 I54L49-I52 HydrophobicContact CD1-CD1 4.22Å; L49-I52 WeakPolarHBondContact O-CB 3.13Å; L49-I52 PolarHBondContact O-N 2.88Å; D50-I52 PolarHBondContact O-N 3.43Å; I52-I54 PolarHBondContact O-N 2.81Å
53R54.7Low51.6Low218 Ų218121.8 Ų121.882%0.82368%0.683SS**G310 helixtrans-79.9-14.9-175.1-159.2-178-66.3-126.32.3114D50 Q51D50-R53 PolarHBondContact O-N 2.04Å; D50-R53 VanDerWaalsContact O-N 3.14Å; Q51-R53 VanDerWaalsContact C-N 3.28Å; Q51-R53 PolarHBondContact O-N 3.26Å
54I52.7Low51.9Low154 Ų154119.8 Ų119.879%0.7968%0.681SS**THydrogen-bonded Turntrans-101.3-20.6179.2-57.8-179.9000111.3I52 G56I52-I54 PolarHBondContact O-N 2.81Å; I54-G56 PolarHBondContact O-N 3.33Å
55S47.3Very low51.7Low95 Ų95121.2 Ų121.266%0.66469%0.69SS**SBendtrans-74.872.1165.4-640000111.2G57S55-G57 PolarHBondContact O-N 3.48Å
56G49Very low51.3Low68 Ų68121.6 Ų121.670%0.70170%0.696SS**  trans-55.3122.517100000110.7I54 S58I54-G56 PolarHBondContact O-N 3.33Å; G56-S58 PolarHBondContact O-N 3.26Å
57G48Very low50.7Low62 Ų62119.3 Ų119.364%0.63969%0.692SS**  trans-6896.3-175.600000112.3S55 N59S55-G57 PolarHBondContact O-N 3.48Å; G57-N59 VanDerWaalsContact C-N 3.33Å; G57-N59 PolarHBondContact O-N 3.45Å; G57-N59 PolarHBondContact O-OD1 2.87Å
58S48Very low49.7Very low103 Ų103119 Ų11972%0.7271%0.705SS**  trans-73.590.2166.2-166.80000108.5G56 E60G56-S58 PolarHBondContact O-N 3.26Å; S58-E60 PolarHBondContact O-N 2.96Å
59N48.8Very low48.8Very low107 Ų107124.8 Ų124.857%0.57272%0.723SS**  trans-80.180.2-174.9-66.4-12000110.4G57 Y61 T62G57-N59 VanDerWaalsContact C-N 3.33Å; G57-N59 PolarHBondContact O-N 3.45Å; G57-N59 PolarHBondContact O-OD1 2.87Å; N59-Y61 PolarHBondContact O-N 2.81Å; N59-T62 PolarHBondContact O-N 3.19Å; N59-T62 PolarHBondContact O-OG1 3.31Å
60E54.9Low47.7Very low176 Ų176129.6 Ų129.682%0.82273%0.731SS**THydrogen-bonded Turntrans-62.35.7-178.6-159.4163.1107.300114.7S58S58-E60 PolarHBondContact O-N 2.96Å
61Y50.1Low46.7Very low232 Ų232129.5 Ų129.591%0.9174%0.74SS**THydrogen-bonded Turntrans-97.6-2.7170.7-147.6-95.8000113.8N59N59-Y61 PolarHBondContact O-N 2.81Å
62T53.6Low46Very low113 Ų113130.8 Ų130.869%0.69376%0.757SS**THydrogen-bonded Turntrans-112.2-18175.4370000114.4N59 G64N59-T62 PolarHBondContact O-N 3.19Å; N59-T62 PolarHBondContact O-OG1 3.31Å; T62-G64 PolarHBondContact O-N 3.29Å
63D49.9Very low44.8Very low112 Ų112129.7 Ų129.760%0.59977%0.765SS**  trans-87.1102.1-176.5-68.7-70.9000112.3
64G50.7Low43.8Very low54 Ų54125.6 Ų125.656%0.55777%0.765SS**  trans-63158.816300000111.7T62 S66T62-G64 PolarHBondContact O-N 3.29Å; G64-S66 PolarHBondContact O-N 3.39Å
65P44.6Very low42.9Very low138 Ų138126.5 Ų126.590%0.89677%0.766SS**SBendtrans-56.7122.1-169.722.7-34.3000112.3A67P65-A67 PolarHBondContact O-N 3.31Å; P65-A67 VanDerWaalsContact O-N 3.14Å
66S43.3Very low42.3Very low117 Ų117130.2 Ų130.282%0.81877%0.773SS**  trans-63.9110.8-164.8-48.80000113.4G64G64-S66 PolarHBondContact O-N 3.39Å
67A38.8Very low41.5Very low98 Ų98137.7 Ų137.781%0.8178%0.78SS**PPolyproline II helixtrans-69.7136.2165.300000110.1P65P65-A67 PolarHBondContact O-N 3.31Å; P65-A67 VanDerWaalsContact O-N 3.14Å
68A36Very low40.5Very low97 Ų97142.7 Ų142.780%0.80278%0.784SS**PPolyproline II helixtrans-68.6150-167.200000114.6
69Q36Very low39.7Very low195 Ų195143.2 Ų143.291%0.91178%0.783SS**PPolyproline II helixtrans-57.4139173.9-72.2-169.7-30.100113
70R31.8Very low38.8Very low247 Ų247145.6 Ų145.693%0.93279%0.79SS**  trans-141.5109.1153.1-78.6-168.5174.5169-0.7111.8
71S33.5Very low37.6Very low116 Ų116145.6 Ų145.681%0.81179%0.792SS**  trans-121.8138.1150.4-620000105.8
72P39.3Very low36.7Very low129 Ų129139.8 Ų139.884%0.83878%0.781SS**  -137.6-171.378.342.6-27000111.2
73A30.6Very low35.5Very low92 Ų92140 Ų14076%0.7678%0.782SS**  cis-152.3170.515.700000114
74T32.2Very low34.6Very low133 Ų133140.1 Ų140.182%0.81679%0.792SS**  trans-83.2128.9179.4-43.30000113.2
75Q34Very low33.6Very low173 Ų173144.3 Ų144.381%0.80881%0.807SS**  trans-179.1152153-106.2153.710200109.5
76Q34.9Very low32.9Very low173 Ų173140.8 Ų140.881%0.80880%0.796SS**  cis-148.6151.3-3.3-162.71715.600110.2
77R32.3Very low32.3Very low225 Ų225141.6 Ų141.685%0.84980%0.802SS**  trans-85.6125.8175.8174.1-172.6-179.4-172.22.4110.4
78K28Very low32.1Very low167 Ų167148 Ų14873%0.72681%0.805SS**  trans-131127.3155.5-167.2175.7-177.9-1720111E80K78-E80 WeakPolarHBondContact CE-OE2 3.39Å; K78-E80 IonicContact NZ-OE2 2.77Å; K78-E80 PolarHBondContact NZ-OE2 3.04Å
79T31.1Very low31.9Very low113 Ų113150.3 Ų150.369%0.69381%0.809SS**  trans-126.3114.1171.7-55.90000107.1
80E29.2Very low31.6Very low157 Ų157149.3 Ų149.373%0.73481%0.81SS**  trans-137.6170.3162.9-71.7-168.413100108.7K78K78-E80 WeakPolarHBondContact CE-OE2 3.39Å; K78-E80 IonicContact NZ-OE2 2.77Å; K78-E80 PolarHBondContact NZ-OE2 3.04Å
81M30Very low31.5Very low176 Ų176141.3 Ų141.387%0.86780%0.804SS**  trans-138.7175.9-145.5-176.7-177.2157.200111.7
82V31.1Very low31.4Very low111 Ų111144.8 Ų144.867%0.67381%0.807SS**  trans9690.9160.2-170.50000117.2
83T28.3Very low30.9Very low117 Ų117146.7 Ų146.772%0.71881%0.805SS**  57.7116.1122.3-45.70000120.9
84S30Very low31Very low114 Ų114149.9 Ų149.980%0.79781%0.805SS**  -172.6131.7110-80.70000115.8
85T29.9Very low30.9Very low142 Ų142150.5 Ų150.587%0.87181%0.808SS**  trans-16.7139152.4-48.50000119.1
86G29.8Very low31.2Very low65 Ų65151.3 Ų151.367%0.6781%0.812SS**  trans148.3115.4135.600000120.4
87S31.5Very low31.4Very low134 Ų134151.4 Ų151.494%0.93781%0.813SS**  trans73163.2147.2-64.50000121.1
88R34Very low31.5Very low233 Ų233149.1 Ų149.188%0.87981%0.812SS**  trans-120.5147.1-168-58.5149.159.7-177.80.8110.7
89T31.4Very low32.2Very low145 Ų145146.7 Ų146.789%0.8981%0.81SS**  trans-165.1162.5139.7160000111.2
90N30Very low32.4Very low173 Ų173145.6 Ų145.693%0.92581%0.807SS**  trans-81.6155.3177.7-64.9-5.6000112
91G29.3Very low32.9Very low79 Ų79144.1 Ų144.181%0.81481%0.805SS**  trans-160.6131.8162.100000110.8
92Q31.4Very low33.4Very low189 Ų189141.4 Ų141.488%0.88379%0.793SS**  trans-98.9135172.5-79.6169.8-11700110.1
93Q30.4Very low34.1Very low170 Ų170142.1 Ų142.179%0.79479%0.793SS**  trans-172.6114.2145.8-104.2164.7-16.900106
94E32.4Very low34.6Very low159 Ų159146.8 Ų146.874%0.74380%0.797SS**  72.9109.373.3-69.1177.4147.200112.9
95T29.3Very low35.2Very low146 Ų146147.1 Ų147.190%0.89679%0.79SS**  trans-14488.8167.9290000109E97T95-E97 PolarHBondContact O-N 2.79Å
96E40.3Very low35.6Very low190 Ų190146.8 Ų146.889%0.88878%0.782SS**  trans-101.554.7-170.2-161.2-170.3152.700112.9
97E39Very low35.9Very low175 Ų175153.3 Ų153.382%0.81879%0.788SS**  trans-125.4-16.2-176.9-70.2-158.9106.500116.6T95 V99T95-E97 PolarHBondContact O-N 2.79Å; E97-V99 PolarHBondContact O-N 3.47Å
98E35Very low36.2Very low177 Ų177151.3 Ų151.383%0.82777%0.774SS**SBendtrans-83.5-7.4-172.9-147.4178.6105.500115.1
99V41.8Very low36.4Very low116 Ų116146.4 Ų146.470%0.70377%0.77SS**SBendtrans-83.4-28.7-173.7179.20000113.4E97 N101E97-V99 PolarHBondContact O-N 3.47Å; V99-N101 PolarHBondContact O-N 3.16Å
100S36.7Very low36.9Very low90 Ų90145 Ų14563%0.62976%0.762SS**Hα-helixtrans-70.3-31.6-167.2-160.80000114.2N102S100-N102 PolarHBondContact O-N 3.35Å
101N39.8Very low37.2Very low126 Ų126145.4 Ų145.467%0.67476%0.757SS**Hα-helixtrans-72.9-27.4-170.7-70.7-41.5000114.4V99V99-N101 PolarHBondContact O-N 3.16Å
102N40.9Very low37.5Very low118 Ų118151.3 Ų151.363%0.63176%0.764SS**Hα-helixtrans-78-28.1-177.1-79.7-65.8000113.6S100 R104S100-N102 PolarHBondContact O-N 3.35Å; N102-R104 PolarHBondContact O-N 3.39Å
103L44.4Very low37.4Very low126 Ų126145.9 Ų145.966%0.6676%0.758SS**Hα-helixtrans-64.3-26.6178.2-88.7161.8000113.3N105L103-N105 PolarHBondContact O-N 3.32Å
104R39.8Very low37.5Very low215 Ų215145.2 Ų145.281%0.81176%0.76SS**Hα-helixtrans-76.9-19.1-174.1-156.4169.3-172.3169.12.5114.2N102N102-R104 PolarHBondContact O-N 3.39Å
105N41.4Very low37.6Very low121 Ų121141.2 Ų141.265%0.64776%0.755SS**Hα-helixtrans-86.2-26179.8-88.9-37.8000114.2L103 Y107L103-N105 PolarHBondContact O-N 3.32Å; N105-Y107 VanDerWaalsContact C-N 3.33Å; N105-Y107 PolarHBondContact O-N 3.48Å
106L38.9Very low37.9Very low136 Ų136142 Ų14271%0.71275%0.754SS**Hα-helixtrans-71.5-25.2178.1-84.898.4000113.6S108L106-S108 VanDerWaalsContact C-N 3.31Å; L106-S108 PolarHBondContact O-N 3.14Å
107Y36.9Very low37.7Very low201 Ų201137.2 Ų137.279%0.78875%0.746SS**THydrogen-bonded Turntrans-76.2-16.3-177-117.6-86.8000114.3N105 V109N105-Y107 VanDerWaalsContact C-N 3.33Å; N105-Y107 PolarHBondContact O-N 3.48Å; Y107-V109 PolarHBondContact O-N 3.41Å
108S37.9Very low37.9Very low93 Ų93134.2 Ų134.265%0.6574%0.742SS**THydrogen-bonded Turntrans-84.3-7-171-56.50000115L106L106-S108 VanDerWaalsContact C-N 3.31Å; L106-S108 PolarHBondContact O-N 3.14Å
109V38.2Very low37.8Very low129 Ų129133.3 Ų133.378%0.78274%0.741SS**SBendtrans-104.3-10.5-168.7-177.60000113.3Y107Y107-V109 PolarHBondContact O-N 3.41Å
110T40.4Very low37.1Very low117 Ų117132.5 Ų132.572%0.71874%0.741SS**SBendtrans-104.21.5-169-32.40000114.6
111H37.8Very low36.8Very low181 Ų181132.7 Ų132.784%0.83874%0.742SS**  trans-115.570.8-176.2-104.4-85.7000113.9
112Q34.3Very low36.5Very low202 Ų202136.6 Ų136.694%0.94475%0.748SS**  trans-142.252160.7-156.8169.797.100112.2
113G30.2Very low35.9Very low75 Ų75138.1 Ų138.177%0.77375%0.751SS**PPolyproline II helixtrans-87.6123166.100000110.5
114N32.6Very low35.2Very low156 Ų156136 Ų13683%0.83476%0.76SS**PPolyproline II helixtrans-69.7142.6-175.8-168.531.2000112.2
115A34.3Very low34.8Very low76 Ų76134.1 Ų134.163%0.62876%0.762SS**PPolyproline II helixtrans-77.2145.6177.500000111.8
116N34.4Very low34.2Very low163 Ų163132.7 Ų132.787%0.87276%0.761SS**  trans-172.1124.9147.6-95.8-33.6000111
117A36.4Very low33.7Very low89 Ų89135.2 Ų135.274%0.73677%0.769SS**  trans-132.9154.9161.200000107
118P44.5Very low33.4Very low112 Ų112130.8 Ų130.873%0.72777%0.768SS**  -151148.796.131.5-10.8000118
119I31.6Very low33.1Very low157 Ų157131.7 Ų131.781%0.80578%0.775SS**  trans68.6104134.1-59.6169.7000120.6
120S27.3Very low32.7Very low100 Ų100130.4 Ų130.470%0.69977%0.771SS**  43.8132.6122.2-169.70000122.2
121S30Very low32.5Very low94 Ų94131.1 Ų131.166%0.65778%0.775SS**  174.413398.6-74.40000116.3
122R33.8Very low32.3Very low208 Ų208130.2 Ų130.279%0.78577%0.771SS**  trans62.1164.5154.6-61.3-176.8117.1159.7-2117.3
123E29.6Very low31.9Very low150 Ų150126.8 Ų126.870%0.70176%0.759SS**  cis-163.2172.6-29.8-103.4162.1-172.300105.1
