A0A3Q0KG95_SCHMA Loading...

Adiponectin receptor, putative

AlphaFold DB , UniProt , Accession A0A3Q0KG95, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 440 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
1M36.6Very low40Very low235 Ų235156.8 Ų156.8100%1.15886%0.859SS**  0119.20-83.2171.7158.600108
2M40.5Very low39.3Very low198 Ų198156.7 Ų156.798%0.97586%0.855SS**  trans46.3123154.1-57.5172.9-179.200118.3
3G37.4Very low38.8Very low77 Ų77152 Ų15279%0.79484%0.841SS**  cis163.2132.95.400000108.5
4S40.5Very low38.7Very low120 Ų120151.6 Ų151.684%0.83983%0.829SS**  trans-79.6-169.7152.1-52.60000108.5
5P51.5Low38.7Very low114 Ų114150.9 Ų150.974%0.7482%0.824SS**  cis-141.3-171.7-535.1-12.3000113.8
6S39.5Very low38.3Very low122 Ų122149.1 Ų149.185%0.85381%0.811SS**  147135.9129.457.50000116.4
7R37.4Very low38.4Very low239 Ų239150.4 Ų150.490%0.90281%0.81SS**  trans-82.7-156.2175.4-57.6-179.8173.2178.7-2.6111.2
8P43.9Very low38.2Very low106 Ų106150.9 Ų150.969%0.68881%0.806SS**  cis-145.1-156.7-7.333.5-6.3000115.8
9T38.9Very low38.2Very low122 Ų122150.7 Ų150.775%0.74881%0.811SS**  trans97.5109.7163.867.70000116.8
10D33.6Very low37.9Very low147 Ų147147.8 Ų147.879%0.78680%0.803SS**  77.1113.771-81.3-23000114.4
11Y40.8Very low37.5Very low245 Ų245146 Ų14696%0.96180%0.801SS**  trans-147.6121.5151.3-101.4-82.8000110.3
12L31Very low37.6Very low155 Ų155143.5 Ų143.581%0.81279%0.787SS**  trans-122.3159-174-136.1158.6000108.2
13S32.9Very low37.4Very low96 Ų96141.6 Ų141.667%0.67178%0.775SS**  trans86.2140.3167.983.70000116.5
14H37.5Very low37.3Very low146 Ų146144.5 Ų144.568%0.67677%0.773SS**  cis-168.4164.539.9-128.7-72.5000113.5
15N38.7Very low37.2Very low141 Ų141147.1 Ų147.175%0.75478%0.777SS**  trans95.7104.3159.3-57.3-17.6000116.9
16I32.9Very low36.3Very low122 Ų122150 Ų15063%0.62678%0.783SS**  cis69109.648.7-52.2178.8000114.4
17H39.3Very low36.1Very low171 Ų171152.9 Ų152.979%0.79278%0.783SS**  174.7107.8127.8-93.4-70.6000109.5
18H35.3Very low36Very low160 Ų160148.3 Ų148.374%0.74178%0.776SS**  69.6108.595.6-110.7-72.7000115.5
19V37.5Very low35.8Very low148 Ų148150.2 Ų150.290%0.89779%0.786SS**  -160119.4124.8175.40000108.1
20S31.8Very low35.6Very low92 Ų92156.4 Ų156.464%0.64380%0.796SS**  trans-95.2150.1173.1-82.90000111.5
21S30.9Very low35.6Very low110 Ų110152.8 Ų152.877%0.76979%0.793SS**  trans49.4123140.967.80000120.7
22E37.2Very low35.4Very low183 Ų183150.8 Ų150.886%0.85579%0.789SS**  -157.3123.9129.1-110175.8176.500112.6
23H37.8Very low35.6Very low158 Ų158152.9 Ų152.973%0.73180%0.795SS**  trans51.7111.1146.8-80.1-62.1000124.6
24D35.3Very low35.8Very low138 Ų138159.5 Ų159.574%0.73881%0.805SS**  26.5114119.9-61.3-42.4000119.3
25N37.5Very low35.7Very low174 Ų174163.4 Ų163.493%0.9381%0.814SS**  -155126.2121.5-125.5-22.1000112.1
26M32.7Very low35.7Very low175 Ų175166 Ų16686%0.86282%0.824SS**  trans-103.5116-171.7-175.3-173.3-17700108
27Q35.7Very low35.9Very low183 Ų183168.2 Ų168.286%0.85583%0.831SS**  trans-168.2128.2154.3-110.5167.225.300113.5
28N35.5Very low35.7Very low142 Ų142165.8 Ų165.876%0.75983%0.833SS**  trans59.8107.6151.6-90.4-20000119.5
29T38.3Very low35.7Very low146 Ų146167 Ų16790%0.89684%0.839SS**  -173124.998.827.30000111.3
30R34.5Very low35.3Very low252 Ų252163.3 Ų163.395%0.95183%0.831SS**  trans-100.6126.4-178.5-163.7-176.1-164.9-177.84.7106.4
31G34.5Very low35.4Very low72 Ų72164.7 Ų164.774%0.74284%0.841SS**  trans166.984.1170.300000120.2
32K35.9Very low35.5Very low202 Ų202164 Ų16488%0.87884%0.842SS**  trans61.6107.2137.2-73.6178.3174.5175.10120.1
33H36.1Very low35.3Very low199 Ų199161.7 Ų161.792%0.92184%0.844SS**  trans-45.9132.2139.8-92.4-63.8000111.9
34R37.5Very low35Very low236 Ų236161.6 Ų161.689%0.89185%0.848SS**  trans-129.8114.4160.7-116.1-179.4-178.6-179.6-0.5109.7
35R35.6Very low35.1Very low227 Ų227161.3 Ų161.386%0.85785%0.851SS**  trans-64.4135.2155.6-85.2179.3-179.6167.40.1108
36M38Very low34.8Very low195 Ų195158.1 Ų158.196%0.96184%0.843SS**  trans-88.2111.5162.8-83.7-178.5165.300108.6
37H36.4Very low35.1Very low169 Ų169155.3 Ų155.378%0.78284%0.84SS**  trans-99.7133.9154.2-100.5-92.8000107.4
38S35.7Very low35.1Very low120 Ų120151.6 Ų151.684%0.83983%0.834SS**  trans-79.8117.4171.91590000109
39E34.5Very low35Very low185 Ų185150.3 Ų150.386%0.86484%0.835SS**  trans-123.4125.7161.4-78.2-178.2162.200108.5
40G29.2Very low34.9Very low71 Ų71150.9 Ų150.973%0.73283%0.833SS**  trans-75.1148.3166.100000110.5
41S35.1Very low35.2Very low122 Ų122144.1 Ų144.185%0.85382%0.822SS**  trans-149.5124.2159.7-84.40000109.2
42A31.9Very low35.3Very low95 Ų95148.4 Ų148.479%0.78583%0.827SS**  trans-72.2144.5167.200000109.8
43C33.8Very low35.5Very low134 Ų134146.1 Ų146.191%0.90582%0.823SS**  trans-126.8126.7160.6-89.40000109
44I30.6Very low35.5Very low156 Ų156142.1 Ų142.180%0.881%0.814SS**  trans-94.6141.9174.8-66.1168.4000108.2
45T38.1Very low35.7Very low132 Ų132137.9 Ų137.981%0.8181%0.809SS**  trans178.7100.2147.331.80000107.3
46S31Very low35.9Very low107 Ų107135 Ų13575%0.74881%0.806SS**  77.597.286.573.50000116
47S40.2Very low35.7Very low116 Ų116131 Ų13181%0.81179%0.792SS**  trans-174.8154.413971.80000107.2
48S34.3Very low35.8Very low105 Ų105129.3 Ų129.373%0.73479%0.789SS**  cis-166.9158.9-25.2-79.30000104.5
49C34.3Very low35.8Very low116 Ų116129 Ų12978%0.78478%0.782SS**  trans92.383.3165.2-54.90000119.3
50D36.6Very low35.8Very low157 Ų157126.5 Ų126.584%0.8478%0.775SS**  71.5141.5125.4-60.6-21.8000125.2
51P39.6Very low36.1Very low110 Ų110132.7 Ų132.771%0.71478%0.776SS**  trans-121.1-167.9-158.736.5-14.7000113.3
52L37.7Very low36Very low163 Ų163134.7 Ų134.785%0.85377%0.774SS**  trans130.1121.2167.7-72.7165.4000107.7
53I39Very low36.1Very low154 Ų154135.5 Ų135.579%0.7977%0.771SS**  cis-163.5147.831.1-60-177.1000108.2
54P37.2Very low36.3Very low115 Ų115138.3 Ų138.375%0.74777%0.771SS**  trans-116.8150.4174.538.9-26.6000115.2
55N41.3Very low36.3Very low147 Ų147141.4 Ų141.479%0.78678%0.779SS**  trans173146.6152.5-111.3-5.8000106
56Q39.1Very low36.2Very low167 Ų167139.6 Ų139.678%0.7878%0.777SS**  cis-165.7163.824.2-137.5166.6-3.200108
57T35.3Very low36.2Very low110 Ų110142.7 Ų142.768%0.67579%0.785SS**  trans-69.8153.1-177.347.80000114.4
58D36.8Very low35.8Very low133 Ų133147 Ų14771%0.71178%0.783SS**  150.9126.7110.6-88.6-46.8000114.6
59T35.8Very low35.7Very low115 Ų115153.4 Ų153.471%0.70679%0.791SS**  trans45.3129.5140.161.20000123.3
60D34.4Very low35.7Very low132 Ų132157.8 Ų157.871%0.70679%0.791SS**  99.2137.2121.7-104.37.7000123.2
61W35.8Very low35.7Very low201 Ų201160 Ų16076%0.76179%0.794SS**  trans77.3103.7158.6-62.7104.3000122.9
62M32.5Very low35.2Very low164 Ų164162.6 Ų162.681%0.80880%0.8SS**  trans48151.1131.4-74.3-16775.300123.8
63P35.8Very low35.2Very low111 Ų111160.6 Ų160.672%0.72180%0.797SS**  trans-103.1149.7-150.438.1-30000115.3
64Q36.9Very low34.9Very low193 Ų193162 Ų16290%0.90280%0.8SS**  trans-124.5140162.6-76.6-1714.300111.8
65F29.7Very low34.4Very low221 Ų221166.5 Ų166.597%0.96981%0.809SS**  trans-48.2128.1172-89.2-105.6000112.5
66A36.6Very low33.9Very low94 Ų94165.3 Ų165.378%0.77781%0.81SS**  trans-143.9126.8159.500000110.6R68A66-R68 PolarHBondContact O-N 2.88Å
67L31.9Very low33.2Very low173 Ų173165.6 Ų165.691%0.90682%0.816SS**  trans-47.2130.4177.4-73.598.5000112.5
68R31.5Very low33.1Very low207 Ų207165.9 Ų165.978%0.78182%0.823SS**  trans-111.193.8164.3-148.5175.1-161.9-166.84.6110.1A66 R70A66-R68 PolarHBondContact O-N 2.88Å; R68-R70 PolarHBondContact O-N 3.08Å
69R32.1Very low32.9Very low239 Ų239164.6 Ų164.690%0.90282%0.824SS**PPolyproline II helixtrans-57.9121.1154.3-70.5-173.8-160.2-165.65.3107.2
70R34.9Very low32.5Very low208 Ų208167 Ų16779%0.78583%0.833SS**PPolyproline II helixtrans-99.1125.5164.6-90.2-174.7178.6170.90.8109.4R68R68-R70 PolarHBondContact O-N 3.08Å
71K36.3Very low32.5Very low204 Ų204166 Ų16689%0.88784%0.836SS**PPolyproline II helixtrans-58140.4179.6-65.4176.4171.7-173.60111.9
72L27.7Very low32.2Very low163 Ų163161.4 Ų161.485%0.85384%0.835SS**PPolyproline II helixtrans-68.7143153.3-98.189000108.9
73P38.6Very low32.4Very low122 Ų122161.4 Ų161.479%0.79284%0.838SS**PPolyproline II helixtrans-78.1138.7164.7-2.320.8000110.6
74E32.8Very low32.2Very low183 Ų183164.7 Ų164.786%0.85584%0.843SS**PPolyproline II helixtrans-61.9141175.7-70.6163.7143.700112.4
75F27.1Very low32Very low210 Ų210162 Ų16292%0.92184%0.84SS**  trans-77.9112.5163.7-106.9-96.4000108.5L77F75-L77 PolarHBondContact O-N 3.48Å
76C29.5Very low32Very low121 Ų121157.1 Ų157.182%0.81883%0.828SS**  trans-81110.2163.3-70.70000109.2
77L24.8Very low31.9Very low173 Ų173159.2 Ų159.291%0.90683%0.831SS**  trans-78.2123.9154.1-80.4160.7000107.2F75F75-L77 PolarHBondContact O-N 3.48Å
78S32.9Very low32.1Very low116 Ų116158.6 Ų158.681%0.81183%0.829SS**  trans-118.3127.3164.1-142.40000109.5
79S34Very low32.2Very low106 Ų106153.2 Ų153.274%0.74183%0.829SS**  trans-42.4150176.547.30000117.4
80D26.7Very low32.2Very low166 Ų166152.9 Ų152.989%0.88883%0.829SS**  trans-40134.4164-71.7-47.8000114.8
81S34.4Very low32.3Very low110 Ų110149 Ų14977%0.76983%0.829SS**  trans-150112.5142.763.70000109.2
82S30.4Very low32.3Very low105 Ų105144.7 Ų144.773%0.73482%0.822SS**  trans-34.8130.3167.347.30000114.8
83N34.9Very low32.8Very low164 Ų164146 Ų14688%0.87782%0.823SS**  trans-158.6127138-94.8-27.7000111.3
84H31.5Very low32.9Very low181 Ų181144.5 Ų144.584%0.83881%0.814SS**  trans-55.6127.6177.7-79.5-88.3000113
85V34.5Very low32.9Very low136 Ų136142.5 Ų142.582%0.82481%0.814SS**  trans-142.9112.2143.8-178.30000109
86T29.4Very low33.5Very low119 Ų119142.5 Ų142.573%0.7381%0.808SS**  trans-69.7128.9168370000111.6
87T34.8Very low33.7Very low137 Ų137143 Ų14384%0.8480%0.803SS**  trans-149.7133.3146.132.80000111.7
88N34.8Very low34.3Very low161 Ų161141.7 Ų141.786%0.86180%0.796SS**  trans-71150.2-170-64.1-45.3000114.2
89A35.1Very low34.6Very low93 Ų93142.3 Ų142.377%0.76979%0.79SS**  147.993.4116.700000111.8
90Y30.4Very low35Very low232 Ų232140.2 Ų140.291%0.9178%0.776SS**  trans-64131159.1-126.4-104000109
91T37.9Very low35.6Very low127 Ų127136.2 Ų136.278%0.77976%0.761SS**  trans-123.2125.5161.3150000108.9
92P37.1Very low35.9Very low114 Ų114135.1 Ų135.174%0.7475%0.749SS**PPolyproline II helixtrans-78.3136.7-177.629.9-30.1000111.1
93Q36.3Very low36.6Very low189 Ų189134.3 Ų134.388%0.88374%0.74SS**PPolyproline II helixtrans-68.6133.6170.2-78.6-167.3-36.900110.8
94P40.9Very low37.1Very low92 Ų92132.2 Ų132.260%0.59773%0.728SS**PPolyproline II helixtrans-81.5121.4169.730.6-28.5000110.1W96P94-W96 VanDerWaalsContact O-CD1 3.31Å; P94-W96 PolarHBondContact O-N 2.76Å
95T34Very low37.5Very low140 Ų140130 Ų13086%0.85972%0.722SS**  trans-69.9113.2168.450.10000109.4
96W38.3Very low37.9Very low211 Ų211130.8 Ų130.880%0.79972%0.717SS**  trans-102.4115.7174.1-69.895.2000110.3P94P94-W96 VanDerWaalsContact O-CD1 3.31Å; P94-W96 PolarHBondContact O-N 2.76Å
97N34.1Very low38.6Very low131 Ų131129.2 Ų129.270%0.70171%0.71SS**  trans-75.7121.1173.8-110.2-20.2000109.5N99 S100N97-N99 PolarHBondContact O-N 3.34Å; N97-S100 PolarHBondContact O-OG 3.1Å
98L37Very low38.8Very low145 Ų145129.7 Ų129.776%0.75971%0.707SS**THydrogen-bonded Turntrans-66-7.8-179.1-134.186.6000113.9
99N39.9Very low39Very low129 Ų129127.8 Ų127.869%0.6970%0.701SS**THydrogen-bonded Turntrans-83.4-16.1-176.4-75.5-0.8000114.2N97 T103N97-N99 PolarHBondContact O-N 3.34Å; N99-T103 PolarHBondContact O-OG1 3.03Å
100S41.9Very low39.5Very low63 Ų63129.1 Ų129.144%0.44170%0.7SS.*THydrogen-bonded Turntrans-82.6-17.1-179.263.20000113.8N97 T103N97-S100 PolarHBondContact O-OG 3.1Å; S100-T103 PolarHBondContact O-OG1 3.47Å
101S39.5Very low40.1Very low82 Ų82123.6 Ų123.657%0.57369%0.692SS**THydrogen-bonded Turntrans-92.2-11180-460000113.3
102V41.6Very low40.1Very low86 Ų86127 Ų12752%0.52170%0.696SS.*THydrogen-bonded Turntrans-92.2-23.4177-179.50000111
103T45Very low40.2Very low88 Ų88127.3 Ų127.354%0.5470%0.696SS.*THydrogen-bonded Turntrans-70.1-27.8176.133.80000113.7N99 S100 H106N99-T103 PolarHBondContact O-OG1 3.03Å; S100-T103 PolarHBondContact O-OG1 3.47Å; T103-H106 PolarHBondContact O-N 3.02Å
104D45.4Very low40.5Very low120 Ų120126.1 Ų126.164%0.64270%0.696SS**THydrogen-bonded Turntrans-76.7-26.8179.7-68.6-25.4000112.8H106 S107D104-H106 VanDerWaalsContact C-N 3.34Å; D104-S107 PolarHBondContact O-OG 3.46Å
105L39Very low40.3Very low134 Ų134130.1 Ų130.170%0.70271%0.706SS**G310 helixtrans-75.9-19.8173.6-98.8115.5000113.6S107L105-S107 VanDerWaalsContact C-N 3.3Å
106H43.5Very low40.7Very low154 Ų154129.2 Ų129.271%0.71371%0.706SS**G310 helixtrans-82.6-5176.4-96.3-80.4000113.8T103 D104T103-H106 PolarHBondContact O-N 3.02Å; D104-H106 VanDerWaalsContact C-N 3.34Å
107S43.5Very low40.9Very low86 Ų86124.3 Ų124.360%0.60170%0.701SS**G310 helixtrans-83.3-8.3179.869.50000114.3D104 L105 T109D104-S107 PolarHBondContact O-OG 3.46Å; L105-S107 VanDerWaalsContact C-N 3.3Å; S107-T109 PolarHBondContact O-N 3.09Å
108L38.8Very low41.1Very low147 Ų147126.1 Ų126.177%0.7771%0.71SS**  trans-78.768.9176.3-71.7164.1000111
109T41Very low41.2Very low120 Ų120124.4 Ų124.474%0.73671%0.71SS**  trans-90.3111.1176.9-33.20000109.2S107S107-T109 PolarHBondContact O-N 3.09Å
110V43.8Very low41.1Very low122 Ų122122.6 Ų122.674%0.73971%0.713SS**  trans-58.1132.3173178.40000109.7K112V110-K112 PolarHBondContact O-N 3.27Å
111P44.5Very low41.2Very low115 Ų115128 Ų12875%0.74773%0.731SS**  trans-66.4118.2178-13.226.7000110.3T113P111-T113 PolarHBondContact O-N 3.33Å
112K36.9Very low41.1Very low200 Ų200134.9 Ų134.987%0.8774%0.744SS**  trans-74113.6168.3-75.9-178.1176.7177.10109.1V110 N114V110-K112 PolarHBondContact O-N 3.27Å; K112-N114 PolarHBondContact O-N 3.31Å
113T39.6Very low40.9Very low119 Ų119141.7 Ų141.773%0.7376%0.76SS**  trans-77.5115.317150.90000110.2P111P111-T113 PolarHBondContact O-N 3.33Å
114N43.5Very low40.8Very low165 Ų165142.4 Ų142.488%0.88277%0.769SS**  trans-83.1123169.2-87.4-12.8000110.3K112K112-N114 PolarHBondContact O-N 3.31Å
115H36Very low40.5Very low175 Ų175142 Ų14281%0.8178%0.783SS**  trans-82.6140169-78.1-79.7000111.3
116S42.8Very low40.9Very low122 Ų122140 Ų14085%0.85378%0.78SS**  trans-154.8151.1152.4-73.90000110.3
117P42.5Very low41.1Very low107 Ų107141.2 Ų141.270%0.69578%0.779SS**  trans-111.4174.5-145.839.5-29.4000115.4
118L37.6Very low41Very low170 Ų170140 Ų14089%0.8978%0.78SS**  trans82.4134.3168.9-55.4146.8000113.8
119S38.3Very low41.3Very low108 Ų108135 Ų13576%0.75576%0.764SS**  cis-165.4148.916.8490000109.9
120A39.4Very low41.9Very low92 Ų92134.2 Ų134.276%0.7676%0.756SS**  trans53.2103.9150.500000119.7
121H44.1Very low42.3Very low177 Ų177136.6 Ų136.682%0.81975%0.753SS**  177.5135.8101.4-128.4-65.8000111R123H121-R123 PolarHBondContact O-N 3.3Å
122R35.8Very low42.7Very low226 Ų226138.9 Ų138.985%0.85375%0.751SS**  trans-49.4126.7168.1-72.6174178.7-171.3-2.8111.8
123R38.9Very low43.8Very low228 Ų228133.4 Ų133.486%0.8674%0.735SS**  -179.6132.7122.6-101.4172.9-85.8-170.1-3.4112.2H121H121-R123 PolarHBondContact O-N 3.3Å
124S41.4Very low45.1Very low103 Ų103135.5 Ų135.572%0.7273%0.734SS**  trans75.995.5151.5-56.50000119.2S126S124-S126 PolarHBondContact O-N 2.91Å
125A39.8Very low46.1Very low113 Ų113130.1 Ų130.193%0.93471%0.712SS**THydrogen-bonded Turntrans-55.193.2152.600000110.5
126S47.2Very low47.5Very low91 Ų91124.2 Ų124.264%0.63669%0.694SS**THydrogen-bonded Turntrans-154.8-6.1164.5-167.60000113.3S124S124-S126 PolarHBondContact O-N 2.91Å
127Y46.9Very low48.9Very low179 Ų179124 Ų12470%0.70268%0.679SS**SBendtrans-94-7.2-176.7-110.6-95000114.6Y131Y127-Y131 HydrophobicContact CD1-CE2 4.4Å
128G42.9Very low50.5Low60 Ų60120.6 Ų120.662%0.61966%0.663SS**Hα-helixtrans-80.8-21.6179.900000114.3
