A0A3Q0KNK3_SCHMA Loading...

Intraflagellar transport protein 46 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KNK3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 322 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
1M36.8Very low50.7Low238 Ų238158.1 Ų158.1100%1.17281%0.81SS**  0109.80-81.8-80-172.500105.8
2D38.6Very low50Low147 Ų147153.6 Ų153.679%0.78680%0.799SS**  trans-57.9140.3-152.9-58.1-76.1000118.1
3K47.6Very low50.1Low209 Ų209152.6 Ų152.691%0.90980%0.795SS**  trans-134115.6141.5-77.4-167.8178.2-174.70108.8
4P47.2Very low50.2Low92 Ų92149 Ų14960%0.59779%0.79SS**  trans-103.7125-179.337.1-27.7000111.3
5Y50.1Low50.8Low227 Ų227148.5 Ų148.589%0.8978%0.781SS**  trans66.1110.8158.4-44.6-72.8000119.3
6D55.2Low51.3Low149 Ų149148.6 Ų148.680%0.79778%0.782SS**  -167101.6114.1-156.19.8000109.7
7E56.4Low51.3Low185 Ų185147.2 Ų147.286%0.86477%0.774SS**  trans-103.8109.1169.7-73.3-174.6175.600107.7
8T64.9Low51.1Low116 Ų116144.3 Ų144.371%0.71277%0.774SS**  trans-86.9127.3167.148.20000109.5
9V52.2Low50.9Low121 Ų121143.6 Ų143.673%0.73378%0.776SS**  trans-101.8107.7175.1175.90000108.4
10D56.7Low50.7Low134 Ų134142.7 Ų142.772%0.71778%0.778SS**  trans-74.4120.8169.8-77.6-38.5000110.2P12D10-P12 WeakPolarHBondContact O-CD 3.41Å
11V52.5Low50.3Low121 Ų121145.8 Ų145.873%0.73378%0.778SS**  trans-95111.6173.2-176.90000108.6
12P42.2Very low50.2Low104 Ų104141.2 Ų141.268%0.67576%0.758SS**  trans-75.4141.7170.632.5-30.1000108.6D10D10-P12 WeakPolarHBondContact O-CD 3.41Å
13D50.3Low50Low141 Ų141143 Ų14375%0.75476%0.762SS**  trans104.134.3174.3-52-20.4000118.3E15D13-E15 VanDerWaalsContact C-N 3.31Å; D13-E15 PolarHBondContact O-N 3.16Å
14S52.6Low49.5Very low102 Ų102139 Ų13971%0.71375%0.746SS**  trans-76.880.8159.260.30000111.2D16S14-D16 PolarHBondContact O-N 2.94Å
15E58.3Low49Very low142 Ų142137.8 Ų137.866%0.66474%0.74SS**  trans-70.6123.5166.3-66.5-174.8162.600111D13 K209D13-E15 VanDerWaalsContact C-N 3.31Å; D13-E15 PolarHBondContact O-N 3.16Å; E15-K209 PolarHBondContact O-NZ 2.91Å; E15-K209 VanDerWaalsContact O-NZ 3.14Å
16D59.8Low48.5Very low149 Ų149133.1 Ų133.180%0.79773%0.73SS**  trans-79.8123.1169.6-74.8-40.4000110.4S14S14-D16 PolarHBondContact O-N 2.94Å
17I49.9Very low48Very low125 Ų125129.6 Ų129.664%0.64172%0.721SS**  trans-107.3113.9-179.8-56.7167.5000109T19I17-T19 PolarHBondContact O-N 2.98Å
18A48.6Very low47.3Very low95 Ų95126.2 Ų126.279%0.78571%0.705SS**PPolyproline II helixtrans-71121.3169.700000110.1
19T47.6Very low46.4Very low132 Ų132124.9 Ų124.981%0.8169%0.694SS**PPolyproline II helixtrans-81.1133.4177.86.30000111.1I17 R21I17-T19 PolarHBondContact O-N 2.98Å; T19-R21 PolarHBondContact O-N 3.23Å
20P46.9Very low46.1Very low125 Ų125126.2 Ų126.281%0.81269%0.69SS**PPolyproline II helixtrans-67.7130174.9-15.228.4000111.2L22P20-L22 PolarHBondContact O-N 3.47Å
21R41Very low45.6Very low208 Ų208125.4 Ų125.479%0.78569%0.685SS**  trans-72.9110.6-178.7-168.4177-174.3170.81.9110.8T19 Q23T19-R21 PolarHBondContact O-N 3.23Å; R21-Q23 PolarHBondContact O-N 3.22Å
22L35.4Very low45.4Very low142 Ų142126.4 Ų126.474%0.74368%0.68SS**  trans-70.5113157.9-147.290.9000107.4P20 Q24P20-L22 PolarHBondContact O-N 3.47Å; L22-Q24 HydrophobicContact CD2-CB 4.44Å; L22-Q24 PolarHBondContact O-N 3.21Å
23Q35Very low45.4Very low185 Ų185129.7 Ų129.786%0.86468%0.684SS**  trans-67.985.4168.3-73.2177.8-54.200108.7R21R21-Q23 PolarHBondContact O-N 3.22Å
24Q37.5Very low45.1Very low123 Ų123132.6 Ų132.658%0.57568%0.684SS**  trans-132.5126163.3-121169.1100108.4L22 L26L22-Q24 HydrophobicContact CD2-CB 4.44Å; L22-Q24 PolarHBondContact O-N 3.21Å; Q24-L26 PolarHBondContact O-N 3.42Å
25S36.4Very low44.9Very low67 Ų67130.6 Ų130.647%0.46967%0.674SS.*  trans-51.2123.4-173.339.20000112A27 E28S25-A27 PolarHBondContact O-N 3.44Å; S25-E28 PolarHBondContact O-N 2.77Å
26L39.7Very low44.2Very low130 Ų130129.9 Ų129.968%0.68168%0.675SS**Hα-helixtrans-60.2-13.3-179.8-146.5138.2000113.1Q24 E28 F30Q24-L26 PolarHBondContact O-N 3.42Å; L26-E28 VanDerWaalsContact C-N 3.35Å; L26-F30 HydrophobicContact CD2-CD2 3.88Å; L26-F30 HydrophobicContact CD2-CE2 3.7Å
27A44.5Very low43.5Very low74 Ų74132.6 Ų132.661%0.61268%0.68SS**Hα-helixtrans-67.4-28.8171.300000113.4S25S25-A27 PolarHBondContact O-N 3.44Å
28E41.7Very low43.3Very low114 Ų114131 Ų13153%0.53368%0.68SS.*Hα-helixtrans-86.9-20.3-176-65.2-176.4153.400113.4S25 L26S25-E28 PolarHBondContact O-N 2.77Å; L26-E28 VanDerWaalsContact C-N 3.35Å
29N45.2Very low42.7Very low88 Ų88131.1 Ų131.147%0.47168%0.675SS.*Hα-helixtrans-86.5-20.8178.8-77.9-23000113.4F33N29-F33 PolarHBondContact O-N 3.2Å
30F45.7Very low42.3Very low150 Ų150134.2 Ų134.266%0.65868%0.677SS**Hα-helixtrans-71.9-33.5175.2-102-90.4000112.7L26 R34L26-F30 HydrophobicContact CD2-CD2 3.88Å; L26-F30 HydrophobicContact CD2-CE2 3.7Å; F30-R34 PolarHBondContact O-N 3.25Å
31D47.5Very low42Very low116 Ų116136 Ų13662%0.6268%0.679SS**Hα-helixtrans-72.9-32.4176.9-77.5-29.8000112.7R34 A35D31-R34 PolarHBondContact O-N 3.42Å; D31-A35 WeakPolarHBondContact O-CB 3.33Å; D31-A35 PolarHBondContact O-N 3.46Å; D31-A35 VanDerWaalsContact O-N 3.11Å
32K46.7Very low41.8Very low143 Ų143132.1 Ų132.162%0.62268%0.681SS**Hα-helixtrans-70.9-32.7177-78.1-180178.8173.90113.3
33F43.7Very low41.6Very low172 Ų172134.9 Ų134.975%0.75469%0.687SS**Hα-helixtrans-76-30175.1-98.9-86.5000112.9N29N29-F33 PolarHBondContact O-N 3.2Å
34R44.5Very low41.7Very low203 Ų203131 Ų13177%0.76669%0.686SS**Hα-helixtrans-74-32.9174.9-167.6172.7179.3147.9-0.5112.8F30 D31F30-R34 PolarHBondContact O-N 3.25Å; D31-R34 PolarHBondContact O-N 3.42Å
35A46.4Very low41.4Very low59 Ų59132.1 Ų132.149%0.48870%0.696SS.*Hα-helixtrans-69.1-31.3178.300000113.5D31 F37D31-A35 WeakPolarHBondContact O-CB 3.33Å; D31-A35 PolarHBondContact O-N 3.46Å; D31-A35 VanDerWaalsContact O-N 3.11Å; A35-F37 PolarHBondContact O-N 2.93Å
36N43.9Very low41.4Very low128 Ų128136.2 Ų136.268%0.68472%0.719SS**THydrogen-bonded Turntrans-80.9-12-176.7-76.6-8.3000114.8
37F46.4Very low40.9Very low205 Ų205135.1 Ų135.190%0.89972%0.722SS**THydrogen-bonded Turntrans-101.7-3174.9-117.9-94.4000113.7A35A35-F37 PolarHBondContact O-N 2.93Å
38S44.6Very low40.5Very low93 Ų93138.1 Ų138.165%0.6573%0.732SS**  trans-106.3-0.6-175.9-165.10000113.9K40S38-K40 VanDerWaalsContact C-N 3.28Å; S38-K40 PolarHBondContact O-N 3.42Å
39S36.1Very low40.2Very low97 Ų97139 Ų13968%0.67875%0.745SS**  trans-83.656.4-178.167.40000113.7
40K39.9Very low39.6Very low196 Ų196139.3 Ų139.385%0.85276%0.761SS**SBendtrans-151.549.6164-80.7-162.2-178.7176.70112.1S38S38-K40 VanDerWaalsContact C-N 3.28Å; S38-K40 PolarHBondContact O-N 3.42Å
41L40.5Very low39.2Very low163 Ų163138.4 Ų138.485%0.85377%0.77SS**SBendtrans-151.8142.5159.1-87.7114.4000110.7
42P36.5Very low38.3Very low126 Ų126142.7 Ų142.782%0.81878%0.783SS**  trans-76.6149.7-173.430.2-32.2000113.4
43K31.7Very low37.8Very low200 Ų200141.7 Ų141.787%0.8779%0.794SS**  trans-70.6142.3-170.2-61.3170177.7175.10113.8
44A35.7Very low37.2Very low104 Ų104140.8 Ų140.886%0.8680%0.797SS**  trans-132130149.100000109
45N32.5Very low36.9Very low146 Ų146139.3 Ų139.378%0.78180%0.802SS**  trans-76142-169.3-65.8-34.1000113.1
46T35.2Very low36.3Very low154 Ų154145.3 Ų145.395%0.94582%0.82SS**  -176.2142.2124.4170000111.3
47S30.1Very low35.5Very low106 Ų106148.8 Ų148.874%0.74183%0.829SS**  trans-122.7129.4-162.152.30000111.7
48V36.3Very low34.9Very low137 Ų137149.3 Ų149.383%0.8383%0.831SS**  trans-160.291.9152.8-169.20000108.2
49T34.3Very low34.1Very low132 Ų132150.5 Ų150.581%0.8184%0.839SS**  42.6114.7106.853.90000118
50A32.6Very low34.1Very low96 Ų96152 Ų15279%0.79385%0.85SS**  trans-102.2170.3166.500000111.6
51P37.5Very low33.6Very low131 Ų131149.9 Ų149.985%0.85185%0.848SS**  trans-127.8142.4147.634.2-20.3000113.6
52K29.2Very low33.4Very low206 Ų206151.3 Ų151.390%0.89685%0.85SS**  trans-94151.7170.2-67.8176.1175.2175.50109.9
53S37.3Very low33.4Very low121 Ų121154.4 Ų154.485%0.84685%0.851SS**  trans-134.5125.3157.257.10000111.2
54N30Very low33.4Very low153 Ų153153.1 Ų153.182%0.81885%0.853SS**  trans-74.7145.1173.4-73.9-28.6000111.6
55I37.7Very low33.3Very low173 Ų173152.1 Ų152.189%0.88785%0.853SS**  trans-139.9140.3145.9-64.9-173000109.7
56E33.8Very low33.5Very low184 Ų184153.1 Ų153.186%0.8686%0.858SS**  trans-75.8157.5-162.4-63.7167.7128.200116.1
57K27.8Very low33.7Very low202 Ų202149.3 Ų149.388%0.87885%0.849SS**  trans-81.1147.7167.9-70.4178.2174.5179.70111.2
58K33.8Very low34Very low216 Ų216151.7 Ų151.794%0.93985%0.854SS**  trans-127.8130.5145.7-87.3-172.5177.5177.70110.8
59S28.5Very low34.4Very low117 Ų117149.3 Ų149.382%0.81884%0.843SS**  trans-95.5149.1177.650.40000111.4
60S35.1Very low34.9Very low130 Ų130147.7 Ų147.791%0.90984%0.837SS**  trans-142.7138.6151.649.50000109
61N29.9Very low35.4Very low150 Ų150150 Ų15080%0.80284%0.836SS**  trans-130123.8-163.8-179.655.3000107
62E36.2Very low36Very low193 Ų193151.3 Ų151.390%0.90284%0.836SS**  trans-142.8102.8163.9-69.2-168.2148.600105.9
63K35.6Very low37Very low191 Ų191149.2 Ų149.283%0.8384%0.835SS**  73.29477.1-132.4-176.3-170.4-170.10114.3
64L32.2Very low37.8Very low174 Ų174149.2 Ų149.291%0.91183%0.825SS**  trans-6.2138.3151.3-64.7151.5000118.9
65G34.6Very low38.7Very low83 Ų83149.6 Ų149.686%0.85683%0.827SS**  trans-134116.715000000108.4
66D35.3Very low39.6Very low166 Ų166150.8 Ų150.889%0.88882%0.822SS**  trans-95.5142.1174.2-164.816.6000107.8
67G39.5Very low40.4Very low75 Ų75149 Ų14977%0.77382%0.819SS**  trans-149.8101.8-172.400000110
68D37.3Very low41.6Very low155 Ų155148.6 Ų148.683%0.82982%0.82SS**  trans-82.7155.5-174.4176.236.7000113.5
69S43.3Very low42.5Very low88 Ų88145.3 Ų145.362%0.61581%0.812SS**  trans69.1119.9152.4-170.90000121
70S46.1Very low43.5Very low97 Ų97147 Ų14768%0.67881%0.812SS**  165.5115.4108.758.70000108.7
71D42.8Very low44.3Very low145 Ų145147.6 Ų147.678%0.77581%0.805SS**  61.4110.4109-67.7-24.1000113
72D50.8Low45.2Very low159 Ų159147.9 Ų147.985%0.8581%0.807SS**  trans-163.4110.2141.3-94.9-28.5000109
73D48.9Very low45.8Very low161 Ų161146.7 Ų146.786%0.86180%0.801SS**  trans-71121162-77-49000107.7
74D54.2Low46.3Very low122 Ų122144.1 Ų144.165%0.65280%0.797SS**  trans-135.2109.1162.1-84.2-36.1000109.4Y76D74-Y76 HydrophobicContact CB-CE2 4.32Å
75D50.1Low47Very low161 Ų161143.9 Ų143.986%0.86179%0.791SS**  trans-64.6123.7169.7-128.3-15.4000108.7
76Y54.9Low47.6Very low197 Ų197146.2 Ų146.277%0.77378%0.784SS**  trans-113.193.9169.9-67.2-70.1000108.8D74D74-Y76 HydrophobicContact CB-CE2 4.32Å
77D50.4Low48.4Very low148 Ų148144.5 Ų144.579%0.79178%0.775SS**  trans-71.5116.6154.5-98.4-32.9000107.6
78E53.6Low48.8Very low192 Ų192146.8 Ų146.890%0.89777%0.769SS**  trans-105.296.9163.4-85.6-178.5169.100108.1
79D52.6Low49.4Very low147 Ų147147.2 Ų147.279%0.78677%0.771SS**  trans-71.8121.3160.1-84.2-42000108.7D81D79-D81 PolarHBondContact O-N 3.43Å
80D49.2Very low49.5Very low152 Ų152150.6 Ų150.681%0.81378%0.782SS**  trans-79.193.9175-125.7-11.5000108.5
81D52.2Low49.7Very low143 Ų143153.9 Ų153.977%0.76579%0.792SS**  trans-118.193.1169.6-86.2-29.3000109.4D79 E83D79-D81 PolarHBondContact O-N 3.43Å; D81-E83 PolarHBondContact O-N 3.38Å
82D49.5Very low49.6Very low157 Ų157155.2 Ų155.284%0.8479%0.794SS**  trans-70.8104165-83.7-41.7000109.4
83E47.7Very low49.1Very low167 Ų167154.3 Ų154.378%0.7879%0.789SS**  trans-129.2105.3165.2-74.6-169.4173.900110.9D81D81-E83 PolarHBondContact O-N 3.38Å
84D47.2Very low48.4Very low137 Ų137151.7 Ų151.773%0.73378%0.783SS**  64.4145.4117.9-71.5-27.5000123.7
85E46.6Very low47.4Very low169 Ų169152.3 Ų152.379%0.7979%0.787SS**  trans77140148.1-76.2170.6-155.200118
86D48.2Very low46.8Very low133 Ų133151.5 Ų151.571%0.71178%0.781SS**  cis-171.6-177.3-1.3-133-21.4000107.7
87D51.6Low46.4Very low130 Ų130147.6 Ų147.670%0.69578%0.78SS**  trans10587.9155.3-76.3-28.9000120.8
88N47.2Very low46.4Very low123 Ų123147.7 Ų147.766%0.65878%0.78SS**  47.2121.6110.3-63.9-49.5000119.9
89D49.3Very low46.4Very low163 Ų163144.1 Ų144.187%0.87277%0.771SS**  -168.5120.1107.3-93.5-24.1000111.1
90D45.7Very low46.6Very low159 Ų159142.3 Ų142.385%0.8576%0.761SS**  trans-61.3132.8161-93.7-37.3000109.4
91D51.5Low46.9Very low166 Ų166144.4 Ų144.489%0.88877%0.766SS**  trans-147.6123.7143.7-132.8-14.8000112.1
92E40Very low47.4Very low173 Ų173141.6 Ų141.681%0.80877%0.77SS**  trans-74.8141.7-176.5-69.3-177.6141.100111.6
93N39.8Very low48.4Very low141 Ų141139.3 Ų139.375%0.75476%0.757SS**  trans58.299.6136.9-172.639.3000118.4
94S34.8Very low49.7Very low105 Ų105134.7 Ų134.773%0.73473%0.732SS**  -172.3116.3121.917.70000114.6
95N33.6Very low51.2Low136 Ų136130.8 Ų130.873%0.72771%0.712SS**  trans58.9112.4136.9-68.6-57.3000121.3
96I37.9Very low52.7Low144 Ų144124.8 Ų124.874%0.73869%0.688SS**  trans83102.7150-47.8152000114.4D98I96-D98 PolarHBondContact O-N 3.04Å
97P46.6Very low54.1Low114 Ų114121.1 Ų121.174%0.7468%0.676SS**  trans-68120.2167.528.2-28.1000108V99P97-V99 PolarHBondContact O-N 3.42Å
98D50.4Low55.3Low150 Ų150119.2 Ų119.280%0.80267%0.666SS**  trans-42.2135.6162.6-78.8-45.1000109.6I96 I100I96-D98 PolarHBondContact O-N 3.04Å; D98-I100 PolarHBondContact O-N 2.9Å
99V51.8Low56.7Low118 Ų118118.4 Ų118.472%0.71565%0.654SS**  trans-45.2105.6-178.2178.70000109.8P97 E101P97-V99 PolarHBondContact O-N 3.42Å; V99-E101 PolarHBondContact O-N 3.34Å; V99-E101 VanDerWaalsContact O-N 3.07Å