124G28.3Very low32.2Very low82 Ų82128.1 Ų128.185%0.84576%0.757SS**  trans120.191.6157.800000118.9
125M31.2Very low32.2Very low175 Ų175128.8 Ų128.886%0.86276%0.755SS**  trans-49.7139.5165.5-173.571.9110.100117.5
126S29.1Very low32Very low90 Ų90131 Ų13163%0.62977%0.766SS**  trans74.4147.2144.7-77.90000126.3
127Q29Very low31.9Very low189 Ų189128.6 Ų128.688%0.88376%0.762SS**  trans89168.2141.6-82.317455.800121.3
128S31.3Very low31.9Very low109 Ų109130.1 Ų130.176%0.76276%0.761SS**  trans-149.6130.2-147.256.40000115.1
129S31.3Very low31.8Very low112 Ų112136.6 Ų136.678%0.78377%0.771SS**  trans-174131.1162.731.10000106.2
130S30Very low32Very low102 Ų102135.4 Ų135.471%0.71377%0.772SS**  cis86.7132.147.876.40000114.7
131V35.1Very low32.5Very low132 Ų132136.5 Ų136.580%0.878%0.78SS**  trans80.2131.5159.7-62.90000123.3
132E33.9Very low33Very low162 Ų162137.4 Ų137.476%0.75779%0.793SS**  trans66.3105.9155.8-51.4-36.273.800126.6
133D27.2Very low32.9Very low129 Ų129131.1 Ų131.169%0.6979%0.793SS**  70.4169.4113.4-149.914.1000123.8
134S34.6Very low33.1Very low103 Ų103130.5 Ų130.572%0.7281%0.805SS**  trans9771.4166.5-62.40000121.1
135Q34.5Very low33.2Very low171 Ų171129.9 Ų129.980%0.79980%0.799SS**  26.3156.7126.9-53.3-172.930.600124.4
136S29.9Very low33.3Very low122 Ų122127.7 Ų127.785%0.85380%0.801SS**  trans82158.9167.3880000116.4
137S31Very low33.8Very low113 Ų113129.1 Ų129.179%0.7981%0.81SS**  cis-147.31654.7-165.30000112.7
138V36.5Very low34.3Very low120 Ų120123.1 Ų123.173%0.72780%0.8SS**  trans-81.6140.3179.3176.90000111.5
139R43.7Very low34.7Very low248 Ų248126.5 Ų126.594%0.93680%0.803SS**  trans-135.9129.5153-72-164.6174.1-172.6-1.5112.3
140T35.5Very low35.2Very low132 Ų132131.3 Ų131.381%0.8180%0.804SS**  trans-97.6154.6167.944.40000110
141S37.8Very low35.6Very low124 Ų124132.8 Ų132.887%0.86780%0.804SS**  trans-150.3131.4165.252.40000109.6
142A39.9Very low35.9Very low113 Ų113134.4 Ų134.493%0.93481%0.807SS**  trans-128.4152.4178.100000109.7
143G30.7Very low35.7Very low76 Ų76130.5 Ų130.578%0.78481%0.81SS**  trans-177.2130.8176.900000111.6
144S34.7Very low36Very low136 Ų136127.9 Ų127.995%0.95181%0.814SS**  trans-136.7143.1-175.6-60.50000111.3
145G31.1Very low36.4Very low70 Ų70129.5 Ų129.572%0.72282%0.822SS**  trans163.2127.4174.300000109.7
146S32.4Very low36.6Very low129 Ų129126.2 Ų126.290%0.90282%0.824SS**  73.1126.363.3-171.50000111.8
147S38.8Very low37Very low119 Ų119127.7 Ų127.783%0.83282%0.822SS**  cis-156175.8-7.6-174.10000108.8
148G39.4Very low37.8Very low64 Ų64127.4 Ų127.466%0.6682%0.82SS**  trans-116168.7-173.100000116.7
149Q40.3Very low38.4Very low179 Ų179130.5 Ų130.584%0.83682%0.82SS**  trans-158.6128.7166.9-104.7169.176.500108.8
150R41.2Very low38.5Very low214 Ų214127 Ų12781%0.80881%0.814SS**  67.1137.5101.1-69.7-168.3167.9-156.7-4.2115
151L39.9Very low38.9Very low133 Ų133126.4 Ų126.470%0.69681%0.805SS**  cis-162.6-172.4-0.2-125.5174.4000111.7
152L40.2Very low39.2Very low165 Ų165126.6 Ų126.686%0.86480%0.795SS**  trans75.6161174-49-176.3000115.2
153G30.5Very low39.4Very low81 Ų81129.8 Ų129.884%0.83578%0.783SS**  cis-144.8-73.71.400000114.4
154G32.4Very low40Very low74 Ų74133.2 Ų133.276%0.76378%0.783SS**  trans132.8-170.4-173.500000113
155P44.5Very low40.4Very low137 Ų137132.9 Ų132.989%0.8977%0.766SS**  cis-117.5-165-5.541.9-29000113
156A39Very low41.1Very low101 Ų101135.3 Ų135.384%0.83577%0.77SS**  trans-72148.1-168.200000116.5
157N37.7Very low41.1Very low154 Ų154138.8 Ų138.882%0.82477%0.768SS**  trans-136.3140.1135.9-167.58000108.7
158S46.7Very low41.3Very low107 Ų107143.6 Ų143.675%0.74877%0.768SS**  trans-103.2117.7-170.9-172.10000111.3
159Y50.2Low41.2Very low184 Ų184145 Ų14572%0.72277%0.774SS**  trans-132.2128.3161.564.6-82.8000109.5I161Y159-I161 HydrophobicContact CD2-CG1 3.97Å; Y159-I161 HydrophobicContact CE2-CD1 3.8Å; Y159-I161 HydrophobicContact CE2-CG1 3.73Å; Y159-I161 PolarHBondContact O-N 2.95Å; Y159-I161 VanDerWaalsContact O-N 3.14Å
160E45Very low41Very low174 Ų174143.7 Ų143.781%0.81377%0.773SS**  trans-72.5106-176.8-70.5-175.8100.600111I162E160-I162 HydrophobicContact CB-CG1 4.29Å; E160-I162 PolarHBondContact O-N 3.43Å
161I43.8Very low41.2Very low121 Ų121139.7 Ų139.762%0.62178%0.778SS**  trans-82.192.1162.7-57.8175.3000107Y159 R163Y159-I161 HydrophobicContact CD2-CG1 3.97Å; Y159-I161 HydrophobicContact CE2-CD1 3.8Å; Y159-I161 HydrophobicContact CE2-CG1 3.73Å; Y159-I161 PolarHBondContact O-N 2.95Å; Y159-I161 VanDerWaalsContact O-N 3.14Å; I161-R163 HydrophobicContact CG2-CB 4.41Å; I161-R163 PolarHBondContact O-N 3.42Å
162I45.1Very low41.3Very low128 Ų128142.7 Ų142.766%0.65679%0.788SS**  trans-67.681.2175.4-58.1177.5000109.1E160 N164E160-I162 HydrophobicContact CB-CG1 4.29Å; E160-I162 PolarHBondContact O-N 3.43Å; I162-N164 PolarHBondContact O-N 2.82Å
163R43.1Very low41.2Very low180 Ų180143.4 Ų143.468%0.67979%0.787SS**  trans-91.586.8179.7-161.5-171.8-149.9-175.712.1109.3I161 Q165I161-R163 HydrophobicContact CG2-CB 4.41Å; I161-R163 PolarHBondContact O-N 3.42Å; R163-Q165 HydrophobicContact CG-CG 4.24Å; R163-Q165 PolarHBondContact O-N 3.36Å
164N44.9Very low42.2Very low147 Ų147147.7 Ų147.779%0.78679%0.79SS**  trans-69.961.1173.2-71.8-1.7000112I162I162-N164 PolarHBondContact O-N 2.82Å
165Q43.1Very low42.3Very low129 Ų129153.1 Ų153.160%0.60379%0.792SS**  trans-74.4130.1161.9-87.3-173.7-35.600108.9R163 K167R163-Q165 HydrophobicContact CG-CG 4.24Å; R163-Q165 PolarHBondContact O-N 3.36Å; Q165-K167 PolarHBondContact O-N 3.33Å; Q165-K167 VanDerWaalsContact O-N 3.14Å
166P44.7Very low42Very low122 Ų122151.3 Ų151.379%0.79278%0.78SS**  trans-55.8121167.9-24.734.8000109.7R168P166-R168 PolarHBondContact O-N 3.21Å
167K33.5Very low42.2Very low201 Ų201153.8 Ų153.887%0.87478%0.779SS**  trans-55.4112.3-178.6-179.1176-179.3178.10109.7Q165 A169Q165-K167 PolarHBondContact O-N 3.33Å; Q165-K167 VanDerWaalsContact O-N 3.14Å; K167-A169 PolarHBondContact O-N 3.37Å
168R43Very low42.8Very low220 Ų220151.5 Ų151.583%0.8377%0.767SS**PPolyproline II helixtrans-65.5126.7161-74.8-169.4172.8-179.7-1.5107.2P166P166-R168 PolarHBondContact O-N 3.21Å
169A37.2Very low42.9Very low94 Ų94150.4 Ų150.478%0.77776%0.764SS**PPolyproline II helixtrans-73.9127.3158.400000106.8K167K167-A169 PolarHBondContact O-N 3.37Å
170D35Very low42.6Very low152 Ų152148.4 Ų148.481%0.81376%0.761SS**PPolyproline II helixtrans-70.6169.2175.9-71.1-62.8000111.5E172D170-E172 PolarHBondContact O-N 2.94Å; D170-E172 VanDerWaalsContact O-N 3.11Å
171S45.2Very low42.8Very low130 Ų130146.5 Ų146.591%0.90975%0.747SS**  trans-75.599.3-179.6-62.50000111.1
172E41.7Very low43.2Very low195 Ų195149.9 Ų149.991%0.91175%0.752SS**  trans-80.2136.5160.7-78-162.5109.100111.7D170 L174D170-E172 PolarHBondContact O-N 2.94Å; D170-E172 VanDerWaalsContact O-N 3.11Å; E172-L174 PolarHBondContact O-N 2.91Å
173E39.4Very low43.7Very low181 Ų181149.7 Ų149.785%0.84675%0.753SS**  trans-61.3118.5-167.8-169.2169.9100.300114.9K175E173-K175 PolarHBondContact O-N 2.81Å
174L50.8Low44.6Very low170 Ų170146 Ų14689%0.8974%0.741SS**  trans28.552.7146.2-66.6174.2000119.3E172 P176E172-L174 PolarHBondContact O-N 2.91Å; L174-P176 WeakPolarHBondContact O-CD 3.12Å
175K34.3Very low45.9Very low189 Ų189142.2 Ų142.282%0.82272%0.719SS**  trans-78.1119.7162.8-159165.8-170.4169.60110E173 L177E173-K175 PolarHBondContact O-N 2.81Å; K175-L177 PolarHBondContact O-N 2.96Å
176P37.8Very low47.4Very low98 Ų98139.6 Ų139.664%0.63672%0.715SS**  trans-7695.1-17029-35.2000112.5L174 N178L174-P176 WeakPolarHBondContact O-CD 3.12Å; P176-N178 HydrophobicContact CB-CB 4.49Å; P176-N178 PolarHBondContact O-N 2.94Å
177L44.6Very low49.1Very low154 Ų154141.9 Ų141.981%0.80671%0.713SS**THydrogen-bonded Turntrans-65.923.4168.7-72.3167000114K175K175-L177 PolarHBondContact O-N 2.96Å
178N49.9Very low51.6Low106 Ų106140.9 Ų140.957%0.56770%0.703SS**THydrogen-bonded Turntrans-82.8-10.4-172.6-70.3-43.4000114.1P176 R182P176-N178 HydrophobicContact CB-CB 4.49Å; P176-N178 PolarHBondContact O-N 2.94Å; N178-R182 VanDerWaalsContact O-CD 3.28Å; N178-R182 WeakPolarHBondContact O-CD 3.27Å; N178-R182 VanDerWaalsContact O-CG 3.24Å; N178-R182 WeakPolarHBondContact O-CG 3.24Å
179A47.5Very low53.6Low83 Ų83131 Ų13169%0.68667%0.668SS**THydrogen-bonded Turntrans-79.9-64.8179.900000111.7Y181 R182A179-Y181 VanDerWaalsContact C-N 3.32Å; A179-Y181 PolarHBondContact O-N 3.3Å; A179-R182 PolarHBondContact O-N 3.42Å
180E45.8Very low55.9Low143 Ų143134.5 Ų134.567%0.66867%0.668SS**Hα-helixtrans-68.3-28.3-170.8-155.3-157105.600113.7K184E180-K184 WeakPolarHBondContact O-CE 3.42Å; E180-K184 IonicContact OE1-NZ 3.33Å; E180-K184 PolarHBondContact OE1-NZ 3.42Å
181Y49.2Very low58.1Low133 Ų133131 Ų13152%0.52266%0.655SS.*Hα-helixtrans-75.7-23.3177.3-122.8-76.8000113.5A179 H185A179-Y181 VanDerWaalsContact C-N 3.32Å; A179-Y181 PolarHBondContact O-N 3.3Å; Y181-H185 PolarHBondContact O-CD2 2.96Å
182R50.8Low60Low193 Ų193126.9 Ų126.973%0.72863%0.626SS**Hα-helixtrans-76.9-31.8-176.5-82.9-175.1172-116.9-3.9113.4N178 A179 H185N178-R182 VanDerWaalsContact O-CD 3.28Å; N178-R182 WeakPolarHBondContact O-CD 3.27Å; N178-R182 VanDerWaalsContact O-CG 3.24Å; N178-R182 WeakPolarHBondContact O-CG 3.24Å; A179-R182 PolarHBondContact O-N 3.42Å; R182-H185 PolarHBondContact O-N 3.49Å
183D55.1Low61.9Low124 Ų124119.9 Ų119.966%0.66361%0.607SS**Hα-helixtrans-72.7-30.9-176.7-158.223.1000112.5H185 S186D183-H185 PolarHBondContact O-N 3.11Å; D183-S186 WeakPolarHBondContact O-CB 3.4Å; D183-S186 PolarHBondContact O-N 2.85Å
184K62.4Low64.1Low101 Ų101117 Ų11744%0.43959%0.588SS.*THydrogen-bonded Turntrans-59-20.5174.4-61.8173.1-168.4171.30113E180 C197E180-K184 WeakPolarHBondContact O-CE 3.42Å; E180-K184 IonicContact OE1-NZ 3.33Å; E180-K184 PolarHBondContact OE1-NZ 3.42Å; K184-C197 VanDerWaalsContact O-CB 3.31Å; K184-C197 WeakPolarHBondContact O-CB 3.34Å
185H73.1Confident65.9Low68 Ų68109.8 Ų109.832%0.31555%0.552SS.*THydrogen-bonded Turntrans-103.56.6175.8-56.2-53.9000114.7Y181 R182 D183 K187 C195 C197 E199Y181-H185 PolarHBondContact O-CD2 2.96Å; R182-H185 PolarHBondContact O-N 3.49Å; D183-H185 PolarHBondContact O-N 3.11Å; H185-K187 PolarHBondContact O-N 2.89Å; H185-C195 VanDerWaalsContact CA-SG 3.56Å; H185-C195 PolarHBondContact O-SG 3.29Å; H185-C197 PolarHBondContact ND1-SG 2.92Å; H185-E199 IonicContact CE1-OE2 2.66Å
186S74.3Confident68.5Low75 Ų75105.5 Ų105.552%0.52453%0.533SS..  trans-60.4-42.7-174.6-179.30000113.6D183 R188D183-S186 WeakPolarHBondContact O-CB 3.4Å; D183-S186 PolarHBondContact O-N 2.85Å; S186-R188 PolarHBondContact O-N 2.76Å