129G43.8Very low52.3Low42 Ų42118.1 Ų118.143%0.43365%0.65SS.*Hα-helixtrans-70.8-40.417900000112.6F132 T133G129-F132 PolarHBondContact O-N 2.79Å; G129-T133 WeakPolarHBondContact O-CG2 3.45Å; G129-T133 PolarHBondContact O-N 3.35Å; G129-T133 PolarHBondContact O-OG1 2.99Å
130D53.3Low54.2Low105 Ų105114.7 Ų114.756%0.56163%0.631SS**Hα-helixtrans-73.6-31.9-173.9-62.5-19000113T133 F134D130-T133 WeakPolarHBondContact CA-OG1 3.33Å; D130-T133 PolarHBondContact O-OG1 3.48Å; D130-T133 VanDerWaalsContact O-OG1 3.06Å; D130-F134 VanDerWaalsContact O-CB 3.24Å; D130-F134 WeakPolarHBondContact O-CB 3.46Å; D130-F134 PolarHBondContact O-N 3.19Å
131Y52.6Low56.3Low172 Ų172114.8 Ų114.868%0.67562%0.616SS**Hα-helixtrans-71.9-37.7174.8-87-86.3000112.4Y127 A135Y127-Y131 HydrophobicContact CD1-CE2 4.4Å; Y131-A135 WeakPolarHBondContact O-CB 3.23Å; Y131-A135 PolarHBondContact O-N 3.11Å
132F53.3Low58.1Low163 Ų163108.7 Ų108.772%0.71560%0.596SS**Hα-helixtrans-71.8-39.7178.7-171.3-96.5000111.6G129 A136G129-F132 PolarHBondContact O-N 2.79Å; F132-A136 VanDerWaalsContact O-CB 3.26Å; F132-A136 WeakPolarHBondContact O-CB 3.34Å; F132-A136 PolarHBondContact O-N 3.31Å
133T60.9Low60.1Low85 Ų85100.5 Ų100.552%0.52158%0.576SS.*Hα-helixtrans-66.9-38.817449.60000112G129 D130 A136 H137G129-T133 WeakPolarHBondContact O-CG2 3.45Å; G129-T133 PolarHBondContact O-N 3.35Å; G129-T133 PolarHBondContact O-OG1 2.99Å; D130-T133 WeakPolarHBondContact CA-OG1 3.33Å; D130-T133 PolarHBondContact O-OG1 3.48Å; D130-T133 VanDerWaalsContact O-OG1 3.06Å; T133-A136 PolarHBondContact O-N 3.38Å; T133-H137 VanDerWaalsContact O-CB 3.3Å; T133-H137 WeakPolarHBondContact O-CB 3.42Å; T133-H137 PolarHBondContact O-N 3.49Å
134F65.3Low62.3Low163 Ų16393 Ų9372%0.71556%0.559SS**Hα-helixtrans-65-44.1174.9-172.8-96000112.5D130 H137 G138D130-F134 VanDerWaalsContact O-CB 3.24Å; D130-F134 WeakPolarHBondContact O-CB 3.46Å; D130-F134 PolarHBondContact O-N 3.19Å; F134-H137 PolarHBondContact O-N 2.98Å; F134-G138 PolarHBondContact O-N 3.33Å
135A64.6Low64.5Low52 Ų5295 Ų9543%0.4355%0.551SS.*Hα-helixtrans-64.8-41.9175.800000112.1Y131 H137 G138 I139Y131-A135 WeakPolarHBondContact O-CB 3.23Å; Y131-A135 PolarHBondContact O-N 3.11Å; A135-H137 VanDerWaalsContact C-N 3.35Å; A135-G138 PolarHBondContact O-N 3.09Å; A135-I139 VanDerWaalsContact O-CG1 3.27Å; A135-I139 WeakPolarHBondContact O-CG1 3.37Å; A135-I139 PolarHBondContact O-N 3.42Å
136A66Low66.6Low51 Ų5192.5 Ų92.542%0.42153%0.53SS..Hα-helixtrans-63.8-38.817500000112.2F132 T133 I139 G140F132-A136 VanDerWaalsContact O-CB 3.26Å; F132-A136 WeakPolarHBondContact O-CB 3.34Å; F132-A136 PolarHBondContact O-N 3.31Å; T133-A136 PolarHBondContact O-N 3.38Å; A136-I139 PolarHBondContact O-N 3.44Å; A136-G140 PolarHBondContact O-N 3.39Å
137H72.6Confident68.3Low117 Ų11792.1 Ų92.154%0.54252%0.524SS..Hα-helixtrans-64.5-44.8174.8-165.7-91.6000111.7T133 F134 A135 I139 G140 E141T133-H137 VanDerWaalsContact O-CB 3.3Å; T133-H137 WeakPolarHBondContact O-CB 3.42Å; T133-H137 PolarHBondContact O-N 3.49Å; F134-H137 PolarHBondContact O-N 2.98Å; A135-H137 VanDerWaalsContact C-N 3.35Å; H137-I139 VanDerWaalsContact C-N 3.35Å; H137-I139 PolarHBondContact O-N 2.99Å; H137-G140 PolarHBondContact O-N 3.17Å; H137-E141 IonicContact CE1-OE1 2.95Å; H137-E141 PolarHBondContact CE1-OE1 2.04Å; H137-E141 IonicContact ND1-OE1 3.26Å; H137-E141 PolarHBondContact ND1-OE1 3.17Å; H137-E141 PolarHBondContact O-N 3.03Å
138G75.7Confident70.2Confident35 Ų3589.2 Ų89.236%0.36152%0.517SS..Hα-helixtrans-62.9-37.4176.400000113.5F134 A135 A142F134-G138 PolarHBondContact O-N 3.33Å; A135-G138 PolarHBondContact O-N 3.09Å; G138-A142 WeakPolarHBondContact O-CB 3.27Å; G138-A142 PolarHBondContact O-N 2.9Å; G138-A142 VanDerWaalsContact O-N 3.07Å
139I76.3Confident72.1Confident119 Ų11992.4 Ų92.461%0.6152%0.515SS*.Hα-helixtrans-68.2-41.3173.7-66.6164.9000110.7A135 A136 H137 A142 A143A135-I139 VanDerWaalsContact O-CG1 3.27Å; A135-I139 WeakPolarHBondContact O-CG1 3.37Å; A135-I139 PolarHBondContact O-N 3.42Å; A136-I139 PolarHBondContact O-N 3.44Å; H137-I139 VanDerWaalsContact C-N 3.35Å; H137-I139 PolarHBondContact O-N 2.99Å; I139-A142 PolarHBondContact O-N 3.04Å; I139-A143 WeakPolarHBondContact O-CB 2.97Å; I139-A143 PolarHBondContact O-N 2.83Å
140G77.7Confident73.8Confident35 Ų3592.8 Ų92.836%0.36151%0.514SS..Hα-helixtrans-60.5-46.6175.900000112.7A136 H137 A142 A143 S144A136-G140 PolarHBondContact O-N 3.39Å; H137-G140 PolarHBondContact O-N 3.17Å; G140-A142 PolarHBondContact O-N 3.21Å; G140-A143 PolarHBondContact O-N 3.16Å; G140-S144 PolarHBondContact O-N 3.4Å; G140-S144 PolarHBondContact O-OG 2.97Å
141E83.3Confident75.1Confident95 Ų9593.4 Ų93.444%0.44451%0.514SS..Hα-helixtrans-65.4-36.4176.3-74.2-178.3173.700113.2H137 R145H137-E141 IonicContact CE1-OE1 2.95Å; H137-E141 PolarHBondContact CE1-OE1 2.04Å; H137-E141 IonicContact ND1-OE1 3.26Å; H137-E141 PolarHBondContact ND1-OE1 3.17Å; H137-E141 PolarHBondContact O-N 3.03Å; E141-R145 WeakPolarHBondContact O-CB 3.47Å; E141-R145 WeakPolarHBondContact O-CG 3.24Å; E141-R145 PolarHBondContact O-N 3.33Å; E141-R145 PolarHBondContact O-NE 3.23Å
142A82.6Confident76.5Confident48 Ų4891.6 Ų91.640%0.39751%0.511SS..Hα-helixtrans-66.7-41.417500000111.3G138 I139 G140 A146G138-A142 WeakPolarHBondContact O-CB 3.27Å; G138-A142 PolarHBondContact O-N 2.9Å; G138-A142 VanDerWaalsContact O-N 3.07Å; I139-A142 PolarHBondContact O-N 3.04Å; G140-A142 PolarHBondContact O-N 3.21Å; A142-A146 WeakPolarHBondContact O-CB 2.93Å; A142-A146 PolarHBondContact O-N 2.85Å
143A77.5Confident77.6Confident54 Ų5488.7 Ų88.745%0.44650%0.503SS..Hα-helixtrans-64-46.4175.800000111.7I139 G140 R145 A146 V147I139-A143 WeakPolarHBondContact O-CB 2.97Å; I139-A143 PolarHBondContact O-N 2.83Å; G140-A143 PolarHBondContact O-N 3.16Å; A143-R145 PolarHBondContact O-N 3.13Å; A143-A146 PolarHBondContact O-N 3.41Å; A143-V147 WeakPolarHBondContact O-CG2 3.43Å; A143-V147 PolarHBondContact O-N 3.46Å
144S84.6Confident78.1Confident72 Ų7289.3 Ų89.350%0.50351%0.507SS..Hα-helixtrans-60.9-45.3177-640000112.1G140 A146 V147 E148G140-S144 PolarHBondContact O-N 3.4Å; G140-S144 PolarHBondContact O-OG 2.97Å; S144-A146 VanDerWaalsContact C-N 3.32Å; S144-A146 PolarHBondContact O-N 3.27Å; S144-V147 PolarHBondContact O-N 3.34Å; S144-E148 PolarHBondContact O-N 2.92Å
145R87.6Confident78.3Confident144 Ų14485.3 Ų85.354%0.54349%0.492SS..Hα-helixtrans-62.6-37.2175.6-77.6-175.5-76.8177.4-9.4112.8E141 A143 H149E141-R145 WeakPolarHBondContact O-CB 3.47Å; E141-R145 WeakPolarHBondContact O-CG 3.24Å; E141-R145 PolarHBondContact O-N 3.33Å; E141-R145 PolarHBondContact O-NE 3.23Å; A143-R145 PolarHBondContact O-N 3.13Å; R145-H149 WeakPolarHBondContact O-CB 3.31Å; R145-H149 PolarHBondContact O-N 2.96Å; R145-H149 PolarHBondContact O-ND1 3.46Å
146A83.8Confident78.5Confident61 Ų6187.4 Ų87.450%0.50449%0.493SS..Hα-helixtrans-67.5-38.7176.200000112A142 A143 S144 A150A142-A146 WeakPolarHBondContact O-CB 2.93Å; A142-A146 PolarHBondContact O-N 2.85Å; A143-A146 PolarHBondContact O-N 3.41Å; S144-A146 VanDerWaalsContact C-N 3.32Å; S144-A146 PolarHBondContact O-N 3.27Å; A146-A150 VanDerWaalsContact O-CB 3.31Å; A146-A150 WeakPolarHBondContact O-CB 3.14Å; A146-A150 PolarHBondContact O-N 3.23Å
147V83.7Confident78.5Confident82 Ų8288 Ų8850%0.49749%0.488SS..Hα-helixtrans-64.7-47.5173.8171.70000110.5A143 S144 H149 A150 E151A143-V147 WeakPolarHBondContact O-CG2 3.43Å; A143-V147 PolarHBondContact O-N 3.46Å; S144-V147 PolarHBondContact O-N 3.34Å; V147-H149 PolarHBondContact O-N 2.86Å; V147-A150 WeakPolarHBondContact O-CB 3.46Å; V147-A150 PolarHBondContact O-N 3.47Å; V147-A150 VanDerWaalsContact O-N 3.14Å; V147-E151 HydrophobicContact CG1-CG 4.46Å; V147-E151 WeakPolarHBondContact O-CG 3.36Å; V147-E151 PolarHBondContact O-N 3.36Å
148E86.2Confident78Confident118 Ų11891 Ų9155%0.55150%0.495SS*.Hα-helixtrans-59.3-45.4176.7-74.8175.9174.800112.1S144 A150 E151 E152S144-E148 PolarHBondContact O-N 2.92Å; E148-A150 VanDerWaalsContact C-N 3.32Å; E148-A150 PolarHBondContact O-N 3.14Å; E148-E151 PolarHBondContact O-N 3.29Å; E148-E152 PolarHBondContact O-N 3.48Å
149H83.5Confident77.3Confident127 Ų12797.1 Ų97.159%0.58851%0.511SS*.Hα-helixtrans-63.9-36.9175.6-81.870.2000112.4R145 V147 L153R145-H149 WeakPolarHBondContact O-CB 3.31Å; R145-H149 PolarHBondContact O-N 2.96Å; R145-H149 PolarHBondContact O-ND1 3.46Å; V147-H149 PolarHBondContact O-N 2.86Å; H149-L153 VanDerWaalsContact O-CB 3.24Å; H149-L153 WeakPolarHBondContact O-CB 3.4Å; H149-L153 PolarHBondContact O-N 2.91Å
150A79.1Confident76.7Confident50 Ų5099.2 Ų99.241%0.41352%0.516SS..Hα-helixtrans-66.6-41.7175.400000111.3A146 V147 E148 L153 V154A146-A150 VanDerWaalsContact O-CB 3.31Å; A146-A150 WeakPolarHBondContact O-CB 3.14Å; A146-A150 PolarHBondContact O-N 3.23Å; V147-A150 WeakPolarHBondContact O-CB 3.46Å; V147-A150 PolarHBondContact O-N 3.47Å; V147-A150 VanDerWaalsContact O-N 3.14Å; E148-A150 VanDerWaalsContact C-N 3.32Å; E148-A150 PolarHBondContact O-N 3.14Å; A150-L153 PolarHBondContact O-N 3.34Å; A150-V154 WeakPolarHBondContact O-CB 2.97Å; A150-V154 WeakPolarHBondContact O-CG2 3Å; A150-V154 PolarHBondContact O-N 3.36Å
151E81.1Confident76.8Confident118 Ų11898.4 Ų98.455%0.55151%0.508SS*.Hα-helixtrans-63.2-46.4174.9-73.1-173.2169.600111.8V147 E148 L153 V154 I155V147-E151 HydrophobicContact CG1-CG 4.46Å; V147-E151 WeakPolarHBondContact O-CG 3.36Å; V147-E151 PolarHBondContact O-N 3.36Å; E148-E151 PolarHBondContact O-N 3.29Å; E151-L153 VanDerWaalsContact C-N 3.35Å; E151-L153 PolarHBondContact O-N 3.49Å; E151-V154 PolarHBondContact O-N 2.92Å; E151-I155 VanDerWaalsContact O-CG1 3.3Å; E151-I155 WeakPolarHBondContact O-CG1 3.31Å; E151-I155 PolarHBondContact O-N 3.47Å
152E80.8Confident77.2Confident134 Ų13495.1 Ų95.163%0.62649%0.491SS*.Hα-helixtrans-61.9-41.5175.7-76.1-167.1164.300112.1E148 I155 H156E148-E152 PolarHBondContact O-N 3.48Å; E152-I155 PolarHBondContact O-N 2.98Å; E152-H156 VanDerWaalsContact O-CB 3.23Å; E152-H156 WeakPolarHBondContact O-CB 3.02Å; E152-H156 PolarHBondContact O-N 3.29Å
153L76.8Confident77.6Confident103 Ų103102.8 Ų102.854%0.53951%0.51SS..Hα-helixtrans-62.8-43.7175-179.164.9000110.9H149 A150 E151 H156 L157H149-L153 VanDerWaalsContact O-CB 3.24Å; H149-L153 WeakPolarHBondContact O-CB 3.4Å; H149-L153 PolarHBondContact O-N 2.91Å; A150-L153 PolarHBondContact O-N 3.34Å; E151-L153 VanDerWaalsContact C-N 3.35Å; E151-L153 PolarHBondContact O-N 3.49Å; L153-H156 PolarHBondContact O-N 2.95Å; L153-L157 HydrophobicContact CD1-CD1 4Å; L153-L157 HydrophobicContact CD1-CG 4.08Å; L153-L157 HydrophobicContact CD2-CD1 4.48Å; L153-L157 HydrophobicContact CG-CD1 3.81Å; L153-L157 HydrophobicContact CG-CG 4.3Å; L153-L157 WeakPolarHBondContact O-CB 3.36Å; L153-L157 WeakPolarHBondContact O-CG 3.37Å; L153-L157 PolarHBondContact O-N 3.47Å
154V72Confident78.5Confident98 Ų98103.5 Ų103.559%0.59451%0.509SS*.Hα-helixtrans-61.6-46.1176.4167.80000110.6A150 E151 L157 W158A150-V154 WeakPolarHBondContact O-CB 2.97Å; A150-V154 WeakPolarHBondContact O-CG2 3Å; A150-V154 PolarHBondContact O-N 3.36Å; E151-V154 PolarHBondContact O-N 2.92Å; V154-L157 PolarHBondContact O-N 2.94Å; V154-W158 WeakPolarHBondContact O-CB 3.26Å; V154-W158 PolarHBondContact O-N 3.35Å
155I69.8Low79Confident79 Ų79101.9 Ų101.941%0.40550%0.496SS..Hα-helixtrans-65-42.9177.4-67.3167.1000110.9E151 E152 W158 K159E151-I155 VanDerWaalsContact O-CG1 3.3Å; E151-I155 WeakPolarHBondContact O-CG1 3.31Å; E151-I155 PolarHBondContact O-N 3.47Å; E152-I155 PolarHBondContact O-N 2.98Å; I155-W158 PolarHBondContact O-N 3.01Å; I155-K159 HydrophobicContact CG2-CD 4.04Å; I155-K159 HydrophobicContact CG2-CG 4.39Å; I155-K159 WeakPolarHBondContact O-CB 3.27Å; I155-K159 WeakPolarHBondContact O-CG 3.36Å; I155-K159 PolarHBondContact O-N 3.47Å
156H68.7Low79.5Confident96 Ų9698 Ų9844%0.44448%0.484SS..Hα-helixtrans-64.9-43.2178.7-170.482.6000111.3E152 L153 W158 K159 K160E152-H156 VanDerWaalsContact O-CB 3.23Å; E152-H156 WeakPolarHBondContact O-CB 3.02Å; E152-H156 PolarHBondContact O-N 3.29Å; L153-H156 PolarHBondContact O-N 2.95Å; H156-W158 VanDerWaalsContact C-N 3.31Å; H156-W158 PolarHBondContact O-N 2.61Å; H156-K159 PolarHBondContact O-N 3.29Å; H156-K160 WeakPolarHBondContact NE2-CD 3.18Å; H156-K160 VanDerWaalsContact NE2-CE 3.33Å; H156-K160 WeakPolarHBondContact NE2-CE 3.34Å; H156-K160 PolarHBondContact NE2-NZ 2.88Å; H156-K160 WeakPolarHBondContact O-CB 3.02Å; H156-K160 PolarHBondContact O-N 2.93Å
157L64.4Low80.1Confident63 Ų6395.7 Ų95.733%0.3346%0.463SS..Hα-helixtrans-65.1-35.4173.8-71173.1000111.7L153 V154 G161L153-L157 HydrophobicContact CD1-CD1 4Å; L153-L157 HydrophobicContact CD1-CG 4.08Å; L153-L157 HydrophobicContact CD2-CD1 4.48Å; L153-L157 HydrophobicContact CG-CD1 3.81Å; L153-L157 HydrophobicContact CG-CG 4.3Å; L153-L157 WeakPolarHBondContact O-CB 3.36Å; L153-L157 WeakPolarHBondContact O-CG 3.37Å; L153-L157 PolarHBondContact O-N 3.47Å; V154-L157 PolarHBondContact O-N 2.94Å; L157-G161 PolarHBondContact O-N 3.44Å
158W63.7Low80.6Confident179 Ų17998 Ų9868%0.67847%0.468SS*.Hα-helixtrans-69.7-38.9175.8-166.838.5000112.1V154 I155 H156 G161V154-W158 WeakPolarHBondContact O-CB 3.26Å; V154-W158 PolarHBondContact O-N 3.35Å; I155-W158 PolarHBondContact O-N 3.01Å; H156-W158 VanDerWaalsContact C-N 3.31Å; H156-W158 PolarHBondContact O-N 2.61Å; W158-G161 PolarHBondContact O-N 3.48Å
159K60.2Low81Confident164 Ų16496.6 Ų96.671%0.71347%0.471SS*.Hα-helixtrans-74.4-35.8177.1-75.3-179.9179.2175.80113.7I155 H156 G161I155-K159 HydrophobicContact CG2-CD 4.04Å; I155-K159 HydrophobicContact CG2-CG 4.39Å; I155-K159 WeakPolarHBondContact O-CB 3.27Å; I155-K159 WeakPolarHBondContact O-CG 3.36Å; I155-K159 PolarHBondContact O-N 3.47Å; H156-K159 PolarHBondContact O-N 3.29Å; K159-G161 VanDerWaalsContact C-N 3.26Å
160K64.7Low81.6Confident163 Ų16390.9 Ų90.971%0.70944%0.444SS*.Hα-helixtrans-74.3-18.7171.4-94.5-176174.9159.50112.8H156H156-K160 WeakPolarHBondContact NE2-CD 3.18Å; H156-K160 VanDerWaalsContact NE2-CE 3.33Å; H156-K160 WeakPolarHBondContact NE2-CE 3.34Å; H156-K160 PolarHBondContact NE2-NZ 2.88Å; H156-K160 WeakPolarHBondContact O-CB 3.02Å; H156-K160 PolarHBondContact O-N 2.93Å
161G79Confident82.3Confident18 Ų1890.5 Ų90.519%0.18644%0.438CS..SBendtrans-72.7164.1177.700000113.2L157 W158 K159L157-G161 PolarHBondContact O-N 3.44Å; W158-G161 PolarHBondContact O-N 3.48Å; K159-G161 VanDerWaalsContact C-N 3.26Å
162W90.8Very high82.9Confident27 Ų2792.9 Ų92.910%0.10245%0.449CS..PPolyproline II helixtrans-63.3151.2168.359.3-93.6000111.1V164 R185 P186 L188 R200 H202W162-V164 HydrophobicContact CH2-CG1 4.2Å; W162-V164 HydrophobicContact CZ3-CB 4.44Å; W162-V164 HydrophobicContact CZ3-CG1 3.64Å; W162-R185 HydrophobicContact CH2-CB 4.41Å; W162-R185 HydrophobicContact CH2-CG 3.39Å; W162-R185 HydrophobicContact CZ2-CG 3.8Å; W162-R185 HydrophobicContact CZ3-CB 4.36Å; W162-R185 HydrophobicContact CZ3-CG 3.77Å; W162-P186 HydrophobicContact CB-CG 3.87Å; W162-P186 HydrophobicContact CD2-CG 4.33Å; W162-P186 HydrophobicContact CE3-CG 3.97Å; W162-P186 HydrophobicContact CG-CG 4.33Å; W162-L188 HydrophobicContact CB-CD2 3.79Å; W162-L188 HydrophobicContact CD2-CD1 4.2Å; W162-L188 HydrophobicContact CD2-CD2 4.28Å; W162-L188 HydrophobicContact CG-CD1 4.17Å; W162-L188 HydrophobicContact CG-CD2 3.6Å; W162-L188 HydrophobicContact CG-CG 4.5Å; W162-R200 VanDerWaalsContact CD2-NH1 3.31Å; W162-R200 HydrophobicContact CZ2-CB 4.27Å; W162-R200 VanDerWaalsContact O-CZ 3.25Å; W162-R200 PolarHBondContact O-NH1 3.38Å; W162-R200 PolarHBondContact O-NH2 3.4Å; W162-H202 HydrophobicContact CH2-CB 4.27Å; W162-H202 AromaticContact CH2-CD2 3.9Å
163R92.3Very high83.5Confident208 Ų20888.9 Ų88.979%0.78543%0.428SS*.PPolyproline II helixtrans-102.9147.9172.1-59.8-174.8-142.7-177.27.8110