100I58.9Low58Low109 Ų109118.3 Ų118.356%0.55965%0.648SS**  trans-61.9114.1173.1-61.6166.7000106.7D98 G102 I103D98-I100 PolarHBondContact O-N 2.9Å; I100-G102 PolarHBondContact O-N 2.92Å; I100-G102 VanDerWaalsContact O-N 3.13Å; I100-I103 HydrophobicContact CB-CD1 3.67Å; I100-I103 HydrophobicContact CB-CG1 4.09Å; I100-I103 HydrophobicContact CD1-CD1 3.93Å; I100-I103 HydrophobicContact CG1-CD1 4.3Å; I100-I103 HydrophobicContact CG2-CD1 4.12Å; I100-I103 HydrophobicContact CG2-CG1 4.25Å; I100-I103 PolarHBondContact O-N 2.86Å; I100-I103 VanDerWaalsContact O-N 3.15Å
101E53.8Low59.7Low196 Ų196117.8 Ų117.892%0.91664%0.64SS**THydrogen-bonded Turntrans-55.1116.4-179.4-164.1174.1-16800109.6V99V99-E101 PolarHBondContact O-N 3.34Å; V99-E101 VanDerWaalsContact O-N 3.07Å
102G63.9Low61Low83 Ų83113.1 Ų113.186%0.85662%0.615SS**THydrogen-bonded Turntrans111.3-5.4-178.100000116.2I100I100-G102 PolarHBondContact O-N 2.92Å; I100-G102 VanDerWaalsContact O-N 3.13Å
103I69.5Low63Low110 Ų110112.2 Ų112.256%0.56462%0.622SS**SBendtrans-82.2135.8171.3-60.8-176.9000110.2I100 N105I100-I103 HydrophobicContact CB-CD1 3.67Å; I100-I103 HydrophobicContact CB-CG1 4.09Å; I100-I103 HydrophobicContact CD1-CD1 3.93Å; I100-I103 HydrophobicContact CG1-CD1 4.3Å; I100-I103 HydrophobicContact CG2-CD1 4.12Å; I100-I103 HydrophobicContact CG2-CG1 4.25Å; I100-I103 PolarHBondContact O-N 2.86Å; I100-I103 VanDerWaalsContact O-N 3.15Å; I103-N105 PolarHBondContact O-N 3.37Å; I103-N105 VanDerWaalsContact O-N 3.13Å
104Y74.6Confident64.9Low69 Ų69107.8 Ų107.827%0.27160%0.599SS.*  trans-61.5113.2176.9173.5-102000111.2P106 Y109 F122 I125 Q126Y104-P106 HydrophobicContact CD1-CG 4.41Å; Y104-P106 HydrophobicContact CE1-CG 3.92Å; Y104-Y109 HydrophobicContact CD2-CD2 4.22Å; Y104-Y109 AromaticContact CD2-CE2 3.8Å; Y104-Y109 HydrophobicContact CD2-CE2 3.8Å; Y104-Y109 AromaticContact CE2-CD2 3.64Å; Y104-Y109 HydrophobicContact CE2-CD2 3.64Å; Y104-Y109 AromaticContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CG 4.49Å; Y104-F122 HydrophobicContact CE2-CD1 4.23Å; Y104-F122 HydrophobicContact CE2-CE1 4.44Å; Y104-F122 WeakPolarHBondContact OH-CD1 3.46Å; Y104-I125 HydrophobicContact CD1-CB 4.34Å; Y104-I125 HydrophobicContact CD1-CG2 3.47Å; Y104-I125 VanDerWaalsContact CD1-CG2 3.47Å; Y104-I125 HydrophobicContact CD2-CG2 4.46Å; Y104-I125 HydrophobicContact CE1-CB 4Å; Y104-I125 HydrophobicContact CE1-CD1 4.44Å; Y104-I125 HydrophobicContact CE1-CG2 3.64Å; Y104-I125 HydrophobicContact CE2-CD1 4.09Å; Y104-I125 HydrophobicContact CG-CG2 3.91Å; Y104-Q126 HydrophobicContact CE1-CG 4.4Å
105N79.3Confident67.3Low55 Ų55105.6 Ų105.629%0.29458%0.584SS.*  trans-104.1115.7172.8-178.612.2000110.4I103 A107 D108 Y109I103-N105 PolarHBondContact O-N 3.37Å; I103-N105 VanDerWaalsContact O-N 3.13Å; N105-A107 PolarHBondContact O-N 3.06Å; N105-A107 PolarHBondContact OD1-N 2.65Å; N105-D108 WeakPolarHBondContact CB-OD2 3.19Å; N105-D108 PolarHBondContact ND2-OD1 2.79Å; N105-D108 VanDerWaalsContact ND2-OD1 3.16Å; N105-D108 PolarHBondContact O-N 3.31Å; N105-Y109 VanDerWaalsContact O-CD2 3.29Å; N105-Y109 WeakPolarHBondContact O-CD2 3.41Å
106P77.6Confident69.5Low44 Ų44103.6 Ų103.629%0.28658%0.581SS.*G310 helixtrans-57.2-30.6179.2-25.934.1000114.8Y104 D108 Y109 Q126Y104-P106 HydrophobicContact CD1-CG 4.41Å; Y104-P106 HydrophobicContact CE1-CG 3.92Å; P106-D108 PolarHBondContact O-N 2.72Å; P106-Y109 PolarHBondContact O-N 2.82Å; P106-Q126 VanDerWaalsContact CB-NE2 3.33Å; P106-Q126 HydrophobicContact CG-CG 4.07Å
107A77.5Confident71.8Confident56 Ų56103.4 Ų103.446%0.46358%0.577SS.*G310 helixtrans-65-29.8-17800000112.7N105 Y109N105-A107 PolarHBondContact O-N 3.06Å; N105-A107 PolarHBondContact OD1-N 2.65Å; A107-Y109 PolarHBondContact O-N 3.44Å
108D78.8Confident73.5Confident90 Ų90101.2 Ų101.248%0.48156%0.558SS.*G310 helixtrans-69.6-18.5-178-61.9-12.5000111.9N105 P106 H111N105-D108 WeakPolarHBondContact CB-OD2 3.19Å; N105-D108 PolarHBondContact ND2-OD1 2.79Å; N105-D108 VanDerWaalsContact ND2-OD1 3.16Å; N105-D108 PolarHBondContact O-N 3.31Å; P106-D108 PolarHBondContact O-N 2.72Å; D108-H111 PolarHBondContact O-CE1 3.41Å; D108-H111 PolarHBondContact O-ND1 3.25Å
109Y76.2Confident75Confident106 Ų106100.9 Ų100.942%0.41655%0.55SS..G310 helixtrans-113.22.3-174-56-83.2000114.1Y104 N105 P106 A107 H111 L112Y104-Y109 HydrophobicContact CD2-CD2 4.22Å; Y104-Y109 AromaticContact CD2-CE2 3.8Å; Y104-Y109 HydrophobicContact CD2-CE2 3.8Å; Y104-Y109 AromaticContact CE2-CD2 3.64Å; Y104-Y109 HydrophobicContact CE2-CD2 3.64Å; Y104-Y109 AromaticContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CG 4.49Å; N105-Y109 VanDerWaalsContact O-CD2 3.29Å; N105-Y109 WeakPolarHBondContact O-CD2 3.41Å; P106-Y109 PolarHBondContact O-N 2.82Å; A107-Y109 PolarHBondContact O-N 3.44Å; Y109-H111 PolarHBondContact O-N 3.21Å; Y109-L112 HydrophobicContact CD1-CD1 4.11Å; Y109-L112 PolarHBondContact O-N 3.01Å
110E76.6Confident76.5Confident161 Ų161100.5 Ų100.575%0.75254%0.54SS*.THydrogen-bonded Turntrans-63.2-26.7179.9-72.9-170167.400113.6L112E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.91Å
111H79.9Confident77.8Confident148 Ų148100 Ų10069%0.68554%0.537SS*.THydrogen-bonded Turntrans-77.6-9-177.970.4-86.1000113.7D108 Y109 T113D108-H111 PolarHBondContact O-CE1 3.41Å; D108-H111 PolarHBondContact O-ND1 3.25Å; Y109-H111 PolarHBondContact O-N 3.21Å; H111-T113 PolarHBondContact O-N 2.93Å
112L80.5Confident79.2Confident68 Ų6893.1 Ų93.136%0.35651%0.505SS..  trans-74.3126.4179.9-83.786.4000111.3Y109 E110 V114Y109-L112 HydrophobicContact CD1-CD1 4.11Å; Y109-L112 PolarHBondContact O-N 3.01Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.91Å; L112-V114 VanDerWaalsContact C-N 3.31Å; L112-V114 HydrophobicContact CB-CG1 4.15Å; L112-V114 HydrophobicContact CD2-CG1 4.45Å; L112-V114 PolarHBondContact O-N 3.42Å
113T81Confident80Confident154 Ų15493.5 Ų93.595%0.94548%0.484SS*.  trans-8275.8174.5-29.20000110.3H111H111-T113 PolarHBondContact O-N 2.93Å
114V80.6Confident80.7Confident47 Ų4795.4 Ų95.429%0.28549%0.485SS..  trans-100.1154.8-177.9-77.20000112.9L112 I118 K119 F122L112-V114 VanDerWaalsContact C-N 3.31Å; L112-V114 HydrophobicContact CB-CG1 4.15Å; L112-V114 HydrophobicContact CD2-CG1 4.45Å; L112-V114 PolarHBondContact O-N 3.42Å; V114-I118 HydrophobicContact CB-CB 3.93Å; V114-I118 HydrophobicContact CB-CD1 4.44Å; V114-I118 HydrophobicContact CB-CG2 3.74Å; V114-I118 HydrophobicContact CG1-CB 4.35Å; V114-I118 HydrophobicContact CG1-CD1 4.4Å; V114-I118 HydrophobicContact CG1-CG2 3.71Å; V114-I118 HydrophobicContact CG2-CG2 4.18Å; V114-K119 HydrophobicContact CG2-CG 4.15Å; V114-F122 HydrophobicContact CG2-CE2 4.42Å
115S83.6Confident81.2Confident60 Ų6095.8 Ų95.842%0.4249%0.491SS..  trans-62.6158.7172.662.20000111.1E117 I118 K119S115-E117 PolarHBondContact O-N 3.16Å; S115-I118 PolarHBondContact O-N 3.28Å; S115-I118 VanDerWaalsContact O-N 3.11Å; S115-I118 WeakPolarHBondContact OG-CD1 3.48Å; S115-I118 WeakPolarHBondContact OG-CG1 3.49Å; S115-K119 PolarHBondContact O-N 3.34Å; S115-K119 VanDerWaalsContact O-N 3.16Å
116S81.6Confident81.3Confident94 Ų9499 Ų9966%0.65751%0.505SS*.Hα-helixtrans-56.4-38.1-179.849.90000112.9I118 K119 E120S116-I118 VanDerWaalsContact C-N 3.35Å; S116-I118 PolarHBondContact O-N 3.22Å; S116-K119 WeakPolarHBondContact O-CB 3.49Å; S116-K119 PolarHBondContact O-N 3.31Å; S116-E120 PolarHBondContact O-N 3.19Å; S116-E120 VanDerWaalsContact O-N 3.14Å
117E84.7Confident81.5Confident139 Ų139104 Ų10465%0.6552%0.518SS*.Hα-helixtrans-61.3-40.4177.4-174.3176.7-166.200112.5S115 K119 E120 I121S115-E117 PolarHBondContact O-N 3.16Å; E117-K119 VanDerWaalsContact C-N 3.34Å; E117-E120 PolarHBondContact O-N 3.26Å; E117-I121 PolarHBondContact O-N 3.27Å
118I83.4Confident81.8Confident68 Ų68109.3 Ų109.335%0.34953%0.527SS..Hα-helixtrans-72.6-32178.4-63.9169000110.9V114 S115 S116 E120 I121 F122V114-I118 HydrophobicContact CB-CB 3.93Å; V114-I118 HydrophobicContact CB-CD1 4.44Å; V114-I118 HydrophobicContact CB-CG2 3.74Å; V114-I118 HydrophobicContact CG1-CB 4.35Å; V114-I118 HydrophobicContact CG1-CD1 4.4Å; V114-I118 HydrophobicContact CG1-CG2 3.71Å; V114-I118 HydrophobicContact CG2-CG2 4.18Å; S115-I118 PolarHBondContact O-N 3.28Å; S115-I118 VanDerWaalsContact O-N 3.11Å; S115-I118 WeakPolarHBondContact OG-CD1 3.48Å; S115-I118 WeakPolarHBondContact OG-CG1 3.49Å; S116-I118 VanDerWaalsContact C-N 3.35Å; S116-I118 PolarHBondContact O-N 3.22Å; I118-E120 VanDerWaalsContact C-N 3.33Å; I118-I121 WeakPolarHBondContact O-CB 3.33Å; I118-I121 PolarHBondContact O-N 2.96Å; I118-F122 HydrophobicContact CG2-CD2 4.16Å; I118-F122 HydrophobicContact CG2-CE2 3.7Å; I118-F122 VanDerWaalsContact O-CD2 3.23Å; I118-F122 WeakPolarHBondContact O-CD2 3.39Å; I118-F122 PolarHBondContact O-N 2.87Å
119K81.4Confident81.8Confident143 Ų143110.6 Ų110.662%0.62254%0.538SS*.Hα-helixtrans-63-39.4173-111.4179.8179.6-174.90112.5V114 S115 S116 E117 I121 F122 E123V114-K119 HydrophobicContact CG2-CG 4.15Å; S115-K119 PolarHBondContact O-N 3.34Å; S115-K119 VanDerWaalsContact O-N 3.16Å; S116-K119 WeakPolarHBondContact O-CB 3.49Å; S116-K119 PolarHBondContact O-N 3.31Å; E117-K119 VanDerWaalsContact C-N 3.34Å; K119-I121 VanDerWaalsContact C-N 3.31Å; K119-I121 PolarHBondContact O-N 3.36Å; K119-F122 PolarHBondContact O-N 3.18Å; K119-E123 PolarHBondContact O-N 3.22Å
120E82.5Confident82.1Confident111 Ų111109.8 Ų109.852%0.51955%0.546SS..Hα-helixtrans-63.7-36.9174.9-69.8173.4-164.600111.6S116 E117 I118 F122 E123 Y124S116-E120 PolarHBondContact O-N 3.19Å; S116-E120 VanDerWaalsContact O-N 3.14Å; E117-E120 PolarHBondContact O-N 3.26Å; I118-E120 VanDerWaalsContact C-N 3.33Å; E120-F122 PolarHBondContact O-N 3.31Å; E120-E123 WeakPolarHBondContact O-CB 3.4Å; E120-E123 PolarHBondContact O-N 2.76Å; E120-Y124 WeakPolarHBondContact O-CD2 3.29Å; E120-Y124 PolarHBondContact O-N 3.13Å
121I85.8Confident82.4Confident97 Ų97110 Ų11050%0.49755%0.547SS..Hα-helixtrans-60.9-43.7175.7-68165.5000112E117 I118 K119 E123 Y124 I125E117-I121 PolarHBondContact O-N 3.27Å; I118-I121 WeakPolarHBondContact O-CB 3.33Å; I118-I121 PolarHBondContact O-N 2.96Å; K119-I121 VanDerWaalsContact C-N 3.31Å; K119-I121 PolarHBondContact O-N 3.36Å; I121-E123 PolarHBondContact O-N 3.04Å; I121-Y124 WeakPolarHBondContact O-CB 3.42Å; I121-Y124 PolarHBondContact O-N 3.15Å; I121-Y124 VanDerWaalsContact O-N 3.07Å; I121-I125 PolarHBondContact O-N 3.11Å
122F83.6Confident82.3Confident53 Ų53109.6 Ų109.623%0.23256%0.555CS.*Hα-helixtrans-63.1-29177.2-74.6-63000113Y104 V114 I118 K119 E120 Y124 I125Y104-F122 HydrophobicContact CE2-CD1 4.23Å; Y104-F122 HydrophobicContact CE2-CE1 4.44Å; Y104-F122 WeakPolarHBondContact OH-CD1 3.46Å; V114-F122 HydrophobicContact CG2-CE2 4.42Å; I118-F122 HydrophobicContact CG2-CD2 4.16Å; I118-F122 HydrophobicContact CG2-CE2 3.7Å; I118-F122 VanDerWaalsContact O-CD2 3.23Å; I118-F122 WeakPolarHBondContact O-CD2 3.39Å; I118-F122 PolarHBondContact O-N 2.87Å; K119-F122 PolarHBondContact O-N 3.18Å; E120-F122 PolarHBondContact O-N 3.31Å; F122-Y124 VanDerWaalsContact C-N 3.33Å; F122-I125 HydrophobicContact CD1-CD1 3.91Å; F122-I125 PolarHBondContact O-N 3.26Å
123E82.1Confident82.5Confident90 Ų90112.2 Ų112.242%0.42157%0.568SS.*Hα-helixtrans-68.6-33.2174.4-158.9-178.1178.400111.8K119 E120 I121 I125 Q126 R127K119-E123 PolarHBondContact O-N 3.22Å; E120-E123 WeakPolarHBondContact O-CB 3.4Å; E120-E123 PolarHBondContact O-N 2.76Å; I121-E123 PolarHBondContact O-N 3.04Å; E123-I125 VanDerWaalsContact C-N 3.29Å; E123-I125 PolarHBondContact O-N 3.45Å; E123-Q126 PolarHBondContact O-N 2.63Å; E123-R127 WeakPolarHBondContact O-CG 3.42Å; E123-R127 PolarHBondContact O-N 3.01Å; E123-R127 IonicContact OE1-CZ 2.86Å; E123-R127 IonicContact OE1-NE 2.64Å; E123-R127 IonicContact OE1-NH2 2.85Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; E123-R127 IonicContact OE2-CZ 3.86Å; E123-R127 IonicContact OE2-NH2 3.68Å; E123-R127 PolarHBondContact OE2-NH2 3.13Å
124Y84.2Confident82.5Confident151 Ų151113.5 Ų113.559%0.59256%0.563SS**Hα-helixtrans-66.3-28.4175.1-73.9-75.5000113.3E120 I121 F122 R127 Y128E120-Y124 WeakPolarHBondContact O-CD2 3.29Å; E120-Y124 PolarHBondContact O-N 3.13Å; I121-Y124 WeakPolarHBondContact O-CB 3.42Å; I121-Y124 PolarHBondContact O-N 3.15Å; I121-Y124 VanDerWaalsContact O-N 3.07Å; F122-Y124 VanDerWaalsContact C-N 3.33Å; Y124-R127 PolarHBondContact O-N 3.16Å; Y124-Y128 WeakPolarHBondContact O-CB 3.17Å; Y124-Y128 PolarHBondContact O-N 3.21Å
125I84.2Confident82.6Confident76 Ų76118.2 Ų118.239%0.3959%0.586SS.*Hα-helixtrans-64.4-43.7176.3-56.8178.1000110.3Y104 I121 F122 E123 R127 Y128Y104-I125 HydrophobicContact CD1-CB 4.34Å; Y104-I125 HydrophobicContact CD1-CG2 3.47Å; Y104-I125 VanDerWaalsContact CD1-CG2 3.47Å; Y104-I125 HydrophobicContact CD2-CG2 4.46Å; Y104-I125 HydrophobicContact CE1-CB 4Å; Y104-I125 HydrophobicContact CE1-CD1 4.44Å; Y104-I125 HydrophobicContact CE1-CG2 3.64Å; Y104-I125 HydrophobicContact CE2-CD1 4.09Å; Y104-I125 HydrophobicContact CG-CG2 3.91Å; I121-I125 PolarHBondContact O-N 3.11Å; F122-I125 HydrophobicContact CD1-CD1 3.91Å; F122-I125 PolarHBondContact O-N 3.26Å; E123-I125 VanDerWaalsContact C-N 3.29Å; E123-I125 PolarHBondContact O-N 3.45Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.14Å; I125-Y128 PolarHBondContact O-N 3.4Å
126Q81.1Confident82.5Confident124 Ų124123.6 Ų123.658%0.57961%0.605SS**Hα-helixtrans-69.4-30.7177.5-63.4-177.820.400112.6Y104 P106 E123 Y128Y104-Q126 HydrophobicContact CE1-CG 4.4Å; P106-Q126 VanDerWaalsContact CB-NE2 3.33Å; P106-Q126 HydrophobicContact CG-CG 4.07Å; E123-Q126 PolarHBondContact O-N 2.63Å; Q126-Y128 VanDerWaalsContact C-N 3.34Å