187K79.5Confident70.8Confident170 Ų170101.6 Ų101.674%0.73951%0.507SS*.  trans-71.994-177-65-176.2-178.1178.80112H185 K196H185-K187 PolarHBondContact O-N 2.89Å; K187-K196 WeakPolarHBondContact O-CB 3.09Å; K187-K196 PolarHBondContact O-N 3.45Å
188R86Confident72.6Confident180 Ų18098.9 Ų98.968%0.67950%0.502SS*.BIsolated β-bridgetrans-88.1173.1172.1-64.4179.3-171.5176.42.7112.2S186 R194 K196S186-R188 PolarHBondContact O-N 2.76Å; R188-R194 WeakPolarHBondContact CA-O 3.01Å; R188-K196 WeakPolarHBondContact O-CD 3.47Å; R188-K196 VanDerWaalsContact O-CE 3.28Å; R188-K196 WeakPolarHBondContact O-CE 3.45Å; R188-K196 PolarHBondContact O-NZ 3.44Å
189C85.7Confident74.3Confident12 Ų1297.4 Ų97.48%0.08149%0.491CS..  trans-107.7125.6176.3-170.80000112.1S191 C192 G193 R194 K196 C302C189-S191 VanDerWaalsContact C-N 3.26Å; C189-S191 PolarHBondContact O-N 3.47Å; C189-S191 PolarHBondContact SG-OG 3.01Å; C189-S191 VanDerWaalsContact SG-OG 3.33Å; C189-C192 PolarHBondContact O-N 2.7Å; C189-G193 WeakPolarHBondContact O-CA 3.19Å; C189-G193 PolarHBondContact O-N 3.26Å; C189-R194 PolarHBondContact N-O 3.29Å; C189-K196 VanDerWaalsContact CA-CE 3.48Å; C189-K196 HydrophobicContact CB-CD 4.31Å; C189-K196 HydrophobicContact CB-CG 4.02Å; C189-C302 HydrophobicContact CB-CB 3.94Å; C189-C302 WeakPolarHBondContact CB-SG 2.9Å
190E85.1Confident76.1Confident168 Ų16893.9 Ų93.979%0.78546%0.462SS*.THydrogen-bonded Turntrans-59.9-33.1-177.7-53.297.8-93.100113.4K196E190-K196 IonicContact OE1-NZ 2.85Å; E190-K196 PolarHBondContact OE1-NZ 3.25Å
191S82.3Confident78Confident77 Ų7789.8 Ų89.854%0.53845%0.446SS..THydrogen-bonded Turntrans-84.3-18.5-178.659.70000114.9C189 C304C189-S191 VanDerWaalsContact C-N 3.26Å; C189-S191 PolarHBondContact O-N 3.47Å; C189-S191 PolarHBondContact SG-OG 3.01Å; C189-S191 VanDerWaalsContact SG-OG 3.33Å; S191-C304 PolarHBondContact OG-SG 2.99Å
192C84Confident79.7Confident44 Ų4488.7 Ų88.730%0.29745%0.446SS..THydrogen-bonded Turntrans-132.4-8.4-170.396.50000114.8C189 R194 C302C189-C192 PolarHBondContact O-N 2.7Å; C192-R194 PolarHBondContact O-N 3.38Å; C192-R194 VanDerWaalsContact SG-CB 3.58Å; C192-R194 PolarHBondContact SG-N 2.06Å; C192-R194 VanDerWaalsContact SG-N 3.43Å; C192-C302 WeakPolarHBondContact CB-SG 3.45Å; C192-C302 WeakPolarHBondContact SG-CB 3.42Å; C192-C302 CovalentContact SG-SG 2.04Å; C192-C302 PolarHBondContact SG-SG 3.09Å
193G81.3Confident81.3Confident49 Ų4983.5 Ų83.551%0.50544%0.437SS..  trans70-27.7-17700000115.9C189C189-G193 WeakPolarHBondContact O-CA 3.19Å; C189-G193 PolarHBondContact O-N 3.26Å
194R86.8Confident82.8Confident120 Ų12081.8 Ų81.845%0.45342%0.421SS..SBendtrans-68.3158.4-177.2-52.8-177.5-173.4-157.10.2112.6R188 C189 C192 R299 G301 C302R188-R194 WeakPolarHBondContact CA-O 3.01Å; C189-R194 PolarHBondContact N-O 3.29Å; C192-R194 PolarHBondContact O-N 3.38Å; C192-R194 VanDerWaalsContact SG-CB 3.58Å; C192-R194 PolarHBondContact SG-N 2.06Å; C192-R194 VanDerWaalsContact SG-N 3.43Å; R194-R299 PolarHBondContact NH1-O 3.49Å; R194-G301 WeakPolarHBondContact CD-O 3.29Å; R194-C302 HydrophobicContact CB-CB 4.08Å
195C89.4Confident83.9Confident19 Ų1980.4 Ų80.413%0.12843%0.429CS..BIsolated β-bridgetrans-70.9145.2180-167.30000112.7H185 C197 C200 G301 C302H185-C195 VanDerWaalsContact CA-SG 3.56Å; H185-C195 PolarHBondContact O-SG 3.29Å; C195-C197 PolarHBondContact SG-N 2.81Å; C195-C197 VanDerWaalsContact SG-N 3.41Å; C195-C200 HydrophobicContact CB-CB 4.19Å; C195-C200 VanDerWaalsContact CB-SG 3.59Å; C195-C200 PolarHBondContact SG-SG 3.38Å; C195-G301 CarbonylContact O-C 3.56Å; C195-G301 VanDerWaalsContact O-CA 3.29Å; C195-G301 WeakPolarHBondContact O-CA 3.49Å; C195-C302 PolarHBondContact O-N 2.96Å
196K86.9Confident84.4Confident99 Ų9979.1 Ų79.143%0.4342%0.424SS..  trans-985.7175.3-63.2170.9172.7145.30113K187 R188 C189 E190K187-K196 WeakPolarHBondContact O-CB 3.09Å; K187-K196 PolarHBondContact O-N 3.45Å; R188-K196 WeakPolarHBondContact O-CD 3.47Å; R188-K196 VanDerWaalsContact O-CE 3.28Å; R188-K196 WeakPolarHBondContact O-CE 3.45Å; R188-K196 PolarHBondContact O-NZ 3.44Å; C189-K196 VanDerWaalsContact CA-CE 3.48Å; C189-K196 HydrophobicContact CB-CD 4.31Å; C189-K196 HydrophobicContact CB-CG 4.02Å; E190-K196 IonicContact OE1-NZ 2.85Å; E190-K196 PolarHBondContact OE1-NZ 3.25Å
197C86.8Confident84.9Confident15 Ų1579.7 Ų79.710%0.10143%0.426CS..  trans-60.7156.7-178.2930000112.2K184 H185 C195 C200 V201K184-C197 VanDerWaalsContact O-CB 3.31Å; K184-C197 WeakPolarHBondContact O-CB 3.34Å; H185-C197 PolarHBondContact ND1-SG 2.92Å; C195-C197 PolarHBondContact SG-N 2.81Å; C195-C197 VanDerWaalsContact SG-N 3.41Å; C197-C200 HydrophobicContact CB-CB 4.13Å; C197-C200 WeakPolarHBondContact CB-SG 3.07Å; C197-C200 CarbonylContact O-C 3.42Å; C197-C200 VanDerWaalsContact O-CB 3.28Å; C197-C200 WeakPolarHBondContact O-CB 3.44Å; C197-C200 PolarHBondContact O-N 3.44Å; C197-C200 WeakPolarHBondContact SG-CB 3.5Å; C197-C200 PolarHBondContact SG-N 2.84Å; C197-C200 CovalentContact SG-SG 2.06Å; C197-C200 PolarHBondContact SG-SG 2.93Å; C197-V201 WeakPolarHBondContact O-CA 3.28Å; C197-V201 PolarHBondContact O-N 3Å
198S82.8Confident85.4Confident98 Ų9874.8 Ų74.869%0.68541%0.413SS*.Hα-helixtrans-62.1-44.4-178.845.30000113.2C200 V201 Q202S198-C200 VanDerWaalsContact C-N 3.27Å; S198-C200 PolarHBondContact O-N 3.16Å; S198-V201 CarbonylContact O-C 3.55Å; S198-V201 WeakPolarHBondContact O-CA 3.36Å; S198-V201 PolarHBondContact O-N 3.39Å; S198-Q202 PolarHBondContact O-N 2.79Å
199E86.1Confident85.3Confident75 Ų7568.9 Ų68.935%0.3540%0.399SS..Hα-helixtrans-64.2-32.3176.9-59.4159.4-150.200112.6H185 R204H185-E199 IonicContact CE1-OE2 2.66Å; E199-R204 PolarHBondContact O-NH2 3.47Å
200C84.9Confident85.3Confident9 Ų974.7 Ų74.76%0.06142%0.42CS..Hα-helixtrans-73-37.6171.7-44.80000110.4C195 C197 S198 Q202 R299 G301C195-C200 HydrophobicContact CB-CB 4.19Å; C195-C200 VanDerWaalsContact CB-SG 3.59Å; C195-C200 PolarHBondContact SG-SG 3.38Å; C197-C200 HydrophobicContact CB-CB 4.13Å; C197-C200 WeakPolarHBondContact CB-SG 3.07Å; C197-C200 CarbonylContact O-C 3.42Å; C197-C200 VanDerWaalsContact O-CB 3.28Å; C197-C200 WeakPolarHBondContact O-CB 3.44Å; C197-C200 PolarHBondContact O-N 3.44Å; C197-C200 WeakPolarHBondContact SG-CB 3.5Å; C197-C200 PolarHBondContact SG-N 2.84Å; C197-C200 CovalentContact SG-SG 2.06Å; C197-C200 PolarHBondContact SG-SG 2.93Å; S198-C200 VanDerWaalsContact C-N 3.27Å; S198-C200 PolarHBondContact O-N 3.16Å; C200-Q202 VanDerWaalsContact C-N 3.28Å; C200-Q202 PolarHBondContact O-N 2.68Å; C200-R299 WeakPolarHBondContact O-CG 3.19Å; C200-G301 VanDerWaalsContact O-CA 3.31Å; C200-G301 WeakPolarHBondContact O-CA 3.3Å; C200-G301 PolarHBondContact O-N 3.05Å
201V85Confident85.2Confident57 Ų5771.3 Ų71.335%0.34541%0.405SS..Hα-helixtrans-61.1-28.6180-171.40000114C197 S198 R299 C302C197-V201 WeakPolarHBondContact O-CA 3.28Å; C197-V201 PolarHBondContact O-N 3Å; S198-V201 CarbonylContact O-C 3.55Å; S198-V201 WeakPolarHBondContact O-CA 3.36Å; S198-V201 PolarHBondContact O-N 3.39Å; V201-R299 PolarHBondContact O-NH1 3.17Å; V201-C302 WeakPolarHBondContact CG2-O 3.46Å
202Q85.4Confident85.2Confident109 Ų10971.5 Ų71.551%0.50941%0.405SS..SBendtrans-81.9139.8-160.9-164.5173.611.300112.4S198 C200 R204S198-Q202 PolarHBondContact O-N 2.79Å; C200-Q202 VanDerWaalsContact C-N 3.28Å; C200-Q202 PolarHBondContact O-N 2.68Å; Q202-R204 PolarHBondContact O-N 3.33Å
203P84.5Confident85.1Confident85 Ų8572.5 Ų72.555%0.55242%0.423SS*.  trans-58.6132.2169.7-21.332000111.7A205 D295P203-A205 PolarHBondContact O-N 2.71Å; P203-D295 VanDerWaalsContact CA-OD1 3.31Å; P203-D295 WeakPolarHBondContact CA-OD1 3.32Å
204R85.9Confident85.2Confident87 Ų8776.7 Ų76.733%0.32843%0.429SS..  trans-89.6104.6175-66.7-57.3-173.4-154.2-5.2110.6E199 Q202 Q291 Y294 D295 A298 R299E199-R204 PolarHBondContact O-NH2 3.47Å; Q202-R204 PolarHBondContact O-N 3.33Å; R204-Q291 PolarHBondContact O-NE2 2.92Å; R204-Y294 HydrophobicContact CB-CD1 4.41Å; R204-Y294 HydrophobicContact CB-CE1 4.06Å; R204-Y294 WeakPolarHBondContact O-CD1 3.42Å; R204-D295 PolarHBondContact N-OD1 3.24Å; R204-A298 HydrophobicContact CB-CB 4.49Å; R204-R299 HydrophobicContact CG-CB 4.49Å
205A85.5Confident85Confident73 Ų7380.4 Ų80.460%0.60344%0.444SS*.PPolyproline II helixtrans-56.5147.117100000111.3P203 Q291 Y294P203-A205 PolarHBondContact O-N 2.71Å; A205-Q291 VanDerWaalsContact CA-OE1 3.28Å; A205-Y294 VanDerWaalsContact O-CE1 3.3Å; A205-Y294 WeakPolarHBondContact O-CE1 3.21Å
206L84.8Confident84.6Confident40 Ų4082.4 Ų82.421%0.20946%0.457CS..PPolyproline II helixtrans-55.9141.8172.1-72.4168.6000110.3S208 P220 Q291 Y294L206-S208 PolarHBondContact O-N 2.95Å; L206-P220 HydrophobicContact CB-CG 4.01Å; L206-P220 HydrophobicContact CD1-CB 4.21Å; L206-P220 HydrophobicContact CD1-CG 4.09Å; L206-Q291 HydrophobicContact CD1-CB 3.99Å; L206-Q291 HydrophobicContact CG-CB 4.17Å; L206-Y294 HydrophobicContact CD2-CD1 4.07Å; L206-Y294 HydrophobicContact CD2-CD2 4.42Å; L206-Y294 HydrophobicContact CD2-CG 3.82Å
207P85.1Confident84.6Confident87 Ų8781.3 Ų81.357%0.56546%0.455SS*.PPolyproline II helixtrans-64.6137.9-179.927.5-34.4000110.9
208S88.3Confident84.5Confident67 Ų6783.4 Ų83.447%0.46947%0.47SS..  trans-109.7148.3165.1570000109.4L206 C218L206-S208 PolarHBondContact O-N 2.95Å; S208-C218 CarbonylContact C-O 3.57Å; S208-C218 VanDerWaalsContact CA-O 3.26Å; S208-C218 WeakPolarHBondContact CA-O 3.37Å; S208-C218 WeakPolarHBondContact CB-O 3.31Å
209C84.3Confident84.9Confident57 Ų5779.9 Ų79.939%0.38545%0.445SS..EExtended strand (participates in β ladder)trans-132.1138.4-174.957.30000111.6M211 C218C209-M211 HydrophobicContact CB-CE 3.93Å; C209-M211 VanDerWaalsContact SG-CE 3.53Å; C209-C218 PolarHBondContact N-O 3.07Å; C209-C218 WeakPolarHBondContact O-CB 3.39Å; C209-C218 PolarHBondContact O-N 2.92Å
210W85.8Confident85Confident134 Ų13478.2 Ų78.251%0.50844%0.441SS..EExtended strand (participates in β ladder)trans-85.8124.2179-74.9100000110.9L217W210-L217 HydrophobicContact CD2-CB 4.22Å; W210-L217 HydrophobicContact CD2-CD1 4.02Å; W210-L217 HydrophobicContact CE3-CB 3.99Å; W210-L217 HydrophobicContact CG-CD1 4.23Å; W210-L217 HydrophobicContact CH2-CB 3.96Å; W210-L217 HydrophobicContact CZ2-CB 4.17Å; W210-L217 HydrophobicContact CZ2-CD1 4.28Å; W210-L217 HydrophobicContact CZ2-CD2 4.29Å; W210-L217 HydrophobicContact CZ2-CG 4.48Å; W210-L217 HydrophobicContact CZ3-CB 3.87Å