164V95Very high84.4Confident69 Ų6984.3 Ų84.342%0.41840%0.404SS..PPolyproline II helixtrans-60.7144.2171.5-69.90000110.2W162 H184 H202W162-V164 HydrophobicContact CH2-CG1 4.2Å; W162-V164 HydrophobicContact CZ3-CB 4.44Å; W162-V164 HydrophobicContact CZ3-CG1 3.64Å; V164-H184 CarbonylContact C-O 3.56Å; V164-H184 WeakPolarHBondContact CA-O 3.48Å; V164-H202 HydrophobicContact CG1-CB 4.32Å
165V96Very high85.5Confident39 Ų3984.4 Ų84.424%0.23639%0.394CS..BIsolated β-bridgetrans-117.1162.4-176.8-61.10000111.5L170 H184 P186V165-L170 HydrophobicContact CG2-CD2 3.65Å; V165-L170 HydrophobicContact CG2-CG 4.27Å; V165-H184 HydrophobicContact CG2-CB 4.15Å; V165-H184 PolarHBondContact N-O 2.93Å; V165-H184 PolarHBondContact O-N 3.19Å; V165-P186 HydrophobicContact CG1-CB 4.1Å; V165-P186 HydrophobicContact CG2-CB 4.42Å
166H97.1Very high86.6Confident62 Ų6282.7 Ų82.729%0.28739%0.385SS..  trans-76.6149.4171.6-166-69.8000110.2H168 S169 L181H166-H168 VanDerWaalsContact C-N 3.33Å; H166-H168 AromaticContact CE1-CE1 3.71Å; H166-H168 AromaticContact CE1-ND1 3.05Å; H166-H168 PolarHBondContact CE1-ND1 2.98Å; H166-H168 AromaticContact ND1-CG 3.86Å; H166-H168 PolarHBondContact ND1-N 2.7Å; H166-H168 AromaticContact ND1-ND1 3.18Å; H166-H168 PolarHBondContact ND1-ND1 3.45Å; H166-H168 VanDerWaalsContact ND1-ND1 3.18Å; H166-H168 PolarHBondContact O-N 3.26Å; H166-S169 WeakPolarHBondContact O-CB 3.37Å; H166-S169 PolarHBondContact O-N 2.97Å; H166-L181 CarbonylContact C-O 3.53Å; H166-L181 WeakPolarHBondContact CA-O 3.31Å; H166-L181 PolarHBondContact CD2-O 3.02Å; H166-L181 PolarHBondContact CE1-O 3.11Å; H166-L181 PolarHBondContact ND1-O 2.95Å
167H96.3Very high87.8Confident13 Ų1378.6 Ų78.66%0.0637%0.367CS..G310 helixtrans-50-47.7179.8-175.786.3000113.5S169 L170 N177 L180 L181 H184H167-S169 PolarHBondContact O-N 3.28Å; H167-S169 VanDerWaalsContact O-N 3.1Å; H167-L170 VanDerWaalsContact O-CB 3.31Å; H167-L170 WeakPolarHBondContact O-CB 3.29Å; H167-L170 PolarHBondContact O-N 3.44Å; H167-N177 PolarHBondContact CE1-O 3.17Å; H167-N177 VanDerWaalsContact CE1-O 3.26Å; H167-N177 PolarHBondContact ND1-O 2.9Å; H167-L180 WeakPolarHBondContact CB-O 3.46Å; H167-L181 PolarHBondContact N-O 3.18Å; H167-H184 AromaticContact ND1-NE2 3.78Å
168H95Very high89.3Confident131 Ų13179.8 Ų79.861%0.60637%0.373SS*.G310 helixtrans-56-22.4174.9-63109.4000115.5H166 R175H166-H168 VanDerWaalsContact C-N 3.33Å; H166-H168 AromaticContact CE1-CE1 3.71Å; H166-H168 AromaticContact CE1-ND1 3.05Å; H166-H168 PolarHBondContact CE1-ND1 2.98Å; H166-H168 AromaticContact ND1-CG 3.86Å; H166-H168 PolarHBondContact ND1-N 2.7Å; H166-H168 AromaticContact ND1-ND1 3.18Å; H166-H168 PolarHBondContact ND1-ND1 3.45Å; H166-H168 VanDerWaalsContact ND1-ND1 3.18Å; H166-H168 PolarHBondContact O-N 3.26Å; H168-R175 PolarHBondContact O-NH2 3.28Å
169S94.7Very high90.9Very high88 Ų8873.1 Ų73.162%0.61535%0.349SS*.G310 helixtrans-87.5-7.9178.4-530000113.1H166 H167H166-S169 WeakPolarHBondContact O-CB 3.37Å; H166-S169 PolarHBondContact O-N 2.97Å; H167-S169 PolarHBondContact O-N 3.28Å; H167-S169 VanDerWaalsContact O-N 3.1Å
170L95.1Very high92.6Very high6 Ų665.7 Ų65.73%0.03132%0.317CS..SBendtrans-74148.6179.6-67.5172.7000111.7V165 H167 L174 R175 H184 R185V165-L170 HydrophobicContact CG2-CD2 3.65Å; V165-L170 HydrophobicContact CG2-CG 4.27Å; H167-L170 VanDerWaalsContact O-CB 3.31Å; H167-L170 WeakPolarHBondContact O-CB 3.29Å; H167-L170 PolarHBondContact O-N 3.44Å; L170-L174 HydrophobicContact CB-CB 4.19Å; L170-L174 HydrophobicContact CD1-CB 4.33Å; L170-L174 HydrophobicContact CD2-CB 4.33Å; L170-L174 HydrophobicContact CD2-CD1 4.2Å; L170-R175 HydrophobicContact CB-CG 3.97Å; L170-R175 VanDerWaalsContact O-CZ 3.25Å; L170-R175 PolarHBondContact O-NE 2.9Å; L170-R175 PolarHBondContact O-NH2 3.45Å; L170-H184 HydrophobicContact CD1-CB 3.86Å; L170-H184 HydrophobicContact CD2-CB 4Å; L170-H184 HydrophobicContact CG-CB 4.24Å; L170-R185 WeakPolarHBondContact CD2-O 3.31Å
171P95.2Very high94.2Very high43 Ų4360.3 Ų60.328%0.27930%0.296SS..  trans-62.5151.7165.130.5-36000110.4W173 L174P171-W173 VanDerWaalsContact C-N 3.25Å; P171-W173 HydrophobicContact CG-CZ2 4.35Å; P171-W173 PolarHBondContact O-N 3.4Å; P171-W173 VanDerWaalsContact O-N 3.13Å; P171-L174 HydrophobicContact CG-CB 4.21Å; P171-L174 HydrophobicContact CG-CD1 3.76Å; P171-L174 HydrophobicContact CG-CG 4.07Å; P171-L174 PolarHBondContact O-N 2.86Å
172H93.8Very high95Very high167 Ų16767.7 Ų67.777%0.77332%0.318SS*.G310 helixtrans-53.2-39.6-172-177.1-83.7000113.6L174 R175H172-L174 PolarHBondContact O-N 3.29Å; H172-R175 PolarHBondContact O-N 3.47Å; H172-R175 VanDerWaalsContact O-N 3.13Å
173W93.7Very high95.3Very high50 Ų5066.9 Ų66.919%0.18932%0.318CS..G310 helixtrans-68.2-14.7-178.769-93.1000114.5P171 Q187 Y262 S265 E266P171-W173 VanDerWaalsContact C-N 3.25Å; P171-W173 HydrophobicContact CG-CZ2 4.35Å; P171-W173 PolarHBondContact O-N 3.4Å; P171-W173 VanDerWaalsContact O-N 3.13Å; W173-Q187 HydrophobicContact CZ2-CG 4.02Å; W173-Y262 VanDerWaalsContact CH2-O 3.27Å; W173-Y262 WeakPolarHBondContact CH2-O 3.34Å; W173-Y262 WeakPolarHBondContact CZ3-O 3.45Å; W173-S265 VanDerWaalsContact CH2-C 3.4Å; W173-E266 HydrophobicContact CB-CB 4.43Å; W173-E266 HydrophobicContact CB-CG 3.91Å; W173-E266 HydrophobicContact CD2-CB 3.88Å; W173-E266 HydrophobicContact CD2-CG 4.26Å; W173-E266 HydrophobicContact CE3-CB 4.35Å; W173-E266 HydrophobicContact CG-CB 3.87Å; W173-E266 HydrophobicContact CG-CG 3.91Å
174L95.9Very high95.5Very high8 Ų857.8 Ų57.84%0.04229%0.285CS..G310 helixtrans-95.6-8.4173.8-75.9178.1000113.6L170 P171 H172 D176 Y262L170-L174 HydrophobicContact CB-CB 4.19Å; L170-L174 HydrophobicContact CD1-CB 4.33Å; L170-L174 HydrophobicContact CD2-CB 4.33Å; L170-L174 HydrophobicContact CD2-CD1 4.2Å; P171-L174 HydrophobicContact CG-CB 4.21Å; P171-L174 HydrophobicContact CG-CD1 3.76Å; P171-L174 HydrophobicContact CG-CG 4.07Å; P171-L174 PolarHBondContact O-N 2.86Å; H172-L174 PolarHBondContact O-N 3.29Å; L174-D176 VanDerWaalsContact C-N 3.33Å; L174-D176 PolarHBondContact O-N 2.93Å; L174-Y262 WeakPolarHBondContact CA-OH 3.22Å; L174-Y262 HydrophobicContact CD2-CD1 4.02Å; L174-Y262 HydrophobicContact CD2-CD2 4.11Å; L174-Y262 HydrophobicContact CD2-CE1 3.74Å; L174-Y262 HydrophobicContact CD2-CE2 3.85Å; L174-Y262 HydrophobicContact CD2-CG 4.19Å; L174-Y262 WeakPolarHBondContact CD2-O 3.31Å; L174-Y262 PolarHBondContact O-OH 3.45Å
175R94Very high95.6Very high100 Ų10054.9 Ų54.938%0.37727%0.266SS..  trans-84.470-176.5-63.6-177-168.5-175.40.6111.8H168 L170 H172H168-R175 PolarHBondContact O-NH2 3.28Å; L170-R175 HydrophobicContact CB-CG 3.97Å; L170-R175 VanDerWaalsContact O-CZ 3.25Å; L170-R175 PolarHBondContact O-NE 2.9Å; L170-R175 PolarHBondContact O-NH2 3.45Å; H172-R175 PolarHBondContact O-N 3.47Å; H172-R175 VanDerWaalsContact O-N 3.13Å
176D92.2Very high95.6Very high43 Ų4354.4 Ų54.423%0.2326%0.264CS..  trans-77.6-52.7-180-177.564.4000112.7L174 P329 R332L174-D176 VanDerWaalsContact C-N 3.33Å; L174-D176 PolarHBondContact O-N 2.93Å; D176-P329 WeakPolarHBondContact O-CB 3.49Å; D176-R332 VanDerWaalsContact C-NH2 3.34Å; D176-R332 PolarHBondContact O-NH2 3.41Å; D176-R332 IonicContact OD1-CZ 2.69Å; D176-R332 IonicContact OD1-NH2 3.65Å; D176-R332 PolarHBondContact OD1-NH2 3.03Å; D176-R332 IonicContact OD2-CZ 2.67Å; D176-R332 IonicContact OD2-NH2 3.57Å; D176-R332 PolarHBondContact OD2-NH2 3.16Å
177N95.2Very high95.6Very high10 Ų1055.5 Ų55.55%0.05327%0.269CS..  trans-122.8110.7-176-168.63.5000111.1H167 F179 L180 R388 E391H167-N177 PolarHBondContact CE1-O 3.17Å; H167-N177 VanDerWaalsContact CE1-O 3.26Å; H167-N177 PolarHBondContact ND1-O 2.9Å; N177-F179 VanDerWaalsContact C-N 3.27Å; N177-F179 PolarHBondContact O-N 3.45Å; N177-F179 WeakPolarHBondContact OD1-CD2 3.46Å; N177-F179 PolarHBondContact OD1-N 3.39Å; N177-L180 HydrophobicContact CB-CD1 4.06Å; N177-L180 HydrophobicContact CB-CG 4.19Å; N177-L180 PolarHBondContact O-N 2.96Å; N177-R388 WeakPolarHBondContact OD1-CD 3.34Å; N177-R388 PolarHBondContact OD1-NH1 3.33Å; N177-E391 PolarHBondContact ND2-OE1 3.2Å
178D95.8Very high95.6Very high88 Ų8855.6 Ų55.647%0.47127%0.27SS..THydrogen-bonded Turntrans-75.4-9.5-178.658.9-16.7000114.1L181 R388D178-L181 WeakPolarHBondContact O-CD2 3.36Å; D178-R388 IonicContact OD1-CZ 2.69Å; D178-R388 IonicContact OD1-NH1 3.76Å; D178-R388 PolarHBondContact OD1-NH1 3.01Å; D178-R388 IonicContact OD1-NH2 3.86Å
179F96.8Very high95.6Very high39 Ų3954.1 Ų54.117%0.17127%0.272CS..THydrogen-bonded Turntrans-80.3-16.3173-59.3-45.7000113.9N177 R388 E391 R392 P395 G396N177-F179 VanDerWaalsContact C-N 3.27Å; N177-F179 PolarHBondContact O-N 3.45Å; N177-F179 WeakPolarHBondContact OD1-CD2 3.46Å; N177-F179 PolarHBondContact OD1-N 3.39Å; F179-R388 HydrophobicContact CD2-CB 4.04Å; F179-R388 HydrophobicContact CE2-CB 4.18Å; F179-R388 VanDerWaalsContact CE2-NH1 3.31Å; F179-E391 HydrophobicContact CB-CB 4.12Å; F179-E391 HydrophobicContact CB-CG 3.76Å; F179-E391 HydrophobicContact CD2-CG 4.34Å; F179-R392 HydrophobicContact CD2-CB 3.82Å; F179-R392 HydrophobicContact CD2-CG 4.41Å; F179-R392 HydrophobicContact CE2-CB 3.54Å; F179-R392 HydrophobicContact CE2-CG 3.66Å; F179-R392 HydrophobicContact CZ-CB 4.08Å; F179-R392 HydrophobicContact CZ-CG 3.74Å; F179-P395 HydrophobicContact CD1-CB 4.4Å; F179-P395 HydrophobicContact CD1-CG 3.98Å; F179-P395 WeakPolarHBondContact O-CA 3.32Å; F179-G396 PolarHBondContact O-N 3.32Å
180L96.9Very high95.7Very high8 Ų852 Ų524%0.04226%0.258CS..  trans-90.5107.4173.5-52.2174.8000108.2H167 N177 H184 E391 D399 Q403H167-L180 WeakPolarHBondContact CB-O 3.46Å; N177-L180 HydrophobicContact CB-CD1 4.06Å; N177-L180 HydrophobicContact CB-CG 4.19Å; N177-L180 PolarHBondContact O-N 2.96Å; L180-H184 PolarHBondContact O-NE2 3.14Å; L180-E391 HydrophobicContact CD2-CB 4.16Å; L180-E391 HydrophobicContact CD2-CG 4.16Å; L180-D399 VanDerWaalsContact CA-OD1 3.24Å; L180-D399 WeakPolarHBondContact CA-OD1 3.41Å; L180-Q403 HydrophobicContact CD2-CB 4Å
181L97.1Very high95.8Very high50 Ų5056.2 Ų56.226%0.26228%0.275SS..  trans-91.8-40-165.9-58.5-175.6000112.6H166 H167 D178 P395 D399H166-L181 CarbonylContact C-O 3.53Å; H166-L181 WeakPolarHBondContact CA-O 3.31Å; H166-L181 PolarHBondContact CD2-O 3.02Å; H166-L181 PolarHBondContact CE1-O 3.11Å; H166-L181 PolarHBondContact ND1-O 2.95Å; H167-L181 PolarHBondContact N-O 3.18Å; D178-L181 WeakPolarHBondContact O-CD2 3.36Å; L181-P395 HydrophobicContact CD1-CB 4.46Å; L181-D399 PolarHBondContact N-OD1 3.28Å
182R96.1Very high95.9Very high173 Ų17363.3 Ų63.365%0.65330%0.297SS*.SBendtrans-128.6172.7-171.9-54.4175.2-176.4-173.50.2110.7T203 D399R182-T203 VanDerWaalsContact O-CG2 3.27Å; R182-T203 WeakPolarHBondContact O-CG2 3.28Å; R182-D399 WeakPolarHBondContact CA-OD2 3.43Å; R182-D399 WeakPolarHBondContact CB-OD2 3.29Å; R182-D399 PolarHBondContact N-OD2 2.83Å
183G96.2Very high96Very high10 Ų1058 Ų5810%0.10327%0.272CS..  trans8211.2173.900000114.9H202 T203G183-H202 CarbonylContact O-C 3.58Å; G183-H202 WeakPolarHBondContact O-CA 3.38Å; G183-H202 VanDerWaalsContact O-CB 3.23Å; G183-H202 WeakPolarHBondContact O-CB 3.31Å; G183-T203 PolarHBondContact O-N 3.42Å
184H97.8Very high96.1Very high16 Ų1655.6 Ų55.67%0.07426%0.263CS..BIsolated β-bridgetrans-77.7146.6-178.7-67.3-82.8000112V164 V165 H167 L170 L180 T203V164-H184 CarbonylContact C-O 3.56Å; V164-H184 WeakPolarHBondContact CA-O 3.48Å; V165-H184 HydrophobicContact CG2-CB 4.15Å; V165-H184 PolarHBondContact N-O 2.93Å; V165-H184 PolarHBondContact O-N 3.19Å; H167-H184 AromaticContact ND1-NE2 3.78Å; L170-H184 HydrophobicContact CD1-CB 3.86Å; L170-H184 HydrophobicContact CD2-CB 4Å; L170-H184 HydrophobicContact CG-CB 4.24Å; L180-H184 PolarHBondContact O-NE2 3.14Å; H184-T203 PolarHBondContact ND1-OG1 3.36Å
185R97.4Very high96.2Very high8 Ų859 Ų593%0.0328%0.278CS..PPolyproline II helixtrans-71.9133.6167.4-75.2178-66.2166.914.1109.5W162 L170 S197 H202 E204 H259 T260 C263W162-R185 HydrophobicContact CH2-CB 4.41Å; W162-R185 HydrophobicContact CH2-CG 3.39Å; W162-R185 HydrophobicContact CZ2-CG 3.8Å; W162-R185 HydrophobicContact CZ3-CB 4.36Å; W162-R185 HydrophobicContact CZ3-CG 3.77Å; L170-R185 WeakPolarHBondContact CD2-O 3.31Å; R185-S197 PolarHBondContact NH1-OG 3.3Å; R185-H202 WeakPolarHBondContact CD-NE2 3.27Å; R185-H202 HydrophobicContact CG-CB 4.01Å; R185-E204 VanDerWaalsContact NH2-CG 3.31Å; R185-H259 PolarHBondContact NH2-O 2.9Å; R185-T260 PolarHBondContact NH1-O 2.98Å; R185-C263 HydrophobicContact CB-CB 3.93Å
186P96.2Very high96.3Very high29 Ų2959.7 Ų59.719%0.18828%0.28CS..PPolyproline II helixtrans-66.3173.8166.231.5-32.5000109.5W162 V165 L188W162-P186 HydrophobicContact CB-CG 3.87Å; W162-P186 HydrophobicContact CD2-CG 4.33Å; W162-P186 HydrophobicContact CE3-CG 3.97Å; W162-P186 HydrophobicContact CG-CG 4.33Å; V165-P186 HydrophobicContact CG1-CB 4.1Å; V165-P186 HydrophobicContact CG2-CB 4.42Å; P186-L188 HydrophobicContact CG-CD2 4.04Å; P186-L188 WeakPolarHBondContact O-CG 3.38Å; P186-L188 PolarHBondContact O-N 3.39Å
187Q97Very high96.5Very high86 Ų8657.6 Ų57.640%0.40227%0.269SS..PPolyproline II helixtrans-64.8123.8171.9-177.7172.6-17.700110.1W173 P189 C263 H264W173-Q187 HydrophobicContact CZ2-CG 4.02Å; Q187-P189 WeakPolarHBondContact O-CD 3.41Å; Q187-C263 CarbonylContact C-O 3.25Å; Q187-C263 VanDerWaalsContact CA-O 3.31Å; Q187-C263 WeakPolarHBondContact CA-O 3.42Å; Q187-H264 WeakPolarHBondContact CG-O 3.3Å
188L96Very high96.6Very high14 Ų1457.8 Ų57.87%0.07327%0.27CS..  trans-117.789.3-177.8-60.8-179.2000109.7W162 P186 S190 E193 C194 C263 H264W162-L188 HydrophobicContact CB-CD2 3.79Å; W162-L188 HydrophobicContact CD2-CD1 4.2Å; W162-L188 HydrophobicContact CD2-CD2 4.28Å; W162-L188 HydrophobicContact CG-CD1 4.17Å; W162-L188 HydrophobicContact CG-CD2 3.6Å; W162-L188 HydrophobicContact CG-CG 4.5Å; P186-L188 HydrophobicContact CG-CD2 4.04Å; P186-L188 WeakPolarHBondContact O-CG 3.38Å; P186-L188 PolarHBondContact O-N 3.39Å; L188-S190 PolarHBondContact O-N 3.38Å; L188-E193 HydrophobicContact CB-CB 4.42Å; L188-E193 HydrophobicContact CD1-CB 4.34Å; L188-C194 PolarHBondContact O-SG 3.47Å; L188-C263 PolarHBondContact N-O 3.06Å; L188-H264 CarbonylContact C-O 3.59Å; L188-H264 VanDerWaalsContact O-CA 3.26Å; L188-H264 WeakPolarHBondContact O-CA 3.13Å
189P95.4Very high96.5Very high101 Ų10161.3 Ų61.366%0.65628%0.282SS*.  trans-74.942.6-175.634.3-38.1000113.1Q187 H264Q187-P189 WeakPolarHBondContact O-CD 3.41Å; P189-H264 WeakPolarHBondContact CA-O 3.29Å
190S96.1Very high96.4Very high44 Ų4462.2 Ų62.231%0.30828%0.284SS..  trans-148.4116.5179.4171.10000109.2L188 R192 E193 C194L188-S190 PolarHBondContact O-N 3.38Å; S190-R192 PolarHBondContact O-N 2.86Å; S190-R192 PolarHBondContact OG-N 3.38Å; S190-E193 PolarHBondContact O-N 2.93Å; S190-E193 PolarHBondContact OG-N 3.47Å; S190-C194 PolarHBondContact O-N 3.19Å; S190-C194 PolarHBondContact O-SG 3.47Å
191F97.6Very high96.4Very high93 Ų9366.8 Ų66.841%0.40831%0.308SS..Hα-helixtrans-53.6-39.4173.4-74.6-75.1000111.8E193 C194 F195 V261 H264 V268F191-E193 VanDerWaalsContact C-N 3.29Å; F191-E193 PolarHBondContact O-N 2.91Å; F191-C194 WeakPolarHBondContact O-CB 3.41Å; F191-C194 PolarHBondContact O-N 3.47Å; F191-C194 VanDerWaalsContact O-N 3.13Å; F191-F195 HydrophobicContact CB-CD2 4.45Å; F191-F195 HydrophobicContact CD1-CE2 4.43Å; F191-F195 VanDerWaalsContact O-CD2 3.29Å; F191-F195 WeakPolarHBondContact O-CD2 3.04Å; F191-F195 PolarHBondContact O-N 3.13Å; F191-V261 HydrophobicContact CD1-CB 4.39Å; F191-V261 HydrophobicContact CD1-CG1 3.77Å; F191-V261 HydrophobicContact CE1-CB 4.17Å; F191-V261 HydrophobicContact CE1-CG1 3.88Å; F191-H264 AromaticContact CD1-CD2 3.99Å; F191-H264 AromaticContact CD2-CD2 3.93Å; F191-H264 AromaticContact CD2-NE2 3.54Å; F191-H264 AromaticContact CE2-NE2 3.61Å; F191-H264 AromaticContact CG-CD2 3.9Å; F191-H264 AromaticContact CG-NE2 3.99Å; F191-H264 PolarHBondContact N-CD2 2.79Å; F191-V268 HydrophobicContact CE1-CG1 3.89Å; F191-V268 HydrophobicContact CZ-CG1 3.95Å; F191-V268 HydrophobicContact CZ-CG2 4.02Å