127R82.4Confident82.4Confident148 Ų148125.2 Ų125.256%0.55861%0.611SS**Hα-helixtrans-81-13.8178.8-68.5174.2-179.7-173.41.6113.3E123 Y124 I125 T129E123-R127 WeakPolarHBondContact O-CG 3.42Å; E123-R127 PolarHBondContact O-N 3.01Å; E123-R127 IonicContact OE1-CZ 2.86Å; E123-R127 IonicContact OE1-NE 2.64Å; E123-R127 IonicContact OE1-NH2 2.85Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; E123-R127 IonicContact OE2-CZ 3.86Å; E123-R127 IonicContact OE2-NH2 3.68Å; E123-R127 PolarHBondContact OE2-NH2 3.13Å; Y124-R127 PolarHBondContact O-N 3.16Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.14Å; R127-T129 PolarHBondContact O-N 3.48Å
128Y84.7Confident82.1Confident167 Ų167127.4 Ų127.466%0.65562%0.618SS**  trans-75.7110.7-177.9-179.7-102.6000110.7Y124 I125 Q126 P130Y124-Y128 WeakPolarHBondContact O-CB 3.17Å; Y124-Y128 PolarHBondContact O-N 3.21Å; I125-Y128 PolarHBondContact O-N 3.4Å; Q126-Y128 VanDerWaalsContact C-N 3.34Å; Y128-P130 HydrophobicContact CE1-CB 3.88Å
129T78.7Confident82Confident117 Ų117132.6 Ų132.672%0.71865%0.646SS**  trans-97.1112.9167.248.10000108.8R127 Q131R127-T129 PolarHBondContact O-N 3.48Å; T129-Q131 PolarHBondContact O-N 3.2Å
130P81.9Confident81.9Confident90 Ų90134.5 Ų134.558%0.58465%0.654SS**  trans-60.4131.2178.622.6-30.9000109.9Y128 T132Y128-P130 HydrophobicContact CE1-CB 3.88Å; P130-T132 PolarHBondContact O-N 3.19Å
131Q82.1Confident81.9Confident166 Ų166134.2 Ų134.278%0.77666%0.662SS**  trans-69.8117.3173.3-68.4-172.5-6.300108.6T129 I133T129-Q131 PolarHBondContact O-N 3.2Å; Q131-I133 HydrophobicContact CB-CG1 4.37Å; Q131-I133 PolarHBondContact O-N 3.41Å; Q131-I133 VanDerWaalsContact O-N 3.1Å
132T79.3Confident81.6Confident139 Ų139138.2 Ų138.285%0.85368%0.676SS**  trans-77.696170.7-550000107.5P130 E134P130-T132 PolarHBondContact O-N 3.19Å; T132-E134 PolarHBondContact O-N 3.47Å
133I84.9Confident81.4Confident122 Ų122142.3 Ų142.363%0.62670%0.699SS**  trans-87.6102.2173.3-57.8172000106.7Q131 L135Q131-I133 HydrophobicContact CB-CG1 4.37Å; Q131-I133 PolarHBondContact O-N 3.41Å; Q131-I133 VanDerWaalsContact O-N 3.1Å; I133-L135 HydrophobicContact CG2-CD2 4.25Å; I133-L135 HydrophobicContact CG2-CG 4.5Å; I133-L135 PolarHBondContact O-N 3.19Å
134E80.2Confident81.4Confident182 Ų182140.3 Ų140.385%0.8569%0.694SS**  trans-74104.9171.1-162.3170.9-168.300108.2T132 E136T132-E134 PolarHBondContact O-N 3.47Å; E134-E136 PolarHBondContact O-N 3.4Å
135L82.8Confident81.3Confident146 Ų146140.3 Ų140.376%0.76470%0.704SS**  trans-76.3118.4178-69.1165.6000108.8I133 T137I133-L135 HydrophobicContact CG2-CD2 4.25Å; I133-L135 HydrophobicContact CG2-CG 4.5Å; I133-L135 PolarHBondContact O-N 3.19Å; L135-T137 PolarHBondContact O-N 3.48Å; L135-T137 VanDerWaalsContact O-N 3.1Å
136E80.7Confident81.1Confident173 Ų173146.6 Ų146.681%0.80872%0.724SS**  trans-60.3113.4172.6-70.2-179.3178.900110.6E134 K138E134-E136 PolarHBondContact O-N 3.4Å; E136-K138 PolarHBondContact O-N 3.48Å
137T79.2Confident81Confident128 Ų128147 Ų14779%0.78573%0.729SS**  trans-79.3105.4173.352.60000110L135 L139L135-T137 PolarHBondContact O-N 3.48Å; L135-T137 VanDerWaalsContact O-N 3.1Å; T137-L139 PolarHBondContact O-N 3.37Å
138K80.1Confident80.8Confident185 Ų185145.1 Ų145.180%0.80474%0.736SS**  trans-79.2110.8170.2-66.7-173.4-179.9179.10109.7E136 K140E136-K138 PolarHBondContact O-N 3.48Å; K138-K140 PolarHBondContact O-N 3.26Å; K138-K140 VanDerWaalsContact O-N 3.12Å
139L80.4Confident80.3Confident176 Ų176141.9 Ų141.992%0.92174%0.743SS**  trans-65.8109166.7-68.7171.2000108.6T137T137-L139 PolarHBondContact O-N 3.37Å
140K80.3Confident79.9Confident184 Ų184142.6 Ų142.680%0.875%0.748SS**  trans-104.4128.8168.3-173-179177.8-174.40107.7K138 F142K138-K140 PolarHBondContact O-N 3.26Å; K138-K140 VanDerWaalsContact O-N 3.12Å; K140-F142 PolarHBondContact O-N 3.25Å; K140-F142 VanDerWaalsContact O-N 3.13Å
141P80.6Confident79.2Confident105 Ų105141.2 Ų141.268%0.68275%0.749SS**  trans-54.5121.7171.1-22.932000109.9I143P141-I143 HydrophobicContact CB-CG1 4.46Å; P141-I143 PolarHBondContact O-N 3.3Å
142F80.5Confident78.6Confident181 Ų181141 Ų14179%0.79475%0.754SS**  trans-80.7109.9169175.5-109.3000107.5K140 P144K140-F142 PolarHBondContact O-N 3.25Å; K140-F142 VanDerWaalsContact O-N 3.13Å; F142-P144 HydrophobicContact CD1-CG 4.06Å; F142-P144 HydrophobicContact CE1-CB 4.13Å; F142-P144 HydrophobicContact CE1-CG 3.62Å; F142-P144 HydrophobicContact CZ-CB 4.28Å; F142-P144 HydrophobicContact CZ-CG 4.25Å
143I79.4Confident78.2Confident138 Ų138142.3 Ų142.371%0.70875%0.754SS**  trans-108.8102.7174.4-56.8170.9000105.6P141P141-I143 HydrophobicContact CB-CG1 4.46Å; P141-I143 PolarHBondContact O-N 3.3Å
144P82.6Confident77.7Confident49 Ų49141.1 Ų141.132%0.31875%0.749SS.*  trans-61.4140.9175.4-7.617.4000109.9F142 Y146 I147F142-P144 HydrophobicContact CD1-CG 4.06Å; F142-P144 HydrophobicContact CE1-CB 4.13Å; F142-P144 HydrophobicContact CE1-CG 3.62Å; F142-P144 HydrophobicContact CZ-CB 4.28Å; F142-P144 HydrophobicContact CZ-CG 4.25Å; P144-Y146 WeakPolarHBondContact CB-O 3.23Å; P144-Y146 PolarHBondContact O-N 3.48Å; P144-I147 HydrophobicContact CG-CG1 4.38Å
145D81.7Confident77.3Confident151 Ų151135.7 Ų135.781%0.80774%0.735SS**SBendtrans-62.1-22.7173.4-67.9-30.1000112.1
146Y79.6Confident76.5Confident207 Ų207136.7 Ų136.781%0.81273%0.733SS**  trans-138.5123.5178.4-56.5-78000109.9P144P144-Y146 WeakPolarHBondContact CB-O 3.23Å; P144-Y146 PolarHBondContact O-N 3.48Å
147I78.4Confident76.2Confident132 Ų132135.5 Ų135.568%0.67773%0.732SS**  trans-99.3131.7167.8-59.7170000105.5P144 A149P144-I147 HydrophobicContact CG-CG1 4.38Å; I147-A149 PolarHBondContact O-N 3.37Å
148P78.3Confident75.9Confident110 Ų110133.4 Ų133.471%0.71471%0.712SS**  trans-55.3120.1173.623.6-32.3000108.1V150P148-V150 VanDerWaalsContact C-N 3.32Å; P148-V150 PolarHBondContact O-N 3.35Å
149A74.3Confident75.7Confident98 Ų98130.8 Ų130.881%0.8171%0.711SS**  trans-66.9101.3167.700000106.1I147 G151I147-A149 PolarHBondContact O-N 3.37Å; A149-G151 VanDerWaalsContact C-N 3.35Å; A149-G151 PolarHBondContact O-N 3.39Å
150V70.7Confident75.5Confident133 Ų133127.5 Ų127.581%0.80670%0.7SS**  trans-61.1108.6159.3-176.40000103.7P148 D152P148-V150 VanDerWaalsContact C-N 3.32Å; P148-V150 PolarHBondContact O-N 3.35Å; V150-D152 PolarHBondContact O-N 3.48Å
151G67.5Low75.6Confident60 Ų60122.6 Ų122.662%0.61968%0.677SS**  trans-55.4137.9174.500000108.2A149 I153A149-G151 VanDerWaalsContact C-N 3.35Å; A149-G151 PolarHBondContact O-N 3.39Å; G151-I153 PolarHBondContact O-N 3.4Å
152D68.8Low75.8Confident163 Ų163124.6 Ų124.687%0.87269%0.69SS**  trans-52.1141.1172.6-75.9-33.2000108.9V150 D154V150-D152 PolarHBondContact O-N 3.48Å; D152-D154 PolarHBondContact O-N 3.36Å
153I70.8Confident76.3Confident165 Ų165119.6 Ų119.685%0.84667%0.671SS**  trans-57.5112.4172.2-58.1169.9000106.1G151 A155G151-I153 PolarHBondContact O-N 3.4Å; I153-A155 PolarHBondContact O-N 3.03Å
154D74.2Confident76.6Confident98 Ų98116.3 Ų116.352%0.52467%0.671SS.*  trans-60116.2174.3-176.9-2.6000107.4D152 F156D152-D154 PolarHBondContact O-N 3.36Å; D154-F156 VanDerWaalsContact O-CD2 3.29Å; D154-F156 WeakPolarHBondContact O-CD2 3.38Å; D154-F156 PolarHBondContact O-N 3.49Å; D154-F156 PolarHBondContact OD1-N 3.33Å
155A72.6Confident76.7Confident68 Ų68119.5 Ų119.556%0.56268%0.68SS**  trans-69.76179.800000112.7I153 L157I153-A155 PolarHBondContact O-N 3.03Å; A155-L157 HydrophobicContact CB-CD1 3.82Å; A155-L157 HydrophobicContact CB-CG 3.88Å; A155-L157 PolarHBondContact O-N 3.34Å
156F65.7Low76.8Confident167 Ų167115.8 Ų115.873%0.73266%0.664SS**  trans55.322-174-65.4-85.7000112.9D154 K158D154-F156 VanDerWaalsContact O-CD2 3.29Å; D154-F156 WeakPolarHBondContact O-CD2 3.38Å; D154-F156 PolarHBondContact O-N 3.49Å; D154-F156 PolarHBondContact OD1-N 3.33Å; F156-K158 VanDerWaalsContact C-N 3.31Å; F156-K158 PolarHBondContact O-N 3.07Å
157L73.8Confident76.8Confident147 Ų147109.4 Ų109.477%0.7764%0.644SS**  trans-79.579.1178.2-70.5172000109.5A155 V159A155-L157 HydrophobicContact CB-CD1 3.82Å; A155-L157 HydrophobicContact CB-CG 3.88Å; A155-L157 PolarHBondContact O-N 3.34Å; L157-V159 PolarHBondContact O-N 3.3Å
158K72.9Confident76.9Confident84 Ų84108.8 Ų108.837%0.36563%0.634SS.*PPolyproline II helixtrans-77.2118.4174.3-60.1-161.6-174.2-167.20110.1F156 P160 L169 D175F156-K158 VanDerWaalsContact C-N 3.31Å; F156-K158 PolarHBondContact O-N 3.07Å; K158-P160 WeakPolarHBondContact O-CD 3.34Å; K158-L169 PolarHBondContact NZ-O 2.92Å; K158-D175 WeakPolarHBondContact CE-OD2 3.45Å; K158-D175 IonicContact NZ-OD2 3.73Å; K158-D175 PolarHBondContact NZ-OD2 3.19Å
159V76.3Confident76.8Confident131 Ų131106.4 Ų106.479%0.79462%0.615SS**PPolyproline II helixtrans-61.7120.8170.5-178.10000107.4L157L157-V159 PolarHBondContact O-N 3.3Å
160P76.8Confident76.9Confident106 Ų106104 Ų10469%0.68860%0.599SS**PPolyproline II helixtrans-61.5149-179.326.2-34000109.6K158K158-P160 WeakPolarHBondContact O-CD 3.34Å
161R82.8Confident77.3Confident82 Ų82104.4 Ų104.431%0.30960%0.597SS.*PPolyproline II helixtrans-53.4137-179-61.9-165.3-73.5173.3-20.8110.4D163 G164 K165 P166 D167R161-D163 WeakPolarHBondContact CB-OD1 3.45Å; R161-D163 IonicContact NE-OD1 3.79Å; R161-D163 IonicContact NH1-OD2 2.74Å; R161-D163 PolarHBondContact O-N 3.18Å; R161-G164 PolarHBondContact O-N 3.48Å; R161-K165 PolarHBondContact NE-O 3.35Å; R161-K165 VanDerWaalsContact NH2-C 3.34Å; R161-P166 PolarHBondContact NH2-O 3.2Å; R161-D167 HydrophobicContact CG-CB 4.14Å
162P84.7Confident77.9Confident147 Ų147108.2 Ų108.296%0.95560%0.602SS**THydrogen-bonded Turntrans-63.9-16-179.325-33.4000113G164P162-G164 VanDerWaalsContact C-N 3.34Å
163D90.4Very high78.2Confident76 Ų76103.4 Ų103.441%0.40658%0.578SS.*THydrogen-bonded Turntrans-85.7-2.9174.775.5-15.1000113.8R161 K165R161-D163 WeakPolarHBondContact CB-OD1 3.45Å; R161-D163 IonicContact NE-OD1 3.79Å; R161-D163 IonicContact NH1-OD2 2.74Å; R161-D163 PolarHBondContact O-N 3.18Å; D163-K165 PolarHBondContact O-N 2.82Å; D163-K165 PolarHBondContact OD1-N 2.83Å; D163-K165 VanDerWaalsContact OD2-CD 3.3Å; D163-K165 WeakPolarHBondContact OD2-CD 3.07Å; D163-K165 WeakPolarHBondContact OD2-CE 3.12Å; D163-K165 WeakPolarHBondContact OD2-CG 2.97Å; D163-K165 IonicContact OD2-NZ 3.27Å; D163-K165 PolarHBondContact OD2-NZ 3.47Å
164G85.3Confident78.6Confident69 Ų69101.5 Ų101.571%0.71157%0.569SS**  trans72.35.6179.300000115R161 P162R161-G164 PolarHBondContact O-N 3.48Å; P162-G164 VanDerWaalsContact C-N 3.34Å
165K85.1Confident78.8Confident116 Ų116100.2 Ų100.250%0.50456%0.563SS.*PPolyproline II helixtrans-81.6149175.8-61.5-172.3-161.6113.90110.1R161 D163 D167R161-K165 PolarHBondContact NE-O 3.35Å; R161-K165 VanDerWaalsContact NH2-C 3.34Å; D163-K165 PolarHBondContact O-N 2.82Å; D163-K165 PolarHBondContact OD1-N 2.83Å; D163-K165 VanDerWaalsContact OD2-CD 3.3Å; D163-K165 WeakPolarHBondContact OD2-CD 3.07Å; D163-K165 WeakPolarHBondContact OD2-CE 3.12Å; D163-K165 WeakPolarHBondContact OD2-CG 2.97Å; D163-K165 IonicContact OD2-NZ 3.27Å; D163-K165 PolarHBondContact OD2-NZ 3.47Å; K165-D167 PolarHBondContact O-N 3.2Å
166P82.9Confident79.2Confident73 Ų7399 Ų9947%0.47455%0.545SS..PPolyproline II helixtrans-65.6128.9-176.925.2-34.4000111.9R161 Y168R161-P166 PolarHBondContact NH2-O 3.2Å; P166-Y168 HydrophobicContact CB-CE1 4.34Å; P166-Y168 HydrophobicContact CB-CE2 4.11Å; P166-Y168 HydrophobicContact CG-CE2 3.75Å; P166-Y168 VanDerWaalsContact CG-OH 3.3Å; P166-Y168 WeakPolarHBondContact CG-OH 3.43Å
167D80.3Confident79.4Confident73 Ų7397.8 Ų97.839%0.3955%0.554SS.*PPolyproline II helixtrans-81.8133.7171.5-166.4-0.7000110R161 K165 L169R161-D167 HydrophobicContact CG-CB 4.14Å; K165-D167 PolarHBondContact O-N 3.2Å; D167-L169 WeakPolarHBondContact OD1-CB 3.45Å; D167-L169 PolarHBondContact OD1-N 3.29Å
168Y80.7Confident79.2Confident119 Ų11994.7 Ų94.747%0.46754%0.544SS..  trans-115.111.9179-59.8-73.2000112.3P166 G170 L171 L172P166-Y168 HydrophobicContact CB-CE1 4.34Å; P166-Y168 HydrophobicContact CB-CE2 4.11Å; P166-Y168 HydrophobicContact CG-CE2 3.75Å; P166-Y168 VanDerWaalsContact CG-OH 3.3Å; P166-Y168 WeakPolarHBondContact CG-OH 3.43Å; Y168-G170 PolarHBondContact O-N 2.94Å; Y168-L171 HydrophobicContact CD1-CD1 4.37Å; Y168-L171 PolarHBondContact O-N 3.28Å; Y168-L172 HydrophobicContact CD1-CD1 4.36Å; Y168-L172 HydrophobicContact CD2-CD1 4.23Å; Y168-L172 HydrophobicContact CG-CD1 3.87Å; Y168-L172 HydrophobicContact CG-CG 4.4Å; Y168-L172 PolarHBondContact O-N 3.39Å
169L76.9Confident79.1Confident59 Ų5996 Ų9631%0.30957%0.57SS.*BIsolated β-bridgetrans-65.6126.6173.2-166.168.2000110.2K158 D167 L171 V173 D175K158-L169 PolarHBondContact NZ-O 2.92Å; D167-L169 WeakPolarHBondContact OD1-CB 3.45Å; D167-L169 PolarHBondContact OD1-N 3.29Å; L169-L171 VanDerWaalsContact C-N 3.34Å; L169-V173 HydrophobicContact CD1-CB 4.35Å; L169-V173 HydrophobicContact CD1-CG1 4.18Å; L169-D175 HydrophobicContact CD2-CB 4.34Å; L169-D175 WeakPolarHBondContact CD2-OD1 3.17Å; L169-D175 HydrophobicContact CG-CB 3.97Å
170G76.2Confident79Confident47 Ų4796.4 Ų96.449%0.48557%0.568SS.*THydrogen-bonded Turntrans90.7-18.8-168.500000114.4Y168 V173Y168-G170 PolarHBondContact O-N 2.94Å; G170-V173 WeakPolarHBondContact CA-O 3.47Å; G170-V173 PolarHBondContact N-O 2.92Å
171L78.3Confident78.9Confident143 Ų14396.6 Ų96.675%0.74956%0.559SS**THydrogen-bonded Turntrans-101.3-52.7178.7-63.2176.3000112.4Y168 L169Y168-L171 HydrophobicContact CD1-CD1 4.37Å; Y168-L171 PolarHBondContact O-N 3.28Å; L169-L171 VanDerWaalsContact C-N 3.34Å
172L80.5Confident78.8Confident139 Ų13994.4 Ų94.473%0.72856%0.557SS**THydrogen-bonded Turntrans-98.3-30.1178.3-67.7177.4000112.5Y168Y168-L172 HydrophobicContact CD1-CD1 4.36Å; Y168-L172 HydrophobicContact CD2-CD1 4.23Å; Y168-L172 HydrophobicContact CG-CD1 3.87Å; Y168-L172 HydrophobicContact CG-CG 4.4Å; Y168-L172 PolarHBondContact O-N 3.39Å