211M83.4Confident85.3Confident97 Ų9781.2 Ų81.248%0.47846%0.456SS..EExtended strand (participates in β ladder)trans-117.6175-176.9-67.2-63.7154.700111.3C209 G213 Q214 R215 C216 C218C209-M211 HydrophobicContact CB-CE 3.93Å; C209-M211 VanDerWaalsContact SG-CE 3.53Å; M211-G213 PolarHBondContact O-N 3.1Å; M211-G213 VanDerWaalsContact O-N 3.1Å; M211-Q214 PolarHBondContact O-N 2.79Å; M211-R215 PolarHBondContact O-N 2.87Å; M211-R215 VanDerWaalsContact O-N 3.09Å; M211-C216 HydrophobicContact CB-CB 4.42Å; M211-C216 PolarHBondContact N-O 3.37Å; M211-C216 PolarHBondContact O-N 3.29Å; M211-C216 VanDerWaalsContact O-N 3.1Å; M211-C218 HydrophobicContact CG-CB 4.25Å
212C82.3Confident85.4Confident80 Ų8082.5 Ų82.554%0.54146%0.457SS..THydrogen-bonded Turntrans57.324.8178.1-56.90000114.8R215 C216C212-R215 HydrophobicContact CB-CB 4.35Å; C212-R215 PolarHBondContact O-NE 2.77Å; C212-R215 PolarHBondContact O-NH2 3.03Å; C212-C216 HydrophobicContact CB-CB 4.28Å
213G81.9Confident85.6Confident66 Ų6680 Ų8068%0.6846%0.455SS*.THydrogen-bonded Turntrans76.957.8-175.100000112.7M211 R215M211-G213 PolarHBondContact O-N 3.1Å; M211-G213 VanDerWaalsContact O-N 3.1Å; G213-R215 PolarHBondContact O-N 2.84Å
214Q82.8Confident86Confident136 Ų13677.1 Ų77.164%0.63644%0.436SS*.THydrogen-bonded Turntrans60.722.2-177.9-53.7-63.7-39.600114.8M211M211-Q214 PolarHBondContact O-N 2.79Å
215R82.3Confident86.2Confident199 Ų19974.1 Ų74.175%0.75143%0.426SS*.THydrogen-bonded Turntrans-104.1-20.6-179.3-71.8-176.6-66.6167.60.3114.5M211 C212 G213M211-R215 PolarHBondContact O-N 2.87Å; M211-R215 VanDerWaalsContact O-N 3.09Å; C212-R215 HydrophobicContact CB-CB 4.35Å; C212-R215 PolarHBondContact O-NE 2.77Å; C212-R215 PolarHBondContact O-NH2 3.03Å; G213-R215 PolarHBondContact O-N 2.84Å
216C82.7Confident86.3Confident61 Ų6177.8 Ų77.841%0.41243%0.425SS..EExtended strand (participates in β ladder)trans-128.7114-178.3-57.40000110.4M211 C212 C218M211-C216 HydrophobicContact CB-CB 4.42Å; M211-C216 PolarHBondContact N-O 3.37Å; M211-C216 PolarHBondContact O-N 3.29Å; M211-C216 VanDerWaalsContact O-N 3.1Å; C212-C216 HydrophobicContact CB-CB 4.28Å; C216-C218 PolarHBondContact O-N 2.95Å
217L86.1Confident86.4Confident75 Ų7578.6 Ų78.639%0.39344%0.443SS..EExtended strand (participates in β ladder)trans-80.6101.8171.8-17958.5000109.7W210 S219W210-L217 HydrophobicContact CD2-CB 4.22Å; W210-L217 HydrophobicContact CD2-CD1 4.02Å; W210-L217 HydrophobicContact CE3-CB 3.99Å; W210-L217 HydrophobicContact CG-CD1 4.23Å; W210-L217 HydrophobicContact CH2-CB 3.96Å; W210-L217 HydrophobicContact CZ2-CB 4.17Å; W210-L217 HydrophobicContact CZ2-CD1 4.28Å; W210-L217 HydrophobicContact CZ2-CD2 4.29Å; W210-L217 HydrophobicContact CZ2-CG 4.48Å; W210-L217 HydrophobicContact CZ3-CB 3.87Å; L217-S219 PolarHBondContact O-N 3.49Å
218C85.4Confident86.7Confident60 Ų6075 Ų7541%0.40542%0.42SS..EExtended strand (participates in β ladder)trans-78104.6170.5-171.40000108.9S208 C209 M211 C216S208-C218 CarbonylContact C-O 3.57Å; S208-C218 VanDerWaalsContact CA-O 3.26Å; S208-C218 WeakPolarHBondContact CA-O 3.37Å; S208-C218 WeakPolarHBondContact CB-O 3.31Å; C209-C218 PolarHBondContact N-O 3.07Å; C209-C218 WeakPolarHBondContact O-CB 3.39Å; C209-C218 PolarHBondContact O-N 2.92Å; M211-C218 HydrophobicContact CG-CB 4.25Å; C216-C218 PolarHBondContact O-N 2.95Å
219S89.6Confident86.8Confident23 Ų2373.3 Ų73.316%0.16141%0.407CS..  trans-113.6151.3165.572.90000110.1L217 D221 K222 A223L217-S219 PolarHBondContact O-N 3.49Å; S219-D221 VanDerWaalsContact C-N 3.27Å; S219-D221 PolarHBondContact O-N 3.5Å; S219-K222 PolarHBondContact O-N 3.37Å; S219-K222 WeakPolarHBondContact OG-CG 3.28Å; S219-K222 PolarHBondContact OG-N 3.49Å; S219-A223 PolarHBondContact O-N 2.77Å
220P89.9Confident87.1Confident40 Ų4070.6 Ų70.626%0.2639%0.389SS..Hα-helixtrans-57.3-38.7179.3-2736.4000113.2L206 K222 A223 V224 L287L206-P220 HydrophobicContact CB-CG 4.01Å; L206-P220 HydrophobicContact CD1-CB 4.21Å; L206-P220 HydrophobicContact CD1-CG 4.09Å; P220-K222 PolarHBondContact O-N 2.91Å; P220-A223 PolarHBondContact O-N 2.93Å; P220-V224 PolarHBondContact O-N 2.84Å; P220-L287 HydrophobicContact CB-CD2 3.43Å; P220-L287 VanDerWaalsContact CB-CD2 3.43Å
221D90.1Very high87.1Confident72 Ų7266.3 Ų66.339%0.38538%0.379SS..Hα-helixtrans-58-44.6172.5-77.1-88.5000113S219 V224 E225 K284S219-D221 VanDerWaalsContact C-N 3.27Å; S219-D221 PolarHBondContact O-N 3.5Å; D221-V224 PolarHBondContact O-N 3.2Å; D221-E225 WeakPolarHBondContact O-CG 3.15Å; D221-E225 PolarHBondContact O-N 3.44Å; D221-K284 IonicContact OD1-NZ 2.64Å; D221-K284 PolarHBondContact OD1-NZ 3.4Å
222K88.6Confident87.4Confident84 Ų8464.9 Ų64.937%0.36538%0.378SS..Hα-helixtrans-70.4-37.3178.9-70.6-69.5166-165.70111.9S219 P220 V224 E225 Y226S219-K222 PolarHBondContact O-N 3.37Å; S219-K222 WeakPolarHBondContact OG-CG 3.28Å; S219-K222 PolarHBondContact OG-N 3.49Å; P220-K222 PolarHBondContact O-N 2.91Å; K222-V224 VanDerWaalsContact C-N 3.3Å; K222-V224 PolarHBondContact O-N 3.4Å; K222-E225 IonicContact NZ-OE2 3.63Å; K222-E225 PolarHBondContact NZ-OE2 2.88Å; K222-E225 PolarHBondContact O-N 3.46Å; K222-Y226 HydrophobicContact CB-CD2 4.3Å; K222-Y226 HydrophobicContact CB-CE2 4.07Å; K222-Y226 HydrophobicContact CD-CE2 4.18Å; K222-Y226 WeakPolarHBondContact O-CD2 3.35Å; K222-Y226 PolarHBondContact O-N 3.45Å
223A89.4Confident87.6Confident57 Ų5761.2 Ų61.247%0.47135%0.353SS..Hα-helixtrans-57.4-42.8172.900000111.8S219 P220 G227S219-A223 PolarHBondContact O-N 2.77Å; P220-A223 PolarHBondContact O-N 2.93Å; A223-G227 PolarHBondContact O-N 3.04Å
224V91.6Very high88Confident24 Ų2460 Ų6015%0.14533%0.329CS..Hα-helixtrans-68.9-44.7173.6171.20000111.9P220 D221 K222 Y226 G227 T228 Y280 L287P220-V224 PolarHBondContact O-N 2.84Å; D221-V224 PolarHBondContact O-N 3.2Å; K222-V224 VanDerWaalsContact C-N 3.3Å; K222-V224 PolarHBondContact O-N 3.4Å; V224-Y226 VanDerWaalsContact C-N 3.32Å; V224-Y226 PolarHBondContact O-N 3.48Å; V224-G227 PolarHBondContact O-N 3.14Å; V224-T228 HydrophobicContact CG1-CG2 4.08Å; V224-T228 WeakPolarHBondContact O-CB 3.31Å; V224-T228 WeakPolarHBondContact O-CG2 3.2Å; V224-T228 PolarHBondContact O-N 3.06Å; V224-T228 PolarHBondContact O-OG1 3.24Å; V224-Y280 HydrophobicContact CG1-CD2 3.98Å; V224-Y280 HydrophobicContact CG1-CE2 4.43Å; V224-L287 HydrophobicContact CB-CD1 3.97Å; V224-L287 HydrophobicContact CG2-CD1 3.6Å; V224-L287 HydrophobicContact CG2-CD2 4.29Å; V224-L287 HydrophobicContact CG2-CG 3.87Å
225E89.8Confident88.1Confident25 Ų2554.9 Ų54.912%0.11731%0.313CS..Hα-helixtrans-59.8-37.4179.9-75.3-169.2159.800113.8D221 K222 V230 C231 K234 Y280D221-E225 WeakPolarHBondContact O-CG 3.15Å; D221-E225 PolarHBondContact O-N 3.44Å; K222-E225 IonicContact NZ-OE2 3.63Å; K222-E225 PolarHBondContact NZ-OE2 2.88Å; K222-E225 PolarHBondContact O-N 3.46Å; E225-V230 PolarHBondContact O-N 3.3Å; E225-V230 VanDerWaalsContact O-N 3.11Å; E225-C231 PolarHBondContact O-N 3.1Å; E225-K234 IonicContact OE1-NZ 2.95Å; E225-K234 PolarHBondContact OE1-NZ 3.39Å; E225-K234 IonicContact OE2-NZ 3.47Å; E225-K234 PolarHBondContact OE2-NZ 3.33Å; E225-K234 VanDerWaalsContact OE2-NZ 3.15Å; E225-Y280 HydrophobicContact CG-CE2 4.37Å
226Y88.3Confident88.3Confident149 Ų14948.4 Ų48.458%0.58429%0.292SS*.Hα-helixtrans-79.4-45.9175.2-65.4-60.4000112.1K222 V224 T228 C229 C231K222-Y226 HydrophobicContact CB-CD2 4.3Å; K222-Y226 HydrophobicContact CB-CE2 4.07Å; K222-Y226 HydrophobicContact CD-CE2 4.18Å; K222-Y226 WeakPolarHBondContact O-CD2 3.35Å; K222-Y226 PolarHBondContact O-N 3.45Å; V224-Y226 VanDerWaalsContact C-N 3.32Å; V224-Y226 PolarHBondContact O-N 3.48Å; Y226-T228 VanDerWaalsContact C-N 3.26Å; Y226-T228 PolarHBondContact O-N 3.14Å; Y226-C229 PolarHBondContact O-N 2.96Å; Y226-C231 HydrophobicContact CD1-CB 3.72Å; Y226-C231 HydrophobicContact CE1-CB 3.96Å
227G87.7Confident88.5Confident58 Ų5845.9 Ų45.960%0.59827%0.274SS*.Hα-helixtrans-67.8-21.1-178.200000114.9A223 V224A223-G227 PolarHBondContact O-N 3.04Å; V224-G227 PolarHBondContact O-N 3.14Å
228T91.1Very high88.3Confident12 Ų1250.1 Ų50.17%0.07429%0.286CS..THydrogen-bonded Turntrans-10416.7177.262.80000113V224 Y226 V230 C276 L277 C279 Y280V224-T228 HydrophobicContact CG1-CG2 4.08Å; V224-T228 WeakPolarHBondContact O-CB 3.31Å; V224-T228 WeakPolarHBondContact O-CG2 3.2Å; V224-T228 PolarHBondContact O-N 3.06Å; V224-T228 PolarHBondContact O-OG1 3.24Å; Y226-T228 VanDerWaalsContact C-N 3.26Å; Y226-T228 PolarHBondContact O-N 3.14Å; T228-V230 PolarHBondContact O-N 3.27Å; T228-C276 VanDerWaalsContact CB-O 3.3Å; T228-C276 WeakPolarHBondContact CB-O 3.48Å; T228-C276 CarbonylContact O-C 3.46Å; T228-L277 PolarHBondContact O-N 2.89Å; T228-C279 HydrophobicContact CG2-CB 4.01Å; T228-Y280 WeakPolarHBondContact OG1-CD2 3.38Å
229C89.3Confident88.2Confident30 Ų3054.7 Ų54.720%0.20330%0.301CS..THydrogen-bonded Turntrans58.813.9176.5-42.60000115.1Y226 C231 C232 C274 C276 L277Y226-C229 PolarHBondContact O-N 2.96Å; C229-C231 PolarHBondContact O-N 3.26Å; C229-C232 VanDerWaalsContact O-CB 3.27Å; C229-C232 WeakPolarHBondContact O-CB 3.5Å; C229-C232 PolarHBondContact O-N 3.09Å; C229-C274 HydrophobicContact CB-CB 4.34Å; C229-C276 HydrophobicContact CB-CB 4.14Å; C229-C276 WeakPolarHBondContact CB-SG 3.27Å; C229-C276 WeakPolarHBondContact SG-CB 3.31Å; C229-C276 CovalentContact SG-SG 2.05Å; C229-C276 PolarHBondContact SG-SG 3.28Å; C229-L277 HydrophobicContact CB-CD1 3.76Å
230V90.4Very high87.5Confident0 Ų057.3 Ų57.30%032%0.319CS..Hα-helixtrans-69.6-21.6178.9168.50000111.9E225 T228 C232 L233 K234 P252 F253 Y280E225-V230 PolarHBondContact O-N 3.3Å; E225-V230 VanDerWaalsContact O-N 3.11Å; T228-V230 PolarHBondContact O-N 3.27Å; V230-C232 PolarHBondContact O-N 2.93Å; V230-L233 PolarHBondContact O-N 3.33Å; V230-K234 WeakPolarHBondContact O-CG 3.43Å; V230-K234 PolarHBondContact O-N 2.97Å; V230-P252 HydrophobicContact CG1-CG 4.46Å; V230-F253 HydrophobicContact CG1-CE2 4.37Å; V230-F253 HydrophobicContact CG2-CE2 4.33Å; V230-F253 HydrophobicContact CG2-CZ 4.21Å; V230-Y280 HydrophobicContact CB-CD2 4.26Å; V230-Y280 HydrophobicContact CB-CE2 4.44Å; V230-Y280 HydrophobicContact CG1-CE2 4.27Å; V230-Y280 HydrophobicContact CG2-CD1 4.28Å; V230-Y280 HydrophobicContact CG2-CD2 3.58Å; V230-Y280 HydrophobicContact CG2-CE2 4.12Å; V230-Y280 HydrophobicContact CG2-CG 3.64Å