192R96.6Very high96.4Very high192 Ų19264.4 Ų64.473%0.72530%0.295SS*.Hα-helixtrans-57.1-43.4177.9-176.5-179.3177-171.9-0.2111.8S190 R196S190-R192 PolarHBondContact O-N 2.86Å; S190-R192 PolarHBondContact OG-N 3.38Å; R192-R196 VanDerWaalsContact O-CB 3.24Å; R192-R196 WeakPolarHBondContact O-CB 3.35Å; R192-R196 PolarHBondContact O-N 3.01Å
193E95.1Very high96.5Very high55 Ų5556.3 Ų56.326%0.25727%0.265SS..Hα-helixtrans-71.7-36.5177.3-70-61.8122.700112L188 S190 F191 R196 S197L188-E193 HydrophobicContact CB-CB 4.42Å; L188-E193 HydrophobicContact CD1-CB 4.34Å; S190-E193 PolarHBondContact O-N 2.93Å; S190-E193 PolarHBondContact OG-N 3.47Å; F191-E193 VanDerWaalsContact C-N 3.29Å; F191-E193 PolarHBondContact O-N 2.91Å; E193-R196 PolarHBondContact O-N 2.82Å; E193-S197 PolarHBondContact O-N 3.25Å
194C97.5Very high96.6Very high0 Ų057 Ų570%027%0.265CS..Hα-helixtrans-60.5-49.4172.5-64.60000111.9L188 S190 F191 S197L188-C194 PolarHBondContact O-SG 3.47Å; S190-C194 PolarHBondContact O-N 3.19Å; S190-C194 PolarHBondContact O-SG 3.47Å; F191-C194 WeakPolarHBondContact O-CB 3.41Å; F191-C194 PolarHBondContact O-N 3.47Å; F191-C194 VanDerWaalsContact O-N 3.13Å; C194-S197 WeakPolarHBondContact O-CB 3.31Å; C194-S197 PolarHBondContact O-N 2.72Å; C194-S197 VanDerWaalsContact O-N 3.16Å; C194-S197 PolarHBondContact O-OG 3.46Å
195F97.6Very high96.6Very high81 Ų8156.7 Ų56.736%0.35527%0.265SS..Hα-helixtrans-67.8-37.5178-82.7-84.1000112.2F191 S197 I198 W256 L257 T260 V261F191-F195 HydrophobicContact CB-CD2 4.45Å; F191-F195 HydrophobicContact CD1-CE2 4.43Å; F191-F195 VanDerWaalsContact O-CD2 3.29Å; F191-F195 WeakPolarHBondContact O-CD2 3.04Å; F191-F195 PolarHBondContact O-N 3.13Å; F195-S197 PolarHBondContact O-N 3.33Å; F195-I198 HydrophobicContact CD1-CD1 3.98Å; F195-I198 WeakPolarHBondContact O-CB 3.37Å; F195-I198 WeakPolarHBondContact O-CG1 3.42Å; F195-I198 PolarHBondContact O-N 3.3Å; F195-W256 HydrophobicContact CD1-CZ3 4.49Å; F195-W256 AromaticContact CE1-CH2 3.93Å; F195-W256 HydrophobicContact CE1-CH2 3.93Å; F195-W256 AromaticContact CE1-CZ3 3.85Å; F195-W256 HydrophobicContact CE1-CZ3 3.85Å; F195-L257 HydrophobicContact CE1-CD2 4.16Å; F195-L257 HydrophobicContact CZ-CD2 3.9Å; F195-T260 HydrophobicContact CD1-CG2 3.88Å; F195-T260 HydrophobicContact CD2-CG2 4.41Å; F195-T260 HydrophobicContact CE1-CG2 4.1Å; F195-T260 HydrophobicContact CG-CG2 4.04Å; F195-T260 HydrophobicContact CZ-CG2 4.44Å; F195-V261 HydrophobicContact CE2-CG1 4.08Å; F195-V261 HydrophobicContact CZ-CG1 4.49Å
196R95.5Very high96.6Very high113 Ų11356.6 Ų56.643%0.42627%0.266SS..Hα-helixtrans-62.9-28.2173.2-169177.6-175.2172.64.7112.2R192 E193 I198 F199R192-R196 VanDerWaalsContact O-CB 3.24Å; R192-R196 WeakPolarHBondContact O-CB 3.35Å; R192-R196 PolarHBondContact O-N 3.01Å; E193-R196 PolarHBondContact O-N 2.82Å; R196-I198 PolarHBondContact O-N 2.89Å; R196-F199 PolarHBondContact O-N 3.05Å
197S96.2Very high96.7Very high0 Ų055.2 Ų55.20%026%0.257CS..G310 helixtrans-66.1-18.417878.10000114R185 E193 C194 F195 F199 R200 H202R185-S197 PolarHBondContact NH1-OG 3.3Å; E193-S197 PolarHBondContact O-N 3.25Å; C194-S197 WeakPolarHBondContact O-CB 3.31Å; C194-S197 PolarHBondContact O-N 2.72Å; C194-S197 VanDerWaalsContact O-N 3.16Å; C194-S197 PolarHBondContact O-OG 3.46Å; F195-S197 PolarHBondContact O-N 3.33Å; S197-F199 PolarHBondContact O-N 3.45Å; S197-F199 VanDerWaalsContact O-N 3.08Å; S197-R200 WeakPolarHBondContact O-CA 3.28Å; S197-R200 WeakPolarHBondContact O-CB 3.3Å; S197-R200 PolarHBondContact O-N 2.68Å; S197-H202 PolarHBondContact O-NE2 2.92Å
198I96.9Very high96.8Very high14 Ų1451.1 Ų51.17%0.07224%0.238CC..G310 helixtrans-52.2-35.6175.2-63.2176000111.7F195 R196 I208 W209 W256 T260F195-I198 HydrophobicContact CD1-CD1 3.98Å; F195-I198 WeakPolarHBondContact O-CB 3.37Å; F195-I198 WeakPolarHBondContact O-CG1 3.42Å; F195-I198 PolarHBondContact O-N 3.3Å; R196-I198 PolarHBondContact O-N 2.89Å; I198-I208 HydrophobicContact CG1-CD1 4.42Å; I198-I208 HydrophobicContact CG1-CG2 4.16Å; I198-I208 HydrophobicContact CG2-CG2 4.18Å; I198-W209 HydrophobicContact CG2-CZ2 4.03Å; I198-W209 PolarHBondContact O-NE1 2.82Å; I198-W256 HydrophobicContact CD1-CZ3 4.18Å; I198-T260 HydrophobicContact CD1-CG2 3.9Å; I198-T260 HydrophobicContact CG1-CG2 3.93Å
199F95.4Very high96.9Very high162 Ų16255 Ų5571%0.71125%0.252SS*.G310 helixtrans-9415.4179.4-56.4-74.1000113.5R196 S197 W209R196-F199 PolarHBondContact O-N 3.05Å; S197-F199 PolarHBondContact O-N 3.45Å; S197-F199 VanDerWaalsContact O-N 3.08Å; F199-W209 HydrophobicContact CD1-CZ2 4.03Å; F199-W209 HydrophobicContact CE1-CH2 4.11Å; F199-W209 AromaticContact CE1-CZ2 3.87Å; F199-W209 HydrophobicContact CE1-CZ2 3.87Å
200R94.4Very high97.1Very high57 Ų5751.8 Ų51.822%0.21523%0.231CC..SBendtrans-115.7150.4174.3-66.4-169.164-175.2-2.2110.4W162 S197 H202 T205W162-R200 VanDerWaalsContact CD2-NH1 3.31Å; W162-R200 HydrophobicContact CZ2-CB 4.27Å; W162-R200 VanDerWaalsContact O-CZ 3.25Å; W162-R200 PolarHBondContact O-NH1 3.38Å; W162-R200 PolarHBondContact O-NH2 3.4Å; S197-R200 WeakPolarHBondContact O-CA 3.28Å; S197-R200 WeakPolarHBondContact O-CB 3.3Å; S197-R200 PolarHBondContact O-N 2.68Å; R200-H202 PolarHBondContact O-CD2 3.49Å; R200-H202 VanDerWaalsContact O-CD2 3.3Å; R200-T205 PolarHBondContact O-OG1 3.25Å
201L96.4Very high97.2Very high104 Ų10450.1 Ų50.155%0.54522%0.218SC..  trans-83.3119.9177.6-163.167.1000110.9T205 I400 W401L201-T205 HydrophobicContact CD1-CG2 4.38Å; L201-I400 HydrophobicContact CD1-CG2 3.48Å; L201-I400 VanDerWaalsContact CD1-CG2 3.48Å; L201-I400 HydrophobicContact CD2-CG2 4.2Å; L201-I400 HydrophobicContact CG-CG2 3.76Å; L201-W401 HydrophobicContact CD1-CH2 4.42Å; L201-W401 HydrophobicContact CD1-CZ2 3.78Å
202H97.1Very high97.2Very high0 Ų047.3 Ų47.30%021%0.207CC..SBendtrans-160.2174.7178.154.365.7000110.3W162 V164 G183 R185 S197 R200 E204 T205W162-H202 HydrophobicContact CH2-CB 4.27Å; W162-H202 AromaticContact CH2-CD2 3.9Å; V164-H202 HydrophobicContact CG1-CB 4.32Å; G183-H202 CarbonylContact O-C 3.58Å; G183-H202 WeakPolarHBondContact O-CA 3.38Å; G183-H202 VanDerWaalsContact O-CB 3.23Å; G183-H202 WeakPolarHBondContact O-CB 3.31Å; R185-H202 WeakPolarHBondContact CD-NE2 3.27Å; R185-H202 HydrophobicContact CG-CB 4.01Å; S197-H202 PolarHBondContact O-NE2 2.92Å; R200-H202 PolarHBondContact O-CD2 3.49Å; R200-H202 VanDerWaalsContact O-CD2 3.3Å; H202-E204 PolarHBondContact ND1-N 2.9Å; H202-E204 VanDerWaalsContact ND1-N 3.18Å; H202-E204 PolarHBondContact O-N 2.85Å; H202-E204 VanDerWaalsContact O-N 3.12Å; H202-T205 PolarHBondContact CE1-N 2.93Å; H202-T205 PolarHBondContact N-OG1 3.41Å; H202-T205 PolarHBondContact ND1-N 3.06Å; H202-T205 PolarHBondContact ND1-OG1 3.33Å; H202-T205 WeakPolarHBondContact O-CB 3.3Å; H202-T205 PolarHBondContact O-N 2.86Å; H202-T205 PolarHBondContact O-OG1 2.93Å
203T97.8Very high97.3Very high3 Ų343.2 Ų43.22%0.01820%0.198CC..THydrogen-bonded Turntrans-54.9-34.2-176.949.70000113.7R182 G183 H184 D399 Q403R182-T203 VanDerWaalsContact O-CG2 3.27Å; R182-T203 WeakPolarHBondContact O-CG2 3.28Å; G183-T203 PolarHBondContact O-N 3.42Å; H184-T203 PolarHBondContact ND1-OG1 3.36Å; T203-D399 WeakPolarHBondContact CA-O 3.18Å; T203-D399 VanDerWaalsContact CG2-O 3.24Å; T203-D399 WeakPolarHBondContact CG2-O 3.19Å; T203-Q403 PolarHBondContact O-NE2 2.83Å
204E98.3Very high97.5Very high24 Ų2440.7 Ų40.711%0.11219%0.187CC..THydrogen-bonded Turntrans-85.3-3.1179.5-59.7-63.6164.900115.1R185 H202 G206 N207 I208 H259 Y262R185-E204 VanDerWaalsContact NH2-CG 3.31Å; H202-E204 PolarHBondContact ND1-N 2.9Å; H202-E204 VanDerWaalsContact ND1-N 3.18Å; H202-E204 PolarHBondContact O-N 2.85Å; H202-E204 VanDerWaalsContact O-N 3.12Å; E204-G206 PolarHBondContact O-N 3.49Å; E204-N207 PolarHBondContact O-N 2.91Å; E204-N207 PolarHBondContact OE2-ND2 2.89Å; E204-I208 HydrophobicContact CB-CD1 4.38Å; E204-I208 VanDerWaalsContact O-CG1 3.32Å; E204-I208 WeakPolarHBondContact O-CG1 3.39Å; E204-I208 PolarHBondContact O-N 3.35Å; E204-H259 IonicContact OE2-CE1 4Å; E204-H259 IonicContact OE2-CG 3.69Å; E204-H259 IonicContact OE2-ND1 3.06Å; E204-H259 PolarHBondContact OE2-ND1 2.96Å; E204-Y262 HydrophobicContact CG-CD1 4.37Å
205T98.1Very high97.6Very high10 Ų1043 Ų436%0.06120%0.197CC..Hα-helixtrans-59.8-51.6-172.9-57.90000111.2R200 L201 H202 N207 I208 W209R200-T205 PolarHBondContact O-OG1 3.25Å; L201-T205 HydrophobicContact CD1-CG2 4.38Å; H202-T205 PolarHBondContact CE1-N 2.93Å; H202-T205 PolarHBondContact N-OG1 3.41Å; H202-T205 PolarHBondContact ND1-N 3.06Å; H202-T205 PolarHBondContact ND1-OG1 3.33Å; H202-T205 WeakPolarHBondContact O-CB 3.3Å; H202-T205 PolarHBondContact O-N 2.86Å; H202-T205 PolarHBondContact O-OG1 2.93Å; T205-N207 VanDerWaalsContact C-N 3.34Å; T205-N207 PolarHBondContact O-N 3.48Å; T205-I208 PolarHBondContact O-N 3.44Å; T205-W209 VanDerWaalsContact O-CD1 3.27Å; T205-W209 PolarHBondContact O-N 2.91Å
206G97.6Very high97.6Very high6 Ų642.3 Ų42.36%0.06220%0.2CC..Hα-helixtrans-65.7-33.8178.200000113.6E204 T210E204-G206 PolarHBondContact O-N 3.49Å; G206-T210 WeakPolarHBondContact O-CB 3.37Å; G206-T210 WeakPolarHBondContact O-CG2 3.38Å; G206-T210 PolarHBondContact O-N 2.97Å; G206-T210 PolarHBondContact O-OG1 3.44Å
207N98.4Very high97.8Very high0 Ų039 Ų390%019%0.193CC..Hα-helixtrans-64.7-42178.1-65.7-23.7000111.1E204 T205 T210 H259 Q403 Q406 H409E204-N207 PolarHBondContact O-N 2.91Å; E204-N207 PolarHBondContact OE2-ND2 2.89Å; T205-N207 VanDerWaalsContact C-N 3.34Å; T205-N207 PolarHBondContact O-N 3.48Å; N207-T210 PolarHBondContact O-OG1 3.44Å; N207-H259 HydrophobicContact CB-CB 4.26Å; N207-Q403 PolarHBondContact ND2-NE2 3.48Å; N207-Q406 WeakPolarHBondContact OD1-CA 3.4Å; N207-Q406 WeakPolarHBondContact OD1-CG 3.3Å; N207-Q406 PolarHBondContact OD1-N 3.32Å; N207-H409 PolarHBondContact O-CE1 3.38Å; N207-H409 PolarHBondContact O-ND1 2.89Å
208I98.7Very high97.9Very high0 Ų039 Ų390%019%0.193CC..Hα-helixtrans-65.1-55.1175.8-64166.8000110.4I198 E204 T205 T210 H211 L212 H259I198-I208 HydrophobicContact CG1-CD1 4.42Å; I198-I208 HydrophobicContact CG1-CG2 4.16Å; I198-I208 HydrophobicContact CG2-CG2 4.18Å; E204-I208 HydrophobicContact CB-CD1 4.38Å; E204-I208 VanDerWaalsContact O-CG1 3.32Å; E204-I208 WeakPolarHBondContact O-CG1 3.39Å; E204-I208 PolarHBondContact O-N 3.35Å; T205-I208 PolarHBondContact O-N 3.44Å; I208-T210 PolarHBondContact O-N 2.92Å; I208-H211 PolarHBondContact O-N 2.91Å; I208-L212 WeakPolarHBondContact O-CB 3.29Å; I208-L212 PolarHBondContact O-N 3.38Å; I208-H259 HydrophobicContact CG1-CB 3.68Å
209W98.6Very high97.9Very high97 Ų9741.7 Ų41.737%0.36721%0.207SC..Hα-helixtrans-66.6-37.8-170.9-8399000113.2I198 F199 T205 L212 I213I198-W209 HydrophobicContact CG2-CZ2 4.03Å; I198-W209 PolarHBondContact O-NE1 2.82Å; F199-W209 HydrophobicContact CD1-CZ2 4.03Å; F199-W209 HydrophobicContact CE1-CH2 4.11Å; F199-W209 AromaticContact CE1-CZ2 3.87Å; F199-W209 HydrophobicContact CE1-CZ2 3.87Å; T205-W209 VanDerWaalsContact O-CD1 3.27Å; T205-W209 PolarHBondContact O-N 2.91Å; W209-L212 HydrophobicContact CE3-CD2 4.33Å; W209-L212 HydrophobicContact CZ3-CD2 4.38Å; W209-L212 PolarHBondContact O-N 2.98Å; W209-I213 HydrophobicContact CE3-CD1 4.25Å; W209-I213 HydrophobicContact CE3-CG1 4.28Å; W209-I213 WeakPolarHBondContact O-CB 3.48Å; W209-I213 WeakPolarHBondContact O-CD1 3.31Å; W209-I213 WeakPolarHBondContact O-CG1 3.44Å; W209-I213 PolarHBondContact O-N 3.33Å
210T98.6Very high98.1Very high33 Ų3338.7 Ų38.720%0.20220%0.198CC..Hα-helixtrans-60.2-49178.646.90000112.2G206 N207 I208 G214 H409 V410G206-T210 WeakPolarHBondContact O-CB 3.37Å; G206-T210 WeakPolarHBondContact O-CG2 3.38Å; G206-T210 PolarHBondContact O-N 2.97Å; G206-T210 PolarHBondContact O-OG1 3.44Å; N207-T210 PolarHBondContact O-OG1 3.44Å; I208-T210 PolarHBondContact O-N 2.92Å; T210-G214 PolarHBondContact O-N 3.3Å; T210-H409 VanDerWaalsContact OG1-CB 3.31Å; T210-H409 WeakPolarHBondContact OG1-CB 3.49Å; T210-H409 PolarHBondContact OG1-ND1 2.86Å; T210-V410 HydrophobicContact CG2-CG2 3.68Å
211H98.7Very high98.2Very high8 Ų838.8 Ų38.84%0.03720%0.202CC..Hα-helixtrans-79.4-26.5178.1-78-176.1000113.7I208 G214 F215 L252 S255 W256 H409I208-H211 PolarHBondContact O-N 2.91Å; H211-G214 PolarHBondContact O-N 3.49Å; H211-F215 WeakPolarHBondContact O-CB 3.37Å; H211-F215 PolarHBondContact O-N 3.35Å; H211-L252 HydrophobicContact CB-CD2 4.24Å; H211-S255 PolarHBondContact CE1-OG 3.05Å; H211-S255 WeakPolarHBondContact ND1-CB 3.29Å; H211-S255 PolarHBondContact ND1-OG 2.94Å; H211-W256 HydrophobicContact CB-CB 4.06Å; H211-H409 AromaticContact CD2-CG 3.74Å; H211-H409 AromaticContact CD2-ND1 3.73Å; H211-H409 AromaticContact CE1-CD2 3.42Å; H211-H409 PolarHBondContact CE1-CD2 3.37Å; H211-H409 VanDerWaalsContact CE1-CD2 3.42Å; H211-H409 AromaticContact CE1-CE1 3.57Å; H211-H409 AromaticContact CE1-CG 3.42Å; H211-H409 VanDerWaalsContact CE1-CG 3.42Å; H211-H409 AromaticContact CE1-ND1 3.52Å; H211-H409 AromaticContact CE1-NE2 3.53Å; H211-H409 AromaticContact CG-CE1 3.96Å; H211-H409 AromaticContact CG-ND1 3.55Å; H211-H409 AromaticContact ND1-CE1 3.38Å; H211-H409 PolarHBondContact ND1-CE1 2.9Å; H211-H409 AromaticContact ND1-CG 3.8Å; H211-H409 AromaticContact ND1-ND1 3.4Å; H211-H409 PolarHBondContact ND1-ND1 3.37Å; H211-H409 AromaticContact ND1-NE2 3.78Å; H211-H409 VanDerWaalsContact NE2-CA 3.3Å; H211-H409 WeakPolarHBondContact NE2-CA 3.49Å; H211-H409 WeakPolarHBondContact NE2-CB 3.48Å; H211-H409 AromaticContact NE2-CD2 3.74Å; H211-H409 AromaticContact NE2-CG 3.38Å; H211-H409 AromaticContact NE2-ND1 3.74Å; H211-H409 PolarHBondContact NE2-O 2.82Å
212L98.6Very high98.3Very high35 Ų3534.3 Ų34.318%0.18318%0.18CC..Hα-helixtrans-65.8-45.4171178.160.7000111.5I208 W209 F215 V216 W256I208-L212 WeakPolarHBondContact O-CB 3.29Å; I208-L212 PolarHBondContact O-N 3.38Å; W209-L212 HydrophobicContact CE3-CD2 4.33Å; W209-L212 HydrophobicContact CZ3-CD2 4.38Å; W209-L212 PolarHBondContact O-N 2.98Å; L212-F215 WeakPolarHBondContact O-CB 3.49Å; L212-F215 PolarHBondContact O-N 3.05Å; L212-V216 WeakPolarHBondContact O-CG2 3.36Å; L212-V216 PolarHBondContact O-N 2.9Å; L212-W256 HydrophobicContact CB-CB 4.27Å; L212-W256 HydrophobicContact CB-CG 4.27Å; L212-W256 HydrophobicContact CD1-CD2 4.05Å; L212-W256 HydrophobicContact CD1-CE3 4.41Å; L212-W256 HydrophobicContact CD1-CG 4.36Å; L212-W256 HydrophobicContact CD1-CZ2 4.38Å
213I98.6Very high98.2Very high105 Ų10538.6 Ų38.654%0.53820%0.202SC..Hα-helixtrans-63.6-45.1175-68.7165.7000109.9W209 F215 V216 C217W209-I213 HydrophobicContact CE3-CD1 4.25Å; W209-I213 HydrophobicContact CE3-CG1 4.28Å; W209-I213 WeakPolarHBondContact O-CB 3.48Å; W209-I213 WeakPolarHBondContact O-CD1 3.31Å; W209-I213 WeakPolarHBondContact O-CG1 3.44Å; W209-I213 PolarHBondContact O-N 3.33Å; I213-F215 VanDerWaalsContact C-N 3.34Å; I213-F215 PolarHBondContact O-N 3.33Å; I213-V216 PolarHBondContact O-N 3.43Å; I213-C217 WeakPolarHBondContact O-CB 3.37Å; I213-C217 PolarHBondContact O-N 3.08Å
214G98.6Very high98.1Very high2 Ų241.3 Ų41.32%0.02122%0.22CC..Hα-helixtrans-56.2-46.617400000112.3T210 H211 V216 C217 F218T210-G214 PolarHBondContact O-N 3.3Å; H211-G214 PolarHBondContact O-N 3.49Å; G214-V216 PolarHBondContact O-N 2.92Å; G214-C217 WeakPolarHBondContact O-CB 3.42Å; G214-C217 PolarHBondContact O-N 3.49Å; G214-F218 WeakPolarHBondContact O-CD2 3.23Å; G214-F218 PolarHBondContact O-N 3.3Å