173V75.7Confident78.6Confident62 Ų6289.6 Ų89.638%0.37652%0.523SS..BIsolated β-bridgetrans-133.8129.6-172.4177.20000107.8L169 G170 D175L169-V173 HydrophobicContact CD1-CB 4.35Å; L169-V173 HydrophobicContact CD1-CG1 4.18Å; G170-V173 WeakPolarHBondContact CA-O 3.47Å; G170-V173 PolarHBondContact N-O 2.92Å; V173-D175 PolarHBondContact O-N 3.35Å
174L78.7Confident78.1Confident125 Ų12589.3 Ų89.365%0.65453%0.525SS*.  trans-61.1132.3-179.4-175.564.9000110.8E176L174-E176 PolarHBondContact O-N 3.42Å
175D77.8Confident77.9Confident72 Ų7286.8 Ų86.839%0.38550%0.496SS..  trans-83.8108.8174.3-158.4-5.5000109.1K158 L169 V173K158-D175 WeakPolarHBondContact CE-OD2 3.45Å; K158-D175 IonicContact NZ-OD2 3.73Å; K158-D175 PolarHBondContact NZ-OD2 3.19Å; L169-D175 HydrophobicContact CD2-CB 4.34Å; L169-D175 WeakPolarHBondContact CD2-OD1 3.17Å; L169-D175 HydrophobicContact CG-CB 3.97Å; V173-D175 PolarHBondContact O-N 3.35Å
176E80.4Confident77.7Confident43 Ų4381.7 Ų81.720%0.20148%0.475CS..  trans-94.6139.6-178.7-69.2178.7-165.500109.6L174 C178 S182L174-E176 PolarHBondContact O-N 3.42Å; E176-C178 PolarHBondContact O-N 3.36Å; E176-S182 VanDerWaalsContact OE1-CB 3.25Å; E176-S182 WeakPolarHBondContact OE1-CB 3.45Å; E176-S182 PolarHBondContact OE1-OG 2.94Å; E176-S182 VanDerWaalsContact OE2-CB 3.27Å; E176-S182 WeakPolarHBondContact OE2-CB 3.49Å; E176-S182 PolarHBondContact OE2-N 2.89Å; E176-S182 PolarHBondContact OE2-OG 3.42Å
177P71.3Confident77.7Confident140 Ų14081 Ų8191%0.90947%0.467SS*.SBendtrans-66.4-3.7-178.829-36.8000113.4
178C69.3Low77.7Confident83 Ų8380.4 Ų80.456%0.56146%0.464SS*.SBendtrans-91.3136.4178.9-68.80000110.5E176 N180E176-C178 PolarHBondContact O-N 3.36Å; C178-N180 CarbonylContact O-C 3.59Å; C178-N180 PolarHBondContact O-N 3.11Å
179A71.7Confident77.7Confident110 Ų11077.3 Ų77.391%0.90946%0.455SS*.SBendtrans-55.7-20.5172.900000113.6
180N73.2Confident77.9Confident140 Ų14078.1 Ų78.175%0.74946%0.457SS*.SBendtrans-110.1116172.3-60.2-54.9000109.5C178C178-N180 CarbonylContact O-C 3.59Å; C178-N180 PolarHBondContact O-N 3.11Å
181Q74.4Confident78.2Confident110 Ų11080.4 Ų80.451%0.51446%0.458SS..PPolyproline II helixtrans-66.1137.6173.7-167.1-173.6-11.300111.2
182S81.1Confident78.2Confident37 Ų3777 Ų7726%0.25944%0.435SS..PPolyproline II helixtrans-61.9149.6173.280.30000112.1E176 P184E176-S182 VanDerWaalsContact OE1-CB 3.25Å; E176-S182 WeakPolarHBondContact OE1-CB 3.45Å; E176-S182 PolarHBondContact OE1-OG 2.94Å; E176-S182 VanDerWaalsContact OE2-CB 3.27Å; E176-S182 WeakPolarHBondContact OE2-CB 3.49Å; E176-S182 PolarHBondContact OE2-N 2.89Å; E176-S182 PolarHBondContact OE2-OG 3.42Å; S182-P184 VanDerWaalsContact O-CD 3.28Å; S182-P184 WeakPolarHBondContact O-CD 3.42Å
183D79.9Confident78.1Confident45 Ų4572.6 Ų72.624%0.24142%0.418CS..PPolyproline II helixtrans-75.8116.5170.5-179.215.7000109.1T185 V186 L187 K206D183-T185 PolarHBondContact O-N 3.14Å; D183-T185 PolarHBondContact OD1-N 3.38Å; D183-T185 PolarHBondContact OD1-OG1 3.32Å; D183-V186 HydrophobicContact CB-CB 4.16Å; D183-V186 HydrophobicContact CB-CG2 3.99Å; D183-V186 PolarHBondContact O-N 3.13Å; D183-L187 PolarHBondContact O-N 3.45Å; D183-K206 WeakPolarHBondContact OD1-CE 3.35Å; D183-K206 IonicContact OD1-NZ 2.78Å; D183-K206 PolarHBondContact OD1-NZ 3.41Å
184P80.1Confident78.2Confident70 Ų7076.3 Ų76.346%0.45544%0.435SS..Hα-helixtrans-54.2-30.5-178.920.3-35.6000113.1S182 N188S182-P184 VanDerWaalsContact O-CD 3.28Å; S182-P184 WeakPolarHBondContact O-CD 3.42Å; P184-N188 VanDerWaalsContact O-CB 3.24Å; P184-N188 WeakPolarHBondContact O-CB 3.33Å; P184-N188 PolarHBondContact O-N 3.5Å
185T80.7Confident78.3Confident16 Ų1673.1 Ų73.110%0.09842%0.423CS..Hα-helixtrans-66.3-48176.7-450000111.3D183 L189 V203 I204 V205D183-T185 PolarHBondContact O-N 3.14Å; D183-T185 PolarHBondContact OD1-N 3.38Å; D183-T185 PolarHBondContact OD1-OG1 3.32Å; T185-L189 WeakPolarHBondContact O-CB 3.13Å; T185-L189 PolarHBondContact O-N 3.34Å; T185-L189 VanDerWaalsContact O-N 3.07Å; T185-V203 HydrophobicContact CG2-CG1 4.05Å; T185-I204 WeakPolarHBondContact CG2-O 3.34Å; T185-I204 PolarHBondContact OG1-O 3.12Å; T185-V205 HydrophobicContact CG2-CG2 4.4Å
186V81.7Confident77.9Confident10 Ų1078.5 Ų78.56%0.06144%0.443CS..Hα-helixtrans-66.7-45.5179.2172.90000109.7D183 N188 L189 Q190D183-V186 HydrophobicContact CB-CB 4.16Å; D183-V186 HydrophobicContact CB-CG2 3.99Å; D183-V186 PolarHBondContact O-N 3.13Å; V186-N188 VanDerWaalsContact C-N 3.35Å; V186-N188 PolarHBondContact O-N 2.88Å; V186-L189 CarbonylContact O-C 3.59Å; V186-L189 WeakPolarHBondContact O-CB 3.47Å; V186-L189 PolarHBondContact O-N 3.48Å; V186-L189 VanDerWaalsContact O-N 3.11Å; V186-Q190 HydrophobicContact CG1-CG 4.31Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 2.89Å
187L81.8Confident77.2Confident58 Ų5883.2 Ų83.230%0.30447%0.465SS..Hα-helixtrans-58.9-46.4177.318063.8000110.9D183 L189 Q190 L191D183-L187 PolarHBondContact O-N 3.45Å; L187-L189 VanDerWaalsContact C-N 3.26Å; L187-L189 PolarHBondContact O-N 2.87Å; L187-Q190 PolarHBondContact O-N 3.35Å; L187-L191 HydrophobicContact CD1-CD1 4.36Å; L187-L191 HydrophobicContact CD1-CG 4.26Å; L187-L191 HydrophobicContact CG-CD1 4.08Å; L187-L191 HydrophobicContact CG-CG 4.39Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 3.35Å
188N81.7Confident76.7Confident61 Ų6183 Ų8333%0.32646%0.461SS..Hα-helixtrans-58.8-40.5176.1-166.5-84.5000111.8P184 V186 R192P184-N188 VanDerWaalsContact O-CB 3.24Å; P184-N188 WeakPolarHBondContact O-CB 3.33Å; P184-N188 PolarHBondContact O-N 3.5Å; V186-N188 VanDerWaalsContact C-N 3.35Å; V186-N188 PolarHBondContact O-N 2.88Å; N188-R192 WeakPolarHBondContact O-CB 3.23Å; N188-R192 PolarHBondContact O-N 3.27Å
189L80.6Confident76.1Confident54 Ų5482.7 Ų82.728%0.28347%0.465SS..Hα-helixtrans-69.8-37.6179.2-170.362.1000112.2T185 V186 L187 A193 I225 L228T185-L189 WeakPolarHBondContact O-CB 3.13Å; T185-L189 PolarHBondContact O-N 3.34Å; T185-L189 VanDerWaalsContact O-N 3.07Å; V186-L189 CarbonylContact O-C 3.59Å; V186-L189 WeakPolarHBondContact O-CB 3.47Å; V186-L189 PolarHBondContact O-N 3.48Å; V186-L189 VanDerWaalsContact O-N 3.11Å; L187-L189 VanDerWaalsContact C-N 3.26Å; L187-L189 PolarHBondContact O-N 2.87Å; L189-A193 WeakPolarHBondContact O-CB 3.5Å; L189-A193 PolarHBondContact O-N 2.84Å; L189-I225 HydrophobicContact CD2-CD1 3.56Å; L189-L228 HydrophobicContact CB-CD2 4.33Å; L189-L228 HydrophobicContact CD1-CD2 4.39Å; L189-L228 HydrophobicContact CD2-CD2 3.23Å; L189-L228 HydrophobicContact CG-CD2 3.36Å
190Q81.5Confident75.4Confident75 Ų7584 Ų8435%0.3546%0.462SS..Hα-helixtrans-64.4-49.5171.8-73.7175.3-16.600111.4V186 L187 R192 A193 L194 L228V186-Q190 HydrophobicContact CG1-CG 4.31Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 2.89Å; L187-Q190 PolarHBondContact O-N 3.35Å; Q190-R192 VanDerWaalsContact C-N 3.27Å; Q190-R192 PolarHBondContact O-N 3.37Å; Q190-A193 WeakPolarHBondContact O-CB 3.44Å; Q190-A193 PolarHBondContact O-N 3.5Å; Q190-L194 WeakPolarHBondContact O-CG 3.26Å; Q190-L194 PolarHBondContact O-N 3.2Å; Q190-L228 HydrophobicContact CB-CD1 4.21Å; Q190-L228 HydrophobicContact CG-CD1 3.67Å
191L81.6Confident74.9Confident96 Ų9685.2 Ų85.250%0.50346%0.461SS..Hα-helixtrans-58.8-39176.2-71.4174.8000111.8L187 L194 S195L187-L191 HydrophobicContact CD1-CD1 4.36Å; L187-L191 HydrophobicContact CD1-CG 4.26Å; L187-L191 HydrophobicContact CG-CD1 4.08Å; L187-L191 HydrophobicContact CG-CG 4.39Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 3.35Å; L191-L194 PolarHBondContact O-N 2.98Å; L191-S195 VanDerWaalsContact O-CB 3.25Å; L191-S195 WeakPolarHBondContact O-CB 3.5Å; L191-S195 PolarHBondContact O-N 3.47Å; L191-S195 PolarHBondContact O-OG 3.07Å
192R79.2Confident74.2Confident72 Ų7287.6 Ų87.627%0.27247%0.472SS..Hα-helixtrans-65.5-40.1174.1-173.9176.2-68.3175.7-0.8112.3N188 Q190 K196 Q197 K201N188-R192 WeakPolarHBondContact O-CB 3.23Å; N188-R192 PolarHBondContact O-N 3.27Å; Q190-R192 VanDerWaalsContact C-N 3.27Å; Q190-R192 PolarHBondContact O-N 3.37Å; R192-K196 PolarHBondContact O-N 3.02Å; R192-Q197 WeakPolarHBondContact CG-O 3.46Å; R192-K201 PolarHBondContact NH2-O 3.37Å
193A76.9Confident73.4Confident45 Ų4588.1 Ų88.137%0.37247%0.473SS..Hα-helixtrans-65.6-4117700000111.7L189 Q190 L228L189-A193 WeakPolarHBondContact O-CB 3.5Å; L189-A193 PolarHBondContact O-N 2.84Å; Q190-A193 WeakPolarHBondContact O-CB 3.44Å; Q190-A193 PolarHBondContact O-N 3.5Å; A193-L228 HydrophobicContact CB-CD1 3.91Å
194L79.4Confident72.8Confident141 Ų14192.6 Ų92.674%0.73850%0.496SS*.Hα-helixtrans-72.3-46.8179.9-69.4172.7000112.9Q190 L191 K196Q190-L194 WeakPolarHBondContact O-CG 3.26Å; Q190-L194 PolarHBondContact O-N 3.2Å; L191-L194 PolarHBondContact O-N 2.98Å; L194-K196 PolarHBondContact O-N 3.49Å
195S79.9Confident72.2Confident58 Ų5894 Ų9441%0.40650%0.503SS..Hα-helixtrans-70.5-10-177.260.60000113.8L191 Q197L191-S195 VanDerWaalsContact O-CB 3.25Å; L191-S195 WeakPolarHBondContact O-CB 3.5Å; L191-S195 PolarHBondContact O-N 3.47Å; L191-S195 PolarHBondContact O-OG 3.07Å; S195-Q197 PolarHBondContact O-N 3Å; S195-Q197 PolarHBondContact OG-N 3.37Å
196K69.6Low71.6Confident184 Ų18498.8 Ų98.880%0.852%0.522SS*.  trans51.411.7-169.5-59.4179.5-178.7176.70113.5R192 L194 T198R192-K196 PolarHBondContact O-N 3.02Å; L194-K196 PolarHBondContact O-N 3.49Å; K196-T198 PolarHBondContact O-N 2.88Å; K196-T198 VanDerWaalsContact O-N 3.15Å
197Q66.5Low71.1Confident142 Ų142102.1 Ų102.166%0.66455%0.546SS*.  trans-75.5109.6-177.9-72.6-175.71.300109R192 S195 A199R192-Q197 WeakPolarHBondContact CG-O 3.46Å; S195-Q197 PolarHBondContact O-N 3Å; S195-Q197 PolarHBondContact OG-N 3.37Å; Q197-A199 PolarHBondContact O-N 2.99Å
198T60.7Low70.8Confident135 Ų135102.8 Ų102.883%0.82855%0.55SS*.  trans-82108.7172.2360000109.1K196K196-T198 PolarHBondContact O-N 2.88Å; K196-T198 VanDerWaalsContact O-N 3.15Å
199A54.9Low70.4Confident77 Ų77105.7 Ų105.764%0.63656%0.559SS**SBendtrans70.182.6143.400000120.4Q197Q197-A199 PolarHBondContact O-N 2.99Å
200T57.1Low69.9Low138 Ų138108 Ų10885%0.84757%0.572SS**  trans-133.4-36.4148.953.20000114.9
201K62.9Low69.5Low166 Ų166106.8 Ų106.872%0.72257%0.574SS**SBendtrans-88.1130.3-178.2-64.1-175179.9-178.90112.7R192 V203R192-K201 PolarHBondContact NH2-O 3.37Å; K201-V203 PolarHBondContact O-N 3.32Å
202Q60.4Low69.1Low159 Ų159110.9 Ų110.974%0.74359%0.591SS**  trans-60.4130.7173.7-65.6-179.15.300108.9I204Q202-I204 PolarHBondContact O-N 2.63Å
203V64.6Low69Low48 Ų48116 Ų11629%0.29162%0.615SS.*  trans-76.5114.1173.8-177.40000106.4T185 K201 V205T185-V203 HydrophobicContact CG2-CG1 4.05Å; K201-V203 PolarHBondContact O-N 3.32Å; V203-V205 HydrophobicContact CB-CG2 4.42Å; V203-V205 HydrophobicContact CG1-CG2 3.88Å; V203-V205 PolarHBondContact O-N 3.26Å
204I66.2Low69Low140 Ų140117.8 Ų117.872%0.71862%0.616SS**  trans-72.1113.3168-59.7169.3000105.6T185 Q202T185-I204 WeakPolarHBondContact CG2-O 3.34Å; T185-I204 PolarHBondContact OG1-O 3.12Å; Q202-I204 PolarHBondContact O-N 2.63Å
205V67.3Low69.2Low99 Ų99114.7 Ų114.760%0.660%0.603SS**PPolyproline II helixtrans-103.3122.9177.2-178.30000107.4T185 V203 S207T185-V205 HydrophobicContact CG2-CG2 4.4Å; V203-V205 HydrophobicContact CB-CG2 4.42Å; V203-V205 HydrophobicContact CG1-CG2 3.88Å; V203-V205 PolarHBondContact O-N 3.26Å; V205-S207 PolarHBondContact O-N 2.92Å
206K68.4Low69.3Low117 Ų117119.9 Ų119.951%0.50962%0.618SS.*PPolyproline II helixtrans-62.2124.7174.7-72.1176.5176.2164.70110.4D183D183-K206 WeakPolarHBondContact OD1-CE 3.35Å; D183-K206 IonicContact OD1-NZ 2.78Å; D183-K206 PolarHBondContact OD1-NZ 3.41Å
207S72.6Confident69.9Low79 Ų79114.3 Ų114.355%0.55260%0.599SS**PPolyproline II helixtrans-91.5127.8170.965.10000110.5V205V205-S207 PolarHBondContact O-N 2.92Å
208L73.9Confident70.7Confident73 Ų73110.1 Ų110.138%0.38258%0.581SS.*  trans-90.8115176.5-62.8169.6000109.8N210 V217 I218L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.39Å; L208-V217 HydrophobicContact CD1-CG1 4.18Å; L208-V217 HydrophobicContact CD2-CG1 3.96Å; L208-I218 HydrophobicContact CD1-CG1 4.01Å
209K73Confident71.9Confident121 Ų121109.3 Ų109.353%0.52657%0.568SS.*THydrogen-bonded Turntrans-69.8-20.2-177.9-66.6-177.9-176.3176.20113.5E15E15-K209 PolarHBondContact O-NZ 2.91Å; E15-K209 VanDerWaalsContact O-NZ 3.14Å
210N72Confident73.3Confident103 Ų103110.6 Ų110.655%0.55156%0.564SS**THydrogen-bonded Turntrans-141.668.6179.9-77.4-43.3000112.3L208 E212 K213 Q214L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.39Å; N210-E212 PolarHBondContact O-N 3.32Å; N210-E212 VanDerWaalsContact O-N 3.16Å; N210-K213 PolarHBondContact O-N 2.81Å; N210-K213 VanDerWaalsContact O-N 3.15Å; N210-Q214 PolarHBondContact O-N 2.89Å
211A72.2Confident74.5Confident49 Ų49109.8 Ų109.841%0.40555%0.545SS..THydrogen-bonded Turntrans-54.4-34.9-177.300000114K213 Q214 I218A211-K213 VanDerWaalsContact C-N 3.3Å; A211-K213 PolarHBondContact O-N 3.26Å; A211-Q214 PolarHBondContact O-N 3.33Å; A211-I218 HydrophobicContact CB-CD1 4.05Å; A211-I218 WeakPolarHBondContact O-CD1 3.19Å
212E74.3Confident75.6Confident183 Ų183106 Ų10686%0.85553%0.532SS*.THydrogen-bonded Turntrans-64.5-30.9-178.7-171.8178.6-174.300113.5N210N210-E212 PolarHBondContact O-N 3.32Å; N210-E212 VanDerWaalsContact O-N 3.16Å
213K76.4Confident76.8Confident178 Ų178104.9 Ų104.977%0.77453%0.525SS*.THydrogen-bonded Turntrans-90.9-16.8-179.6-67.4-175.6179179.90113.2N210 A211N210-K213 PolarHBondContact O-N 2.81Å; N210-K213 VanDerWaalsContact O-N 3.15Å; A211-K213 VanDerWaalsContact C-N 3.3Å; A211-K213 PolarHBondContact O-N 3.26Å