231C87.6Confident86.6Confident44 Ų4456.7 Ų56.730%0.29732%0.315SS..Hα-helixtrans-53.5-39.1163.952.40000112.9E225 Y226 C229 K234 G235E225-C231 PolarHBondContact O-N 3.1Å; Y226-C231 HydrophobicContact CD1-CB 3.72Å; Y226-C231 HydrophobicContact CE1-CB 3.96Å; C229-C231 PolarHBondContact O-N 3.26Å; C231-K234 PolarHBondContact O-N 3.34Å; C231-G235 PolarHBondContact O-N 3.39Å
232C87.9Confident85.2Confident68 Ų6860.5 Ų60.546%0.45934%0.336SS..Hα-helixtrans-69.1-41.7178.2-550000111.4C229 V230 K234 G235 I236C229-C232 VanDerWaalsContact O-CB 3.27Å; C229-C232 WeakPolarHBondContact O-CB 3.5Å; C229-C232 PolarHBondContact O-N 3.09Å; V230-C232 PolarHBondContact O-N 2.93Å; C232-K234 VanDerWaalsContact C-N 3.34Å; C232-K234 PolarHBondContact O-N 3.22Å; C232-G235 PolarHBondContact O-N 3.21Å; C232-I236 WeakPolarHBondContact O-CG1 3.29Å; C232-I236 PolarHBondContact O-N 3.28Å
233L88.4Confident83.8Confident2 Ų261.1 Ų61.11%0.0134%0.343CS..Hα-helixtrans-58.1-45.1171-85177.3000111.8V230 G235 I236 F237 F253 I267 C270 L277V230-L233 PolarHBondContact O-N 3.33Å; L233-G235 VanDerWaalsContact C-N 3.32Å; L233-G235 PolarHBondContact O-N 3.47Å; L233-I236 PolarHBondContact O-N 2.93Å; L233-F237 HydrophobicContact CD2-CE2 4.13Å; L233-F237 WeakPolarHBondContact O-CB 3.17Å; L233-F237 WeakPolarHBondContact O-CD2 3.31Å; L233-F237 PolarHBondContact O-N 2.93Å; L233-F253 HydrophobicContact CD1-CE1 4.25Å; L233-F253 HydrophobicContact CD1-CZ 3.88Å; L233-I267 HydrophobicContact CD1-CG1 4.45Å; L233-I267 HydrophobicContact CD2-CG1 4.15Å; L233-C270 HydrophobicContact CD2-CB 3.73Å; L233-C270 HydrophobicContact CG-CB 4.41Å; L233-L277 HydrophobicContact CD1-CD2 3.56Å; L233-L277 HydrophobicContact CD1-CG 3.92Å; L233-L277 HydrophobicContact CD2-CD2 4.25Å; L233-L277 HydrophobicContact CG-CD2 3.85Å; L233-L277 HydrophobicContact CG-CG 4.4Å
234K88.5Confident82.4Confident40 Ų4065.9 Ų65.917%0.17436%0.361CS..Hα-helixtrans-60.5-41.8176.6-67.9-151.7175.476.60111.7E225 V230 C231 C232 F237 Y238 A249E225-K234 IonicContact OE1-NZ 2.95Å; E225-K234 PolarHBondContact OE1-NZ 3.39Å; E225-K234 IonicContact OE2-NZ 3.47Å; E225-K234 PolarHBondContact OE2-NZ 3.33Å; E225-K234 VanDerWaalsContact OE2-NZ 3.15Å; V230-K234 WeakPolarHBondContact O-CG 3.43Å; V230-K234 PolarHBondContact O-N 2.97Å; C231-K234 PolarHBondContact O-N 3.34Å; C232-K234 VanDerWaalsContact C-N 3.34Å; C232-K234 PolarHBondContact O-N 3.22Å; K234-F237 PolarHBondContact O-N 3.38Å; K234-Y238 WeakPolarHBondContact O-CB 3.26Å; K234-Y238 PolarHBondContact O-N 3.08Å; K234-A249 WeakPolarHBondContact CD-O 3.45Å; K234-A249 VanDerWaalsContact CE-O 3.29Å; K234-A249 WeakPolarHBondContact CE-O 3.08Å; K234-A249 VanDerWaalsContact CG-O 3.26Å; K234-A249 WeakPolarHBondContact CG-O 3.34Å
235G86.6Confident80.7Confident29 Ų2972.1 Ų72.130%0.29939%0.388SS..Hα-helixtrans-64.9-43.6176.800000113.5C231 C232 L233 Y238 H239C231-G235 PolarHBondContact O-N 3.39Å; C232-G235 PolarHBondContact O-N 3.21Å; L233-G235 VanDerWaalsContact C-N 3.32Å; L233-G235 PolarHBondContact O-N 3.47Å; G235-Y238 WeakPolarHBondContact O-CB 3.38Å; G235-Y238 PolarHBondContact O-N 2.05Å; G235-H239 PolarHBondContact O-CD2 3Å; G235-H239 VanDerWaalsContact O-CD2 3.23Å; G235-H239 PolarHBondContact O-N 2.6Å
236I85.9Confident79.5Confident64 Ų6473.2 Ų73.233%0.32840%0.395SS..Hα-helixtrans-63-46174.8-67165.4000110.1C232 L233 Y238 H239 C240 T266 C270C232-I236 WeakPolarHBondContact O-CG1 3.29Å; C232-I236 PolarHBondContact O-N 3.28Å; L233-I236 PolarHBondContact O-N 2.93Å; I236-Y238 VanDerWaalsContact C-N 3.29Å; I236-Y238 PolarHBondContact O-N 2.91Å; I236-H239 PolarHBondContact O-N 3.38Å; I236-C240 WeakPolarHBondContact O-CB 3.45Å; I236-C240 PolarHBondContact O-N 2.66Å; I236-C240 PolarHBondContact O-SG 3.14Å; I236-C240 VanDerWaalsContact O-SG 3.34Å; I236-T266 HydrophobicContact CG2-CG2 3.82Å; I236-C270 VanDerWaalsContact CD1-SG 3.59Å
237F85.8Confident78.4Confident7 Ų769.2 Ų69.23%0.03139%0.386CS..Hα-helixtrans-65.9-28.8176.8-77.1-48.3000113.8L233 K234 S241 C248 A249 P252 R263 T266 I267L233-F237 HydrophobicContact CD2-CE2 4.13Å; L233-F237 WeakPolarHBondContact O-CB 3.17Å; L233-F237 WeakPolarHBondContact O-CD2 3.31Å; L233-F237 PolarHBondContact O-N 2.93Å; K234-F237 PolarHBondContact O-N 3.38Å; F237-S241 WeakPolarHBondContact O-CB 3.41Å; F237-S241 PolarHBondContact O-N 3.07Å; F237-S241 VanDerWaalsContact O-N 3.08Å; F237-C248 WeakPolarHBondContact CD1-SG 3.4Å; F237-A249 HydrophobicContact CB-CB 4.35Å; F237-P252 HydrophobicContact CD2-CB 3.81Å; F237-P252 HydrophobicContact CE2-CB 3.66Å; F237-R263 HydrophobicContact CE1-CB 4.07Å; F237-R263 HydrophobicContact CE1-CG 4.17Å; F237-R263 HydrophobicContact CZ-CB 4.06Å; F237-T266 HydrophobicContact CE1-CG2 4.16Å; F237-T266 HydrophobicContact CZ-CG2 4.23Å; F237-I267 HydrophobicContact CE2-CD1 4.36Å; F237-I267 HydrophobicContact CE2-CG1 4.09Å; F237-I267 HydrophobicContact CZ-CD1 4.18Å; F237-I267 HydrophobicContact CZ-CG1 3.94Å
238Y83.5Confident77.3Confident164 Ų16467 Ų6764%0.64336%0.361SS*.Hα-helixtrans-67.9-46.9171.5-179.9-107.2000111.6K234 G235 I236 S241K234-Y238 WeakPolarHBondContact O-CB 3.26Å; K234-Y238 PolarHBondContact O-N 3.08Å; G235-Y238 WeakPolarHBondContact O-CB 3.38Å; G235-Y238 PolarHBondContact O-N 2.05Å; I236-Y238 VanDerWaalsContact C-N 3.29Å; I236-Y238 PolarHBondContact O-N 2.91Å; Y238-S241 PolarHBondContact O-N 3.02Å
239H83.1Confident76.2Confident156 Ų15667.5 Ų67.572%0.72237%0.367SS*.Hα-helixtrans-75.2-21.2178.1-71.3-62.8000114.8G235 I236G235-H239 PolarHBondContact O-CD2 3Å; G235-H239 VanDerWaalsContact O-CD2 3.23Å; G235-H239 PolarHBondContact O-N 2.6Å; I236-H239 PolarHBondContact O-N 3.38Å
240C73.3Confident75.3Confident79 Ų7971.6 Ų71.653%0.53439%0.387SS..THydrogen-bonded Turntrans-92.7-5.1173-64.30000113.5I236I236-C240 WeakPolarHBondContact O-CB 3.45Å; I236-C240 PolarHBondContact O-N 2.66Å; I236-C240 PolarHBondContact O-SG 3.14Å; I236-C240 VanDerWaalsContact O-SG 3.34Å
241S71.8Confident74.4Confident26 Ų2677.7 Ų77.718%0.18241%0.413CS..  trans-76.7129.6164.2-1540000108.7F237 Y238 D243 D246F237-S241 WeakPolarHBondContact O-CB 3.41Å; F237-S241 PolarHBondContact O-N 3.07Å; F237-S241 VanDerWaalsContact O-N 3.08Å; Y238-S241 PolarHBondContact O-N 3.02Å; S241-D243 PolarHBondContact OG-O 3.47Å; S241-D246 WeakPolarHBondContact OG-CB 3.2Å
242N61.2Low73.6Confident153 Ų15375.9 Ų75.982%0.81840%0.401SS*.SBendtrans-94.6-1.5178.4-159.7104.4000111.9
243D59Low72.8Confident96 Ų9675.7 Ų75.751%0.51339%0.392SS..SBendtrans-157.7146.3-167-156.642.3000108.1S241S241-D243 PolarHBondContact OG-O 3.47Å
244D59.2Low72Confident158 Ų15877 Ų7785%0.84540%0.402SS*.THydrogen-bonded Turntrans-82.9-10.2-178.850.4-57000114.2D246D244-D246 VanDerWaalsContact C-N 3.31Å; D244-D246 PolarHBondContact O-N 3.28Å
245E57.1Low70.8Confident154 Ų15479.1 Ų79.172%0.7242%0.421SS*.THydrogen-bonded Turntrans-65.1-30.5168.2-66.7-69.9153.600112.8T247E245-T247 PolarHBondContact O-N 2.74Å; E245-T247 PolarHBondContact O-OG1 2.73Å
246D63Low69.8Low49 Ų4982.8 Ų82.826%0.26244%0.442SS..  trans-71.995.4-178.2-122.7-15.3000109.3S241 D244 C248S241-D246 WeakPolarHBondContact OG-CB 3.2Å; D244-D246 VanDerWaalsContact C-N 3.31Å; D244-D246 PolarHBondContact O-N 3.28Å; D246-C248 HydrophobicContact CB-CB 4.45Å; D246-C248 PolarHBondContact O-N 2.76Å
247T66.6Low68.9Low65 Ų6581.9 Ų81.940%0.39944%0.436SS..THydrogen-bonded Turntrans-70.846.5-179.6-31.60000112.6E245 D250 Q257E245-T247 PolarHBondContact O-N 2.74Å; E245-T247 PolarHBondContact O-OG1 2.73Å; T247-D250 HydrophobicContact CG2-CB 4.33Å; T247-Q257 PolarHBondContact O-NE2 3.15Å
248C63.9Low67.9Low11 Ų1185 Ų857%0.07446%0.459CS..THydrogen-bonded Turntrans-83.2-45.4-163.7176.20000111.6F237 D246 K251 R263F237-C248 WeakPolarHBondContact CD1-SG 3.4Å; D246-C248 HydrophobicContact CB-CB 4.45Å; D246-C248 PolarHBondContact O-N 2.76Å; C248-K251 CarbonylContact O-C 3.59Å; C248-R263 PolarHBondContact O-NH2 3.46Å; C248-R263 PolarHBondContact SG-NH1 3.33Å
249A67.5Low67.2Low23 Ų2384.2 Ų84.219%0.1946%0.455CS..THydrogen-bonded Turntrans-72.3-28.5-176.200000113.9K234 F237 P252K234-A249 WeakPolarHBondContact CD-O 3.45Å; K234-A249 VanDerWaalsContact CE-O 3.29Å; K234-A249 WeakPolarHBondContact CE-O 3.08Å; K234-A249 VanDerWaalsContact CG-O 3.26Å; K234-A249 WeakPolarHBondContact CG-O 3.34Å; F237-A249 HydrophobicContact CB-CB 4.35Å; A249-P252 WeakPolarHBondContact O-CD 3.44Å
250D71.3Confident66.9Low116 Ų11679 Ų7962%0.6244%0.435SS*.THydrogen-bonded Turntrans-69.7-37.4179.2-73.9-43.4000113T247 P252T247-D250 HydrophobicContact CG2-CB 4.33Å; D250-P252 VanDerWaalsContact C-CD 3.42Å; D250-P252 WeakPolarHBondContact O-CD 3.46Å
251K71.2Confident67.2Low128 Ų12879.7 Ų79.756%0.55744%0.44SS*.  trans-126.863.4-173.6-67.4164.4-173.5151.30110.1C248 F253 S254 R263C248-K251 CarbonylContact O-C 3.59Å; K251-F253 PolarHBondContact O-N 3.33Å; K251-F253 VanDerWaalsContact O-N 3.11Å; K251-S254 WeakPolarHBondContact O-CB 3.1Å; K251-S254 PolarHBondContact O-N 3.18Å; K251-R263 PolarHBondContact O-NH2 3Å; K251-R263 VanDerWaalsContact O-NH2 3.07Å
252P70.2Confident67.7Low5 Ų582.2 Ų82.23%0.03245%0.454CS..THydrogen-bonded Turntrans-49.7-45.1-174.514.8-28.4000112.1V230 F237 A249 D250 S254 R263V230-P252 HydrophobicContact CG1-CG 4.46Å; F237-P252 HydrophobicContact CD2-CB 3.81Å; F237-P252 HydrophobicContact CE2-CB 3.66Å; A249-P252 WeakPolarHBondContact O-CD 3.44Å; D250-P252 VanDerWaalsContact C-CD 3.42Å; D250-P252 WeakPolarHBondContact O-CD 3.46Å; P252-S254 VanDerWaalsContact C-N 3.35Å; P252-S254 PolarHBondContact O-N 3.11Å; P252-R263 PolarHBondContact O-NH2 3.34Å
253F70.9Confident68.8Low64 Ų6475.5 Ų75.528%0.28142%0.418SS..THydrogen-bonded Turntrans-82.611.9-178.4-51-79.7000115.9V230 L233 K251 I267 Y280V230-F253 HydrophobicContact CG1-CE2 4.37Å; V230-F253 HydrophobicContact CG2-CE2 4.33Å; V230-F253 HydrophobicContact CG2-CZ 4.21Å; L233-F253 HydrophobicContact CD1-CE1 4.25Å; L233-F253 HydrophobicContact CD1-CZ 3.88Å; K251-F253 PolarHBondContact O-N 3.33Å; K251-F253 VanDerWaalsContact O-N 3.11Å; F253-I267 HydrophobicContact CD1-CD1 4.24Å; F253-I267 HydrophobicContact CD1-CG2 4.48Å; F253-I267 HydrophobicContact CE1-CG2 4.15Å; F253-Y280 HydrophobicContact CD2-CD1 4.15Å; F253-Y280 AromaticContact CD2-CE1 3.62Å; F253-Y280 HydrophobicContact CD2-CE1 3.62Å; F253-Y280 AromaticContact CE2-CD1 3.41Å; F253-Y280 HydrophobicContact CE2-CD1 3.41Å; F253-Y280 VanDerWaalsContact CE2-CD1 3.41Å; F253-Y280 AromaticContact CE2-CE1 3.21Å; F253-Y280 HydrophobicContact CE2-CE1 3.21Å; F253-Y280 HydrophobicContact CE2-CG 4.32Å; F253-Y280 AromaticContact CE2-CZ 3.98Å; F253-Y280 AromaticContact CZ-CD1 3.72Å; F253-Y280 HydrophobicContact CZ-CD1 3.72Å; F253-Y280 HydrophobicContact CZ-CE1 4.02Å; F253-Y280 HydrophobicContact CZ-CG 4.46Å