215F98.8Very high97.8Very high50 Ų5041 Ų4122%0.21922%0.219CC..Hα-helixtrans-57-49.8177.7172.6-91.2000111.8H211 L212 I213 C217 F218 L219 I249 L252 W256H211-F215 WeakPolarHBondContact O-CB 3.37Å; H211-F215 PolarHBondContact O-N 3.35Å; L212-F215 WeakPolarHBondContact O-CB 3.49Å; L212-F215 PolarHBondContact O-N 3.05Å; I213-F215 VanDerWaalsContact C-N 3.34Å; I213-F215 PolarHBondContact O-N 3.33Å; F215-C217 VanDerWaalsContact C-N 3.34Å; F215-C217 PolarHBondContact O-N 2.98Å; F215-F218 PolarHBondContact O-N 3.06Å; F215-L219 HydrophobicContact CE1-CD2 4.48Å; F215-L219 WeakPolarHBondContact O-CB 3.4Å; F215-L219 PolarHBondContact O-N 3.4Å; F215-I249 HydrophobicContact CD2-CG2 4Å; F215-I249 VanDerWaalsContact CD2-O 3.27Å; F215-I249 WeakPolarHBondContact CD2-O 3.41Å; F215-I249 HydrophobicContact CE2-CG2 3.45Å; F215-I249 VanDerWaalsContact CE2-CG2 3.45Å; F215-I249 WeakPolarHBondContact CE2-O 3.5Å; F215-I249 HydrophobicContact CZ-CG2 4.15Å; F215-L252 HydrophobicContact CB-CB 4.03Å; F215-W256 AromaticContact CG-NE1 4Å
216V98.7Very high97.6Very high66 Ų6643.5 Ų43.540%0.423%0.232SC..Hα-helixtrans-63.5-40.9177.7174.20000111L212 I213 G214 L219 I220L212-V216 WeakPolarHBondContact O-CG2 3.36Å; L212-V216 PolarHBondContact O-N 2.9Å; I213-V216 PolarHBondContact O-N 3.43Å; G214-V216 PolarHBondContact O-N 2.92Å; V216-L219 PolarHBondContact O-N 2.95Å; V216-I220 HydrophobicContact CG1-CD1 3.86Å; V216-I220 HydrophobicContact CG1-CG1 4.46Å; V216-I220 WeakPolarHBondContact O-CG1 3.23Å; V216-I220 PolarHBondContact O-N 3.5Å
217C98.5Very high97.3Very high44 Ų4448.2 Ų48.230%0.29726%0.259SS..Hα-helixtrans-59.3-51.4176.7-178.60000111.7I213 G214 F215 L219 I220 L221I213-C217 WeakPolarHBondContact O-CB 3.37Å; I213-C217 PolarHBondContact O-N 3.08Å; G214-C217 WeakPolarHBondContact O-CB 3.42Å; G214-C217 PolarHBondContact O-N 3.49Å; F215-C217 VanDerWaalsContact C-N 3.34Å; F215-C217 PolarHBondContact O-N 2.98Å; C217-L219 VanDerWaalsContact C-N 3.32Å; C217-L219 PolarHBondContact O-N 3.37Å; C217-I220 PolarHBondContact O-N 3.48Å; C217-L221 WeakPolarHBondContact O-CB 3.25Å; C217-L221 VanDerWaalsContact O-CG 3.29Å; C217-L221 WeakPolarHBondContact O-CG 3.02Å; C217-L221 PolarHBondContact O-N 3.45Å
218F98.6Very high96.7Very high0 Ų053.1 Ų53.10%028%0.281CS..Hα-helixtrans-66.2-32.1178.5-87.9-87.1000113.1G214 F215 S222 F244 F245 A248 I249 L252 A416 L417G214-F218 WeakPolarHBondContact O-CD2 3.23Å; G214-F218 PolarHBondContact O-N 3.3Å; F215-F218 PolarHBondContact O-N 3.06Å; F218-S222 WeakPolarHBondContact O-CB 2.98Å; F218-S222 PolarHBondContact O-N 3.27Å; F218-F244 AromaticContact CE1-CE1 3.81Å; F218-F244 HydrophobicContact CE1-CE1 3.81Å; F218-F244 AromaticContact CE1-CZ 3.84Å; F218-F244 HydrophobicContact CE1-CZ 3.84Å; F218-F244 HydrophobicContact CZ-CZ 4.35Å; F218-F245 HydrophobicContact CD1-CD1 4.01Å; F218-F245 HydrophobicContact CD1-CE1 4.31Å; F218-A248 HydrophobicContact CD1-CB 3.64Å; F218-A248 HydrophobicContact CE1-CB 3.91Å; F218-A248 HydrophobicContact CG-CB 4.01Å; F218-A248 HydrophobicContact CZ-CB 4.49Å; F218-I249 HydrophobicContact CB-CG1 3.99Å; F218-L252 HydrophobicContact CD2-CD1 3.67Å; F218-L252 HydrophobicContact CE2-CD1 4.26Å; F218-L252 HydrophobicContact CG-CD1 4.35Å; F218-A416 HydrophobicContact CE1-CB 4.3Å; F218-A416 HydrophobicContact CE2-CB 3.88Å; F218-A416 HydrophobicContact CZ-CB 3.4Å; F218-A416 VanDerWaalsContact CZ-CB 3.4Å; F218-L417 HydrophobicContact CE2-CD2 4.13Å; F218-L417 HydrophobicContact CE2-CG 4.23Å; F218-L417 HydrophobicContact CZ-CD2 4.06Å; F218-L417 HydrophobicContact CZ-CG 4.25Å
219L98.4Very high95.3Very high70 Ų7059.1 Ų59.137%0.36632%0.321SS..Hα-helixtrans-63.9-47.7172.9-176.464.5000111.4F215 V216 C217 S222 I223 I249F215-L219 HydrophobicContact CE1-CD2 4.48Å; F215-L219 WeakPolarHBondContact O-CB 3.4Å; F215-L219 PolarHBondContact O-N 3.4Å; V216-L219 PolarHBondContact O-N 2.95Å; C217-L219 VanDerWaalsContact C-N 3.32Å; C217-L219 PolarHBondContact O-N 3.37Å; L219-S222 PolarHBondContact O-N 3.37Å; L219-I223 HydrophobicContact CD1-CD1 4.26Å; L219-I223 HydrophobicContact CG-CD1 4.17Å; L219-I223 VanDerWaalsContact O-CG1 3.32Å; L219-I223 WeakPolarHBondContact O-CG1 3.2Å; L219-I223 PolarHBondContact O-N 3.02Å; L219-I223 VanDerWaalsContact O-N 3.08Å; L219-I249 HydrophobicContact CD1-CD1 4.24Å
220I98.2Very high93.7Very high98 Ų9857 Ų5750%0.50333%0.329SS..Hα-helixtrans-62.1-49.2176.6-67.6167.8000110.1V216 C217 S222 I223 S224V216-I220 HydrophobicContact CG1-CD1 3.86Å; V216-I220 HydrophobicContact CG1-CG1 4.46Å; V216-I220 WeakPolarHBondContact O-CG1 3.23Å; V216-I220 PolarHBondContact O-N 3.5Å; C217-I220 PolarHBondContact O-N 3.48Å; I220-S222 VanDerWaalsContact C-N 3.33Å; I220-S222 PolarHBondContact O-N 3.19Å; I220-I223 PolarHBondContact O-N 2.92Å; I220-S224 WeakPolarHBondContact O-CB 3.23Å; I220-S224 PolarHBondContact O-N 3.41Å; I220-S224 PolarHBondContact O-OG 3.23Å; I220-S224 VanDerWaalsContact O-OG 3.05Å
221L97.2Very high92.4Very high59 Ų5957.6 Ų57.631%0.30933%0.331SS..Hα-helixtrans-59.8-41.4179.5-70.3172.4000112.3C217 S224 F225 F245 L417 L420C217-L221 WeakPolarHBondContact O-CB 3.25Å; C217-L221 VanDerWaalsContact O-CG 3.29Å; C217-L221 WeakPolarHBondContact O-CG 3.02Å; C217-L221 PolarHBondContact O-N 3.45Å; L221-S224 PolarHBondContact O-N 2.9Å; L221-F225 VanDerWaalsContact O-CB 3.3Å; L221-F225 WeakPolarHBondContact O-CB 3.48Å; L221-F225 PolarHBondContact O-N 3.41Å; L221-F245 HydrophobicContact CB-CE1 3.68Å; L221-F245 HydrophobicContact CB-CZ 4.29Å; L221-L417 HydrophobicContact CD1-CD2 3.77Å; L221-L420 HydrophobicContact CD1-CD2 4.23Å
222S97.3Very high91.3Very high11 Ų1164.9 Ų64.98%0.07737%0.37CS..Hα-helixtrans-60.7-47.9176.1172.90000111.7F218 L219 I220 F225 L226 Q242F218-S222 WeakPolarHBondContact O-CB 2.98Å; F218-S222 PolarHBondContact O-N 3.27Å; L219-S222 PolarHBondContact O-N 3.37Å; I220-S222 VanDerWaalsContact C-N 3.33Å; I220-S222 PolarHBondContact O-N 3.19Å; S222-F225 PolarHBondContact O-N 3.12Å; S222-L226 WeakPolarHBondContact O-CG 3.33Å; S222-L226 PolarHBondContact O-N 3.49Å; S222-Q242 PolarHBondContact O-NE2 2.9Å; S222-Q242 VanDerWaalsContact O-NE2 3.16Å; S222-Q242 PolarHBondContact OG-NE2 3.35Å; S222-Q242 PolarHBondContact OG-OE1 3.35Å
223I96.3Very high90.5Very high90 Ų9065 Ų6546%0.46237%0.37SS..Hα-helixtrans-64.3-48.7178.1-66.4166.2000109.9L219 I220 F225 L226 V227L219-I223 HydrophobicContact CD1-CD1 4.26Å; L219-I223 HydrophobicContact CG-CD1 4.17Å; L219-I223 VanDerWaalsContact O-CG1 3.32Å; L219-I223 WeakPolarHBondContact O-CG1 3.2Å; L219-I223 PolarHBondContact O-N 3.02Å; L219-I223 VanDerWaalsContact O-N 3.08Å; I220-I223 PolarHBondContact O-N 2.92Å; I223-F225 VanDerWaalsContact C-N 3.29Å; I223-F225 PolarHBondContact O-N 3.5Å; I223-L226 PolarHBondContact O-N 3.01Å; I223-L226 VanDerWaalsContact O-N 3.09Å; I223-V227 HydrophobicContact CG2-CG1 4.34Å; I223-V227 WeakPolarHBondContact O-CG2 3.15Å; I223-V227 PolarHBondContact O-N 3.19Å
224S94.6Very high89.9Confident59 Ų5966.8 Ų66.841%0.41338%0.376SS..Hα-helixtrans-55.5-43.2177.4-66.20000112I220 L221 L226 V227 H228I220-S224 WeakPolarHBondContact O-CB 3.23Å; I220-S224 PolarHBondContact O-N 3.41Å; I220-S224 PolarHBondContact O-OG 3.23Å; I220-S224 VanDerWaalsContact O-OG 3.05Å; L221-S224 PolarHBondContact O-N 2.9Å; S224-L226 VanDerWaalsContact C-N 3.35Å; S224-L226 PolarHBondContact O-N 3.31Å; S224-V227 PolarHBondContact O-N 3.17Å; S224-H228 WeakPolarHBondContact O-CB 3.31Å; S224-H228 PolarHBondContact O-N 3.37Å
225F93.6Very high89.5Confident18 Ų1874.6 Ų74.68%0.07941%0.405CS..Hα-helixtrans-63.3-37.2177.2176.4-100000112.8L221 S222 I223 L231 K238 V241 F245 M424L221-F225 VanDerWaalsContact O-CB 3.3Å; L221-F225 WeakPolarHBondContact O-CB 3.48Å; L221-F225 PolarHBondContact O-N 3.41Å; S222-F225 PolarHBondContact O-N 3.12Å; I223-F225 VanDerWaalsContact C-N 3.29Å; I223-F225 PolarHBondContact O-N 3.5Å; F225-L231 HydrophobicContact CD2-CD1 3.89Å; F225-L231 HydrophobicContact CE2-CD1 4.01Å; F225-K238 HydrophobicContact CE1-CB 4.06Å; F225-K238 HydrophobicContact CE1-CG 4.19Å; F225-K238 HydrophobicContact CZ-CG 4.37Å; F225-V241 HydrophobicContact CD1-CG1 4.43Å; F225-V241 HydrophobicContact CE1-CB 3.79Å; F225-V241 HydrophobicContact CE1-CG1 3.91Å; F225-V241 HydrophobicContact CE2-CG1 4.28Å; F225-V241 HydrophobicContact CZ-CB 3.73Å; F225-V241 HydrophobicContact CZ-CG1 3.82Å; F225-V241 HydrophobicContact CZ-CG2 3.99Å; F225-F245 HydrophobicContact CB-CE2 3.88Å; F225-F245 HydrophobicContact CB-CZ 4.17Å; F225-F245 HydrophobicContact CD1-CD2 4.45Å; F225-F245 AromaticContact CD1-CE2 3.92Å; F225-F245 HydrophobicContact CD1-CE2 3.92Å; F225-F245 AromaticContact CG-CE2 3.85Å; F225-F245 HydrophobicContact CG-CE2 3.85Å; F225-F245 HydrophobicContact CG-CZ 4.49Å; F225-M424 HydrophobicContact CD2-SD 4.49Å; F225-M424 HydrophobicContact CE2-CE 3.98Å; F225-M424 HydrophobicContact CE2-SD 4.01Å
226L93Very high89.2Confident63 Ų6377.9 Ų77.933%0.3342%0.421SS..Hα-helixtrans-69.7-44.8177.1-70.2171.1000112.6S222 I223 S224 W235 K238 M239 Q242S222-L226 WeakPolarHBondContact O-CG 3.33Å; S222-L226 PolarHBondContact O-N 3.49Å; I223-L226 PolarHBondContact O-N 3.01Å; I223-L226 VanDerWaalsContact O-N 3.09Å; S224-L226 VanDerWaalsContact C-N 3.35Å; S224-L226 PolarHBondContact O-N 3.31Å; L226-W235 HydrophobicContact CD2-CZ3 4.49Å; L226-K238 PolarHBondContact O-NZ 3.13Å; L226-M239 HydrophobicContact CD2-CE 3.9Å; L226-Q242 HydrophobicContact CD2-CG 3.84Å; L226-Q242 HydrophobicContact CG-CG 4.41Å
227V90.9Very high88.8Confident104 Ų10475.3 Ų75.363%0.6340%0.404SS*.Hα-helixtrans-86.3-11.2-171.7-55.20000113.8I223 S224 P229I223-V227 HydrophobicContact CG2-CG1 4.34Å; I223-V227 WeakPolarHBondContact O-CG2 3.15Å; I223-V227 PolarHBondContact O-N 3.19Å; S224-V227 PolarHBondContact O-N 3.17Å; V227-P229 WeakPolarHBondContact O-CD 3.49Å
228H86.4Confident88.6Confident103 Ų10374.7 Ų74.748%0.47740%0.397SS..  trans-60.4111.6-175.3-167.285.4000111.2S224 G230 L231S224-H228 WeakPolarHBondContact O-CB 3.31Å; S224-H228 PolarHBondContact O-N 3.37Å; H228-G230 PolarHBondContact CD2-N 3.38Å; H228-G230 PolarHBondContact O-N 3.45Å; H228-L231 HydrophobicContact CB-CD1 3.96Å; H228-L231 HydrophobicContact CB-CG 4.27Å; H228-L231 PolarHBondContact O-N 2.86Å
229P69.1Low88.4Confident127 Ų12777.5 Ų77.583%0.82541%0.411SS*.THydrogen-bonded Turntrans-72.6-12.6-168.126.6-32.7000114.1V227V227-P229 WeakPolarHBondContact O-CD 3.49Å
230G65.7Low88.3Confident52 Ų5275.8 Ų75.854%0.53640%0.402SS..THydrogen-bonded Turntrans-96-5.1179.700000115.9H228 N232H228-G230 PolarHBondContact CD2-N 3.38Å; H228-G230 PolarHBondContact O-N 3.45Å; G230-N232 PolarHBondContact O-N 2.8Å; G230-N232 VanDerWaalsContact O-N 3.12Å
231L71.2Confident88.2Confident46 Ų4671.3 Ų71.324%0.24138%0.379CS..  trans-83.490.5178.2-74.1172.3000109F225 H228 I233F225-L231 HydrophobicContact CD2-CD1 3.89Å; F225-L231 HydrophobicContact CE2-CD1 4.01Å; H228-L231 HydrophobicContact CB-CD1 3.96Å; H228-L231 HydrophobicContact CB-CG 4.27Å; H228-L231 PolarHBondContact O-N 2.86Å; L231-I233 HydrophobicContact CB-CD1 4.36Å; L231-I233 HydrophobicContact CB-CG1 4.37Å; L231-I233 HydrophobicContact CD2-CD1 3.89Å; L231-I233 PolarHBondContact O-N 3.43Å
232N74.9Confident88.2Confident161 Ų16169.3 Ų69.386%0.86137%0.368SS*.  trans-69.351.1170.8-72.3-27000111.8G230G230-N232 PolarHBondContact O-N 2.8Å; G230-N232 VanDerWaalsContact O-N 3.12Å
233I81.5Confident88.2Confident37 Ų3771.8 Ų71.819%0.1938%0.382CS..  trans-106.5130-178.8-65-179.5000107.7L231 E237 K238 L431L231-I233 HydrophobicContact CB-CD1 4.36Å; L231-I233 HydrophobicContact CB-CG1 4.37Å; L231-I233 HydrophobicContact CD2-CD1 3.89Å; L231-I233 PolarHBondContact O-N 3.43Å; I233-E237 HydrophobicContact CG2-CB 3.27Å; I233-E237 HydrophobicContact CG2-CG 4.12Å; I233-K238 HydrophobicContact CG2-CG 4.16Å; I233-L431 HydrophobicContact CG1-CD1 4.39Å; I233-L431 HydrophobicContact CG2-CD1 4.42Å
234H87.3Confident88.3Confident142 Ų14267.5 Ų67.566%0.65736%0.36SS*.  trans-54.1147.2176.5-68.294.1000111.4Q236 E237 K238H234-Q236 PolarHBondContact O-N 3.17Å; H234-Q236 VanDerWaalsContact O-N 3.17Å; H234-E237 HydrophobicContact CB-CG 4.42Å; H234-E237 WeakPolarHBondContact O-CB 3.31Å; H234-E237 PolarHBondContact O-N 3.18Å; H234-K238 PolarHBondContact O-N 3.3Å
235W89.2Confident88.5Confident166 Ų16664.9 Ų64.963%0.62934%0.342SS*.Hα-helixtrans-55.8-36.5-178169.5-102.2000112.9L226 E237 K238 M239L226-W235 HydrophobicContact CD2-CZ3 4.49Å; W235-E237 VanDerWaalsContact C-N 3.33Å; W235-E237 PolarHBondContact O-N 3.15Å; W235-K238 WeakPolarHBondContact O-CB 3.37Å; W235-K238 PolarHBondContact O-N 3.34Å; W235-M239 HydrophobicContact CD2-CE 4.05Å; W235-M239 HydrophobicContact CD2-CG 4.07Å; W235-M239 HydrophobicContact CD2-SD 4.41Å; W235-M239 VanDerWaalsContact CE2-CG 3.49Å; W235-M239 HydrophobicContact CE3-CE 3.84Å; W235-M239 HydrophobicContact CG-CG 4.41Å; W235-M239 HydrophobicContact CH2-CE 3.22Å; W235-M239 HydrophobicContact CH2-SD 3.67Å; W235-M239 HydrophobicContact CZ2-CE 3.44Å; W235-M239 VanDerWaalsContact CZ2-CE 3.44Å; W235-M239 HydrophobicContact CZ2-CG 3.79Å; W235-M239 HydrophobicContact CZ2-SD 3.23Å; W235-M239 WeakPolarHBondContact CZ2-SD 3.45Å; W235-M239 HydrophobicContact CZ3-CE 3.43Å; W235-M239 VanDerWaalsContact CZ3-CE 3.43Å; W235-M239 HydrophobicContact CZ3-SD 4.39Å; W235-M239 WeakPolarHBondContact O-CG 3.41Å; W235-M239 PolarHBondContact O-N 3.01Å
236Q91.9Very high88.7Confident120 Ų12067.5 Ų67.556%0.56136%0.359SS*.Hα-helixtrans-58.1-44.7177.1-62.292.5-40.500111.9H234 M239 I240H234-Q236 PolarHBondContact O-N 3.17Å; H234-Q236 VanDerWaalsContact O-N 3.17Å; Q236-M239 PolarHBondContact O-N 3.47Å; Q236-I240 WeakPolarHBondContact O-CG1 3.27Å; Q236-I240 PolarHBondContact O-N 3.39Å
237E91.9Very high89Confident11 Ų1164.9 Ų64.95%0.05135%0.346CS..Hα-helixtrans-66.7-38.8178.2-62-54.2145.100111.3I233 H234 W235 M239 I240 V241 H293 Y294 Y297 L431I233-E237 HydrophobicContact CG2-CB 3.27Å; I233-E237 HydrophobicContact CG2-CG 4.12Å; H234-E237 HydrophobicContact CB-CG 4.42Å; H234-E237 WeakPolarHBondContact O-CB 3.31Å; H234-E237 PolarHBondContact O-N 3.18Å; W235-E237 VanDerWaalsContact C-N 3.33Å; W235-E237 PolarHBondContact O-N 3.15Å; E237-M239 VanDerWaalsContact C-N 3.31Å; E237-M239 PolarHBondContact O-N 3.19Å; E237-I240 PolarHBondContact O-N 3.49Å; E237-V241 PolarHBondContact O-N 3.39Å; E237-H293 IonicContact OE1-CE1 3.9Å; E237-H293 IonicContact OE1-NE2 3.25Å; E237-H293 PolarHBondContact OE1-NE2 3.39Å; E237-H293 IonicContact OE2-CD2 3.6Å; E237-H293 IonicContact OE2-NE2 3.05Å; E237-H293 PolarHBondContact OE2-NE2 3.04Å; E237-Y294 PolarHBondContact O-OH 3.34Å; E237-Y294 WeakPolarHBondContact OE2-CE1 3.23Å; E237-Y294 PolarHBondContact OE2-OH 3.47Å; E237-Y297 WeakPolarHBondContact OE1-CE2 3.4Å; E237-Y297 PolarHBondContact OE1-OH 3.4Å; E237-L431 HydrophobicContact CG-CD2 4.21Å
238K93.4Very high89.4Confident31 Ų3160 Ų6014%0.13532%0.316CS..Hα-helixtrans-59.7-43.6171.9-66.2-171.3177.3-171.50111.2F225 L226 I233 H234 W235 I240 V241 Q242F225-K238 HydrophobicContact CE1-CB 4.06Å; F225-K238 HydrophobicContact CE1-CG 4.19Å; F225-K238 HydrophobicContact CZ-CG 4.37Å; L226-K238 PolarHBondContact O-NZ 3.13Å; I233-K238 HydrophobicContact CG2-CG 4.16Å; H234-K238 PolarHBondContact O-N 3.3Å; W235-K238 WeakPolarHBondContact O-CB 3.37Å; W235-K238 PolarHBondContact O-N 3.34Å; K238-I240 VanDerWaalsContact C-N 3.33Å; K238-I240 PolarHBondContact O-N 3.05Å; K238-V241 PolarHBondContact O-N 3.46Å; K238-Q242 VanDerWaalsContact O-CG 3.31Å; K238-Q242 WeakPolarHBondContact O-CG 3.4Å; K238-Q242 PolarHBondContact O-N 3.1Å