214Q77Confident77.7Confident84 Ų84104.5 Ų104.539%0.39352%0.524SS..  trans-111.345.4-171.5-67.3-175.4-46.700112.6N210 A211 K216 V217 I218N210-Q214 PolarHBondContact O-N 2.89Å; A211-Q214 PolarHBondContact O-N 3.33Å; Q214-K216 PolarHBondContact O-N 3.26Å; Q214-K216 VanDerWaalsContact O-N 3.17Å; Q214-V217 HydrophobicContact CB-CB 4.44Å; Q214-V217 HydrophobicContact CB-CG2 4.25Å; Q214-V217 PolarHBondContact O-N 2.69Å; Q214-V217 VanDerWaalsContact O-N 3.09Å; Q214-I218 PolarHBondContact O-N 2.89Å
215T84Confident78.4Confident75 Ų7598.9 Ų98.946%0.4650%0.496SS..Hα-helixtrans-53.8-37.6-179.8-43.40000112.8V217 I218 E219T215-V217 PolarHBondContact O-N 3.48Å; T215-I218 WeakPolarHBondContact O-CB 3.42Å; T215-I218 PolarHBondContact O-N 3.27Å; T215-E219 HydrophobicContact CG2-CG 4.4Å; T215-E219 WeakPolarHBondContact O-CG 3.29Å; T215-E219 PolarHBondContact O-N 3.26Å
216K82.1Confident79.2Confident168 Ų16898 Ų9873%0.7349%0.49SS*.Hα-helixtrans-61.1-39.6178.6-66.5-174.2179-178.60113.5Q214 I218 E219 N220Q214-K216 PolarHBondContact O-N 3.26Å; Q214-K216 VanDerWaalsContact O-N 3.17Å; K216-I218 VanDerWaalsContact C-N 3.3Å; K216-E219 PolarHBondContact O-N 3.12Å; K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 VanDerWaalsContact O-CG 3.27Å; K216-N220 PolarHBondContact O-N 2.81Å
217V80.5Confident79.8Confident66 Ų6695.9 Ų95.940%0.449%0.485SS..Hα-helixtrans-68.2-37.3179.2-177.30000109.9L208 Q214 T215 W221L208-V217 HydrophobicContact CD1-CG1 4.18Å; L208-V217 HydrophobicContact CD2-CG1 3.96Å; Q214-V217 HydrophobicContact CB-CB 4.44Å; Q214-V217 HydrophobicContact CB-CG2 4.25Å; Q214-V217 PolarHBondContact O-N 2.69Å; Q214-V217 VanDerWaalsContact O-N 3.09Å; T215-V217 PolarHBondContact O-N 3.48Å; V217-W221 VanDerWaalsContact O-CB 3.32Å; V217-W221 WeakPolarHBondContact O-CB 3.34Å; V217-W221 PolarHBondContact O-N 3.39Å
218I83.4Confident80.1Confident54 Ų5492.5 Ų92.528%0.27746%0.46SS..Hα-helixtrans-67.3-47.3176.3-60.7171.2000110.5L208 A211 Q214 T215 K216 N220 W221 I222L208-I218 HydrophobicContact CD1-CG1 4.01Å; A211-I218 HydrophobicContact CB-CD1 4.05Å; A211-I218 WeakPolarHBondContact O-CD1 3.19Å; Q214-I218 PolarHBondContact O-N 2.89Å; T215-I218 WeakPolarHBondContact O-CB 3.42Å; T215-I218 PolarHBondContact O-N 3.27Å; K216-I218 VanDerWaalsContact C-N 3.3Å; I218-N220 PolarHBondContact O-N 3.45Å; I218-W221 PolarHBondContact O-N 2.92Å; I218-I222 HydrophobicContact CG2-CD1 3.73Å; I218-I222 HydrophobicContact CG2-CG1 4.31Å; I218-I222 WeakPolarHBondContact O-CB 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.2Å; I218-I222 PolarHBondContact O-N 2.83Å
219E86Confident80.1Confident118 Ų11895.8 Ų95.855%0.55147%0.469SS*.Hα-helixtrans-59.7-44.6176.2-74.7175.7-178.400111.9T215 K216 I222 K223T215-E219 HydrophobicContact CG2-CG 4.4Å; T215-E219 WeakPolarHBondContact O-CG 3.29Å; T215-E219 PolarHBondContact O-N 3.26Å; K216-E219 PolarHBondContact O-N 3.12Å; E219-I222 PolarHBondContact O-N 3.48Å; E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 PolarHBondContact O-N 2.9Å
220N84Confident80.2Confident105 Ų105100.3 Ų100.356%0.56148%0.482SS*.Hα-helixtrans-61.7-46.1175.5-76.6-7.1000111.6K216 I218 K223 S224K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 VanDerWaalsContact O-CG 3.27Å; K216-N220 PolarHBondContact O-N 2.81Å; I218-N220 PolarHBondContact O-N 3.45Å; N220-K223 WeakPolarHBondContact O-CB 3.45Å; N220-K223 PolarHBondContact O-N 3.44Å; N220-S224 PolarHBondContact O-N 3.27Å; N220-S224 PolarHBondContact O-OG 3.35Å; N220-S224 VanDerWaalsContact O-OG 3.14Å
221W84Confident80.2Confident120 Ų12099.3 Ų99.346%0.45549%0.489SS..Hα-helixtrans-62.8-43.8176.817981000112V217 I218 K223 S224 I225V217-W221 VanDerWaalsContact O-CB 3.32Å; V217-W221 WeakPolarHBondContact O-CB 3.34Å; V217-W221 PolarHBondContact O-N 3.39Å; I218-W221 PolarHBondContact O-N 2.92Å; W221-K223 VanDerWaalsContact C-N 3.3Å; W221-K223 PolarHBondContact O-N 3.43Å; W221-S224 PolarHBondContact O-N 2.86Å; W221-I225 HydrophobicContact CD2-CG1 3.97Å; W221-I225 HydrophobicContact CG-CG1 4.33Å; W221-I225 HydrophobicContact CH2-CG1 4.45Å; W221-I225 HydrophobicContact CZ2-CD1 4.32Å; W221-I225 HydrophobicContact CZ2-CG1 3.83Å; W221-I225 WeakPolarHBondContact O-CB 3.5Å; W221-I225 VanDerWaalsContact O-CG1 3.28Å; W221-I225 WeakPolarHBondContact O-CG1 3.49Å; W221-I225 PolarHBondContact O-N 3.36Å
222I84.9Confident80Confident86 Ų86101.5 Ų101.544%0.44149%0.489SS..Hα-helixtrans-58.1-45.6175.3-71.4167.4000110.2I218 E219 I225 T226I218-I222 HydrophobicContact CG2-CD1 3.73Å; I218-I222 HydrophobicContact CG2-CG1 4.31Å; I218-I222 WeakPolarHBondContact O-CB 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.2Å; I218-I222 PolarHBondContact O-N 2.83Å; E219-I222 PolarHBondContact O-N 3.48Å; I222-I225 PolarHBondContact O-N 3.22Å; I222-T226 VanDerWaalsContact O-CB 3.28Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 PolarHBondContact O-N 2.88Å; I222-T226 PolarHBondContact O-OG1 3.04Å
223K86.2Confident79.5Confident137 Ų13798.5 Ų98.560%0.59649%0.486SS*.Hα-helixtrans-59.6-52.6177.1-174.9-177.1175.6-171.70110.8E219 N220 W221 I225 T226 D227E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 PolarHBondContact O-N 2.9Å; N220-K223 WeakPolarHBondContact O-CB 3.45Å; N220-K223 PolarHBondContact O-N 3.44Å; W221-K223 VanDerWaalsContact C-N 3.3Å; W221-K223 PolarHBondContact O-N 3.43Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 3.1Å; K223-T226 WeakPolarHBondContact O-CB 3.44Å; K223-T226 PolarHBondContact O-N 3.12Å; K223-T226 VanDerWaalsContact O-N 3.13Å; K223-D227 VanDerWaalsContact O-CG 3.28Å; K223-D227 PolarHBondContact O-N 2.74Å
224S82.8Confident78.8Confident39 Ų3993.4 Ų93.427%0.27348%0.477SS..Hα-helixtrans-58.8-40179.2-65.80000113.7N220 W221 L228N220-S224 PolarHBondContact O-N 3.27Å; N220-S224 PolarHBondContact O-OG 3.35Å; N220-S224 VanDerWaalsContact O-OG 3.14Å; W221-S224 PolarHBondContact O-N 2.86Å; S224-L228 PolarHBondContact O-N 2.87Å
225I82.5Confident78.4Confident23 Ų2395.8 Ų95.812%0.11850%0.499CS..Hα-helixtrans-72-38.6176.6-67.6-62.6000111.3L189 W221 I222 K223 D227 L228 Y229L189-I225 HydrophobicContact CD2-CD1 3.56Å; W221-I225 HydrophobicContact CD2-CG1 3.97Å; W221-I225 HydrophobicContact CG-CG1 4.33Å; W221-I225 HydrophobicContact CH2-CG1 4.45Å; W221-I225 HydrophobicContact CZ2-CD1 4.32Å; W221-I225 HydrophobicContact CZ2-CG1 3.83Å; W221-I225 WeakPolarHBondContact O-CB 3.5Å; W221-I225 VanDerWaalsContact O-CG1 3.28Å; W221-I225 WeakPolarHBondContact O-CG1 3.49Å; W221-I225 PolarHBondContact O-N 3.36Å; I222-I225 PolarHBondContact O-N 3.22Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 3.1Å; I225-D227 VanDerWaalsContact C-N 3.32Å; I225-D227 PolarHBondContact O-N 3.44Å; I225-L228 HydrophobicContact CD1-CD2 4.47Å; I225-L228 WeakPolarHBondContact O-CB 3.34Å; I225-L228 PolarHBondContact O-N 3.25Å; I225-Y229 HydrophobicContact CG2-CD2 3.59Å; I225-Y229 HydrophobicContact CG2-CE2 3.31Å; I225-Y229 WeakPolarHBondContact O-CD2 3.46Å; I225-Y229 PolarHBondContact O-N 2.78Å
226T83.4Confident77.7Confident79 Ų7996 Ų9649%0.48550%0.501SS..Hα-helixtrans-62.1-42.7174.7-57.50000110.6I222 K223 Y229 R230I222-T226 VanDerWaalsContact O-CB 3.28Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 PolarHBondContact O-N 2.88Å; I222-T226 PolarHBondContact O-OG1 3.04Å; K223-T226 WeakPolarHBondContact O-CB 3.44Å; K223-T226 PolarHBondContact O-N 3.12Å; K223-T226 VanDerWaalsContact O-N 3.13Å; T226-Y229 PolarHBondContact O-N 3.38Å; T226-R230 WeakPolarHBondContact O-CB 3.5Å; T226-R230 PolarHBondContact O-N 2.98Å
227D81.6Confident77.4Confident74 Ų7491.1 Ų91.140%0.39649%0.485SS..Hα-helixtrans-63.5-41.5175.9-68.6-25.2000111.6K223 I225 Y229 R230 A231K223-D227 VanDerWaalsContact O-CG 3.28Å; K223-D227 PolarHBondContact O-N 2.74Å; I225-D227 VanDerWaalsContact C-N 3.32Å; I225-D227 PolarHBondContact O-N 3.44Å; D227-Y229 PolarHBondContact O-N 3.36Å; D227-R230 WeakPolarHBondContact O-CB 3.37Å; D227-R230 PolarHBondContact O-N 3.33Å; D227-A231 PolarHBondContact O-N 3.18Å
228L78Confident77.3Confident7 Ų795.5 Ų95.54%0.03750%0.5CS..Hα-helixtrans-59.6-44.9172.1175.282.6000112.2L189 Q190 A193 S224 I225 R230 A231 K232L189-L228 HydrophobicContact CB-CD2 4.33Å; L189-L228 HydrophobicContact CD1-CD2 4.39Å; L189-L228 HydrophobicContact CD2-CD2 3.23Å; L189-L228 HydrophobicContact CG-CD2 3.36Å; Q190-L228 HydrophobicContact CB-CD1 4.21Å; Q190-L228 HydrophobicContact CG-CD1 3.67Å; A193-L228 HydrophobicContact CB-CD1 3.91Å; S224-L228 PolarHBondContact O-N 2.87Å; I225-L228 HydrophobicContact CD1-CD2 4.47Å; I225-L228 WeakPolarHBondContact O-CB 3.34Å; I225-L228 PolarHBondContact O-N 3.25Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 3.23Å; L228-A231 PolarHBondContact O-N 3.44Å; L228-K232 PolarHBondContact O-N 3.39Å
229Y74.8Confident77.2Confident143 Ų14396.1 Ų96.156%0.56150%0.5SS*.Hα-helixtrans-67.2-32.5177.4-78.7-67.4000112I225 T226 D227 A231 K232I225-Y229 HydrophobicContact CG2-CD2 3.59Å; I225-Y229 HydrophobicContact CG2-CE2 3.31Å; I225-Y229 WeakPolarHBondContact O-CD2 3.46Å; I225-Y229 PolarHBondContact O-N 2.78Å; T226-Y229 PolarHBondContact O-N 3.38Å; D227-Y229 PolarHBondContact O-N 3.36Å; Y229-A231 VanDerWaalsContact C-N 3.31Å; Y229-K232 HydrophobicContact CD1-CD 4.05Å; Y229-K232 HydrophobicContact CE1-CD 4.49Å; Y229-K232 PolarHBondContact O-N 3.15Å
230R74.5Confident76.9Confident215 Ų21595.9 Ų95.981%0.81151%0.506SS*.Hα-helixtrans-67.2-32.2174.7-167.5177-173.6173.91.6112.5T226 D227 L228 K232T226-R230 WeakPolarHBondContact O-CB 3.5Å; T226-R230 PolarHBondContact O-N 2.98Å; D227-R230 WeakPolarHBondContact O-CB 3.37Å; D227-R230 PolarHBondContact O-N 3.33Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 3.23Å; R230-K232 VanDerWaalsContact C-N 3.33Å
231A72Confident76.7Confident83 Ų8397.2 Ų97.269%0.68650%0.503SS*.Hα-helixtrans-75.7-18.2175.300000113.4D227 L228 Y229D227-A231 PolarHBondContact O-N 3.18Å; L228-A231 PolarHBondContact O-N 3.44Å; Y229-A231 VanDerWaalsContact C-N 3.31Å
232K68Low76.6Confident95 Ų9598.5 Ų98.541%0.41352%0.52SS..SBendtrans-69.2134.3172.5-70.2179.9-178.5172.90109L228 Y229 R230 A234L228-K232 PolarHBondContact O-N 3.39Å; Y229-K232 HydrophobicContact CD1-CD 4.05Å; Y229-K232 HydrophobicContact CE1-CD 4.49Å; Y229-K232 PolarHBondContact O-N 3.15Å; R230-K232 VanDerWaalsContact C-N 3.33Å; K232-A234 PolarHBondContact O-N 3.09Å
233P63.4Low76.6Confident120 Ų12095.7 Ų95.778%0.77951%0.505SS*.PPolyproline II helixtrans-57135.8174.524.4-32.3000108.9
234A62.8Low76.6Confident71 Ų7190.7 Ų90.759%0.58749%0.486SS*.PPolyproline II helixtrans-55132.2177.800000108.8K232 T236K232-A234 PolarHBondContact O-N 3.09Å; A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 VanDerWaalsContact O-N 3.09Å
235P67.3Low76.8Confident134 Ų13495.3 Ų95.387%0.8750%0.503SS*.SBendtrans-65.7-15.5-176.526.9-34.7000112.6
236T69.9Low77Confident80 Ų8096.5 Ų96.549%0.49151%0.509SS..SBendtrans-125.5128.6-177.654.50000109.8A234A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 VanDerWaalsContact O-N 3.09Å
237V75.9Confident77Confident65 Ų6597.2 Ų97.239%0.39452%0.518SS..  trans-85.7119.9172.6176.60000108.7Y239 H299V237-Y239 HydrophobicContact CG1-CD1 4.21Å; V237-Y239 HydrophobicContact CG1-CE1 4Å; V237-H299 WeakPolarHBondContact CG2-NE2 3.21Å
238H77.7Confident77.3Confident157 Ų157100.1 Ų100.173%0.72753%0.529SS*.  trans-91.3110.8173.3-65.6-66.6000109.6
239Y82.1Confident77.8Confident68 Ų68101.1 Ų101.127%0.26753%0.534SS..  trans-72.4137.2174.2-57.6-66000110.7V237 R241 M243 H296 H299V237-Y239 HydrophobicContact CG1-CD1 4.21Å; V237-Y239 HydrophobicContact CG1-CE1 4Å; Y239-R241 VanDerWaalsContact C-N 3.25Å; Y239-R241 WeakPolarHBondContact CB-O 3.24Å; Y239-R241 PolarHBondContact O-N 3.43Å; Y239-M243 HydrophobicContact CD1-CG 3.9Å; Y239-M243 HydrophobicContact CD2-CB 3.96Å; Y239-M243 HydrophobicContact CD2-CG 3.93Å; Y239-M243 HydrophobicContact CE1-CG 4.35Å; Y239-M243 HydrophobicContact CE2-CB 4.31Å; Y239-M243 HydrophobicContact CE2-CG 4.4Å; Y239-M243 HydrophobicContact CG-CB 4.19Å; Y239-M243 HydrophobicContact CG-CG 3.63Å; Y239-H296 HydrophobicContact CD1-CB 3.87Å; Y239-H296 HydrophobicContact CE1-CB 4.24Å; Y239-H296 WeakPolarHBondContact CE1-O 3.3Å; Y239-H299 AromaticContact CE1-ND1 3.89Å; Y239-H299 AromaticContact CZ-ND1 3.64Å; Y239-H299 PolarHBondContact OH-ND1 3.04Å
240T78.4Confident78.2Confident112 Ų11297.4 Ų97.469%0.68752%0.523SS*.SBendtrans-68.8-23179.139.50000113.7H296T240-H296 PolarHBondContact OG1-ND1 3Å
241R80.4Confident78.8Confident133 Ų13390.2 Ų90.250%0.50251%0.509SS..SBendtrans-135160.6178.1-71.1-171.6178.4-178.41.5109.2Y239 M243 Y291Y239-R241 VanDerWaalsContact C-N 3.25Å; Y239-R241 WeakPolarHBondContact CB-O 3.24Å; Y239-R241 PolarHBondContact O-N 3.43Å; R241-M243 PolarHBondContact O-N 2.72Å; R241-M243 VanDerWaalsContact O-N 3.12Å; R241-Y291 HydrophobicContact CB-CD2 3.8Å; R241-Y291 HydrophobicContact CB-CE1 4.41Å; R241-Y291 HydrophobicContact CB-CE2 3.47Å; R241-Y291 VanDerWaalsContact CB-CE2 3.47Å; R241-Y291 HydrophobicContact CB-CG 4.39Å; R241-Y291 HydrophobicContact CG-CD2 4.38Å; R241-Y291 HydrophobicContact CG-CE2 4.39Å
242N82.6Confident79.4Confident148 Ų14892.7 Ų92.779%0.79152%0.515SS*.PPolyproline II helixtrans-55.3116.2176.9-61.963.3000109.8Y291N242-Y291 PolarHBondContact O-OH 3.17Å; N242-Y291 VanDerWaalsContact O-OH 3.04Å