254S73.7Confident70.1Confident31 Ų3176.2 Ų76.222%0.21741%0.413CS..  trans-78137.2175.3-1690000112.1K251 P252 S256K251-S254 WeakPolarHBondContact O-CB 3.1Å; K251-S254 PolarHBondContact O-N 3.18Å; P252-S254 VanDerWaalsContact C-N 3.35Å; P252-S254 PolarHBondContact O-N 3.11Å; S254-S256 PolarHBondContact OG-N 2.98Å; S254-S256 PolarHBondContact OG-OG 3.45Å
255C62.9Low71.4Confident84 Ų8473 Ų7357%0.56840%0.4SS*.SBendtrans-960174.1-159.40000113.4W264C255-W264 HydrophobicContact CB-CZ2 4.4Å
256S64.6Low72.9Confident106 Ų10667.1 Ų67.174%0.74137%0.374SS*.SBendtrans-91.610.5-171.3740000115.3S254S254-S256 PolarHBondContact OG-N 2.98Å; S254-S256 PolarHBondContact OG-OG 3.45Å
257Q66.7Low74.1Confident44 Ų4465.2 Ų65.221%0.20636%0.364CS..SBendtrans-114.8162.8-174.7-79.3171.1-19.900111.1T247T247-Q257 PolarHBondContact O-NE2 3.15Å
258S64.6Low75.1Confident74 Ų7467.4 Ų67.452%0.51737%0.371SS..THydrogen-bonded Turntrans-56162.9170.359.80000111.2C260S258-C260 PolarHBondContact O-N 2.7Å
259R70.6Confident76.3Confident146 Ų14673 Ų7355%0.55139%0.394SS*.THydrogen-bonded Turntrans58.523175.5-45.9173.381-176.83.7114.2C261 V262 R263R259-C261 VanDerWaalsContact C-N 3.29Å; R259-C261 PolarHBondContact O-N 2.82Å; R259-C261 VanDerWaalsContact O-N 3.11Å; R259-V262 WeakPolarHBondContact O-CB 3.05Å; R259-V262 PolarHBondContact O-N 3.15Å; R259-R263 PolarHBondContact O-N 3.14Å
260C75.3Confident77.2Confident46 Ų4672.5 Ų72.531%0.31139%0.389SS..Hα-helixtrans-48.3-42.6-174.660.50000114.4S258 V262 R263 W264S258-C260 PolarHBondContact O-N 2.7Å; C260-V262 VanDerWaalsContact C-N 3.35Å; C260-V262 PolarHBondContact O-N 2.69Å; C260-R263 WeakPolarHBondContact O-CB 3.39Å; C260-R263 PolarHBondContact O-N 3.2Å; C260-W264 PolarHBondContact O-N 2.98Å
261C79.9Confident78Confident95 Ų9567.6 Ų67.664%0.64236%0.364SS*.Hα-helixtrans-58.2-43.4177.6-570000112.7R259 R263 W264 T265R259-C261 VanDerWaalsContact C-N 3.29Å; R259-C261 PolarHBondContact O-N 2.82Å; R259-C261 VanDerWaalsContact O-N 3.11Å; C261-R263 VanDerWaalsContact C-N 3.34Å; C261-W264 PolarHBondContact O-N 3.29Å; C261-T265 PolarHBondContact O-N 3.23Å; C261-T265 PolarHBondContact O-OG1 2.99Å
262V82.6Confident78.8Confident79 Ų7968 Ų6848%0.47937%0.371SS..Hα-helixtrans-65.5-39.3178.7-176.80000110.5R259 C260 W264 T265 T266R259-V262 WeakPolarHBondContact O-CB 3.05Å; R259-V262 PolarHBondContact O-N 3.15Å; C260-V262 VanDerWaalsContact C-N 3.35Å; C260-V262 PolarHBondContact O-N 2.69Å; V262-W264 PolarHBondContact O-N 2.91Å; V262-T265 PolarHBondContact O-N 3.38Å; V262-T265 PolarHBondContact O-OG1 3.2Å; V262-T266 WeakPolarHBondContact O-CB 3.1Å; V262-T266 PolarHBondContact O-N 3.42Å; V262-T266 PolarHBondContact O-OG1 3.15Å
263R83.8Confident79.5Confident12 Ų1273.3 Ų73.35%0.04540%0.399CS..Hα-helixtrans-61.8-46.1175.7-53.2171.568.193.210.4111.5F237 C248 K251 P252 R259 C260 C261 T266 I267F237-R263 HydrophobicContact CE1-CB 4.07Å; F237-R263 HydrophobicContact CE1-CG 4.17Å; F237-R263 HydrophobicContact CZ-CB 4.06Å; C248-R263 PolarHBondContact O-NH2 3.46Å; C248-R263 PolarHBondContact SG-NH1 3.33Å; K251-R263 PolarHBondContact O-NH2 3Å; K251-R263 VanDerWaalsContact O-NH2 3.07Å; P252-R263 PolarHBondContact O-NH2 3.34Å; R259-R263 PolarHBondContact O-N 3.14Å; C260-R263 WeakPolarHBondContact O-CB 3.39Å; C260-R263 PolarHBondContact O-N 3.2Å; C261-R263 VanDerWaalsContact C-N 3.34Å; R263-T266 PolarHBondContact O-N 3.17Å; R263-I267 WeakPolarHBondContact O-CB 3.44Å; R263-I267 WeakPolarHBondContact O-CD1 3.3Å; R263-I267 VanDerWaalsContact O-CG1 3.24Å; R263-I267 WeakPolarHBondContact O-CG1 3.36Å; R263-I267 PolarHBondContact O-N 2.92Å
264W86.6Confident80.2Confident110 Ų11072.2 Ų72.242%0.41740%0.399SS..Hα-helixtrans-67-38.8179.5-74.2115.5000112.2C255 C260 C261 V262 I267 M268C255-W264 HydrophobicContact CB-CZ2 4.4Å; C260-W264 PolarHBondContact O-N 2.98Å; C261-W264 PolarHBondContact O-N 3.29Å; V262-W264 PolarHBondContact O-N 2.91Å; W264-I267 HydrophobicContact CE3-CD1 4.35Å; W264-I267 PolarHBondContact O-N 3.13Å; W264-M268 WeakPolarHBondContact O-CB 3.45Å; W264-M268 VanDerWaalsContact O-CG 3.28Å; W264-M268 WeakPolarHBondContact O-CG 3.05Å; W264-M268 PolarHBondContact O-N 3.44Å
265T86.8Confident80.8Confident92 Ų9275.1 Ų75.156%0.56442%0.417SS*.Hα-helixtrans-66.9-40.6173.455.80000112.1C261 V262 I267 M268 F269C261-T265 PolarHBondContact O-N 3.23Å; C261-T265 PolarHBondContact O-OG1 2.99Å; V262-T265 PolarHBondContact O-N 3.38Å; V262-T265 PolarHBondContact O-OG1 3.2Å; T265-I267 PolarHBondContact O-N 2.88Å; T265-M268 PolarHBondContact O-N 2.96Å; T265-F269 VanDerWaalsContact O-CB 3.32Å; T265-F269 WeakPolarHBondContact O-CB 3.4Å; T265-F269 PolarHBondContact O-N 3.07Å
266T87.6Confident82.1Confident30 Ų3072.6 Ų72.618%0.18440%0.4CS..Hα-helixtrans-59.7-45172-60.20000111.9I236 F237 V262 R263 F269 C270I236-T266 HydrophobicContact CG2-CG2 3.82Å; F237-T266 HydrophobicContact CE1-CG2 4.16Å; F237-T266 HydrophobicContact CZ-CG2 4.23Å; V262-T266 WeakPolarHBondContact O-CB 3.1Å; V262-T266 PolarHBondContact O-N 3.42Å; V262-T266 PolarHBondContact O-OG1 3.15Å; R263-T266 PolarHBondContact O-N 3.17Å; T266-F269 PolarHBondContact O-N 3.3Å; T266-C270 WeakPolarHBondContact O-CB 3.22Å; T266-C270 PolarHBondContact O-N 3.36Å; T266-C270 PolarHBondContact O-SG 2.92Å
267I88.5Confident83.1Confident9 Ų967.9 Ų67.95%0.04637%0.366CS..Hα-helixtrans-63.5-42.9177.8-70.1161.3000111.3L233 F237 F253 R263 W264 T265 S271L233-I267 HydrophobicContact CD1-CG1 4.45Å; L233-I267 HydrophobicContact CD2-CG1 4.15Å; F237-I267 HydrophobicContact CE2-CD1 4.36Å; F237-I267 HydrophobicContact CE2-CG1 4.09Å; F237-I267 HydrophobicContact CZ-CD1 4.18Å; F237-I267 HydrophobicContact CZ-CG1 3.94Å; F253-I267 HydrophobicContact CD1-CD1 4.24Å; F253-I267 HydrophobicContact CD1-CG2 4.48Å; F253-I267 HydrophobicContact CE1-CG2 4.15Å; R263-I267 WeakPolarHBondContact O-CB 3.44Å; R263-I267 WeakPolarHBondContact O-CD1 3.3Å; R263-I267 VanDerWaalsContact O-CG1 3.24Å; R263-I267 WeakPolarHBondContact O-CG1 3.36Å; R263-I267 PolarHBondContact O-N 2.92Å; W264-I267 HydrophobicContact CE3-CD1 4.35Å; W264-I267 PolarHBondContact O-N 3.13Å; T265-I267 PolarHBondContact O-N 2.88Å; I267-S271 WeakPolarHBondContact O-CB 3.47Å; I267-S271 PolarHBondContact O-N 3.35Å; I267-S271 PolarHBondContact O-OG 3.23Å
268M87.9Confident84.1Confident111 Ų11174.3 Ų74.355%0.54739%0.389SS..Hα-helixtrans-64.8-46.2177-72.8-61.2-64.700111.7W264 T265 S271 L272W264-M268 WeakPolarHBondContact O-CB 3.45Å; W264-M268 VanDerWaalsContact O-CG 3.28Å; W264-M268 WeakPolarHBondContact O-CG 3.05Å; W264-M268 PolarHBondContact O-N 3.44Å; T265-M268 PolarHBondContact O-N 2.96Å; M268-S271 WeakPolarHBondContact O-CB 3.49Å; M268-S271 PolarHBondContact O-N 3.5Å; M268-S271 VanDerWaalsContact O-N 3.15Å; M268-L272 PolarHBondContact O-N 2.91Å; M268-L272 VanDerWaalsContact O-N 3.15Å
269F89.9Confident85.3Confident129 Ų12974.2 Ų74.257%0.56639%0.387SS*.Hα-helixtrans-61.6-47.4177.1-178.3-108.2000112T265 T266 S271 L272 L273T265-F269 VanDerWaalsContact O-CB 3.32Å; T265-F269 WeakPolarHBondContact O-CB 3.4Å; T265-F269 PolarHBondContact O-N 3.07Å; T266-F269 PolarHBondContact O-N 3.3Å; F269-S271 PolarHBondContact O-N 3.11Å; F269-L272 PolarHBondContact O-N 2.88Å; F269-L272 VanDerWaalsContact O-N 3.17Å; F269-L273 HydrophobicContact CD1-CD1 4.05Å; F269-L273 HydrophobicContact CE1-CD1 3.52Å; F269-L273 HydrophobicContact CE1-CG 4.43Å; F269-L273 HydrophobicContact CZ-CD1 3.82Å; F269-L273 HydrophobicContact CZ-CG 4.43Å; F269-L273 PolarHBondContact O-N 3.45Å
270C86.4Confident86.2Confident12 Ų1268.8 Ų68.88%0.08137%0.367CS..Hα-helixtrans-62.6-31.4174.9-65.10000112.2L233 I236 T266 L272 L273 C274 L277L233-C270 HydrophobicContact CD2-CB 3.73Å; L233-C270 HydrophobicContact CG-CB 4.41Å; I236-C270 VanDerWaalsContact CD1-SG 3.59Å; T266-C270 WeakPolarHBondContact O-CB 3.22Å; T266-C270 PolarHBondContact O-N 3.36Å; T266-C270 PolarHBondContact O-SG 2.92Å; C270-L272 VanDerWaalsContact C-N 3.33Å; C270-L273 PolarHBondContact O-N 3.34Å; C270-C274 WeakPolarHBondContact O-CA 3.5Å; C270-C274 VanDerWaalsContact O-CB 3.3Å; C270-C274 WeakPolarHBondContact O-CB 3.4Å; C270-C274 PolarHBondContact O-N 2.84Å; C270-L277 HydrophobicContact CB-CD2 3.67Å
271S88Confident86.8Confident12 Ų1272.1 Ų72.18%0.08438%0.381CS..Hα-helixtrans-70.2-29.4177.4-61.30000113I267 M268 F269 C274I267-S271 WeakPolarHBondContact O-CB 3.47Å; I267-S271 PolarHBondContact O-N 3.35Å; I267-S271 PolarHBondContact O-OG 3.23Å; M268-S271 WeakPolarHBondContact O-CB 3.49Å; M268-S271 PolarHBondContact O-N 3.5Å; M268-S271 VanDerWaalsContact O-N 3.15Å; F269-S271 PolarHBondContact O-N 3.11Å; S271-C274 CarbonylContact O-C 3.57Å
272L86.6Confident87.3Confident138 Ų13871.1 Ų71.172%0.72337%0.373SS*.Hα-helixtrans-72.9-39.8173.3-65.5171.2000111.7M268 F269 C270M268-L272 PolarHBondContact O-N 2.91Å; M268-L272 VanDerWaalsContact O-N 3.15Å; F269-L272 PolarHBondContact O-N 2.88Å; F269-L272 VanDerWaalsContact O-N 3.17Å; C270-L272 VanDerWaalsContact C-N 3.33Å
273L85.9Confident87.7Confident115 Ų11568.1 Ų68.160%0.60236%0.358SS*.Hα-helixtrans-74.4-34.4176.9-64.1179.3000113.1F269 C270F269-L273 HydrophobicContact CD1-CD1 4.05Å; F269-L273 HydrophobicContact CE1-CD1 3.52Å; F269-L273 HydrophobicContact CE1-CG 4.43Å; F269-L273 HydrophobicContact CZ-CD1 3.82Å; F269-L273 HydrophobicContact CZ-CG 4.43Å; F269-L273 PolarHBondContact O-N 3.45Å; C270-L273 PolarHBondContact O-N 3.34Å
274C84.9Confident88Confident42 Ų4270.3 Ų70.328%0.28437%0.368SS..  trans-131.580.6-171.6-70.30000109.9C229 C270 S271 C276 L277C229-C274 HydrophobicContact CB-CB 4.34Å; C270-C274 WeakPolarHBondContact O-CA 3.5Å; C270-C274 VanDerWaalsContact O-CB 3.3Å; C270-C274 WeakPolarHBondContact O-CB 3.4Å; C270-C274 PolarHBondContact O-N 2.84Å; S271-C274 CarbonylContact O-C 3.57Å; C274-C276 PolarHBondContact O-N 3.37Å; C274-L277 HydrophobicContact CB-CD1 3.8Å; C274-L277 WeakPolarHBondContact O-CB 3.44Å; C274-L277 PolarHBondContact O-N 3.45Å
275P86.3Confident88.2Confident91 Ų9166.7 Ų66.759%0.59137%0.365SS*.G310 helixtrans-60.5-17.7-178.123.2-34.1000113.7L277 W278P275-L277 PolarHBondContact O-N 2.88Å; P275-L277 VanDerWaalsContact O-N 3.14Å; P275-W278 PolarHBondContact O-N 3.27Å; P275-W278 VanDerWaalsContact O-N 3.07Å