239M94.8Very high90Very high60 Ų6056.4 Ų56.430%0.29630%0.3SS..Hα-helixtrans-65.1-36.4179.4-69.4-54.593.600112.9L226 W235 Q236 E237 Q242 V243L226-M239 HydrophobicContact CD2-CE 3.9Å; W235-M239 HydrophobicContact CD2-CE 4.05Å; W235-M239 HydrophobicContact CD2-CG 4.07Å; W235-M239 HydrophobicContact CD2-SD 4.41Å; W235-M239 VanDerWaalsContact CE2-CG 3.49Å; W235-M239 HydrophobicContact CE3-CE 3.84Å; W235-M239 HydrophobicContact CG-CG 4.41Å; W235-M239 HydrophobicContact CH2-CE 3.22Å; W235-M239 HydrophobicContact CH2-SD 3.67Å; W235-M239 HydrophobicContact CZ2-CE 3.44Å; W235-M239 VanDerWaalsContact CZ2-CE 3.44Å; W235-M239 HydrophobicContact CZ2-CG 3.79Å; W235-M239 HydrophobicContact CZ2-SD 3.23Å; W235-M239 WeakPolarHBondContact CZ2-SD 3.45Å; W235-M239 HydrophobicContact CZ3-CE 3.43Å; W235-M239 VanDerWaalsContact CZ3-CE 3.43Å; W235-M239 HydrophobicContact CZ3-SD 4.39Å; W235-M239 WeakPolarHBondContact O-CG 3.41Å; W235-M239 PolarHBondContact O-N 3.01Å; Q236-M239 PolarHBondContact O-N 3.47Å; E237-M239 VanDerWaalsContact C-N 3.31Å; E237-M239 PolarHBondContact O-N 3.19Å; M239-Q242 HydrophobicContact CE-CB 4.38Å; M239-Q242 HydrophobicContact CE-CG 3.89Å; M239-Q242 WeakPolarHBondContact O-CB 3.36Å; M239-Q242 PolarHBondContact O-N 3.43Å; M239-V243 PolarHBondContact O-N 3.18Å; M239-V243 VanDerWaalsContact O-N 3.13Å
240I96.2Very high91.4Very high34 Ų3453.7 Ų53.717%0.17428%0.278CS..Hα-helixtrans-64.5-43.7177.5-70.2168.5000111Q236 E237 K238 Q242 V243 P290 H293Q236-I240 WeakPolarHBondContact O-CG1 3.27Å; Q236-I240 PolarHBondContact O-N 3.39Å; E237-I240 PolarHBondContact O-N 3.49Å; K238-I240 VanDerWaalsContact C-N 3.33Å; K238-I240 PolarHBondContact O-N 3.05Å; I240-Q242 VanDerWaalsContact C-N 3.33Å; I240-V243 WeakPolarHBondContact O-CB 3.47Å; I240-V243 PolarHBondContact O-N 2.85Å; I240-P290 HydrophobicContact CG2-CB 3.83Å; I240-H293 VanDerWaalsContact CD1-CD2 3.49Å; I240-H293 WeakPolarHBondContact CD1-CD2 3.38Å; I240-H293 WeakPolarHBondContact CD1-CE1 3.3Å; I240-H293 WeakPolarHBondContact CD1-NE2 3.45Å; I240-H293 HydrophobicContact CG2-CB 3.99Å
241V96.2Very high92.9Very high3 Ų351.7 Ų51.72%0.01826%0.257CS..Hα-helixtrans-67.8-33.6173.5-179.10000111.5F225 E237 K238 V243 F244 F245 Y294 I423F225-V241 HydrophobicContact CD1-CG1 4.43Å; F225-V241 HydrophobicContact CE1-CB 3.79Å; F225-V241 HydrophobicContact CE1-CG1 3.91Å; F225-V241 HydrophobicContact CE2-CG1 4.28Å; F225-V241 HydrophobicContact CZ-CB 3.73Å; F225-V241 HydrophobicContact CZ-CG1 3.82Å; F225-V241 HydrophobicContact CZ-CG2 3.99Å; E237-V241 PolarHBondContact O-N 3.39Å; K238-V241 PolarHBondContact O-N 3.46Å; V241-V243 PolarHBondContact O-N 3.45Å; V241-F244 WeakPolarHBondContact O-CB 3.19Å; V241-F244 PolarHBondContact O-N 3.04Å; V241-F245 HydrophobicContact CG1-CD2 4.01Å; V241-F245 HydrophobicContact CG1-CE2 3.7Å; V241-F245 PolarHBondContact O-N 2.98Å; V241-Y294 HydrophobicContact CG2-CE2 4.11Å; V241-I423 HydrophobicContact CG2-CG2 4.17Å
242Q96.7Very high94.3Very high18 Ų1849.7 Ų49.78%0.08425%0.247CC..Hα-helixtrans-64.7-24.2176-77.3-58.6-23.300114.4S222 L226 K238 M239 I240 F244 F245 T246S222-Q242 PolarHBondContact O-NE2 2.9Å; S222-Q242 VanDerWaalsContact O-NE2 3.16Å; S222-Q242 PolarHBondContact OG-NE2 3.35Å; S222-Q242 PolarHBondContact OG-OE1 3.35Å; L226-Q242 HydrophobicContact CD2-CG 3.84Å; L226-Q242 HydrophobicContact CG-CG 4.41Å; K238-Q242 VanDerWaalsContact O-CG 3.31Å; K238-Q242 WeakPolarHBondContact O-CG 3.4Å; K238-Q242 PolarHBondContact O-N 3.1Å; M239-Q242 HydrophobicContact CE-CB 4.38Å; M239-Q242 HydrophobicContact CE-CG 3.89Å; M239-Q242 WeakPolarHBondContact O-CB 3.36Å; M239-Q242 PolarHBondContact O-N 3.43Å; I240-Q242 VanDerWaalsContact C-N 3.33Å; Q242-F244 VanDerWaalsContact C-N 3.26Å; Q242-F244 PolarHBondContact O-N 3.46Å; Q242-F245 PolarHBondContact O-N 3.1Å; Q242-T246 VanDerWaalsContact O-CB 3.3Å; Q242-T246 WeakPolarHBondContact O-CB 3.25Å; Q242-T246 PolarHBondContact O-N 3.07Å; Q242-T246 PolarHBondContact O-OG1 3.12Å
243V97.9Very high95.4Very high63 Ų6342.3 Ų42.338%0.38221%0.209SC..Hα-helixtrans-58.3-43.5170.7177.20000110.1M239 I240 V241 S247 V289M239-V243 PolarHBondContact O-N 3.18Å; M239-V243 VanDerWaalsContact O-N 3.13Å; I240-V243 WeakPolarHBondContact O-CB 3.47Å; I240-V243 PolarHBondContact O-N 2.85Å; V241-V243 PolarHBondContact O-N 3.45Å; V243-S247 WeakPolarHBondContact O-CB 3.36Å; V243-S247 PolarHBondContact O-N 2.87Å; V243-S247 PolarHBondContact O-OG 3.16Å; V243-V289 HydrophobicContact CB-CG1 4.45Å; V243-V289 HydrophobicContact CG1-CB 4.17Å; V243-V289 HydrophobicContact CG1-CG1 4.25Å; V243-V289 HydrophobicContact CG1-CG2 4.36Å
244F98.4Very high96.2Very high0 Ų042.9 Ų42.90%021%0.21CC..Hα-helixtrans-64.8-50.7175.9169.9-115.7000111.8F218 V241 Q242 T246 S247 A248 L283 G286 P290 A416 L420 I423F218-F244 AromaticContact CE1-CE1 3.81Å; F218-F244 HydrophobicContact CE1-CE1 3.81Å; F218-F244 AromaticContact CE1-CZ 3.84Å; F218-F244 HydrophobicContact CE1-CZ 3.84Å; F218-F244 HydrophobicContact CZ-CZ 4.35Å; V241-F244 WeakPolarHBondContact O-CB 3.19Å; V241-F244 PolarHBondContact O-N 3.04Å; Q242-F244 VanDerWaalsContact C-N 3.26Å; Q242-F244 PolarHBondContact O-N 3.46Å; F244-T246 VanDerWaalsContact C-N 3.34Å; F244-T246 PolarHBondContact O-N 2.78Å; F244-S247 PolarHBondContact O-N 3.47Å; F244-S247 VanDerWaalsContact O-N 3.16Å; F244-S247 PolarHBondContact O-OG 3.07Å; F244-A248 PolarHBondContact O-N 3.46Å; F244-L283 HydrophobicContact CE2-CD1 3.99Å; F244-G286 VanDerWaalsContact CA-O 3.29Å; F244-G286 WeakPolarHBondContact CA-O 3.25Å; F244-G286 WeakPolarHBondContact CB-O 3.35Å; F244-G286 PolarHBondContact N-O 3.47Å; F244-P290 HydrophobicContact CB-CG 3.93Å; F244-A416 HydrophobicContact CZ-CB 4.28Å; F244-A416 WeakPolarHBondContact CZ-O 3.45Å; F244-L420 HydrophobicContact CD1-CD1 4.06Å; F244-L420 HydrophobicContact CE1-CB 3.85Å; F244-L420 HydrophobicContact CE1-CD1 3.93Å; F244-L420 HydrophobicContact CE1-CG 4.38Å; F244-I423 HydrophobicContact CB-CD1 4.19Å; F244-I423 HydrophobicContact CD1-CD1 3.9Å; F244-I423 HydrophobicContact CD2-CD1 4.4Å; F244-I423 HydrophobicContact CE1-CD1 4.4Å; F244-I423 HydrophobicContact CG-CD1 3.89Å
245F98.4Very high96.8Very high4 Ų436.1 Ų36.12%0.01818%0.179CC..Hα-helixtrans-55-48.8177.8-80.1-63.6000112.3F218 L221 F225 V241 Q242 S247 A248 I249 L420F218-F245 HydrophobicContact CD1-CD1 4.01Å; F218-F245 HydrophobicContact CD1-CE1 4.31Å; L221-F245 HydrophobicContact CB-CE1 3.68Å; L221-F245 HydrophobicContact CB-CZ 4.29Å; F225-F245 HydrophobicContact CB-CE2 3.88Å; F225-F245 HydrophobicContact CB-CZ 4.17Å; F225-F245 HydrophobicContact CD1-CD2 4.45Å; F225-F245 AromaticContact CD1-CE2 3.92Å; F225-F245 HydrophobicContact CD1-CE2 3.92Å; F225-F245 AromaticContact CG-CE2 3.85Å; F225-F245 HydrophobicContact CG-CE2 3.85Å; F225-F245 HydrophobicContact CG-CZ 4.49Å; V241-F245 HydrophobicContact CG1-CD2 4.01Å; V241-F245 HydrophobicContact CG1-CE2 3.7Å; V241-F245 PolarHBondContact O-N 2.98Å; Q242-F245 PolarHBondContact O-N 3.1Å; F245-S247 VanDerWaalsContact C-N 3.32Å; F245-S247 PolarHBondContact O-N 2.88Å; F245-A248 PolarHBondContact O-N 3.43Å; F245-I249 WeakPolarHBondContact O-CB 3.4Å; F245-I249 WeakPolarHBondContact O-CD1 3.33Å; F245-I249 WeakPolarHBondContact O-CG1 3.47Å; F245-I249 PolarHBondContact O-N 3.2Å; F245-L420 HydrophobicContact CE1-CD1 4.29Å; F245-L420 HydrophobicContact CE1-CD2 4Å; F245-L420 HydrophobicContact CE2-CD1 4.29Å; F245-L420 HydrophobicContact CZ-CD1 3.78Å; F245-L420 HydrophobicContact CZ-CD2 3.97Å
246T98.5Very high97.2Very high72 Ų7230 Ų3044%0.44216%0.155SC..Hα-helixtrans-60.7-43.4179.3-56.40000110.9Q242 F244 A248 I249 L250Q242-T246 VanDerWaalsContact O-CB 3.3Å; Q242-T246 WeakPolarHBondContact O-CB 3.25Å; Q242-T246 PolarHBondContact O-N 3.07Å; Q242-T246 PolarHBondContact O-OG1 3.12Å; F244-T246 VanDerWaalsContact C-N 3.34Å; F244-T246 PolarHBondContact O-N 2.78Å; T246-A248 PolarHBondContact O-N 3.21Å; T246-I249 PolarHBondContact O-N 2.93Å; T246-L250 HydrophobicContact CG2-CD1 4.08Å; T246-L250 HydrophobicContact CG2-CG 4.46Å; T246-L250 WeakPolarHBondContact O-CB 3.35Å; T246-L250 VanDerWaalsContact O-CG 3.3Å; T246-L250 WeakPolarHBondContact O-CG 3.27Å; T246-L250 PolarHBondContact O-N 3.48Å
247S98.6Very high97.5Very high8 Ų826.5 Ų26.56%0.05614%0.14CC..Hα-helixtrans-63.6-40.8177.873.30000113.2V243 F244 F245 L250 A251 L282 G286V243-S247 WeakPolarHBondContact O-CB 3.36Å; V243-S247 PolarHBondContact O-N 2.87Å; V243-S247 PolarHBondContact O-OG 3.16Å; F244-S247 PolarHBondContact O-N 3.47Å; F244-S247 VanDerWaalsContact O-N 3.16Å; F244-S247 PolarHBondContact O-OG 3.07Å; F245-S247 VanDerWaalsContact C-N 3.32Å; F245-S247 PolarHBondContact O-N 2.88Å; S247-L250 PolarHBondContact O-N 3.45Å; S247-A251 VanDerWaalsContact O-CB 3.3Å; S247-A251 WeakPolarHBondContact O-CB 3.23Å; S247-A251 PolarHBondContact O-N 2.83Å; S247-L282 VanDerWaalsContact CB-O 3.27Å; S247-L282 WeakPolarHBondContact CB-O 3.49Å; S247-G286 WeakPolarHBondContact OG-CA 3.38Å
248A98.7Very high97.8Very high1 Ų126.5 Ų26.51%0.00814%0.14CC..Hα-helixtrans-67.1-43.5176.600000111.8F218 F244 F245 T246 L250 A251 L252 L283F218-A248 HydrophobicContact CD1-CB 3.64Å; F218-A248 HydrophobicContact CE1-CB 3.91Å; F218-A248 HydrophobicContact CG-CB 4.01Å; F218-A248 HydrophobicContact CZ-CB 4.49Å; F244-A248 PolarHBondContact O-N 3.46Å; F245-A248 PolarHBondContact O-N 3.43Å; T246-A248 PolarHBondContact O-N 3.21Å; A248-L250 PolarHBondContact O-N 3.37Å; A248-A251 PolarHBondContact O-N 2.7Å; A248-L252 WeakPolarHBondContact O-CB 3.4Å; A248-L252 VanDerWaalsContact O-CG 3.22Å; A248-L252 WeakPolarHBondContact O-CG 3.45Å; A248-L252 PolarHBondContact O-N 3.29Å; A248-L283 HydrophobicContact CB-CD1 3.98Å
249I98.8Very high98.1Very high28 Ų2825.1 Ų25.114%0.14413%0.134CC..Hα-helixtrans-60.5-45175.5-69.1165.7000110.4F215 F218 L219 F245 T246 G253F215-I249 HydrophobicContact CD2-CG2 4Å; F215-I249 VanDerWaalsContact CD2-O 3.27Å; F215-I249 WeakPolarHBondContact CD2-O 3.41Å; F215-I249 HydrophobicContact CE2-CG2 3.45Å; F215-I249 VanDerWaalsContact CE2-CG2 3.45Å; F215-I249 WeakPolarHBondContact CE2-O 3.5Å; F215-I249 HydrophobicContact CZ-CG2 4.15Å; F218-I249 HydrophobicContact CB-CG1 3.99Å; L219-I249 HydrophobicContact CD1-CD1 4.24Å; F245-I249 WeakPolarHBondContact O-CB 3.4Å; F245-I249 WeakPolarHBondContact O-CD1 3.33Å; F245-I249 WeakPolarHBondContact O-CG1 3.47Å; F245-I249 PolarHBondContact O-N 3.2Å; T246-I249 PolarHBondContact O-N 2.93Å; I249-G253 WeakPolarHBondContact O-CA 3.37Å; I249-G253 PolarHBondContact O-N 3.31Å
250L98.7Very high98.3Very high70 Ų7022.3 Ų22.337%0.36612%0.12SC..Hα-helixtrans-65.1-45.6177.4-73.2173.6000112.1T246 S247 A248 G253 F254 L282T246-L250 HydrophobicContact CG2-CD1 4.08Å; T246-L250 HydrophobicContact CG2-CG 4.46Å; T246-L250 WeakPolarHBondContact O-CB 3.35Å; T246-L250 VanDerWaalsContact O-CG 3.3Å; T246-L250 WeakPolarHBondContact O-CG 3.27Å; T246-L250 PolarHBondContact O-N 3.48Å; S247-L250 PolarHBondContact O-N 3.45Å; A248-L250 PolarHBondContact O-N 3.37Å; L250-G253 PolarHBondContact O-N 2.91Å; L250-F254 HydrophobicContact CB-CE2 4.3Å; L250-F254 HydrophobicContact CD2-CZ 4.12Å; L250-F254 WeakPolarHBondContact O-CB 3.46Å; L250-F254 WeakPolarHBondContact O-CD2 3.01Å; L250-F254 VanDerWaalsContact O-CG 3.25Å; L250-F254 WeakPolarHBondContact O-CG 3.27Å; L250-F254 PolarHBondContact O-N 3.24Å; L250-L282 HydrophobicContact CD1-CD1 4.28Å
251A98.7Very high98.4Very high10 Ų1020.7 Ų20.78%0.08311%0.112CC..Hα-helixtrans-62-52.1-179.400000112.2S247 A248 G253 F254 S255 G279 L283S247-A251 VanDerWaalsContact O-CB 3.3Å; S247-A251 WeakPolarHBondContact O-CB 3.23Å; S247-A251 PolarHBondContact O-N 2.83Å; A248-A251 PolarHBondContact O-N 2.7Å; A251-G253 VanDerWaalsContact C-N 3.29Å; A251-G253 PolarHBondContact O-N 3.47Å; A251-F254 PolarHBondContact O-N 2.9Å; A251-S255 WeakPolarHBondContact O-CB 3.32Å; A251-S255 PolarHBondContact O-N 3.44Å; A251-G279 VanDerWaalsContact CB-O 3.22Å; A251-G279 WeakPolarHBondContact CB-O 3.34Å; A251-L283 HydrophobicContact CB-CB 3.81Å; A251-L283 HydrophobicContact CB-CD2 4.38Å
252L98.7Very high98.5Very high5 Ų522 Ų223%0.02612%0.117CC..Hα-helixtrans-64.4-38.8177.9-62.7171.6000110.7H211 F215 F218 A248 S255 W256 V413H211-L252 HydrophobicContact CB-CD2 4.24Å; F215-L252 HydrophobicContact CB-CB 4.03Å; F218-L252 HydrophobicContact CD2-CD1 3.67Å; F218-L252 HydrophobicContact CE2-CD1 4.26Å; F218-L252 HydrophobicContact CG-CD1 4.35Å; A248-L252 WeakPolarHBondContact O-CB 3.4Å; A248-L252 VanDerWaalsContact O-CG 3.22Å; A248-L252 WeakPolarHBondContact O-CG 3.45Å; A248-L252 PolarHBondContact O-N 3.29Å; L252-S255 PolarHBondContact O-N 2.87Å; L252-W256 PolarHBondContact O-N 2.61Å; L252-V413 HydrophobicContact CD2-CG2 3.96Å
253G98.7Very high98.5Very high6 Ų621.2 Ų21.26%0.06211%0.113CC..Hα-helixtrans-58-52.5175.700000113.1I249 L250 A251 S255 L257I249-G253 WeakPolarHBondContact O-CA 3.37Å; I249-G253 PolarHBondContact O-N 3.31Å; L250-G253 PolarHBondContact O-N 2.91Å; A251-G253 VanDerWaalsContact C-N 3.29Å; A251-G253 PolarHBondContact O-N 3.47Å; G253-S255 VanDerWaalsContact C-N 3.29Å; G253-S255 PolarHBondContact O-N 3.46Å; G253-L257 VanDerWaalsContact O-CB 3.3Å; G253-L257 WeakPolarHBondContact O-CB 3.44Å; G253-L257 WeakPolarHBondContact O-CD1 3.44Å; G253-L257 WeakPolarHBondContact O-CG 3.48Å; G253-L257 PolarHBondContact O-N 2.89Å
254F98.7Very high98.5Very high48 Ų4819.3 Ų19.321%0.21110%0.1CC..Hα-helixtrans-62.6-38.3176.7-65.6-28.8000112.1L250 A251 F258 L275 L282L250-F254 HydrophobicContact CB-CE2 4.3Å; L250-F254 HydrophobicContact CD2-CZ 4.12Å; L250-F254 WeakPolarHBondContact O-CB 3.46Å; L250-F254 WeakPolarHBondContact O-CD2 3.01Å; L250-F254 VanDerWaalsContact O-CG 3.25Å; L250-F254 WeakPolarHBondContact O-CG 3.27Å; L250-F254 PolarHBondContact O-N 3.24Å; A251-F254 PolarHBondContact O-N 2.9Å; F254-F258 VanDerWaalsContact O-CB 3.3Å; F254-F258 WeakPolarHBondContact O-CB 3.48Å; F254-F258 PolarHBondContact O-N 2.95Å; F254-L275 HydrophobicContact CB-CB 4.26Å; F254-L275 HydrophobicContact CD1-CB 4.35Å; F254-L275 HydrophobicContact CD2-CB 4.46Å; F254-L275 VanDerWaalsContact CD2-O 3.28Å; F254-L275 WeakPolarHBondContact CD2-O 3.42Å; F254-L275 HydrophobicContact CG-CB 4.13Å; F254-L282 HydrophobicContact CE2-CD1 4.15Å
255S98.7Very high98.5Very high1 Ų120.7 Ų20.71%0.00711%0.11CC..Hα-helixtrans-67.6-54.1-178.5-167.70000113.2H211 A251 L252 G253 L257 F258 H259 D276H211-S255 PolarHBondContact CE1-OG 3.05Å; H211-S255 WeakPolarHBondContact ND1-CB 3.29Å; H211-S255 PolarHBondContact ND1-OG 2.94Å; A251-S255 WeakPolarHBondContact O-CB 3.32Å; A251-S255 PolarHBondContact O-N 3.44Å; L252-S255 PolarHBondContact O-N 2.87Å; G253-S255 VanDerWaalsContact C-N 3.29Å; G253-S255 PolarHBondContact O-N 3.46Å; S255-L257 VanDerWaalsContact C-N 3.25Å; S255-L257 PolarHBondContact O-N 3Å; S255-F258 WeakPolarHBondContact O-CB 3.45Å; S255-F258 PolarHBondContact O-N 3.29Å; S255-F258 VanDerWaalsContact O-N 3.13Å; S255-H259 PolarHBondContact O-CD2 2.92Å; S255-H259 VanDerWaalsContact O-CD2 3.22Å; S255-H259 PolarHBondContact O-N 2.77Å; S255-D276 WeakPolarHBondContact CA-OD1 3.08Å; S255-D276 WeakPolarHBondContact CB-OD1 3.45Å; S255-D276 PolarHBondContact OG-OD1 3.36Å
256W98.8Very high98.4Very high37 Ų3724.7 Ų24.714%0.1413%0.129CC..Hα-helixtrans-65.1-33.3-179.281-103.8000111.5F195 I198 H211 L212 F215 L252 T260F195-W256 HydrophobicContact CD1-CZ3 4.49Å; F195-W256 AromaticContact CE1-CH2 3.93Å; F195-W256 HydrophobicContact CE1-CH2 3.93Å; F195-W256 AromaticContact CE1-CZ3 3.85Å; F195-W256 HydrophobicContact CE1-CZ3 3.85Å; I198-W256 HydrophobicContact CD1-CZ3 4.18Å; H211-W256 HydrophobicContact CB-CB 4.06Å; L212-W256 HydrophobicContact CB-CB 4.27Å; L212-W256 HydrophobicContact CB-CG 4.27Å; L212-W256 HydrophobicContact CD1-CD2 4.05Å; L212-W256 HydrophobicContact CD1-CE3 4.41Å; L212-W256 HydrophobicContact CD1-CG 4.36Å; L212-W256 HydrophobicContact CD1-CZ2 4.38Å; F215-W256 AromaticContact CG-NE1 4Å; L252-W256 PolarHBondContact O-N 2.61Å; W256-T260 WeakPolarHBondContact O-CB 3.42Å; W256-T260 PolarHBondContact O-N 3.28Å; W256-T260 PolarHBondContact O-OG1 3.46Å