243M83.6Confident80.3Confident27 Ų2792.4 Ų92.413%0.13351%0.512CS..PPolyproline II helixtrans-102.2148.6170.7-76.5-65.6-173.700108.5Y239 R241 P289 Y291 H296 L300Y239-M243 HydrophobicContact CD1-CG 3.9Å; Y239-M243 HydrophobicContact CD2-CB 3.96Å; Y239-M243 HydrophobicContact CD2-CG 3.93Å; Y239-M243 HydrophobicContact CE1-CG 4.35Å; Y239-M243 HydrophobicContact CE2-CB 4.31Å; Y239-M243 HydrophobicContact CE2-CG 4.4Å; Y239-M243 HydrophobicContact CG-CB 4.19Å; Y239-M243 HydrophobicContact CG-CG 3.63Å; R241-M243 PolarHBondContact O-N 2.72Å; R241-M243 VanDerWaalsContact O-N 3.12Å; M243-P289 HydrophobicContact SD-CG 3.73Å; M243-Y291 HydrophobicContact CE-CD2 3.83Å; M243-Y291 HydrophobicContact CE-CE2 3.94Å; M243-Y291 HydrophobicContact SD-CE2 4.13Å; M243-H296 HydrophobicContact CE-CB 3.91Å; M243-L300 HydrophobicContact CB-CD2 4.12Å; M243-L300 HydrophobicContact CG-CD2 4.48Å; M243-L300 HydrophobicContact SD-CD2 4.2Å
244P87.4Confident81.5Confident31 Ų3190.6 Ų90.620%0.20150%0.5CS..PPolyproline II helixtrans-56.1145.5169.7-22.733.3000111.2L249 P289P244-L249 HydrophobicContact CB-CD1 4.23Å; P244-L249 HydrophobicContact CB-CD2 3.97Å; P244-L249 HydrophobicContact CB-CG 3.96Å; P244-L249 HydrophobicContact CG-CD2 4.35Å; P244-P289 HydrophobicContact CG-CG 4.42Å
245E86.2Confident82.6Confident136 Ų13692.1 Ų92.164%0.63650%0.502SS*.PPolyproline II helixtrans-70.4144.3173.2-71.7-66.1158.100109.8S247 E248 L249E245-S247 PolarHBondContact O-N 3.45Å; E245-S247 VanDerWaalsContact O-N 3.12Å; E245-E248 WeakPolarHBondContact O-CB 3.46Å; E245-E248 PolarHBondContact O-N 3.36Å; E245-L249 PolarHBondContact O-N 3.28Å
246I86.7Confident83.6Confident48 Ų4889.5 Ų89.525%0.24649%0.487CS..Hα-helixtrans-57.8-34.3-177-61.5165.8000111.1E248 L249 M250 L300 L304 E307I246-E248 VanDerWaalsContact C-N 3.3Å; I246-E248 PolarHBondContact O-N 3.39Å; I246-L249 PolarHBondContact O-N 2.88Å; I246-M250 HydrophobicContact CG2-CG 4.45Å; I246-M250 HydrophobicContact CG2-SD 4.34Å; I246-M250 WeakPolarHBondContact O-CG 3.4Å; I246-M250 PolarHBondContact O-N 3.1Å; I246-M250 VanDerWaalsContact O-N 3.11Å; I246-L300 HydrophobicContact CG1-CD1 3.78Å; I246-L304 HydrophobicContact CG2-CD1 4.01Å; I246-E307 HydrophobicContact CG2-CB 4.08Å; I246-E307 HydrophobicContact CG2-CG 3.85Å
247S84.6Confident84.4Confident94 Ų9489 Ų8966%0.65748%0.478SS*.Hα-helixtrans-64.5-30.2176.5540000114.2E245E245-S247 PolarHBondContact O-N 3.45Å; E245-S247 VanDerWaalsContact O-N 3.12Å
248E87.5Confident84.8Confident135 Ų13590.4 Ų90.463%0.63148%0.481SS*.Hα-helixtrans-74-39.7178-168.1171.7-160.800110.3E245 I246 M250 A251E245-E248 WeakPolarHBondContact O-CB 3.46Å; E245-E248 PolarHBondContact O-N 3.36Å; I246-E248 VanDerWaalsContact C-N 3.3Å; I246-E248 PolarHBondContact O-N 3.39Å; E248-M250 VanDerWaalsContact C-N 3.25Å; E248-M250 PolarHBondContact O-N 3.44Å; E248-A251 VanDerWaalsContact O-CB 3.23Å; E248-A251 WeakPolarHBondContact O-CB 3.25Å; E248-A251 PolarHBondContact O-N 3.29Å
249L87.6Confident85.3Confident29 Ų2988.9 Ų88.915%0.15247%0.474CS..Hα-helixtrans-70.9-16.8174.8-62.4178.4000113.9P244 E245 I246 A251 L286 D287 I288 L300 L304P244-L249 HydrophobicContact CB-CD1 4.23Å; P244-L249 HydrophobicContact CB-CD2 3.97Å; P244-L249 HydrophobicContact CB-CG 3.96Å; P244-L249 HydrophobicContact CG-CD2 4.35Å; E245-L249 PolarHBondContact O-N 3.28Å; I246-L249 PolarHBondContact O-N 2.88Å; L249-A251 VanDerWaalsContact C-N 3.29Å; L249-L286 WeakPolarHBondContact CD2-O 3.28Å; L249-D287 HydrophobicContact CD2-CB 4.34Å; L249-I288 HydrophobicContact CD1-CD1 4.37Å; L249-I288 HydrophobicContact CD1-CG1 3.87Å; L249-I288 HydrophobicContact CD2-CG1 4.46Å; L249-L300 HydrophobicContact CD1-CD1 4.45Å; L249-L300 HydrophobicContact CD1-CD2 3.68Å; L249-L300 HydrophobicContact CD1-CG 3.91Å; L249-L304 HydrophobicContact CB-CD1 3.78Å; L249-L304 HydrophobicContact CB-CD2 3.97Å; L249-L304 HydrophobicContact CB-CG 4.49Å; L249-L304 HydrophobicContact CD1-CD2 4.36Å
250M84.3Confident85.4Confident65 Ų6589.5 Ų89.532%0.3249%0.485SS..THydrogen-bonded Turntrans-83.8-1.3173.2-73-177.57600113.5I246 E248 L304 E307 F308I246-M250 HydrophobicContact CG2-CG 4.45Å; I246-M250 HydrophobicContact CG2-SD 4.34Å; I246-M250 WeakPolarHBondContact O-CG 3.4Å; I246-M250 PolarHBondContact O-N 3.1Å; I246-M250 VanDerWaalsContact O-N 3.11Å; E248-M250 VanDerWaalsContact C-N 3.25Å; E248-M250 PolarHBondContact O-N 3.44Å; M250-L304 HydrophobicContact CG-CD1 3.7Å; M250-E307 HydrophobicContact SD-CB 4.15Å; M250-F308 HydrophobicContact CB-CZ 4.28Å; M250-F308 HydrophobicContact CE-CD1 4.18Å; M250-F308 HydrophobicContact CE-CE1 4.17Å; M250-F308 HydrophobicContact CG-CE1 4.35Å; M250-F308 HydrophobicContact CG-CE2 4.18Å; M250-F308 HydrophobicContact CG-CZ 4Å
251A85.8Confident85.6Confident64 Ų6486.4 Ų86.453%0.52946%0.463SS..SBendtrans-62.1151.6177.400000111.7E248 L249E248-A251 VanDerWaalsContact O-CB 3.23Å; E248-A251 WeakPolarHBondContact O-CB 3.25Å; E248-A251 PolarHBondContact O-N 3.29Å; L249-A251 VanDerWaalsContact C-N 3.29Å
252V85.1Confident85.6Confident134 Ų13485.4 Ų85.481%0.81247%0.468SS*.PPolyproline II helixtrans-66.2136.7173.5-178.80000108.9
253W86.7Confident85.5Confident90 Ų9084.9 Ų84.934%0.34147%0.465SS..PPolyproline II helixtrans-61.3143.9178.9-62.876.1000111F257 I261 L285 L286W253-F257 HydrophobicContact CB-CD1 4.47Å; W253-F257 AromaticContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CE1 4Å; W253-F257 AromaticContact CE3-CD1 3.08Å; W253-F257 HydrophobicContact CE3-CD1 3.08Å; W253-F257 AromaticContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CG 4.05Å; W253-F257 AromaticContact CE3-CZ 3.89Å; W253-F257 HydrophobicContact CE3-CZ 3.89Å; W253-F257 AromaticContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CZ 4.24Å; W253-F257 AromaticContact CZ3-CD1 3.53Å; W253-F257 HydrophobicContact CZ3-CD1 3.53Å; W253-F257 AromaticContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE2 4.4Å; W253-F257 HydrophobicContact CZ3-CG 4.5Å; W253-F257 AromaticContact CZ3-CZ 3.38Å; W253-F257 HydrophobicContact CZ3-CZ 3.38Å; W253-I261 HydrophobicContact CH2-CD1 4.37Å; W253-L285 HydrophobicContact CH2-CG 4.21Å; W253-L285 WeakPolarHBondContact CH2-O 3.32Å; W253-L285 WeakPolarHBondContact CZ3-O 3.48Å; W253-L286 HydrophobicContact CH2-CD2 3.89Å; W253-L286 HydrophobicContact CZ2-CD2 3.64Å
254P88.4Confident84.8Confident81 Ų8189.3 Ų89.353%0.52649%0.487SS..PPolyproline II helixtrans-57.9140.4172.4-2333.2000111.3S256 F257 E258P254-S256 VanDerWaalsContact C-N 3.26Å; P254-S256 PolarHBondContact O-N 2.89Å; P254-F257 HydrophobicContact CB-CB 4.33Å; P254-F257 WeakPolarHBondContact O-CA 3.49Å; P254-F257 WeakPolarHBondContact O-CB 3.44Å; P254-F257 PolarHBondContact O-N 3.28Å; P254-E258 PolarHBondContact O-N 2.98Å
255T86.7Confident83.7Confident103 Ų10396.4 Ų96.463%0.63252%0.517SS*.Hα-helixtrans-57.3-37.9-175.156.40000113.1F257 E258 E259T255-F257 PolarHBondContact O-N 2.97Å; T255-E258 PolarHBondContact O-N 3.43Å; T255-E259 WeakPolarHBondContact O-CB 3.43Å; T255-E259 WeakPolarHBondContact O-CG 3.42Å; T255-E259 PolarHBondContact O-N 3.32Å
256S88.4Confident82.6Confident79 Ų7993 Ų9355%0.55250%0.504SS*.Hα-helixtrans-60.8-34.3175.4560000112.7P254 T260P254-S256 VanDerWaalsContact C-N 3.26Å; P254-S256 PolarHBondContact O-N 2.89Å; S256-T260 PolarHBondContact O-N 2.91Å; S256-T260 PolarHBondContact O-OG1 2.9Å
257F85.9Confident81.5Confident70 Ų7093.5 Ų93.531%0.30751%0.511SS..Hα-helixtrans-79.6-42.8179.9-171.7-84.8000111W253 P254 T255 E259 T260 I261 L285W253-F257 HydrophobicContact CB-CD1 4.47Å; W253-F257 AromaticContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CE1 4Å; W253-F257 AromaticContact CE3-CD1 3.08Å; W253-F257 HydrophobicContact CE3-CD1 3.08Å; W253-F257 AromaticContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CG 4.05Å; W253-F257 AromaticContact CE3-CZ 3.89Å; W253-F257 HydrophobicContact CE3-CZ 3.89Å; W253-F257 AromaticContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CZ 4.24Å; W253-F257 AromaticContact CZ3-CD1 3.53Å; W253-F257 HydrophobicContact CZ3-CD1 3.53Å; W253-F257 AromaticContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE2 4.4Å; W253-F257 HydrophobicContact CZ3-CG 4.5Å; W253-F257 AromaticContact CZ3-CZ 3.38Å; W253-F257 HydrophobicContact CZ3-CZ 3.38Å; P254-F257 HydrophobicContact CB-CB 4.33Å; P254-F257 WeakPolarHBondContact O-CA 3.49Å; P254-F257 WeakPolarHBondContact O-CB 3.44Å; P254-F257 PolarHBondContact O-N 3.28Å; T255-F257 PolarHBondContact O-N 2.97Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.8Å; F257-T260 WeakPolarHBondContact O-CA 3.49Å; F257-T260 WeakPolarHBondContact O-CB 3.31Å; F257-T260 PolarHBondContact O-N 3Å; F257-I261 HydrophobicContact CD1-CD1 4.03Å; F257-I261 HydrophobicContact CD1-CG1 4.15Å; F257-I261 HydrophobicContact CE1-CD1 3.21Å; F257-I261 HydrophobicContact CE1-CG1 3.58Å; F257-I261 HydrophobicContact CZ-CD1 3.92Å; F257-I261 HydrophobicContact CZ-CG1 4.15Å; F257-I261 PolarHBondContact O-N 3.33Å; F257-L285 HydrophobicContact CZ-CD1 3.84Å
258E85.7Confident80.6Confident95 Ų9591.3 Ų91.344%0.44449%0.492SS..Hα-helixtrans-58.9-44.3174.5-175.1177.7-178.500111.8P254 T255 T260 I261 N262P254-E258 PolarHBondContact O-N 2.98Å; T255-E258 PolarHBondContact O-N 3.43Å; E258-T260 VanDerWaalsContact C-N 3.27Å; E258-T260 PolarHBondContact O-N 3.04Å; E258-I261 PolarHBondContact O-N 3.26Å; E258-N262 WeakPolarHBondContact O-CB 3.08Å; E258-N262 VanDerWaalsContact O-CG 3.3Å; E258-N262 PolarHBondContact O-N 3.12Å; E258-N262 PolarHBondContact O-ND2 3.11Å
259E86.7Confident79.6Confident124 Ų12490.8 Ų90.858%0.57950%0.503SS*.Hα-helixtrans-59.6-38.7173.1-74.1174.1-165.400111.9T255 F257 N262 N263T255-E259 WeakPolarHBondContact O-CB 3.43Å; T255-E259 WeakPolarHBondContact O-CG 3.42Å; T255-E259 PolarHBondContact O-N 3.32Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.8Å; E259-N262 PolarHBondContact O-N 3.35Å; E259-N263 WeakPolarHBondContact O-CB 3.24Å; E259-N263 PolarHBondContact O-N 3.45Å; E259-N263 PolarHBondContact O-ND2 3.31Å
260T84.3Confident78.8Confident82 Ų8297 Ų9750%0.50353%0.531SS..Hα-helixtrans-67.3-44.9178.6-57.20000111.4S256 F257 E258 N262 N263 M264S256-T260 PolarHBondContact O-N 2.91Å; S256-T260 PolarHBondContact O-OG1 2.9Å; F257-T260 WeakPolarHBondContact O-CA 3.49Å; F257-T260 WeakPolarHBondContact O-CB 3.31Å; F257-T260 PolarHBondContact O-N 3Å; E258-T260 VanDerWaalsContact C-N 3.27Å; E258-T260 PolarHBondContact O-N 3.04Å; T260-N262 VanDerWaalsContact C-N 3.35Å; T260-N263 PolarHBondContact O-N 3.27Å; T260-M264 WeakPolarHBondContact O-CB 3.48Å; T260-M264 PolarHBondContact O-N 3.32Å
261I83.2Confident78.2Confident46 Ų4697.7 Ų97.724%0.23654%0.536CS..Hα-helixtrans-63.4-40.2174.5-77.5-165.5000111.6W253 F257 E258 N263 M264 L266 L285W253-I261 HydrophobicContact CH2-CD1 4.37Å; F257-I261 HydrophobicContact CD1-CD1 4.03Å; F257-I261 HydrophobicContact CD1-CG1 4.15Å; F257-I261 HydrophobicContact CE1-CD1 3.21Å; F257-I261 HydrophobicContact CE1-CG1 3.58Å; F257-I261 HydrophobicContact CZ-CD1 3.92Å; F257-I261 HydrophobicContact CZ-CG1 4.15Å; F257-I261 PolarHBondContact O-N 3.33Å; E258-I261 PolarHBondContact O-N 3.26Å; I261-N263 VanDerWaalsContact C-N 3.3Å; I261-N263 PolarHBondContact O-N 3.31Å; I261-M264 CarbonylContact O-C 3.44Å; I261-M264 PolarHBondContact O-N 2.82Å; I261-L266 HydrophobicContact CD1-CD1 4.29Å; I261-L266 HydrophobicContact CG1-CD1 4.29Å; I261-L266 HydrophobicContact CG2-CD1 4.1Å; I261-L285 HydrophobicContact CD1-CD1 4.2Å
262N81.3Confident77.9Confident113 Ų113103 Ų10360%0.60456%0.556SS**Hα-helixtrans-67.5-33.5-179.8-75.5-32.4000112.2E258 E259 T260E258-N262 WeakPolarHBondContact O-CB 3.08Å; E258-N262 VanDerWaalsContact O-CG 3.3Å; E258-N262 PolarHBondContact O-N 3.12Å; E258-N262 PolarHBondContact O-ND2 3.11Å; E259-N262 PolarHBondContact O-N 3.35Å; T260-N262 VanDerWaalsContact C-N 3.35Å
263N79.8Confident77.8Confident136 Ų13698.8 Ų98.873%0.72753%0.532SS*.Hα-helixtrans-78.5-36.3176.3-69.6-34.7000112.5E259 T260 I261 Q265E259-N263 WeakPolarHBondContact O-CB 3.24Å; E259-N263 PolarHBondContact O-N 3.45Å; E259-N263 PolarHBondContact O-ND2 3.31Å; T260-N263 PolarHBondContact O-N 3.27Å; I261-N263 VanDerWaalsContact C-N 3.3Å; I261-N263 PolarHBondContact O-N 3.31Å; N263-Q265 PolarHBondContact O-N 3.41Å; N263-Q265 VanDerWaalsContact O-N 3.16Å
264M69Low77.9Confident120 Ų12097.2 Ų97.259%0.59153%0.534SS*.SBendtrans-8094.1175.1-163.6172.6-165.200107.1T260 I261 L266T260-M264 WeakPolarHBondContact O-CB 3.48Å; T260-M264 PolarHBondContact O-N 3.32Å; I261-M264 CarbonylContact O-C 3.44Å; I261-M264 PolarHBondContact O-N 2.82Å; M264-L266 HydrophobicContact CG-CD2 4.06Å; M264-L266 HydrophobicContact CG-CG 4.49Å; M264-L266 PolarHBondContact O-N 3.45Å; M264-L266 HydrophobicContact SD-CD2 3.9Å
265Q63.5Low77.9Confident180 Ų18099.9 Ų99.984%0.84154%0.543SS*.  trans-55.793.9163.3-72.5-178.9-13.300106.8N263 S267N263-Q265 PolarHBondContact O-N 3.41Å; N263-Q265 VanDerWaalsContact O-N 3.16Å; Q265-S267 PolarHBondContact O-N 3.28Å
266L62.9Low78Confident66 Ų66101.4 Ų101.435%0.34654%0.541SS..  trans-67.986.3-176.5-77.3170.3000106.2I261 M264 L268 L285I261-L266 HydrophobicContact CD1-CD1 4.29Å; I261-L266 HydrophobicContact CG1-CD1 4.29Å; I261-L266 HydrophobicContact CG2-CD1 4.1Å; M264-L266 HydrophobicContact CG-CD2 4.06Å; M264-L266 HydrophobicContact CG-CG 4.49Å; M264-L266 PolarHBondContact O-N 3.45Å; M264-L266 HydrophobicContact SD-CD2 3.9Å; L266-L268 HydrophobicContact CB-CD1 3.97Å; L266-L268 HydrophobicContact CB-CG 4.19Å; L266-L268 HydrophobicContact CD1-CD1 4.45Å; L266-L268 PolarHBondContact O-N 3.34Å; L266-L285 HydrophobicContact CD1-CD2 4.31Å