276C89.6Confident88.4Confident32 Ų3266 Ų6622%0.21636%0.363CS..G310 helixtrans-50.8-27.7166.441.30000114T228 C229 C274 W278 C279T228-C276 VanDerWaalsContact CB-O 3.3Å; T228-C276 WeakPolarHBondContact CB-O 3.48Å; T228-C276 CarbonylContact O-C 3.46Å; C229-C276 HydrophobicContact CB-CB 4.14Å; C229-C276 WeakPolarHBondContact CB-SG 3.27Å; C229-C276 WeakPolarHBondContact SG-CB 3.31Å; C229-C276 CovalentContact SG-SG 2.05Å; C229-C276 PolarHBondContact SG-SG 3.28Å; C274-C276 PolarHBondContact O-N 3.37Å; C276-W278 VanDerWaalsContact C-N 3.3Å; C276-W278 PolarHBondContact O-N 3.4Å; C276-C279 WeakPolarHBondContact O-CB 3.44Å; C276-C279 PolarHBondContact O-N 3Å; C276-C279 VanDerWaalsContact O-N 3.08Å
277L87.3Confident88.6Confident6 Ų665.8 Ų65.83%0.03136%0.36CS..G310 helixtrans-59.1-38.5174.9-94.260.7000112.4T228 C229 L233 C270 C274 P275 C279 Y280T228-L277 PolarHBondContact O-N 2.89Å; C229-L277 HydrophobicContact CB-CD1 3.76Å; L233-L277 HydrophobicContact CD1-CD2 3.56Å; L233-L277 HydrophobicContact CD1-CG 3.92Å; L233-L277 HydrophobicContact CD2-CD2 4.25Å; L233-L277 HydrophobicContact CG-CD2 3.85Å; L233-L277 HydrophobicContact CG-CG 4.4Å; C270-L277 HydrophobicContact CB-CD2 3.67Å; C274-L277 HydrophobicContact CB-CD1 3.8Å; C274-L277 WeakPolarHBondContact O-CB 3.44Å; C274-L277 PolarHBondContact O-N 3.45Å; P275-L277 PolarHBondContact O-N 2.88Å; P275-L277 VanDerWaalsContact O-N 3.14Å; L277-C279 PolarHBondContact O-N 3.01Å; L277-Y280 WeakPolarHBondContact O-CB 3.33Å; L277-Y280 PolarHBondContact O-N 2.96Å
278W86.3Confident88.8Confident179 Ų17968.3 Ų68.368%0.67838%0.383SS*.G310 helixtrans-66.9-23.5178.8-73.79.9000111.9P275 C276 Y280 P282P275-W278 PolarHBondContact O-N 3.27Å; P275-W278 VanDerWaalsContact O-N 3.07Å; C276-W278 VanDerWaalsContact C-N 3.3Å; C276-W278 PolarHBondContact O-N 3.4Å; W278-Y280 VanDerWaalsContact C-N 3.29Å; W278-Y280 PolarHBondContact O-N 2.98Å; W278-P282 WeakPolarHBondContact O-CD 3.47Å
279C90.1Very high88.9Confident72 Ų7269.3 Ų69.349%0.48639%0.388SS..G310 helixtrans-76-11.4172.9-570000113.6T228 C276 L277 P282 G283T228-C279 HydrophobicContact CG2-CB 4.01Å; C276-C279 WeakPolarHBondContact O-CB 3.44Å; C276-C279 PolarHBondContact O-N 3Å; C276-C279 VanDerWaalsContact O-N 3.08Å; L277-C279 PolarHBondContact O-N 3.01Å; C279-P282 WeakPolarHBondContact O-CD 3.44Å; C279-P282 WeakPolarHBondContact O-CG 3.3Å; C279-G283 WeakPolarHBondContact O-CA 3.29Å; C279-G283 PolarHBondContact O-N 3.07Å
280Y90.3Very high88.9Confident33 Ų3366.6 Ų66.613%0.12938%0.384CS..Hα-helixtrans-64.3-43.9177.5177.5-108.5000112.9V224 E225 T228 V230 F253 L277 W278 G283 K284V224-Y280 HydrophobicContact CG1-CD2 3.98Å; V224-Y280 HydrophobicContact CG1-CE2 4.43Å; E225-Y280 HydrophobicContact CG-CE2 4.37Å; T228-Y280 WeakPolarHBondContact OG1-CD2 3.38Å; V230-Y280 HydrophobicContact CB-CD2 4.26Å; V230-Y280 HydrophobicContact CB-CE2 4.44Å; V230-Y280 HydrophobicContact CG1-CE2 4.27Å; V230-Y280 HydrophobicContact CG2-CD1 4.28Å; V230-Y280 HydrophobicContact CG2-CD2 3.58Å; V230-Y280 HydrophobicContact CG2-CE2 4.12Å; V230-Y280 HydrophobicContact CG2-CG 3.64Å; F253-Y280 HydrophobicContact CD2-CD1 4.15Å; F253-Y280 AromaticContact CD2-CE1 3.62Å; F253-Y280 HydrophobicContact CD2-CE1 3.62Å; F253-Y280 AromaticContact CE2-CD1 3.41Å; F253-Y280 HydrophobicContact CE2-CD1 3.41Å; F253-Y280 VanDerWaalsContact CE2-CD1 3.41Å; F253-Y280 AromaticContact CE2-CE1 3.21Å; F253-Y280 HydrophobicContact CE2-CE1 3.21Å; F253-Y280 HydrophobicContact CE2-CG 4.32Å; F253-Y280 AromaticContact CE2-CZ 3.98Å; F253-Y280 AromaticContact CZ-CD1 3.72Å; F253-Y280 HydrophobicContact CZ-CD1 3.72Å; F253-Y280 HydrophobicContact CZ-CE1 4.02Å; F253-Y280 HydrophobicContact CZ-CG 4.46Å; L277-Y280 WeakPolarHBondContact O-CB 3.33Å; L277-Y280 PolarHBondContact O-N 2.96Å; W278-Y280 VanDerWaalsContact C-N 3.29Å; W278-Y280 PolarHBondContact O-N 2.98Å; Y280-G283 PolarHBondContact O-N 2.94Å; Y280-K284 HydrophobicContact CD2-CG 4.15Å; Y280-K284 HydrophobicContact CE1-CG 4.13Å; Y280-K284 HydrophobicContact CE2-CD 4.29Å; Y280-K284 HydrophobicContact CE2-CG 3.74Å; Y280-K284 WeakPolarHBondContact O-CB 3.2Å; Y280-K284 WeakPolarHBondContact O-CG 3.49Å; Y280-K284 PolarHBondContact O-N 3.39Å; Y280-K284 VanDerWaalsContact OH-CE 3.31Å; Y280-K284 WeakPolarHBondContact OH-CE 3.32Å
281L88.4Confident89.2Confident116 Ų11668.7 Ų68.761%0.60739%0.393SS*.Hα-helixtrans-63-54.6179.8-78.177.9000112.3G283 K284 G285L281-G283 VanDerWaalsContact C-N 3.31Å; L281-G283 PolarHBondContact O-N 3.5Å; L281-K284 PolarHBondContact O-N 2.93Å; L281-G285 PolarHBondContact O-N 3.31Å
282P90.1Very high89.2Confident73 Ų7371.1 Ų71.147%0.47441%0.409SS..Hα-helixtrans-65.4-34.3174.626.5-33.4000111.7W278 C279 G285 C286W278-P282 WeakPolarHBondContact O-CD 3.47Å; C279-P282 WeakPolarHBondContact O-CD 3.44Å; C279-P282 WeakPolarHBondContact O-CG 3.3Å; P282-G285 CarbonylContact O-C 3.53Å; P282-G285 WeakPolarHBondContact O-CA 3.37Å; P282-G285 PolarHBondContact O-N 3.03Å; P282-G285 VanDerWaalsContact O-N 3.14Å; P282-C286 WeakPolarHBondContact O-CB 3.42Å; P282-C286 PolarHBondContact O-N 2.96Å; P282-C286 PolarHBondContact O-SG 3.02Å
283G89.7Confident89.3Confident16 Ų1668.2 Ų68.217%0.16540%0.399CS..Hα-helixtrans-58.5-48.217400000112.8C279 Y280 L281 G285 C286 L287C279-G283 WeakPolarHBondContact O-CA 3.29Å; C279-G283 PolarHBondContact O-N 3.07Å; Y280-G283 PolarHBondContact O-N 2.94Å; L281-G283 VanDerWaalsContact C-N 3.31Å; L281-G283 PolarHBondContact O-N 3.5Å; G283-G285 VanDerWaalsContact C-N 3.34Å; G283-G285 PolarHBondContact O-N 3.39Å; G283-C286 PolarHBondContact O-N 3.42Å; G283-L287 WeakPolarHBondContact O-CG 3.44Å; G283-L287 PolarHBondContact O-N 2.88Å
284K90.9Very high89.5Confident59 Ų5967 Ų6726%0.25739%0.387SS..Hα-helixtrans-63.6-36.4172.5-79.8-78.8177.8170.90112.4D221 Y280 L281 L287 A288D221-K284 IonicContact OD1-NZ 2.64Å; D221-K284 PolarHBondContact OD1-NZ 3.4Å; Y280-K284 HydrophobicContact CD2-CG 4.15Å; Y280-K284 HydrophobicContact CE1-CG 4.13Å; Y280-K284 HydrophobicContact CE2-CD 4.29Å; Y280-K284 HydrophobicContact CE2-CG 3.74Å; Y280-K284 WeakPolarHBondContact O-CB 3.2Å; Y280-K284 WeakPolarHBondContact O-CG 3.49Å; Y280-K284 PolarHBondContact O-N 3.39Å; Y280-K284 VanDerWaalsContact OH-CE 3.31Å; Y280-K284 WeakPolarHBondContact OH-CE 3.32Å; L281-K284 PolarHBondContact O-N 2.93Å; K284-L287 PolarHBondContact O-N 3.29Å; K284-A288 WeakPolarHBondContact O-CB 3.26Å; K284-A288 PolarHBondContact O-N 3.04Å
285G91.3Very high89.6Confident34 Ų3465.9 Ų65.935%0.35138%0.379SS..Hα-helixtrans-61.3-49.4172.500000112.6L281 P282 G283 L287 A288 M289L281-G285 PolarHBondContact O-N 3.31Å; P282-G285 CarbonylContact O-C 3.53Å; P282-G285 WeakPolarHBondContact O-CA 3.37Å; P282-G285 PolarHBondContact O-N 3.03Å; P282-G285 VanDerWaalsContact O-N 3.14Å; G283-G285 VanDerWaalsContact C-N 3.34Å; G283-G285 PolarHBondContact O-N 3.39Å; G285-L287 PolarHBondContact O-N 3.19Å; G285-A288 PolarHBondContact O-N 3.43Å; G285-M289 WeakPolarHBondContact O-CG 3.47Å; G285-M289 PolarHBondContact O-N 3.46Å
286C91.1Very high89.6Confident76 Ų7664.9 Ų64.951%0.51437%0.366SS..Hα-helixtrans-59.4-45174.5-68.70000111.4P282 G283 A288 M289 C290P282-C286 WeakPolarHBondContact O-CB 3.42Å; P282-C286 PolarHBondContact O-N 2.96Å; P282-C286 PolarHBondContact O-SG 3.02Å; G283-C286 PolarHBondContact O-N 3.42Å; C286-A288 PolarHBondContact O-N 3.5Å; C286-M289 PolarHBondContact O-N 3.33Å; C286-C290 WeakPolarHBondContact O-CB 3.33Å; C286-C290 PolarHBondContact O-N 3.47Å; C286-C290 PolarHBondContact O-SG 3.37Å
287L91.4Very high89.4Confident26 Ų2669.4 Ų69.414%0.13639%0.392CS..Hα-helixtrans-57.8-46.4173.5-73-175.8000112P220 V224 G283 K284 G285 M289 C290 Q291P220-L287 HydrophobicContact CB-CD2 3.43Å; P220-L287 VanDerWaalsContact CB-CD2 3.43Å; V224-L287 HydrophobicContact CB-CD1 3.97Å; V224-L287 HydrophobicContact CG2-CD1 3.6Å; V224-L287 HydrophobicContact CG2-CD2 4.29Å; V224-L287 HydrophobicContact CG2-CG 3.87Å; G283-L287 WeakPolarHBondContact O-CG 3.44Å; G283-L287 PolarHBondContact O-N 2.88Å; K284-L287 PolarHBondContact O-N 3.29Å; G285-L287 PolarHBondContact O-N 3.19Å; L287-M289 VanDerWaalsContact C-N 3.33Å; L287-M289 PolarHBondContact O-N 3.31Å; L287-C290 PolarHBondContact O-N 2.76Å; L287-Q291 WeakPolarHBondContact O-CB 3.49Å; L287-Q291 PolarHBondContact O-N 3.08Å
288A92Very high89.3Confident63 Ų6371 Ų7152%0.52141%0.407SS..Hα-helixtrans-63.1-37.5178.200000112.4K284 G285 C286 C292K284-A288 WeakPolarHBondContact O-CB 3.26Å; K284-A288 PolarHBondContact O-N 3.04Å; G285-A288 PolarHBondContact O-N 3.43Å; C286-A288 PolarHBondContact O-N 3.5Å; A288-C292 VanDerWaalsContact O-CB 3.29Å; A288-C292 WeakPolarHBondContact O-CB 3.43Å; A288-C292 PolarHBondContact O-N 3.38Å
289M91.1Very high89.3Confident132 Ų13264 Ų6465%0.6538%0.38SS*.Hα-helixtrans-68.7-48.5174-70.4-173.572.400112G285 C286 L287 Q291 C292 C293G285-M289 WeakPolarHBondContact O-CG 3.47Å; G285-M289 PolarHBondContact O-N 3.46Å; C286-M289 PolarHBondContact O-N 3.33Å; L287-M289 VanDerWaalsContact C-N 3.33Å; L287-M289 PolarHBondContact O-N 3.31Å; M289-Q291 VanDerWaalsContact C-N 3.3Å; M289-Q291 PolarHBondContact O-N 2.68Å; M289-C292 WeakPolarHBondContact O-CB 3.24Å; M289-C292 PolarHBondContact O-N 2.95Å; M289-C292 VanDerWaalsContact O-N 3.16Å; M289-C293 WeakPolarHBondContact O-CB 3.19Å; M289-C293 PolarHBondContact O-N 3.39Å; M289-C293 PolarHBondContact O-SG 3.45Å; M289-C293 VanDerWaalsContact O-SG 3.36Å
290C89.8Confident88.9Confident72 Ų7264.3 Ų64.349%0.48638%0.381SS..Hα-helixtrans-59.3-40.9175.3-69.90000111.7C286 L287 C293 Y294C286-C290 WeakPolarHBondContact O-CB 3.33Å; C286-C290 PolarHBondContact O-N 3.47Å; C286-C290 PolarHBondContact O-SG 3.37Å; L287-C290 PolarHBondContact O-N 2.76Å; C290-C293 PolarHBondContact O-N 3.11Å; C290-Y294 WeakPolarHBondContact O-CB 3.45Å; C290-Y294 PolarHBondContact O-N 3.28Å
291Q92.1Very high88.7Confident56 Ų5662.8 Ų62.826%0.26238%0.375SS..Hα-helixtrans-63.2-42.5174.5176.557.891.400111.8R204 A205 L206 L287 M289 D295R204-Q291 PolarHBondContact O-NE2 2.92Å; A205-Q291 VanDerWaalsContact CA-OE1 3.28Å; L206-Q291 HydrophobicContact CD1-CB 3.99Å; L206-Q291 HydrophobicContact CG-CB 4.17Å; L287-Q291 WeakPolarHBondContact O-CB 3.49Å; L287-Q291 PolarHBondContact O-N 3.08Å; M289-Q291 VanDerWaalsContact C-N 3.3Å; M289-Q291 PolarHBondContact O-N 2.68Å; Q291-D295 WeakPolarHBondContact O-CB 3.49Å; Q291-D295 PolarHBondContact O-N 3.49Å