257L98.7Very high98.4Very high46 Ų4631.6 Ų31.624%0.24115%0.147CC..Hα-helixtrans-63.6-46.9172.8-76.6171.4000111.2F195 G253 S255 T260 V261 F272F195-L257 HydrophobicContact CE1-CD2 4.16Å; F195-L257 HydrophobicContact CZ-CD2 3.9Å; G253-L257 VanDerWaalsContact O-CB 3.3Å; G253-L257 WeakPolarHBondContact O-CB 3.44Å; G253-L257 WeakPolarHBondContact O-CD1 3.44Å; G253-L257 WeakPolarHBondContact O-CG 3.48Å; G253-L257 PolarHBondContact O-N 2.89Å; S255-L257 VanDerWaalsContact C-N 3.25Å; S255-L257 PolarHBondContact O-N 3Å; L257-T260 WeakPolarHBondContact O-CB 3.36Å; L257-T260 PolarHBondContact O-N 3.45Å; L257-T260 VanDerWaalsContact O-N 3.14Å; L257-V261 WeakPolarHBondContact O-CG2 3.27Å; L257-V261 PolarHBondContact O-N 2.91Å; L257-F272 HydrophobicContact CB-CD1 4.03Å; L257-F272 HydrophobicContact CB-CE1 3.91Å
258F98.5Very high98.3Very high12 Ų1232.3 Ų32.35%0.05315%0.15CC..Hα-helixtrans-55-55.3174.9164.5-116.1000111.4F254 S255 T260 V261 Y262 F272 N273 D276F254-F258 VanDerWaalsContact O-CB 3.3Å; F254-F258 WeakPolarHBondContact O-CB 3.48Å; F254-F258 PolarHBondContact O-N 2.95Å; S255-F258 WeakPolarHBondContact O-CB 3.45Å; S255-F258 PolarHBondContact O-N 3.29Å; S255-F258 VanDerWaalsContact O-N 3.13Å; F258-T260 PolarHBondContact O-N 2.97Å; F258-V261 CarbonylContact O-C 3.51Å; F258-V261 PolarHBondContact O-N 3.19Å; F258-V261 VanDerWaalsContact O-N 3.16Å; F258-Y262 AromaticContact CE2-CD2 3.55Å; F258-Y262 HydrophobicContact CE2-CD2 3.55Å; F258-Y262 HydrophobicContact CE2-CE2 4.27Å; F258-Y262 HydrophobicContact CE2-CG 4.2Å; F258-Y262 AromaticContact CZ-CD2 3.66Å; F258-Y262 HydrophobicContact CZ-CD2 3.66Å; F258-Y262 HydrophobicContact CZ-CE2 4.09Å; F258-Y262 HydrophobicContact CZ-CG 4.19Å; F258-Y262 WeakPolarHBondContact O-CA 3.27Å; F258-Y262 VanDerWaalsContact O-CB 3.29Å; F258-Y262 WeakPolarHBondContact O-CB 3.18Å; F258-Y262 PolarHBondContact O-N 2.84Å; F258-F272 HydrophobicContact CB-CB 3.93Å; F258-F272 VanDerWaalsContact CD2-C 3.49Å; F258-F272 HydrophobicContact CD2-CB 3.81Å; F258-F272 HydrophobicContact CG-CB 4.36Å; F258-N273 HydrophobicContact CD2-CB 4.02Å; F258-N273 VanDerWaalsContact CD2-N 3.26Å; F258-N273 HydrophobicContact CE2-CB 3.52Å; F258-N273 HydrophobicContact CZ-CB 3.97Å; F258-D276 HydrophobicContact CB-CB 4.08Å; F258-D276 HydrophobicContact CD1-CB 4.11Å; F258-D276 HydrophobicContact CG-CB 4.18Å
259H98.6Very high98.2Very high2 Ų232.4 Ų32.41%0.00915%0.151CC..Hα-helixtrans-62.1-27.9179.3-74-79.5000112.4R185 E204 N207 I208 S255 H405 H409R185-H259 PolarHBondContact NH2-O 2.9Å; E204-H259 IonicContact OE2-CE1 4Å; E204-H259 IonicContact OE2-CG 3.69Å; E204-H259 IonicContact OE2-ND1 3.06Å; E204-H259 PolarHBondContact OE2-ND1 2.96Å; N207-H259 HydrophobicContact CB-CB 4.26Å; I208-H259 HydrophobicContact CG1-CB 3.68Å; S255-H259 PolarHBondContact O-CD2 2.92Å; S255-H259 VanDerWaalsContact O-CD2 3.22Å; S255-H259 PolarHBondContact O-N 2.77Å; H259-H405 AromaticContact CE1-CD2 3.97Å; H259-H405 AromaticContact CE1-CE1 3.91Å; H259-H405 AromaticContact CE1-NE2 3.49Å; H259-H405 PolarHBondContact CE1-NE2 3.46Å; H259-H405 AromaticContact NE2-NE2 3.52Å; H259-H409 AromaticContact CD2-CE1 3.48Å; H259-H409 PolarHBondContact CD2-CE1 3.19Å; H259-H409 VanDerWaalsContact CD2-CE1 3.48Å; H259-H409 AromaticContact NE2-CE1 3.26Å; H259-H409 PolarHBondContact NE2-CE1 3.44Å; H259-H409 VanDerWaalsContact NE2-CE1 3.26Å; H259-H409 AromaticContact NE2-NE2 3.43Å; H259-H409 PolarHBondContact NE2-NE2 3.08Å
260T98.6Very high98.1Very high0 Ų034.7 Ų34.70%016%0.161CC..Hα-helixtrans-68.5-51.4173.6-61.20000111.5R185 F195 I198 W256 L257 F258R185-T260 PolarHBondContact NH1-O 2.98Å; F195-T260 HydrophobicContact CD1-CG2 3.88Å; F195-T260 HydrophobicContact CD2-CG2 4.41Å; F195-T260 HydrophobicContact CE1-CG2 4.1Å; F195-T260 HydrophobicContact CG-CG2 4.04Å; F195-T260 HydrophobicContact CZ-CG2 4.44Å; I198-T260 HydrophobicContact CD1-CG2 3.9Å; I198-T260 HydrophobicContact CG1-CG2 3.93Å; W256-T260 WeakPolarHBondContact O-CB 3.42Å; W256-T260 PolarHBondContact O-N 3.28Å; W256-T260 PolarHBondContact O-OG1 3.46Å; L257-T260 WeakPolarHBondContact O-CB 3.36Å; L257-T260 PolarHBondContact O-N 3.45Å; L257-T260 VanDerWaalsContact O-N 3.14Å; F258-T260 PolarHBondContact O-N 2.97Å
261V98.5Very high98.1Very high1 Ų136 Ų361%0.00617%0.167CC..Hα-helixtrans-92.72.7-173.8-51.70000114F191 F195 L257 F258 C263 H264 V268 F272F191-V261 HydrophobicContact CD1-CB 4.39Å; F191-V261 HydrophobicContact CD1-CG1 3.77Å; F191-V261 HydrophobicContact CE1-CB 4.17Å; F191-V261 HydrophobicContact CE1-CG1 3.88Å; F195-V261 HydrophobicContact CE2-CG1 4.08Å; F195-V261 HydrophobicContact CZ-CG1 4.49Å; L257-V261 WeakPolarHBondContact O-CG2 3.27Å; L257-V261 PolarHBondContact O-N 2.91Å; F258-V261 CarbonylContact O-C 3.51Å; F258-V261 PolarHBondContact O-N 3.19Å; F258-V261 VanDerWaalsContact O-N 3.16Å; V261-C263 PolarHBondContact O-N 3.08Å; V261-C263 VanDerWaalsContact O-N 3.13Å; V261-H264 WeakPolarHBondContact O-CB 3.5Å; V261-H264 PolarHBondContact O-N 3.43Å; V261-V268 HydrophobicContact CB-CG1 4.1Å; V261-V268 HydrophobicContact CG2-CG1 3.82Å; V261-F272 HydrophobicContact CG2-CB 3.94Å; V261-F272 HydrophobicContact CG2-CD1 3.85Å; V261-F272 HydrophobicContact CG2-CD2 3.56Å; V261-F272 HydrophobicContact CG2-CE1 4.22Å; V261-F272 HydrophobicContact CG2-CE2 3.95Å; V261-F272 HydrophobicContact CG2-CG 3.49Å; V261-F272 VanDerWaalsContact CG2-CG 3.49Å; V261-F272 HydrophobicContact CG2-CZ 4.26Å
262Y98Very high98.1Very high29 Ų2937.4 Ų37.411%0.11417%0.171CC..THydrogen-bonded Turntrans-51.7-39.6-177.9176.7-133.8000112.2W173 L174 E204 F258 H264W173-Y262 VanDerWaalsContact CH2-O 3.27Å; W173-Y262 WeakPolarHBondContact CH2-O 3.34Å; W173-Y262 WeakPolarHBondContact CZ3-O 3.45Å; L174-Y262 WeakPolarHBondContact CA-OH 3.22Å; L174-Y262 HydrophobicContact CD2-CD1 4.02Å; L174-Y262 HydrophobicContact CD2-CD2 4.11Å; L174-Y262 HydrophobicContact CD2-CE1 3.74Å; L174-Y262 HydrophobicContact CD2-CE2 3.85Å; L174-Y262 HydrophobicContact CD2-CG 4.19Å; L174-Y262 WeakPolarHBondContact CD2-O 3.31Å; L174-Y262 PolarHBondContact O-OH 3.45Å; E204-Y262 HydrophobicContact CG-CD1 4.37Å; F258-Y262 AromaticContact CE2-CD2 3.55Å; F258-Y262 HydrophobicContact CE2-CD2 3.55Å; F258-Y262 HydrophobicContact CE2-CE2 4.27Å; F258-Y262 HydrophobicContact CE2-CG 4.2Å; F258-Y262 AromaticContact CZ-CD2 3.66Å; F258-Y262 HydrophobicContact CZ-CD2 3.66Å; F258-Y262 HydrophobicContact CZ-CE2 4.09Å; F258-Y262 HydrophobicContact CZ-CG 4.19Å; F258-Y262 WeakPolarHBondContact O-CA 3.27Å; F258-Y262 VanDerWaalsContact O-CB 3.29Å; F258-Y262 WeakPolarHBondContact O-CB 3.18Å; F258-Y262 PolarHBondContact O-N 2.84Å; Y262-H264 VanDerWaalsContact C-N 3.31Å; Y262-H264 PolarHBondContact O-N 3.44Å
263C97.6Very high98Very high2 Ų238.1 Ų38.11%0.01418%0.175CC..THydrogen-bonded Turntrans-80.23.2-179.9630000115.6R185 Q187 L188 V261R185-C263 HydrophobicContact CB-CB 3.93Å; Q187-C263 CarbonylContact C-O 3.25Å; Q187-C263 VanDerWaalsContact CA-O 3.31Å; Q187-C263 WeakPolarHBondContact CA-O 3.42Å; L188-C263 PolarHBondContact N-O 3.06Å; V261-C263 PolarHBondContact O-N 3.08Å; V261-C263 VanDerWaalsContact O-N 3.13Å
264H98.3Very high97.9Very high24 Ų2440.4 Ų40.411%0.11118%0.184CC..SBendtrans-67.8-63.2-170.3-175.1-75.3000113.9Q187 L188 P189 F191 V261 Y262 V268Q187-H264 WeakPolarHBondContact CG-O 3.3Å; L188-H264 CarbonylContact C-O 3.59Å; L188-H264 VanDerWaalsContact O-CA 3.26Å; L188-H264 WeakPolarHBondContact O-CA 3.13Å; P189-H264 WeakPolarHBondContact CA-O 3.29Å; F191-H264 AromaticContact CD1-CD2 3.99Å; F191-H264 AromaticContact CD2-CD2 3.93Å; F191-H264 AromaticContact CD2-NE2 3.54Å; F191-H264 AromaticContact CE2-NE2 3.61Å; F191-H264 AromaticContact CG-CD2 3.9Å; F191-H264 AromaticContact CG-NE2 3.99Å; F191-H264 PolarHBondContact N-CD2 2.79Å; V261-H264 WeakPolarHBondContact O-CB 3.5Å; V261-H264 PolarHBondContact O-N 3.43Å; Y262-H264 VanDerWaalsContact C-N 3.31Å; Y262-H264 PolarHBondContact O-N 3.44Å; H264-V268 HydrophobicContact CB-CB 4.05Å; H264-V268 HydrophobicContact CB-CG1 3.88Å
265S97.8Very high97.9Very high28 Ų2840.7 Ų40.720%0.19619%0.187CC..  trans-167.4155.5-178.259.90000107.5W173 R267 V268 G269W173-S265 VanDerWaalsContact CH2-C 3.4Å; S265-R267 VanDerWaalsContact C-N 3.25Å; S265-R267 PolarHBondContact O-N 3.33Å; S265-R267 VanDerWaalsContact O-N 3.15Å; S265-V268 PolarHBondContact O-N 3.22Å; S265-V268 VanDerWaalsContact O-N 3.12Å; S265-V268 WeakPolarHBondContact OG-CB 3.3Å; S265-V268 WeakPolarHBondContact OG-CG2 3.3Å; S265-V268 PolarHBondContact OG-N 2.76Å; S265-G269 PolarHBondContact O-N 3.42Å
266E96.9Very high97.9Very high88 Ų8841.2 Ų41.241%0.41119%0.19SC..Hα-helixtrans-53.1-41.6-178.2-174.3177175.600113.1W173 G269 K270W173-E266 HydrophobicContact CB-CB 4.43Å; W173-E266 HydrophobicContact CB-CG 3.91Å; W173-E266 HydrophobicContact CD2-CB 3.88Å; W173-E266 HydrophobicContact CD2-CG 4.26Å; W173-E266 HydrophobicContact CE3-CB 4.35Å; W173-E266 HydrophobicContact CG-CB 3.87Å; W173-E266 HydrophobicContact CG-CG 3.91Å; E266-G269 PolarHBondContact O-N 3.45Å; E266-K270 HydrophobicContact CG-CD 4.22Å; E266-K270 HydrophobicContact CG-CG 4.5Å; E266-K270 WeakPolarHBondContact O-CB 3.43Å; E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.31Å; E266-K270 WeakPolarHBondContact OE1-CE 3.25Å; E266-K270 IonicContact OE1-NZ 2.71Å; E266-K270 PolarHBondContact OE1-NZ 3.17Å
267R97.1Very high97.8Very high218 Ų21840.1 Ų40.182%0.82319%0.186SC*.Hα-helixtrans-62.4-49.1178.7-176.6177.1178.8165.60.1112.5S265 L271S265-R267 VanDerWaalsContact C-N 3.25Å; S265-R267 PolarHBondContact O-N 3.33Å; S265-R267 VanDerWaalsContact O-N 3.15Å; R267-L271 WeakPolarHBondContact O-CB 3.35Å; R267-L271 PolarHBondContact O-N 3.46Å
268V97.9Very high97.8Very high22 Ų2239.9 Ų39.913%0.13319%0.186CC..Hα-helixtrans-66.1-44.2178.9173.40000110.5F191 V261 H264 S265 K270 L271 F272F191-V268 HydrophobicContact CE1-CG1 3.89Å; F191-V268 HydrophobicContact CZ-CG1 3.95Å; F191-V268 HydrophobicContact CZ-CG2 4.02Å; V261-V268 HydrophobicContact CB-CG1 4.1Å; V261-V268 HydrophobicContact CG2-CG1 3.82Å; H264-V268 HydrophobicContact CB-CB 4.05Å; H264-V268 HydrophobicContact CB-CG1 3.88Å; S265-V268 PolarHBondContact O-N 3.22Å; S265-V268 VanDerWaalsContact O-N 3.12Å; S265-V268 WeakPolarHBondContact OG-CB 3.3Å; S265-V268 WeakPolarHBondContact OG-CG2 3.3Å; S265-V268 PolarHBondContact OG-N 2.76Å; V268-K270 PolarHBondContact O-N 3.23Å; V268-L271 PolarHBondContact O-N 3.07Å; V268-F272 HydrophobicContact CG1-CD2 3.93Å; V268-F272 HydrophobicContact CG1-CE2 4.16Å; V268-F272 WeakPolarHBondContact O-CD2 3.36Å; V268-F272 PolarHBondContact O-N 3.5Å
269G96.7Very high97.8Very high3 Ų339.3 Ų39.33%0.03118%0.183CC..Hα-helixtrans-58.2-47.8176.900000112.1S265 E266 N273S265-G269 PolarHBondContact O-N 3.42Å; E266-G269 PolarHBondContact O-N 3.45Å; G269-N273 WeakPolarHBondContact O-CB 3.17Å; G269-N273 PolarHBondContact O-N 2.91Å
270K96.6Very high97.8Very high77 Ų7741.1 Ų41.134%0.33519%0.193SC..Hα-helixtrans-62.3-43.7176-75-178.6-176.61720112.7E266 V268 N273 K274 L327E266-K270 HydrophobicContact CG-CD 4.22Å; E266-K270 HydrophobicContact CG-CG 4.5Å; E266-K270 WeakPolarHBondContact O-CB 3.43Å; E266-K270 WeakPolarHBondContact O-CG 3.23Å; E266-K270 PolarHBondContact O-N 3.31Å; E266-K270 WeakPolarHBondContact OE1-CE 3.25Å; E266-K270 IonicContact OE1-NZ 2.71Å; E266-K270 PolarHBondContact OE1-NZ 3.17Å; V268-K270 PolarHBondContact O-N 3.23Å; K270-N273 PolarHBondContact O-N 3.45Å; K270-K274 VanDerWaalsContact O-CG 3.31Å; K270-K274 WeakPolarHBondContact O-CG 3.29Å; K270-K274 PolarHBondContact O-N 2.69Å; K270-L327 HydrophobicContact CB-CD1 4.16Å; K270-L327 HydrophobicContact CG-CD1 3.99Å
271L97.7Very high97.7Very high97 Ų9741.3 Ų41.351%0.50819%0.194SC..Hα-helixtrans-60.4-50.6179.4175.362.6000111.5R267 V268 K274 L275R267-L271 WeakPolarHBondContact O-CB 3.35Å; R267-L271 PolarHBondContact O-N 3.46Å; V268-L271 PolarHBondContact O-N 3.07Å; L271-K274 WeakPolarHBondContact O-CB 3.25Å; L271-K274 PolarHBondContact O-N 3.34Å; L271-L275 PolarHBondContact O-N 3.45Å; L271-L275 VanDerWaalsContact O-N 3.1Å
272F98.1Very high97.7Very high39 Ų3944 Ų4417%0.17121%0.208CC..Hα-helixtrans-72.6-29.3-178.5-82.9-97.7000112.7L257 F258 V261 V268 K274 L275 D276L257-F272 HydrophobicContact CB-CD1 4.03Å; L257-F272 HydrophobicContact CB-CE1 3.91Å; F258-F272 HydrophobicContact CB-CB 3.93Å; F258-F272 VanDerWaalsContact CD2-C 3.49Å; F258-F272 HydrophobicContact CD2-CB 3.81Å; F258-F272 HydrophobicContact CG-CB 4.36Å; V261-F272 HydrophobicContact CG2-CB 3.94Å; V261-F272 HydrophobicContact CG2-CD1 3.85Å; V261-F272 HydrophobicContact CG2-CD2 3.56Å; V261-F272 HydrophobicContact CG2-CE1 4.22Å; V261-F272 HydrophobicContact CG2-CE2 3.95Å; V261-F272 HydrophobicContact CG2-CG 3.49Å; V261-F272 VanDerWaalsContact CG2-CG 3.49Å; V261-F272 HydrophobicContact CG2-CZ 4.26Å; V268-F272 HydrophobicContact CG1-CD2 3.93Å; V268-F272 HydrophobicContact CG1-CE2 4.16Å; V268-F272 WeakPolarHBondContact O-CD2 3.36Å; V268-F272 PolarHBondContact O-N 3.5Å; F272-K274 VanDerWaalsContact C-N 3.33Å; F272-L275 HydrophobicContact CD1-CD1 4.37Å; F272-L275 PolarHBondContact O-N 3.16Å; F272-D276 WeakPolarHBondContact O-CB 3.45Å; F272-D276 PolarHBondContact O-N 2.81Å
273N96.8Very high97.8Very high20 Ų2043.1 Ų43.111%0.10721%0.205CC..Hα-helixtrans-61.3-43.4170.8-170.2-15.2000111F258 G269 K270 L275 D276 Y277 L327F258-N273 HydrophobicContact CD2-CB 4.02Å; F258-N273 VanDerWaalsContact CD2-N 3.26Å; F258-N273 HydrophobicContact CE2-CB 3.52Å; F258-N273 HydrophobicContact CZ-CB 3.97Å; G269-N273 WeakPolarHBondContact O-CB 3.17Å; G269-N273 PolarHBondContact O-N 2.91Å; K270-N273 PolarHBondContact O-N 3.45Å; N273-L275 PolarHBondContact O-N 3Å; N273-D276 WeakPolarHBondContact O-CB 3.31Å; N273-D276 PolarHBondContact O-N 3.26Å; N273-Y277 PolarHBondContact O-N 2.93Å; N273-Y277 VanDerWaalsContact O-N 3.09Å; N273-Y277 WeakPolarHBondContact OD1-CE2 3.45Å; N273-Y277 PolarHBondContact OD1-OH 3.43Å; N273-L327 HydrophobicContact CB-CD2 4.44Å
274K98.1Very high97.8Very high54 Ų5443.9 Ų43.924%0.23521%0.21CC..Hα-helixtrans-60.6-43.1173.6-71.1-178.7-170.3-157.40112.1K270 L271 F272 Y277 V278 T322 D324 L327K270-K274 VanDerWaalsContact O-CG 3.31Å; K270-K274 WeakPolarHBondContact O-CG 3.29Å; K270-K274 PolarHBondContact O-N 2.69Å; L271-K274 WeakPolarHBondContact O-CB 3.25Å; L271-K274 PolarHBondContact O-N 3.34Å; F272-K274 VanDerWaalsContact C-N 3.33Å; K274-Y277 PolarHBondContact O-N 2.92Å; K274-V278 WeakPolarHBondContact O-CG2 3.37Å; K274-V278 PolarHBondContact O-N 3.29Å; K274-T322 HydrophobicContact CB-CG2 4.04Å; K274-T322 WeakPolarHBondContact CD-O 3.14Å; K274-T322 WeakPolarHBondContact CE-O 3.22Å; K274-T322 HydrophobicContact CG-CG2 4.3Å; K274-T322 PolarHBondContact NZ-O 2.9Å; K274-D324 WeakPolarHBondContact CE-OD1 3.16Å; K274-D324 IonicContact NZ-OD1 2.65Å; K274-D324 PolarHBondContact NZ-OD1 3.46Å; K274-L327 HydrophobicContact CG-CD1 4.28Å; K274-L327 HydrophobicContact CG-CD2 4.13Å
275L98.3Very high97.8Very high54 Ų5444 Ų4428%0.28321%0.211SC..Hα-helixtrans-64.2-39.3176.8-69.2174.4000112.2F254 L271 F272 N273 V278 G279F254-L275 HydrophobicContact CB-CB 4.26Å; F254-L275 HydrophobicContact CD1-CB 4.35Å; F254-L275 HydrophobicContact CD2-CB 4.46Å; F254-L275 VanDerWaalsContact CD2-O 3.28Å; F254-L275 WeakPolarHBondContact CD2-O 3.42Å; F254-L275 HydrophobicContact CG-CB 4.13Å; L271-L275 PolarHBondContact O-N 3.45Å; L271-L275 VanDerWaalsContact O-N 3.1Å; F272-L275 HydrophobicContact CD1-CD1 4.37Å; F272-L275 PolarHBondContact O-N 3.16Å; N273-L275 PolarHBondContact O-N 3Å; L275-V278 PolarHBondContact O-N 2.78Å; L275-G279 PolarHBondContact O-N 3.41Å