267S63.3Low78.1Confident58 Ų58101.2 Ų101.241%0.40653%0.534SS..  trans-73.556170.5560000108.6Q265 S269 Q270 L271Q265-S267 PolarHBondContact O-N 3.28Å; S267-S269 PolarHBondContact O-N 3.45Å; S267-Q270 VanDerWaalsContact CB-OE1 3.27Å; S267-Q270 PolarHBondContact O-N 3.07Å; S267-Q270 PolarHBondContact OG-OE1 2.93Å; S267-L271 WeakPolarHBondContact O-CD1 3.4Å
268L65.9Low78.2Confident47 Ų47101.6 Ų101.625%0.24653%0.534CS..G310 helixtrans-52.5-27.4177-82150000111.4L266 Q270 Y278L266-L268 HydrophobicContact CB-CD1 3.97Å; L266-L268 HydrophobicContact CB-CG 4.19Å; L266-L268 HydrophobicContact CD1-CD1 4.45Å; L266-L268 PolarHBondContact O-N 3.34Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; L268-Y278 HydrophobicContact CB-CE2 4.35Å; L268-Y278 HydrophobicContact CD2-CE2 3.95Å
269S66.6Low78.5Confident125 Ų12598 Ų9887%0.87452%0.519SS*.G310 helixtrans-77.3-13.3176.3-49.60000114.8S267S267-S269 PolarHBondContact O-N 3.45Å
270Q71.1Confident78.7Confident158 Ų15894 Ų9474%0.73850%0.501SS*.G310 helixtrans-103.3-1.7-179.1-66.2-178.8-26.200113S267 L268 D272S267-Q270 VanDerWaalsContact CB-OE1 3.27Å; S267-Q270 PolarHBondContact O-N 3.07Å; S267-Q270 PolarHBondContact OG-OE1 2.93Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; Q270-D272 PolarHBondContact O-N 2.82Å
271L73.1Confident78.9Confident80 Ų8093.4 Ų93.442%0.41949%0.494SS..  trans-71115.7174.5-81.3101000109.5S267 C273 I281S267-L271 WeakPolarHBondContact O-CD1 3.4Å; L271-C273 PolarHBondContact O-N 3.21Å; L271-I281 HydrophobicContact CD2-CD1 3.87Å
272D78.9Confident79.2Confident176 Ų17693.1 Ų93.194%0.94149%0.492SS*.  trans-77.274.4167.9-172.521.2000109.3Q270Q270-D272 PolarHBondContact O-N 2.82Å
273C82.9Confident79.7Confident46 Ų4687.7 Ų87.731%0.31146%0.464SS..  trans-133.3156178.870.90000112.4L271 D277L271-C273 PolarHBondContact O-N 3.21Å; C273-D277 HydrophobicContact CB-CB 4.07Å
274S88.4Confident80.1Confident56 Ų5684.4 Ų84.439%0.39246%0.455SS..  trans-67.5155.5177.481.30000110.7K276 D277 Y278S274-K276 PolarHBondContact O-N 3.31Å; S274-K276 VanDerWaalsContact O-N 3.07Å; S274-D277 WeakPolarHBondContact CB-OD2 3.46Å; S274-D277 PolarHBondContact O-N 3.3Å; S274-D277 PolarHBondContact OG-N 3.02Å; S274-D277 PolarHBondContact OG-OD2 3.3Å; S274-Y278 PolarHBondContact O-N 3Å
275L89Confident81Confident137 Ų13781 Ų8172%0.71744%0.439SS*.Hα-helixtrans-53.5-33.8176.9177.762.6000112.6V279L275-V279 HydrophobicContact CD1-CG2 4.41Å; L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.11Å
276K89.3Confident82.2Confident135 Ų13574.8 Ų74.859%0.58741%0.412SS*.Hα-helixtrans-66.8-45.3178.1-66.9177.7-176.8171.70111S274 Y278 V279 D280S274-K276 PolarHBondContact O-N 3.31Å; S274-K276 VanDerWaalsContact O-N 3.07Å; K276-Y278 VanDerWaalsContact C-N 3.33Å; K276-V279 PolarHBondContact O-N 3.49Å; K276-D280 PolarHBondContact O-N 2.86Å
277D89Confident83.5Confident76 Ų7677.5 Ų77.541%0.40643%0.426SS..Hα-helixtrans-68.4-37.4179-53.5-40.3000110.5C273 S274 V279 D280 I281C273-D277 HydrophobicContact CB-CB 4.07Å; S274-D277 WeakPolarHBondContact CB-OD2 3.46Å; S274-D277 PolarHBondContact O-N 3.3Å; S274-D277 PolarHBondContact OG-N 3.02Å; S274-D277 PolarHBondContact OG-OD2 3.3Å; D277-V279 PolarHBondContact O-N 3.22Å; D277-D280 PolarHBondContact O-N 3.48Å; D277-I281 WeakPolarHBondContact O-CB 3.43Å; D277-I281 WeakPolarHBondContact O-CD1 3.41Å; D277-I281 WeakPolarHBondContact O-CG1 3.43Å; D277-I281 PolarHBondContact O-N 2.93Å
278Y89.5Confident84.8Confident78 Ų7874.9 Ų74.931%0.30641%0.408SS..Hα-helixtrans-60.3-45.4174.6-171.4-106.2000112.3L268 S274 K276 D280 I281 I282L268-Y278 HydrophobicContact CB-CE2 4.35Å; L268-Y278 HydrophobicContact CD2-CE2 3.95Å; S274-Y278 PolarHBondContact O-N 3Å; K276-Y278 VanDerWaalsContact C-N 3.33Å; Y278-D280 VanDerWaalsContact C-N 3.33Å; Y278-D280 PolarHBondContact O-N 3.23Å; Y278-I281 PolarHBondContact O-N 2.9Å; Y278-I282 HydrophobicContact CD1-CD1 3.74Å; Y278-I282 HydrophobicContact CE1-CD1 3.17Å; Y278-I282 HydrophobicContact CE1-CG1 4.23Å; Y278-I282 HydrophobicContact CE2-CD1 4.29Å; Y278-I282 VanDerWaalsContact CZ-CD1 3.49Å; Y278-I282 WeakPolarHBondContact O-CG1 3.29Å; Y278-I282 PolarHBondContact O-N 2.98Å
279V90.7Very high86Confident20 Ų2074.5 Ų74.512%0.12141%0.408CS..Hα-helixtrans-61.4-43.5174.1169.50000110.8L275 K276 D277 I281 I282 C283 L298L275-V279 HydrophobicContact CD1-CG2 4.41Å; L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.11Å; K276-V279 PolarHBondContact O-N 3.49Å; D277-V279 PolarHBondContact O-N 3.22Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.93Å; V279-I282 PolarHBondContact O-N 3.04Å; V279-C283 WeakPolarHBondContact O-CB 3.44Å; V279-C283 PolarHBondContact O-N 3.44Å; V279-C283 PolarHBondContact O-SG 3.5Å; V279-L298 HydrophobicContact CG1-CD1 4.32Å; V279-L298 HydrophobicContact CG1-CD2 3.83Å; V279-L298 HydrophobicContact CG1-CG 3.98Å; V279-L298 HydrophobicContact CG2-CD2 4.25Å
280D90.4Very high87.1Confident39 Ų3970.8 Ų70.821%0.20938%0.38CS..Hα-helixtrans-65.2-38.1-179.6-64-8.9000111.3K276 D277 Y278 A284 V290 R294K276-D280 PolarHBondContact O-N 2.86Å; D277-D280 PolarHBondContact O-N 3.48Å; Y278-D280 VanDerWaalsContact C-N 3.33Å; Y278-D280 PolarHBondContact O-N 3.23Å; D280-A284 WeakPolarHBondContact O-CB 3.41Å; D280-A284 PolarHBondContact O-N 2.97Å; D280-V290 WeakPolarHBondContact OD1-CG1 3.28Å; D280-R294 IonicContact OD1-CZ 2.63Å; D280-R294 IonicContact OD1-NE 3.43Å; D280-R294 PolarHBondContact OD1-NE 3.33Å; D280-R294 IonicContact OD1-NH2 3.98Å; D280-R294 IonicContact OD2-CZ 3.36Å; D280-R294 IonicContact OD2-NE 3.48Å; D280-R294 PolarHBondContact OD2-NE 3.45Å; D280-R294 IonicContact OD2-NH2 3.53Å; D280-R294 PolarHBondContact OD2-NH2 2.88Å
281I88.4Confident87.8Confident69 Ų6966.5 Ų66.535%0.35436%0.358SS..Hα-helixtrans-65.1-47.1174.7-68.1162.6000111.1L271 D277 Y278 V279 A284 L285L271-I281 HydrophobicContact CD2-CD1 3.87Å; D277-I281 WeakPolarHBondContact O-CB 3.43Å; D277-I281 WeakPolarHBondContact O-CD1 3.41Å; D277-I281 WeakPolarHBondContact O-CG1 3.43Å; D277-I281 PolarHBondContact O-N 2.93Å; Y278-I281 PolarHBondContact O-N 2.9Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.93Å; I281-A284 PolarHBondContact O-N 3.43Å; I281-L285 WeakPolarHBondContact O-CB 3.38Å; I281-L285 PolarHBondContact O-N 3.33Å
282I89.9Confident88.2Confident40 Ų4069.9 Ų69.921%0.20538%0.376CS..Hα-helixtrans-64.6-45.2178.9-71.6178.5000111Y278 V279 A284 L285 L286 L301Y278-I282 HydrophobicContact CD1-CD1 3.74Å; Y278-I282 HydrophobicContact CE1-CD1 3.17Å; Y278-I282 HydrophobicContact CE1-CG1 4.23Å; Y278-I282 HydrophobicContact CE2-CD1 4.29Å; Y278-I282 VanDerWaalsContact CZ-CD1 3.49Å; Y278-I282 WeakPolarHBondContact O-CG1 3.29Å; Y278-I282 PolarHBondContact O-N 2.98Å; V279-I282 PolarHBondContact O-N 3.04Å; I282-A284 VanDerWaalsContact C-N 3.32Å; I282-A284 PolarHBondContact O-N 3.43Å; I282-L285 PolarHBondContact O-N 2.94Å; I282-L286 HydrophobicContact CG2-CD1 4.08Å; I282-L286 PolarHBondContact O-N 2.96Å; I282-L286 VanDerWaalsContact O-N 3.13Å; I282-L301 HydrophobicContact CG2-CD1 4.25Å; I282-L301 HydrophobicContact CG2-CD2 4.18Å
283C91.5Very high88.4Confident0 Ų064.7 Ų64.70%035%0.348CS..Hα-helixtrans-62.5-41.2177.1-75.20000111V279 L285 L286 D287 I288 V290V279-C283 WeakPolarHBondContact O-CB 3.44Å; V279-C283 PolarHBondContact O-N 3.44Å; V279-C283 PolarHBondContact O-SG 3.5Å; C283-L285 PolarHBondContact O-N 3.13Å; C283-L286 PolarHBondContact O-N 3.47Å; C283-D287 PolarHBondContact O-N 2.85Å; C283-I288 CarbonylContact C-O 3.42Å; C283-I288 HydrophobicContact CB-CB 4.07Å; C283-I288 HydrophobicContact CB-CG2 4.3Å; C283-I288 WeakPolarHBondContact O-CA 3.28Å; C283-I288 PolarHBondContact O-N 3.13Å; C283-V290 HydrophobicContact CB-CG2 3.46Å; C283-V290 VanDerWaalsContact CB-CG2 3.46Å
284A88.7Confident88.7Confident67 Ų6766.6 Ų66.655%0.55435%0.349SS*.Hα-helixtrans-64.4-37.6175.100000112.8D280 I281 I282 L286 D287D280-A284 WeakPolarHBondContact O-CB 3.41Å; D280-A284 PolarHBondContact O-N 2.97Å; I281-A284 PolarHBondContact O-N 3.43Å; I282-A284 VanDerWaalsContact C-N 3.32Å; I282-A284 PolarHBondContact O-N 3.43Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 3.37Å; A284-D287 PolarHBondContact O-N 3.14Å
285L88.1Confident88.7Confident49 Ų4969.2 Ų69.226%0.25736%0.357SS..Hα-helixtrans-62.2-40176.8-171.772.6000111.2W253 F257 I261 L266 I281 I282 C283 D287W253-L285 HydrophobicContact CH2-CG 4.21Å; W253-L285 WeakPolarHBondContact CH2-O 3.32Å; W253-L285 WeakPolarHBondContact CZ3-O 3.48Å; F257-L285 HydrophobicContact CZ-CD1 3.84Å; I261-L285 HydrophobicContact CD1-CD1 4.2Å; L266-L285 HydrophobicContact CD1-CD2 4.31Å; I281-L285 WeakPolarHBondContact O-CB 3.38Å; I281-L285 PolarHBondContact O-N 3.33Å; I282-L285 PolarHBondContact O-N 2.94Å; C283-L285 PolarHBondContact O-N 3.13Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.69Å
286L89.3Confident88.7Confident49 Ų4964.2 Ų64.226%0.25733%0.33SS..THydrogen-bonded Turntrans-90.716.8-177.2-67.4169.7000113.7L249 W253 I282 C283 A284 I288 L301L249-L286 WeakPolarHBondContact CD2-O 3.28Å; W253-L286 HydrophobicContact CH2-CD2 3.89Å; W253-L286 HydrophobicContact CZ2-CD2 3.64Å; I282-L286 HydrophobicContact CG2-CD1 4.08Å; I282-L286 PolarHBondContact O-N 2.96Å; I282-L286 VanDerWaalsContact O-N 3.13Å; C283-L286 PolarHBondContact O-N 3.47Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 3.37Å; L286-I288 HydrophobicContact CB-CD1 4.17Å; L286-I288 HydrophobicContact CB-CG1 4.24Å; L286-I288 PolarHBondContact O-N 3.02Å; L286-I288 VanDerWaalsContact O-N 3.14Å; L286-L301 HydrophobicContact CD1-CD1 3.2Å
287D88.9Confident88.8Confident122 Ų12257.8 Ų57.865%0.65230%0.302SS*.THydrogen-bonded Turntrans55.427.1-176.6-73.2-41.9000114.5L249 C283 A284 L285L249-D287 HydrophobicContact CD2-CB 4.34Å; C283-D287 PolarHBondContact O-N 2.85Å; A284-D287 PolarHBondContact O-N 3.14Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.69Å
288I91.5Very high88.9Confident4 Ų456 Ų562%0.02129%0.292CS..  trans-92.4115.7175.5-61173.2000109.2L249 C283 L286 V290 L300 L301L249-I288 HydrophobicContact CD1-CD1 4.37Å; L249-I288 HydrophobicContact CD1-CG1 3.87Å; L249-I288 HydrophobicContact CD2-CG1 4.46Å; C283-I288 CarbonylContact C-O 3.42Å; C283-I288 HydrophobicContact CB-CB 4.07Å; C283-I288 HydrophobicContact CB-CG2 4.3Å; C283-I288 WeakPolarHBondContact O-CA 3.28Å; C283-I288 PolarHBondContact O-N 3.13Å; L286-I288 HydrophobicContact CB-CD1 4.17Å; L286-I288 HydrophobicContact CB-CG1 4.24Å; L286-I288 PolarHBondContact O-N 3.02Å; L286-I288 VanDerWaalsContact O-N 3.14Å; I288-V290 PolarHBondContact O-N 2.85Å; I288-L300 HydrophobicContact CG1-CD2 4.37Å; I288-L300 HydrophobicContact CG2-CD2 4.11Å; I288-L301 HydrophobicContact CD1-CB 3.97Å; I288-L301 HydrophobicContact CD1-CD1 3.98Å
289P90.8Very high89Confident38 Ų3855.7 Ų55.725%0.24729%0.294CS..  trans-69.3134.5179.827.5-32.6000111.2M243 P244 Y291 S297M243-P289 HydrophobicContact SD-CG 3.73Å; P244-P289 HydrophobicContact CG-CG 4.42Å; P289-Y291 HydrophobicContact CB-CE1 4.31Å; P289-Y291 HydrophobicContact CB-CE2 4.13Å; P289-Y291 HydrophobicContact CG-CE2 4.04Å; P289-S297 PolarHBondContact O-OG 3.43Å
290V89.4Confident89Confident48 Ų4854.9 Ų54.929%0.29129%0.289SS..  trans-101118171.3-174.80000109.4D280 C283 I288 R294 S297D280-V290 WeakPolarHBondContact OD1-CG1 3.28Å; C283-V290 HydrophobicContact CB-CG2 3.46Å; C283-V290 VanDerWaalsContact CB-CG2 3.46Å; I288-V290 PolarHBondContact O-N 2.85Å; V290-R294 HydrophobicContact CG1-CG 3.78Å; V290-S297 WeakPolarHBondContact CA-OG 3.4Å
291Y86.1Confident89.1Confident67 Ų6754.3 Ų54.326%0.26329%0.286SS..  trans-102.3-152.3174.5-57.7-62.2000110.4R241 N242 M243 P289 N293R241-Y291 HydrophobicContact CB-CD2 3.8Å; R241-Y291 HydrophobicContact CB-CE1 4.41Å; R241-Y291 HydrophobicContact CB-CE2 3.47Å; R241-Y291 VanDerWaalsContact CB-CE2 3.47Å; R241-Y291 HydrophobicContact CB-CG 4.39Å; R241-Y291 HydrophobicContact CG-CD2 4.38Å; R241-Y291 HydrophobicContact CG-CE2 4.39Å; N242-Y291 PolarHBondContact O-OH 3.17Å; N242-Y291 VanDerWaalsContact O-OH 3.04Å; M243-Y291 HydrophobicContact CE-CD2 3.83Å; M243-Y291 HydrophobicContact CE-CE2 3.94Å; M243-Y291 HydrophobicContact SD-CE2 4.13Å; P289-Y291 HydrophobicContact CB-CE1 4.31Å; P289-Y291 HydrophobicContact CB-CE2 4.13Å; P289-Y291 HydrophobicContact CG-CE2 4.04Å; Y291-N293 PolarHBondContact O-N 3.5Å
292N81.8Confident89.3Confident151 Ų15157.3 Ų57.381%0.80730%0.296SS*.SBendtrans-63.4-25.4178.8-61.34.1000113.3
293N83.3Confident89.2Confident67 Ų6756.4 Ų56.436%0.35829%0.294SS..  trans-117106.8-178.8-170.7-2.7000111.4Y291 I295 H296Y291-N293 PolarHBondContact O-N 3.5Å; N293-I295 PolarHBondContact O-N 2.87Å; N293-I295 VanDerWaalsContact OD1-CB 3.24Å; N293-I295 WeakPolarHBondContact OD1-CB 3.27Å; N293-I295 WeakPolarHBondContact OD1-CG1 3.25Å; N293-I295 PolarHBondContact OD1-N 3.49Å; N293-H296 PolarHBondContact O-N 2.53Å
294R88.2Confident89.2Confident87 Ų8756.8 Ų56.833%0.32830%0.296SS..Hα-helixtrans-65.5-23.2176.9-69.2175.6175.785.8-1.2113.3D280 V290 H296 S297 L298D280-R294 IonicContact OD1-CZ 2.63Å; D280-R294 IonicContact OD1-NE 3.43Å; D280-R294 PolarHBondContact OD1-NE 3.33Å; D280-R294 IonicContact OD1-NH2 3.98Å; D280-R294 IonicContact OD2-CZ 3.36Å; D280-R294 IonicContact OD2-NE 3.48Å; D280-R294 PolarHBondContact OD2-NE 3.45Å; D280-R294 IonicContact OD2-NH2 3.53Å; D280-R294 PolarHBondContact OD2-NH2 2.88Å; V290-R294 HydrophobicContact CG1-CG 3.78Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.43Å; R294-S297 PolarHBondContact O-N 2.73Å; R294-L298 WeakPolarHBondContact O-CB 3.39Å; R294-L298 WeakPolarHBondContact O-CG 3.34Å; R294-L298 PolarHBondContact O-N 2.99Å