292C87.6Confident88.7Confident63 Ų6357.8 Ų57.843%0.42635%0.35SS..Hα-helixtrans-63-51.2174.3-175.10000111A288 M289 Y294 D295 Q296A288-C292 VanDerWaalsContact O-CB 3.29Å; A288-C292 WeakPolarHBondContact O-CB 3.43Å; A288-C292 PolarHBondContact O-N 3.38Å; M289-C292 WeakPolarHBondContact O-CB 3.24Å; M289-C292 PolarHBondContact O-N 2.95Å; M289-C292 VanDerWaalsContact O-N 3.16Å; C292-Y294 VanDerWaalsContact C-N 3.35Å; C292-Y294 PolarHBondContact O-N 3.43Å; C292-D295 PolarHBondContact O-N 2.9Å; C292-Q296 VanDerWaalsContact O-CD 3.32Å; C292-Q296 WeakPolarHBondContact O-CG 3.33Å; C292-Q296 PolarHBondContact O-N 3.27Å; C292-Q296 PolarHBondContact SG-NE2 3.37Å
293C88.8Confident88.3Confident77 Ų7760 Ų6052%0.5235%0.349SS..Hα-helixtrans-57.3-44.1176.8-71.60000112.5M289 C290 Q296 V297M289-C293 WeakPolarHBondContact O-CB 3.19Å; M289-C293 PolarHBondContact O-N 3.39Å; M289-C293 PolarHBondContact O-SG 3.45Å; M289-C293 VanDerWaalsContact O-SG 3.36Å; C290-C293 PolarHBondContact O-N 3.11Å; C293-Q296 WeakPolarHBondContact O-CB 3.41Å; C293-Q296 PolarHBondContact O-N 3.06Å; C293-V297 PolarHBondContact O-N 2.92Å
294Y89.6Confident88Confident88 Ų8862.4 Ų62.435%0.34536%0.362SS..Hα-helixtrans-63.4-45176.5-177.4-104.3000111.7R204 A205 L206 C290 C292 Q296 V297 A298R204-Y294 HydrophobicContact CB-CD1 4.41Å; R204-Y294 HydrophobicContact CB-CE1 4.06Å; R204-Y294 WeakPolarHBondContact O-CD1 3.42Å; A205-Y294 VanDerWaalsContact O-CE1 3.3Å; A205-Y294 WeakPolarHBondContact O-CE1 3.21Å; L206-Y294 HydrophobicContact CD2-CD1 4.07Å; L206-Y294 HydrophobicContact CD2-CD2 4.42Å; L206-Y294 HydrophobicContact CD2-CG 3.82Å; C290-Y294 WeakPolarHBondContact O-CB 3.45Å; C290-Y294 PolarHBondContact O-N 3.28Å; C292-Y294 VanDerWaalsContact C-N 3.35Å; C292-Y294 PolarHBondContact O-N 3.43Å; Y294-Q296 VanDerWaalsContact C-N 3.28Å; Y294-Q296 PolarHBondContact O-N 3.39Å; Y294-V297 PolarHBondContact O-N 2.86Å; Y294-V297 VanDerWaalsContact O-N 3.16Å; Y294-A298 HydrophobicContact CD1-CB 4.27Å; Y294-A298 HydrophobicContact CD2-CB 4.18Å; Y294-A298 HydrophobicContact CE1-CB 3.96Å; Y294-A298 HydrophobicContact CE2-CB 3.86Å; Y294-A298 HydrophobicContact CG-CB 4.37Å; Y294-A298 VanDerWaalsContact O-CB 3.27Å; Y294-A298 WeakPolarHBondContact O-CB 3.28Å; Y294-A298 PolarHBondContact O-N 3.42Å
295D89Confident87.1Confident20 Ų2069.4 Ų69.411%0.10739%0.393CS..Hα-helixtrans-65.1-28.8174.2-171.947.6000112.7P203 R204 Q291 C292 V297 R299P203-D295 VanDerWaalsContact CA-OD1 3.31Å; P203-D295 WeakPolarHBondContact CA-OD1 3.32Å; R204-D295 PolarHBondContact N-OD1 3.24Å; Q291-D295 WeakPolarHBondContact O-CB 3.49Å; Q291-D295 PolarHBondContact O-N 3.49Å; C292-D295 PolarHBondContact O-N 2.9Å; D295-V297 VanDerWaalsContact C-N 3.27Å; D295-V297 PolarHBondContact O-N 3.31Å; D295-R299 WeakPolarHBondContact O-CB 3.45Å; D295-R299 IonicContact OD1-CZ 3.7Å; D295-R299 IonicContact OD1-NE 2.68Å; D295-R299 PolarHBondContact OD1-NE 3.14Å; D295-R299 IonicContact OD1-NH2 3.36Å; D295-R299 PolarHBondContact OD1-NH2 3.35Å; D295-R299 IonicContact OD2-CZ 2.73Å; D295-R299 IonicContact OD2-NE 2.7Å; D295-R299 PolarHBondContact OD2-NE 2.76Å; D295-R299 IonicContact OD2-NH2 3.15Å; D295-R299 PolarHBondContact OD2-NH2 3.01Å
296Q85.1Confident85.5Confident69 Ų6974 Ų7432%0.32241%0.41SS..Hα-helixtrans-64-34174.2-49.6-41.613.300112.8C292 C293 Y294C292-Q296 VanDerWaalsContact O-CD 3.32Å; C292-Q296 WeakPolarHBondContact O-CG 3.33Å; C292-Q296 PolarHBondContact O-N 3.27Å; C292-Q296 PolarHBondContact SG-NE2 3.37Å; C293-Q296 WeakPolarHBondContact O-CB 3.41Å; C293-Q296 PolarHBondContact O-N 3.06Å; Y294-Q296 VanDerWaalsContact C-N 3.28Å; Y294-Q296 PolarHBondContact O-N 3.39Å
297V85.8Confident83.8Confident127 Ų12775.3 Ų75.377%0.7742%0.417SS*.Hα-helixtrans-100.9-47.4-169.7177.60000111.9C293 Y294 D295 R299C293-V297 PolarHBondContact O-N 2.92Å; Y294-V297 PolarHBondContact O-N 2.86Å; Y294-V297 VanDerWaalsContact O-N 3.16Å; D295-V297 VanDerWaalsContact C-N 3.27Å; D295-V297 PolarHBondContact O-N 3.31Å; V297-R299 VanDerWaalsContact C-N 3.34Å; V297-R299 PolarHBondContact O-N 3.39Å
298A85.4Confident81.9Confident40 Ų4080 Ų8033%0.33145%0.447SS..Hα-helixtrans-78.7-12.6-175.800000113.9R204 Y294 P300R204-A298 HydrophobicContact CB-CB 4.49Å; Y294-A298 HydrophobicContact CD1-CB 4.27Å; Y294-A298 HydrophobicContact CD2-CB 4.18Å; Y294-A298 HydrophobicContact CE1-CB 3.96Å; Y294-A298 HydrophobicContact CE2-CB 3.86Å; Y294-A298 HydrophobicContact CG-CB 4.37Å; Y294-A298 VanDerWaalsContact O-CB 3.27Å; Y294-A298 WeakPolarHBondContact O-CB 3.28Å; Y294-A298 PolarHBondContact O-N 3.42Å; A298-P300 WeakPolarHBondContact O-CD 3.45Å
299R86Confident79.9Confident32 Ų3284 Ų8412%0.12146%0.459CS..  trans-84.4118.7-179.8-166.8-159.1-71.7-147.4-3.6112.1R194 C200 V201 R204 D295 V297R194-R299 PolarHBondContact NH1-O 3.49Å; C200-R299 WeakPolarHBondContact O-CG 3.19Å; V201-R299 PolarHBondContact O-NH1 3.17Å; R204-R299 HydrophobicContact CG-CB 4.49Å; D295-R299 WeakPolarHBondContact O-CB 3.45Å; D295-R299 IonicContact OD1-CZ 3.7Å; D295-R299 IonicContact OD1-NE 2.68Å; D295-R299 PolarHBondContact OD1-NE 3.14Å; D295-R299 IonicContact OD1-NH2 3.36Å; D295-R299 PolarHBondContact OD1-NH2 3.35Å; D295-R299 IonicContact OD2-CZ 2.73Å; D295-R299 IonicContact OD2-NE 2.7Å; D295-R299 PolarHBondContact OD2-NE 2.76Å; D295-R299 IonicContact OD2-NH2 3.15Å; D295-R299 PolarHBondContact OD2-NH2 3.01Å; V297-R299 VanDerWaalsContact C-N 3.34Å; V297-R299 PolarHBondContact O-N 3.39Å
300P82.2Confident77.7Confident79 Ų7983.6 Ų83.651%0.51346%0.463SS..  trans-80.2-18.3-177.932.5-36.3000114.2A298A298-P300 WeakPolarHBondContact O-CD 3.45Å
301G86.4Confident75.6Confident0 Ų091.4 Ų91.40%048%0.483CS..SBendtrans-77173.4-176.300000115.3R194 C195 C200R194-G301 WeakPolarHBondContact CD-O 3.29Å; C195-G301 CarbonylContact O-C 3.56Å; C195-G301 VanDerWaalsContact O-CA 3.29Å; C195-G301 WeakPolarHBondContact O-CA 3.49Å; C200-G301 VanDerWaalsContact O-CA 3.31Å; C200-G301 WeakPolarHBondContact O-CA 3.3Å; C200-G301 PolarHBondContact O-N 3.05Å
302C86.6Confident73.5Confident12 Ų1293.9 Ų93.98%0.08151%0.505CS..  trans-73.8154.1177.2-157.10000112.7C189 C192 R194 C195 V201 C304C189-C302 HydrophobicContact CB-CB 3.94Å; C189-C302 WeakPolarHBondContact CB-SG 2.9Å; C192-C302 WeakPolarHBondContact CB-SG 3.45Å; C192-C302 WeakPolarHBondContact SG-CB 3.42Å; C192-C302 CovalentContact SG-SG 2.04Å; C192-C302 PolarHBondContact SG-SG 3.09Å; R194-C302 HydrophobicContact CB-CB 4.08Å; C195-C302 PolarHBondContact O-N 2.96Å; V201-C302 WeakPolarHBondContact CG2-O 3.46Å; C302-C304 VanDerWaalsContact SG-SG 3.67Å
303R82.8Confident71.4Confident120 Ų12099.1 Ų99.145%0.45353%0.528SS..  trans-134.313.5-173.7-65-179.655.2-133.2-18.3114K305R303-K305 PolarHBondContact O-N 3.23Å
304C83.3Confident69.3Low66 Ų66102.1 Ų102.145%0.44654%0.538SS..  trans-70.8122.4-178.5-63.10000111.8S191 C302 N306S191-C304 PolarHBondContact OG-SG 2.99Å; C302-C304 VanDerWaalsContact SG-SG 3.67Å; C304-N306 PolarHBondContact O-N 3.45Å
305K73Confident67Low205 Ų205103.2 Ų103.289%0.89156%0.555SS**SBendtrans-83.7103.7168.9-67.8-176177.1-175.80108.9R303R303-K305 PolarHBondContact O-N 3.23Å
306N56.7Low64.5Low132 Ų132111.3 Ų111.371%0.70659%0.59SS**  trans62.8132-173.1-61.5-37.5000115C304C304-N306 PolarHBondContact O-N 3.45Å
307P54.5Low62.4Low102 Ų102115.2 Ų115.266%0.66261%0.612SS**SBendtrans-85.3-7.6177.934.6-35.5000113.8L309P307-L309 PolarHBondContact O-N 3.14Å
308T53.3Low60.1Low125 Ų125114.6 Ų114.677%0.76761%0.61SS**SBendtrans-89.13.4-159.925.10000116.7
309L50Low57.9Low147 Ų147118.1 Ų118.177%0.7763%0.633SS**SBendtrans-143.7133.9178.2-113.3165.2000114.3P307P307-L309 PolarHBondContact O-N 3.14Å
310T44.4Very low55.8Low123 Ų123122.6 Ų122.676%0.75566%0.663SS**  trans54.775.4163.937.10000118.4
311R44.4Very low53.8Low236 Ų236128.2 Ų128.289%0.89168%0.68SS**  34.5103.8109.8-162.2-178.4-161-179.66.1116.9
312C48.7Very low51.5Low109 Ų109136 Ų13674%0.73672%0.72SS**  trans59.778.2148.2-56.30000119.2
313L44.6Very low49.4Very low173 Ų173144.5 Ų144.591%0.90676%0.756SS**  trans-114.371.8145.3-82.9173.1000110.7
314I44.7Very low47.4Very low140 Ų140149.6 Ų149.672%0.71878%0.775SS**  trans-91.1115.7154.9-62.1174.4000105.9K316I314-K316 VanDerWaalsContact C-N 3.34Å; I314-K316 PolarHBondContact O-N 3.49Å
315P39.8Very low45.5Very low111 Ų111151.8 Ų151.872%0.72179%0.789SS**  trans-67.393.8171-17.331.8000109.2L317P315-L317 PolarHBondContact O-N 3.38Å; P315-L317 VanDerWaalsContact O-N 3.14Å
316K38Very low44.3Very low190 Ų190151 Ų15183%0.82681%0.809SS**  trans-69.9105.7166.5-76.5-168.3174.7-174.30107.6I314I314-K316 VanDerWaalsContact C-N 3.34Å; I314-K316 PolarHBondContact O-N 3.49Å
317L39.8Very low43.7Very low150 Ų150152 Ų15279%0.78581%0.814SS**  trans-56.6131.7166.6-77.587.7000108.5P315 S319P315-L317 PolarHBondContact O-N 3.38Å; P315-L317 VanDerWaalsContact O-N 3.14Å; L317-S319 PolarHBondContact O-N 3.35Å; L317-S319 VanDerWaalsContact O-N 3.16Å
318P36.8Very low43.1Very low114 Ų114154.6 Ų154.674%0.7482%0.822SS**  trans-67.4116175.427.3-32.8000109.3V320P318-V320 PolarHBondContact O-N 3.48Å
319S40.7Very low42.5Very low114 Ų114156.2 Ų156.280%0.79783%0.825SS**  trans-70.691.3173.9-56.20000110.1L317 K321L317-S319 PolarHBondContact O-N 3.35Å; L317-S319 VanDerWaalsContact O-N 3.16Å; S319-K321 PolarHBondContact O-N 3.03Å
320V41.7Very low42.1Very low126 Ų126156.8 Ų156.876%0.76483%0.828SS**  trans-65.294.8174.7-178.60000109.1P318 L322P318-V320 PolarHBondContact O-N 3.48Å; V320-L322 VanDerWaalsContact C-N 3.31Å; V320-L322 PolarHBondContact O-N 3.1Å
321K39.9Very low42Very low198 Ų198158.9 Ų158.986%0.86183%0.833SS**  trans-70.788.6168.1-77.1-169.9174.9-175.20108.9S319 K323S319-K321 PolarHBondContact O-N 3.03Å; K321-K323 PolarHBondContact O-N 2.93Å
322L39Very low41.8Very low162 Ų162153.7 Ų153.785%0.84883%0.829SS**  trans-64.4106.9169.5-169.966.2000108.7V320 R324V320-L322 VanDerWaalsContact C-N 3.31Å; V320-L322 PolarHBondContact O-N 3.1Å; L322-R324 PolarHBondContact O-N 2.64Å
323K41.8Very low41.3Very low192 Ų192156.9 Ų156.984%0.83584%0.836SS**  trans-71.9113.9-177.6-171-178.6-178.9-173.30108.7K321K321-K323 PolarHBondContact O-N 2.93Å
324R40Very low41Very low226 Ų226155.7 Ų155.785%0.85383%0.83SS**  trans-62128.6173.8-166-176.2-68.6-178.3-2.1108.7L322L322-R324 PolarHBondContact O-N 2.64Å
325P44.9Very low40.7Very low113 Ų113157 Ų15773%0.73484%0.84SS**  trans-68.4168.3170.530.1-34000110.9
326S46.7Very low40.8Very low188 Ų188161.2 Ų161.2100%1.31585%0.851SS**  trans-79.60177.4-169.90000112.9

Retrieved 326 of 326 residues in 400.6 ms (Link to these results)