295I89.3Confident89.2Confident110 Ų11060.3 Ų60.356%0.56430%0.296SS*.Hα-helixtrans-64.6-34.4178.8-57.1-59.4000111.3N293 L298 H299N293-I295 PolarHBondContact O-N 2.87Å; N293-I295 VanDerWaalsContact OD1-CB 3.24Å; N293-I295 WeakPolarHBondContact OD1-CB 3.27Å; N293-I295 WeakPolarHBondContact OD1-CG1 3.25Å; N293-I295 PolarHBondContact OD1-N 3.49Å; I295-L298 PolarHBondContact O-N 3.48Å; I295-H299 WeakPolarHBondContact O-CB 3.32Å; I295-H299 PolarHBondContact O-N 2.64Å
296H88.8Confident89.2Confident32 Ų3262.7 Ų62.715%0.14831%0.308CS..Hα-helixtrans-66.3-42.7176.6-71.1-178.1000111.5Y239 T240 M243 N293 R294 H299 L300Y239-H296 HydrophobicContact CD1-CB 3.87Å; Y239-H296 HydrophobicContact CE1-CB 4.24Å; Y239-H296 WeakPolarHBondContact CE1-O 3.3Å; T240-H296 PolarHBondContact OG1-ND1 3Å; M243-H296 HydrophobicContact CE-CB 3.91Å; N293-H296 PolarHBondContact O-N 2.53Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.43Å; H296-H299 PolarHBondContact O-N 2.9Å; H296-L300 PolarHBondContact O-N 2.97Å; H296-L300 VanDerWaalsContact O-N 3.12Å
297S91Very high89.1Confident0 Ų064.5 Ų64.50%032%0.315CS..Hα-helixtrans-66.2-42176.7-51.30000111.3P289 V290 R294 L300 L301P289-S297 PolarHBondContact O-OG 3.43Å; V290-S297 WeakPolarHBondContact CA-OG 3.4Å; R294-S297 PolarHBondContact O-N 2.73Å; S297-L300 PolarHBondContact O-N 3.06Å; S297-L301 PolarHBondContact O-N 3.42Å
298L92.2Very high89Confident38 Ų3861.4 Ų61.420%0.19930%0.296CS..Hα-helixtrans-65.1-38.3174.1-75172.3000112.9V279 R294 I295 L300 L301 F302V279-L298 HydrophobicContact CG1-CD1 4.32Å; V279-L298 HydrophobicContact CG1-CD2 3.83Å; V279-L298 HydrophobicContact CG1-CG 3.98Å; V279-L298 HydrophobicContact CG2-CD2 4.25Å; R294-L298 WeakPolarHBondContact O-CB 3.39Å; R294-L298 WeakPolarHBondContact O-CG 3.34Å; R294-L298 PolarHBondContact O-N 2.99Å; I295-L298 PolarHBondContact O-N 3.48Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.8Å; L298-L301 HydrophobicContact CD2-CD2 3.97Å; L298-L301 WeakPolarHBondContact O-CB 3.41Å; L298-L301 PolarHBondContact O-N 2.85Å; L298-F302 HydrophobicContact CB-CE2 4.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.39Å; L298-F302 WeakPolarHBondContact O-CG 3.47Å; L298-F302 PolarHBondContact O-N 3.18Å
299H90.6Very high88.7Confident72 Ų7266 Ų6633%0.33332%0.316SS..Hα-helixtrans-59.9-43.3173.9179.1-93.2000110.9V237 Y239 I295 H296 S303V237-H299 WeakPolarHBondContact CG2-NE2 3.21Å; Y239-H299 AromaticContact CE1-ND1 3.89Å; Y239-H299 AromaticContact CZ-ND1 3.64Å; Y239-H299 PolarHBondContact OH-ND1 3.04Å; I295-H299 WeakPolarHBondContact O-CB 3.32Å; I295-H299 PolarHBondContact O-N 2.64Å; H296-H299 PolarHBondContact O-N 2.9Å; H299-S303 PolarHBondContact CE1-OG 2.91Å; H299-S303 VanDerWaalsContact O-CB 3.28Å; H299-S303 WeakPolarHBondContact O-CB 3.49Å; H299-S303 PolarHBondContact O-N 3.49Å; H299-S303 PolarHBondContact O-OG 2.96Å
300L90.7Very high88.3Confident3 Ų369 Ų692%0.01633%0.33CS..Hα-helixtrans-65.9-42175.9-169.163.4000111.7M243 I246 L249 I288 H296 S297 L298 F302 S303 L304M243-L300 HydrophobicContact CB-CD2 4.12Å; M243-L300 HydrophobicContact CG-CD2 4.48Å; M243-L300 HydrophobicContact SD-CD2 4.2Å; I246-L300 HydrophobicContact CG1-CD1 3.78Å; L249-L300 HydrophobicContact CD1-CD1 4.45Å; L249-L300 HydrophobicContact CD1-CD2 3.68Å; L249-L300 HydrophobicContact CD1-CG 3.91Å; I288-L300 HydrophobicContact CG1-CD2 4.37Å; I288-L300 HydrophobicContact CG2-CD2 4.11Å; H296-L300 PolarHBondContact O-N 2.97Å; H296-L300 VanDerWaalsContact O-N 3.12Å; S297-L300 PolarHBondContact O-N 3.06Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.8Å; L300-F302 PolarHBondContact O-N 2.96Å; L300-S303 PolarHBondContact O-N 3.38Å; L300-L304 VanDerWaalsContact O-CB 3.32Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.29Å
301L92.5Very high87.8Confident28 Ų2867.8 Ų67.815%0.14732%0.323CS..Hα-helixtrans-57.1-49175.1179.970.4000112I282 L286 I288 S297 L298 L304 Y305I282-L301 HydrophobicContact CG2-CD1 4.25Å; I282-L301 HydrophobicContact CG2-CD2 4.18Å; L286-L301 HydrophobicContact CD1-CD1 3.2Å; I288-L301 HydrophobicContact CD1-CB 3.97Å; I288-L301 HydrophobicContact CD1-CD1 3.98Å; S297-L301 PolarHBondContact O-N 3.42Å; L298-L301 HydrophobicContact CD2-CD2 3.97Å; L298-L301 WeakPolarHBondContact O-CB 3.41Å; L298-L301 PolarHBondContact O-N 2.85Å; L301-L304 WeakPolarHBondContact O-CB 3.43Å; L301-L304 PolarHBondContact O-N 3.05Å; L301-Y305 PolarHBondContact O-N 3.28Å
302F92.3Very high86.6Confident131 Ų13171.5 Ų71.558%0.57534%0.343SS*.Hα-helixtrans-70.5-33.2178.3-64.4-41.4000112.6L298 L300 Y305 L306L298-F302 HydrophobicContact CB-CE2 4.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.39Å; L298-F302 WeakPolarHBondContact O-CG 3.47Å; L298-F302 PolarHBondContact O-N 3.18Å; L300-F302 PolarHBondContact O-N 2.96Å; F302-Y305 PolarHBondContact O-N 2.9Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 2.66Å
303S89.1Confident85.6Confident22 Ų2271.2 Ų71.215%0.15434%0.337CS..Hα-helixtrans-64.7-44.1173.2-59.70000111H299 L300 L306 E307H299-S303 PolarHBondContact CE1-OG 2.91Å; H299-S303 VanDerWaalsContact O-CB 3.28Å; H299-S303 WeakPolarHBondContact O-CB 3.49Å; H299-S303 PolarHBondContact O-N 3.49Å; H299-S303 PolarHBondContact O-OG 2.96Å; L300-S303 PolarHBondContact O-N 3.38Å; S303-L306 PolarHBondContact O-N 2.82Å; S303-E307 PolarHBondContact O-N 3.41Å
304L90Very high84.3Confident7 Ų772.9 Ų72.94%0.03734%0.341CS..Hα-helixtrans-59.5-47173.8-179.164.1000111I246 L249 M250 L300 L301 L306 E307 F308I246-L304 HydrophobicContact CG2-CD1 4.01Å; L249-L304 HydrophobicContact CB-CD1 3.78Å; L249-L304 HydrophobicContact CB-CD2 3.97Å; L249-L304 HydrophobicContact CB-CG 4.49Å; L249-L304 HydrophobicContact CD1-CD2 4.36Å; M250-L304 HydrophobicContact CG-CD1 3.7Å; L300-L304 VanDerWaalsContact O-CB 3.32Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.29Å; L301-L304 WeakPolarHBondContact O-CB 3.43Å; L301-L304 PolarHBondContact O-N 3.05Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.91Å; L304-E307 PolarHBondContact O-N 3.41Å; L304-F308 HydrophobicContact CD1-CD2 3.9Å; L304-F308 HydrophobicContact CD1-CE2 3.54Å; L304-F308 HydrophobicContact CD1-CZ 4.48Å; L304-F308 HydrophobicContact CD2-CE2 4.31Å; L304-F308 HydrophobicContact CG-CD2 3.85Å; L304-F308 HydrophobicContact CG-CE2 3.74Å; L304-F308 VanDerWaalsContact O-CD2 3.26Å; L304-F308 WeakPolarHBondContact O-CD2 3.46Å; L304-F308 PolarHBondContact O-N 3.04Å
305Y90.1Very high82.8Confident142 Ų14277.6 Ų77.656%0.55736%0.359SS*.Hα-helixtrans-60-41.6175.8-179.8-100.3000112.7L301 F302 F308 K309L301-Y305 PolarHBondContact O-N 3.28Å; F302-Y305 PolarHBondContact O-N 2.9Å; Y305-F308 PolarHBondContact O-N 2.87Å; Y305-K309 HydrophobicContact CD1-CG 4.27Å; Y305-K309 HydrophobicContact CE1-CG 3.84Å; Y305-K309 VanDerWaalsContact CZ-CE 3.48Å; Y305-K309 WeakPolarHBondContact O-CB 3.39Å; Y305-K309 WeakPolarHBondContact O-CG 3.3Å; Y305-K309 PolarHBondContact O-N 3.29Å; Y305-K309 WeakPolarHBondContact OH-CE 3.37Å
306L88.3Confident81Confident99 Ų9978.1 Ų78.152%0.51836%0.359SS..Hα-helixtrans-66.9-42.4178.3-177.362.5000111.9F302 S303 L304 F308 K309 N310F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 2.66Å; S303-L306 PolarHBondContact O-N 2.82Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.91Å; L306-F308 VanDerWaalsContact C-N 3.34Å; L306-K309 PolarHBondContact O-N 2.95Å; L306-N310 WeakPolarHBondContact O-CB 3.08Å; L306-N310 VanDerWaalsContact O-CG 3.26Å; L306-N310 PolarHBondContact O-N 3.47Å; L306-N310 PolarHBondContact O-ND2 3.39Å
307E87Confident79.3Confident87 Ų8781.6 Ų81.641%0.40738%0.379SS..Hα-helixtrans-62.6-41.4173.8-76.2-59.5150.600111.4I246 M250 S303 L304 K309 N310 S311I246-E307 HydrophobicContact CG2-CB 4.08Å; I246-E307 HydrophobicContact CG2-CG 3.85Å; M250-E307 HydrophobicContact SD-CB 4.15Å; S303-E307 PolarHBondContact O-N 3.41Å; L304-E307 PolarHBondContact O-N 3.41Å; E307-K309 PolarHBondContact O-N 3.14Å; E307-N310 PolarHBondContact O-N 3.37Å; E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.19Å
308F85.8Confident77.4Confident56 Ų5688.3 Ų88.325%0.24641%0.41CS..Hα-helixtrans-60.6-44.4173-87.4-59.4000112.6M250 L304 Y305 L306 N310 S311 F314M250-F308 HydrophobicContact CB-CZ 4.28Å; M250-F308 HydrophobicContact CE-CD1 4.18Å; M250-F308 HydrophobicContact CE-CE1 4.17Å; M250-F308 HydrophobicContact CG-CE1 4.35Å; M250-F308 HydrophobicContact CG-CE2 4.18Å; M250-F308 HydrophobicContact CG-CZ 4Å; L304-F308 HydrophobicContact CD1-CD2 3.9Å; L304-F308 HydrophobicContact CD1-CE2 3.54Å; L304-F308 HydrophobicContact CD1-CZ 4.48Å; L304-F308 HydrophobicContact CD2-CE2 4.31Å; L304-F308 HydrophobicContact CG-CD2 3.85Å; L304-F308 HydrophobicContact CG-CE2 3.74Å; L304-F308 VanDerWaalsContact O-CD2 3.26Å; L304-F308 WeakPolarHBondContact O-CD2 3.46Å; L304-F308 PolarHBondContact O-N 3.04Å; Y305-F308 PolarHBondContact O-N 2.87Å; L306-F308 VanDerWaalsContact C-N 3.34Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.47Å; F308-S311 PolarHBondContact O-N 3.38Å; F308-S311 PolarHBondContact O-OG 2.94Å; F308-F314 AromaticContact CD1-CD2 3.67Å; F308-F314 HydrophobicContact CD1-CD2 3.67Å; F308-F314 AromaticContact CD1-CE2 3.16Å; F308-F314 HydrophobicContact CD1-CE2 3.16Å; F308-F314 AromaticContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CE1-CD2 4.31Å; F308-F314 AromaticContact CE1-CE2 3.35Å; F308-F314 HydrophobicContact CE1-CE2 3.35Å; F308-F314 AromaticContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CG-CE2 4.4Å
309K84.9Confident75.1Confident100 Ų10091.1 Ų91.144%0.43543%0.433SS..Hα-helixtrans-61.3-35.2174.6-82.3-81.6-178.3-1740112.9Y305 L306 E307Y305-K309 HydrophobicContact CD1-CG 4.27Å; Y305-K309 HydrophobicContact CE1-CG 3.84Å; Y305-K309 VanDerWaalsContact CZ-CE 3.48Å; Y305-K309 WeakPolarHBondContact O-CB 3.39Å; Y305-K309 WeakPolarHBondContact O-CG 3.3Å; Y305-K309 PolarHBondContact O-N 3.29Å; Y305-K309 WeakPolarHBondContact OH-CE 3.37Å; L306-K309 PolarHBondContact O-N 2.95Å; E307-K309 PolarHBondContact O-N 3.14Å
310N83.4Confident73Confident101 Ų10193 Ų9354%0.5445%0.449SS..Hα-helixtrans-80.9-30179.5-71.3-25.9000112.7L306 E307 F308 Q312L306-N310 WeakPolarHBondContact O-CB 3.08Å; L306-N310 VanDerWaalsContact O-CG 3.26Å; L306-N310 PolarHBondContact O-N 3.47Å; L306-N310 PolarHBondContact O-ND2 3.39Å; E307-N310 PolarHBondContact O-N 3.37Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.47Å; N310-Q312 PolarHBondContact O-N 2.81Å
311S78.3Confident70.8Confident23 Ų23100 Ų10016%0.16149%0.485CS..SBendtrans-66.7129.5-179.673.90000111.5E307 F308 H313 F314E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.19Å; F308-S311 PolarHBondContact O-N 3.38Å; F308-S311 PolarHBondContact O-OG 2.94Å; S311-H313 PolarHBondContact O-N 2.93Å; S311-F314 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact OG-CD2 3.44Å
312Q61.6Low68.3Low145 Ų145108.2 Ų108.268%0.67854%0.537SS*.Hα-helixtrans-63.7-25.3-174.1-67.7-1721.600113.6N310 F314 R315 Q316N310-Q312 PolarHBondContact O-N 2.81Å; Q312-F314 PolarHBondContact O-N 3.28Å; Q312-R315 PolarHBondContact O-N 3.06Å; Q312-Q316 PolarHBondContact O-N 3.07Å
313H59.4Low67.1Low146 Ų146107.1 Ų107.168%0.67654%0.535SS*.Hα-helixtrans-57.3-32-177.5-76.4-73.9000113.5S311S311-H313 PolarHBondContact O-N 2.93Å
314F56.9Low65.9Low102 Ų102111.6 Ų111.645%0.44756%0.555SS.*Hα-helixtrans-91.7-25.8179.7-67.7-85.6000113.6F308 S311 Q312 Q316 N317 E318F308-F314 AromaticContact CD1-CD2 3.67Å; F308-F314 HydrophobicContact CD1-CD2 3.67Å; F308-F314 AromaticContact CD1-CE2 3.16Å; F308-F314 HydrophobicContact CD1-CE2 3.16Å; F308-F314 AromaticContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CE1-CD2 4.31Å; F308-F314 AromaticContact CE1-CE2 3.35Å; F308-F314 HydrophobicContact CE1-CE2 3.35Å; F308-F314 AromaticContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CG-CE2 4.4Å; S311-F314 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact OG-CD2 3.44Å; Q312-F314 PolarHBondContact O-N 3.28Å; F314-Q316 PolarHBondContact O-N 3.16Å; F314-N317 PolarHBondContact O-N 3.32Å; F314-E318 PolarHBondContact O-N 3.34Å
315R56.2Low64.6Low185 Ų185117.4 Ų117.470%0.69858%0.584SS**Hα-helixtrans-65.2-24.6174.4-57.3-169.793.3-170.68.5112.2Q312Q312-R315 PolarHBondContact O-N 3.06Å
316Q52.7Low63.1Low122 Ų122115.9 Ų115.957%0.5759%0.585SS**Hα-helixtrans-80.6-32.6175.6-80.9158.6-7.900112.8Q312 F314 S319Q312-Q316 PolarHBondContact O-N 3.07Å; F314-Q316 PolarHBondContact O-N 3.16Å; Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 PolarHBondContact O-OG 3.17Å
317N53Low61.5Low105 Ų105117 Ų11756%0.56159%0.589SS**Hα-helixtrans-78.9-23.4-178.9-72.1-3.6000114F314 S319 V320F314-N317 PolarHBondContact O-N 3.32Å; N317-S319 PolarHBondContact O-N 3.15Å; N317-V320 PolarHBondContact O-N 3.09Å
318E50.7Low59.8Low140 Ų140119 Ų11965%0.65460%0.602SS**G310 helixtrans-64.5-19.3171.5-89.1178164.200112.9F314 V320F314-E318 PolarHBondContact O-N 3.34Å; E318-V320 VanDerWaalsContact C-N 3.33Å; E318-V320 PolarHBondContact O-N 2.78Å
319S44.5Very low57.9Low97 Ų97123.5 Ų123.568%0.67863%0.627SS**G310 helixtrans-82.3-2.7-179.3700000115.4Q316 N317Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 PolarHBondContact O-OG 3.17Å; N317-S319 PolarHBondContact O-N 3.15Å
320V45.9Very low55.9Low112 Ų112125.3 Ų125.368%0.67964%0.642SS**G310 helixtrans-112.1-0.9-173.2-169.30000112.8N317 E318N317-V320 PolarHBondContact O-N 3.09Å; E318-V320 VanDerWaalsContact C-N 3.33Å; E318-V320 PolarHBondContact O-N 2.78Å
321I43.6Very low53.6Low151 Ų151127.3 Ų127.377%0.77465%0.65SS**  trans-12247.5-175.7-43.4-178.5000112
322T40.2Very low51.3Low200 Ų200136.8 Ų136.8100%1.22770%0.695SS**  trans-129.20157.9-49.80000108.4

Retrieved 322 of 322 residues in 324.4 ms (Link to these results)