276D98.1Very high97.8Very high13 Ų1342.8 Ų42.87%0.0720%0.203CC..Hα-helixtrans-58.9-47.4175-176.240.2000111.1S255 F258 F272 N273 V278 G279 I280S255-D276 WeakPolarHBondContact CA-OD1 3.08Å; S255-D276 WeakPolarHBondContact CB-OD1 3.45Å; S255-D276 PolarHBondContact OG-OD1 3.36Å; F258-D276 HydrophobicContact CB-CB 4.08Å; F258-D276 HydrophobicContact CD1-CB 4.11Å; F258-D276 HydrophobicContact CG-CB 4.18Å; F272-D276 WeakPolarHBondContact O-CB 3.45Å; F272-D276 PolarHBondContact O-N 2.81Å; N273-D276 WeakPolarHBondContact O-CB 3.31Å; N273-D276 PolarHBondContact O-N 3.26Å; D276-V278 PolarHBondContact O-N 3.35Å; D276-G279 WeakPolarHBondContact O-CA 3.38Å; D276-G279 PolarHBondContact O-N 3.36Å; D276-I280 PolarHBondContact O-N 3.2Å; D276-I280 VanDerWaalsContact O-N 3.17Å
277Y97.4Very high97.8Very high14 Ų1439.1 Ų39.16%0.05519%0.187CC..Hα-helixtrans-65.3-37.3175-64.8-20.4000114N273 K274 G279 I280 S281 C321 L327 R335 F339N273-Y277 PolarHBondContact O-N 2.93Å; N273-Y277 VanDerWaalsContact O-N 3.09Å; N273-Y277 WeakPolarHBondContact OD1-CE2 3.45Å; N273-Y277 PolarHBondContact OD1-OH 3.43Å; K274-Y277 PolarHBondContact O-N 2.92Å; Y277-G279 VanDerWaalsContact C-N 3.25Å; Y277-G279 PolarHBondContact O-N 2.85Å; Y277-I280 HydrophobicContact CD1-CD1 4.33Å; Y277-I280 PolarHBondContact O-N 3.37Å; Y277-S281 PolarHBondContact O-N 3.26Å; Y277-C321 HydrophobicContact CD2-CB 3.94Å; Y277-C321 WeakPolarHBondContact CD2-O 3.5Å; Y277-C321 HydrophobicContact CG-CB 4.12Å; Y277-L327 HydrophobicContact CD2-CD2 3.89Å; Y277-L327 HydrophobicContact CE2-CD2 3.56Å; Y277-R335 VanDerWaalsContact CE2-CD 3.5Å; Y277-R335 WeakPolarHBondContact OH-CD 3.48Å; Y277-R335 PolarHBondContact OH-NE 3.07Å; Y277-F339 HydrophobicContact CD1-CE2 4.42Å
278V98.3Very high97.8Very high40 Ų4029.5 Ų29.524%0.24215%0.153CC..Hα-helixtrans-61.9-38.1171.1169.60000110.5K274 L275 D276 I280 S281 L282 A318 T322K274-V278 WeakPolarHBondContact O-CG2 3.37Å; K274-V278 PolarHBondContact O-N 3.29Å; L275-V278 PolarHBondContact O-N 2.78Å; D276-V278 PolarHBondContact O-N 3.35Å; V278-I280 VanDerWaalsContact C-N 3.34Å; V278-I280 PolarHBondContact O-N 3.16Å; V278-S281 WeakPolarHBondContact O-CB 3.14Å; V278-S281 PolarHBondContact O-N 2.93Å; V278-L282 HydrophobicContact CG1-CD1 3.98Å; V278-L282 HydrophobicContact CG1-CG 4.17Å; V278-L282 WeakPolarHBondContact O-CG 3.23Å; V278-L282 PolarHBondContact O-N 3.46Å; V278-A318 HydrophobicContact CG2-CB 4.37Å; V278-T322 HydrophobicContact CG2-CG2 3.79Å
279G98.4Very high97.8Very high0 Ų029.7 Ų29.70%015%0.154CC..Hα-helixtrans-54.4-47.2174.300000112.6A251 L275 D276 Y277 S281 L282 L283A251-G279 VanDerWaalsContact CB-O 3.22Å; A251-G279 WeakPolarHBondContact CB-O 3.34Å; L275-G279 PolarHBondContact O-N 3.41Å; D276-G279 WeakPolarHBondContact O-CA 3.38Å; D276-G279 PolarHBondContact O-N 3.36Å; Y277-G279 VanDerWaalsContact C-N 3.25Å; Y277-G279 PolarHBondContact O-N 2.85Å; G279-S281 PolarHBondContact O-N 3.27Å; G279-L282 PolarHBondContact O-N 3.4Å; G279-L283 PolarHBondContact O-N 3.1Å
280I97.8Very high97.8Very high41 Ų4129.5 Ų29.521%0.2115%0.153CC..Hα-helixtrans-59.5-46.6176.8-58.1172.8000110.9D276 Y277 V278 L282 L283 V284 F339D276-I280 PolarHBondContact O-N 3.2Å; D276-I280 VanDerWaalsContact O-N 3.17Å; Y277-I280 HydrophobicContact CD1-CD1 4.33Å; Y277-I280 PolarHBondContact O-N 3.37Å; V278-I280 VanDerWaalsContact C-N 3.34Å; V278-I280 PolarHBondContact O-N 3.16Å; I280-L282 VanDerWaalsContact C-N 3.35Å; I280-L282 PolarHBondContact O-N 3.38Å; I280-L283 PolarHBondContact O-N 3.4Å; I280-V284 WeakPolarHBondContact O-CG2 3.38Å; I280-V284 PolarHBondContact O-N 2.91Å; I280-V284 VanDerWaalsContact O-N 3.12Å; I280-F339 HydrophobicContact CB-CD1 4.18Å; I280-F339 HydrophobicContact CB-CE1 3.89Å; I280-F339 HydrophobicContact CB-CE2 4.43Å; I280-F339 HydrophobicContact CB-CZ 4.02Å; I280-F339 HydrophobicContact CD1-CD2 4.21Å; I280-F339 HydrophobicContact CD1-CE2 3.97Å; I280-F339 HydrophobicContact CD1-CZ 4.32Å; I280-F339 HydrophobicContact CG2-CB 4.21Å; I280-F339 HydrophobicContact CG2-CD1 3.47Å; I280-F339 VanDerWaalsContact CG2-CD1 3.47Å; I280-F339 HydrophobicContact CG2-CD2 4.18Å; I280-F339 HydrophobicContact CG2-CE1 3.72Å; I280-F339 HydrophobicContact CG2-CE2 4.39Å; I280-F339 HydrophobicContact CG2-CG 3.71Å; I280-F339 HydrophobicContact CG2-CZ 4.17Å
281S98.1Very high97.8Very high3 Ų326.5 Ų26.52%0.02114%0.139CC..Hα-helixtrans-59.4-45176.4-70.70000112.1Y277 V278 G279 L283 V284 I285 G314 A318Y277-S281 PolarHBondContact O-N 3.26Å; V278-S281 WeakPolarHBondContact O-CB 3.14Å; V278-S281 PolarHBondContact O-N 2.93Å; G279-S281 PolarHBondContact O-N 3.27Å; S281-L283 PolarHBondContact O-N 3.42Å; S281-V284 PolarHBondContact O-N 3.33Å; S281-I285 VanDerWaalsContact O-CG1 3.27Å; S281-I285 WeakPolarHBondContact O-CG1 3.23Å; S281-I285 PolarHBondContact O-N 3.34Å; S281-G314 PolarHBondContact OG-O 3.41Å; S281-A318 PolarHBondContact OG-N 3.28Å
282L98.4Very high97.7Very high58 Ų5822 Ų2230%0.30412%0.115SC..Hα-helixtrans-61.9-42.8178.7-70.9175.1000111.6S247 L250 F254 V278 G279 I280 V284 I285 G286S247-L282 VanDerWaalsContact CB-O 3.27Å; S247-L282 WeakPolarHBondContact CB-O 3.49Å; L250-L282 HydrophobicContact CD1-CD1 4.28Å; F254-L282 HydrophobicContact CE2-CD1 4.15Å; V278-L282 HydrophobicContact CG1-CD1 3.98Å; V278-L282 HydrophobicContact CG1-CG 4.17Å; V278-L282 WeakPolarHBondContact O-CG 3.23Å; V278-L282 PolarHBondContact O-N 3.46Å; G279-L282 PolarHBondContact O-N 3.4Å; I280-L282 VanDerWaalsContact C-N 3.35Å; I280-L282 PolarHBondContact O-N 3.38Å; L282-V284 PolarHBondContact O-N 3.46Å; L282-I285 PolarHBondContact O-N 3.36Å; L282-G286 PolarHBondContact O-N 3.42Å
283L98.4Very high97.6Very high10 Ų1021.1 Ų21.15%0.05211%0.112CC..Hα-helixtrans-59.6-46177.2174.258.8000111.8F244 A248 A251 G279 I280 S281 G286 S287 V412F244-L283 HydrophobicContact CE2-CD1 3.99Å; A248-L283 HydrophobicContact CB-CD1 3.98Å; A251-L283 HydrophobicContact CB-CB 3.81Å; A251-L283 HydrophobicContact CB-CD2 4.38Å; G279-L283 PolarHBondContact O-N 3.1Å; I280-L283 PolarHBondContact O-N 3.4Å; S281-L283 PolarHBondContact O-N 3.42Å; L283-G286 PolarHBondContact O-N 3.45Å; L283-S287 WeakPolarHBondContact O-CB 3.1Å; L283-S287 PolarHBondContact O-N 2.89Å; L283-S287 PolarHBondContact O-OG 3.26Å; L283-S287 VanDerWaalsContact O-OG 3.07Å; L283-V412 HydrophobicContact CD2-CG1 4.11Å
284V97.9Very high97.5Very high19 Ų1920.3 Ų20.312%0.11511%0.108CC..Hα-helixtrans-66.9-39.5178.9177.90000111.5I280 S281 L282 S287 S288 F342I280-V284 WeakPolarHBondContact O-CG2 3.38Å; I280-V284 PolarHBondContact O-N 2.91Å; I280-V284 VanDerWaalsContact O-N 3.12Å; S281-V284 PolarHBondContact O-N 3.33Å; L282-V284 PolarHBondContact O-N 3.46Å; V284-S287 PolarHBondContact O-OG 3.04Å; V284-S288 WeakPolarHBondContact O-CB 3.22Å; V284-S288 PolarHBondContact O-N 3.21Å; V284-S288 PolarHBondContact O-OG 3.47Å; V284-F342 HydrophobicContact CB-CD1 3.86Å; V284-F342 HydrophobicContact CB-CE1 3.51Å; V284-F342 HydrophobicContact CB-CZ 4.08Å; V284-F342 HydrophobicContact CG1-CD1 3.66Å; V284-F342 HydrophobicContact CG1-CD2 4.23Å; V284-F342 HydrophobicContact CG1-CE1 3.46Å; V284-F342 VanDerWaalsContact CG1-CE1 3.46Å; V284-F342 HydrophobicContact CG1-CE2 4.04Å; V284-F342 HydrophobicContact CG1-CG 4.04Å; V284-F342 HydrophobicContact CG1-CZ 3.65Å; V284-F342 HydrophobicContact CG2-CD1 4.23Å; V284-F342 HydrophobicContact CG2-CE1 4.33Å
285I98.4Very high97.2Very high26 Ų2617.9 Ų17.913%0.13310%0.097CC..Hα-helixtrans-60.7-54.8173.4-67.9165.5000109.8S281 L282 S287 S288 V289 V310 L311 F342S281-I285 VanDerWaalsContact O-CG1 3.27Å; S281-I285 WeakPolarHBondContact O-CG1 3.23Å; S281-I285 PolarHBondContact O-N 3.34Å; L282-I285 PolarHBondContact O-N 3.36Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 3.49Å; I285-S288 PolarHBondContact O-N 2.96Å; I285-S288 VanDerWaalsContact O-N 3.15Å; I285-V289 WeakPolarHBondContact O-CG2 3.3Å; I285-V289 PolarHBondContact O-N 2.94Å; I285-V289 VanDerWaalsContact O-N 3.13Å; I285-V310 HydrophobicContact CB-CG1 4.32Å; I285-V310 HydrophobicContact CG1-CG1 4.08Å; I285-L311 HydrophobicContact CD1-CD2 4.47Å; I285-L311 HydrophobicContact CG2-CD2 3.6Å; I285-F342 HydrophobicContact CG1-CE1 4.45Å; I285-F342 HydrophobicContact CG1-CZ 3.97Å
286G98.2Very high97Very high2 Ų215.4 Ų15.42%0.0218%0.084CC..Hα-helixtrans-70-26.4-172.900000113.7F244 S247 L282 L283 P290F244-G286 VanDerWaalsContact CA-O 3.29Å; F244-G286 WeakPolarHBondContact CA-O 3.25Å; F244-G286 WeakPolarHBondContact CB-O 3.35Å; F244-G286 PolarHBondContact N-O 3.47Å; S247-G286 WeakPolarHBondContact OG-CA 3.38Å; L282-G286 PolarHBondContact O-N 3.42Å; L283-G286 PolarHBondContact O-N 3.45Å; G286-P290 WeakPolarHBondContact O-CD 3.36Å
287S97.6Very high96.7Very high12 Ų1217.9 Ų17.98%0.0849%0.093CC..Hα-helixtrans-73.3-33.8171.671.60000112.6L283 V284 I285 H419L283-S287 WeakPolarHBondContact O-CB 3.1Å; L283-S287 PolarHBondContact O-N 2.89Å; L283-S287 PolarHBondContact O-OG 3.26Å; L283-S287 VanDerWaalsContact O-OG 3.07Å; V284-S287 PolarHBondContact O-OG 3.04Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 3.49Å; S287-H419 PolarHBondContact O-NE2 2.83Å
288S97.4Very high96.4Very high16 Ų1618.2 Ų18.211%0.11210%0.097CC..Hα-helixtrans-74.2-36.8-179.8-59.80000112.6V284 I285 W291 I292V284-S288 WeakPolarHBondContact O-CB 3.22Å; V284-S288 PolarHBondContact O-N 3.21Å; V284-S288 PolarHBondContact O-OG 3.47Å; I285-S288 PolarHBondContact O-N 2.96Å; I285-S288 VanDerWaalsContact O-N 3.15Å; S288-W291 PolarHBondContact O-N 3.32Å; S288-I292 WeakPolarHBondContact O-CB 3.3Å; S288-I292 VanDerWaalsContact O-CG1 3.27Å; S288-I292 WeakPolarHBondContact O-CG1 3.31Å; S288-I292 PolarHBondContact O-N 2.87Å
289V97.6Very high96.1Very high25 Ų2518.1 Ų18.115%0.1529%0.093CC..Hα-helixtrans-54.2-57.6-176.81690000113.7V243 I285 W291 I292 H293V243-V289 HydrophobicContact CB-CG1 4.45Å; V243-V289 HydrophobicContact CG1-CB 4.17Å; V243-V289 HydrophobicContact CG1-CG1 4.25Å; V243-V289 HydrophobicContact CG1-CG2 4.36Å; I285-V289 WeakPolarHBondContact O-CG2 3.3Å; I285-V289 PolarHBondContact O-N 2.94Å; I285-V289 VanDerWaalsContact O-N 3.13Å; V289-W291 VanDerWaalsContact C-N 3.35Å; V289-W291 PolarHBondContact O-N 3.33Å; V289-I292 PolarHBondContact O-N 2.82Å; V289-H293 WeakPolarHBondContact O-CB 3.38Å; V289-H293 PolarHBondContact O-N 2.83Å
290P96.7Very high95.9Very high0 Ų022.8 Ų22.80%012%0.118CC..Hα-helixtrans-65-39.2179.425.2-33.7000112I240 F244 G286 H293 Y294 I423I240-P290 HydrophobicContact CG2-CB 3.83Å; F244-P290 HydrophobicContact CB-CG 3.93Å; G286-P290 WeakPolarHBondContact O-CD 3.36Å; P290-H293 PolarHBondContact O-N 2.69Å; P290-Y294 HydrophobicContact CB-CD2 4.46Å; P290-Y294 HydrophobicContact CB-CE2 4.25Å; P290-Y294 WeakPolarHBondContact O-CD2 3.4Å; P290-Y294 PolarHBondContact O-N 3.3Å; P290-I423 HydrophobicContact CB-CD1 4.26Å; P290-I423 HydrophobicContact CB-CG1 4.37Å; P290-I423 HydrophobicContact CB-CG2 3.9Å; P290-I423 HydrophobicContact CG-CD1 3.51Å; P290-I423 HydrophobicContact CG-CG1 4.06Å; P290-I423 HydrophobicContact CG-CG2 4.33Å
291W96Very high95.8Very high14 Ų1425.1 Ų25.15%0.05314%0.138CC..Hα-helixtrans-62.7-45.3178.7171.873.1000112.3S288 V289 S295 G346 P349 C350 L371S288-W291 PolarHBondContact O-N 3.32Å; V289-W291 VanDerWaalsContact C-N 3.35Å; V289-W291 PolarHBondContact O-N 3.33Å; W291-S295 PolarHBondContact NE1-OG 2.84Å; W291-S295 VanDerWaalsContact O-CB 3.28Å; W291-S295 WeakPolarHBondContact O-CB 3.48Å; W291-S295 PolarHBondContact O-N 3.49Å; W291-S295 PolarHBondContact O-OG 3.45Å; W291-G346 WeakPolarHBondContact CH2-O 3.36Å; W291-P349 HydrophobicContact CH2-CB 3.74Å; W291-P349 HydrophobicContact CH2-CG 3.69Å; W291-P349 HydrophobicContact CZ3-CB 3.9Å; W291-P349 HydrophobicContact CZ3-CG 3.62Å; W291-C350 HydrophobicContact CH2-CB 3.91Å; W291-C350 HydrophobicContact CZ2-CB 3.79Å; W291-L371 HydrophobicContact CZ2-CD1 4.38Å
292I96.3Very high95.7Very high1 Ų128.7 Ų28.71%0.00515%0.153CC..Hα-helixtrans-64.5-42.1174.7-68.7164000110.5S288 V289 Y294 S295 F296 K303 I307 V310S288-I292 WeakPolarHBondContact O-CB 3.3Å; S288-I292 VanDerWaalsContact O-CG1 3.27Å; S288-I292 WeakPolarHBondContact O-CG1 3.31Å; S288-I292 PolarHBondContact O-N 2.87Å; V289-I292 PolarHBondContact O-N 2.82Å; I292-Y294 PolarHBondContact O-N 2.95Å; I292-S295 PolarHBondContact O-N 2.89Å; I292-F296 HydrophobicContact CG2-CD2 4.09Å; I292-F296 PolarHBondContact O-N 2.96Å; I292-K303 HydrophobicContact CG2-CG 4.14Å; I292-I307 HydrophobicContact CB-CG1 4.36Å; I292-I307 HydrophobicContact CD1-CG1 4.42Å; I292-I307 HydrophobicContact CG2-CD1 4.43Å; I292-I307 HydrophobicContact CG2-CG1 3.92Å; I292-V310 HydrophobicContact CD1-CG2 4.03Å
293H95.8Very high95.6Very high22 Ų2227.1 Ų27.110%0.10214%0.144CC..Hα-helixtrans-58.6-47.9178.7171.473.1000112.1E237 I240 V289 P290 Y297 K303E237-H293 IonicContact OE1-CE1 3.9Å; E237-H293 IonicContact OE1-NE2 3.25Å; E237-H293 PolarHBondContact OE1-NE2 3.39Å; E237-H293 IonicContact OE2-CD2 3.6Å; E237-H293 IonicContact OE2-NE2 3.05Å; E237-H293 PolarHBondContact OE2-NE2 3.04Å; I240-H293 VanDerWaalsContact CD1-CD2 3.49Å; I240-H293 WeakPolarHBondContact CD1-CD2 3.38Å; I240-H293 WeakPolarHBondContact CD1-CE1 3.3Å; I240-H293 WeakPolarHBondContact CD1-NE2 3.45Å; I240-H293 HydrophobicContact CG2-CB 3.99Å; V289-H293 WeakPolarHBondContact O-CB 3.38Å; V289-H293 PolarHBondContact O-N 2.83Å; P290-H293 PolarHBondContact O-N 2.69Å; H293-Y297 AromaticContact CE1-CD2 3.73Å; H293-Y297 AromaticContact CE1-CE2 3.65Å; H293-Y297 AromaticContact NE2-CD2 3.53Å; H293-Y297 AromaticContact NE2-CE2 3.35Å; H293-Y297 WeakPolarHBondContact NE2-CE2 3.41Å; H293-Y297 WeakPolarHBondContact O-CA 3.41Å; H293-Y297 WeakPolarHBondContact O-CB 3.25Å; H293-Y297 PolarHBondContact O-N 3.24Å; H293-K303 PolarHBondContact ND1-NZ 3.05Å
294Y93.9Very high95.5Very high3 Ų330.6 Ų30.61%0.01216%0.161CC..Hα-helixtrans-74.4-34-179.6-68.3-59.4000113.2E237 V241 P290 I292 Y297 I423 I426 A427 R430E237-Y294 PolarHBondContact O-OH 3.34Å; E237-Y294 WeakPolarHBondContact OE2-CE1 3.23Å; E237-Y294 PolarHBondContact OE2-OH 3.47Å; V241-Y294 HydrophobicContact CG2-CE2 4.11Å; P290-Y294 HydrophobicContact CB-CD2 4.46Å; P290-Y294 HydrophobicContact CB-CE2 4.25Å; P290-Y294 WeakPolarHBondContact O-CD2 3.4Å; P290-Y294 PolarHBondContact O-N 3.3Å; I292-Y294 PolarHBondContact O-N 2.95Å; Y294-Y297 HydrophobicContact CD1-CD2 4.3Å; Y294-I423 HydrophobicContact CD2-CG2 4.42Å; Y294-I423 HydrophobicContact CE2-CG2 4.25Å; Y294-I426 HydrophobicContact CD2-CG2 4.24Å; Y294-I426 HydrophobicContact CG-CG2 4.31Å; Y294-A427 HydrophobicContact CD1-CB 3.95Å; Y294-A427 HydrophobicContact CD2-CB 3.77Å; Y294-A427 HydrophobicContact CE1-CB 3.72Å; Y294-A427 HydrophobicContact CE2-CB 3.54Å; Y294-A427 HydrophobicContact CG-CB 4Å; Y294-R430 HydrophobicContact CD1-CB 4.33Å; Y294-R430 HydrophobicContact CD1-CG 4.4Å
295S92.5Very high95.6Very high3 Ų334 Ų342%0.02118%0.182CC..Hα-helixtrans-68-47.5176.8-56.20000111.3W291 I292 Y353 I426W291-S295 PolarHBondContact NE1-OG 2.84Å; W291-S295 VanDerWaalsContact O-CB 3.28Å; W291-S295 WeakPolarHBondContact O-CB 3.48Å; W291-S295 PolarHBondContact O-N 3.49Å; W291-S295 PolarHBondContact O-OG 3.45Å; I292-S295 PolarHBondContact O-N 2.89Å; S295-Y353 WeakPolarHBondContact O-CD2 3.32Å; S295-Y353 WeakPolarHBondContact O-CE2 3.5Å; S295-I426 WeakPolarHBondContact OG-CD1 3.41Å
296F93.5Very high95.5Very high1 Ų134.4 Ų34.40%0.00418%0.182CC..THydrogen-bonded Turntrans-102.532.9-178.8-63.1-84000112I292 C298 Y299 F302 K303 Y306 P349 H352 I356I292-F296 HydrophobicContact CG2-CD2 4.09Å; I292-F296 PolarHBondContact O-N 2.96Å; F296-C298 VanDerWaalsContact C-N 3.26Å; F296-C298 PolarHBondContact O-N 3.1Å; F296-Y299 CarbonylContact O-C 3.53Å; F296-Y299 PolarHBondContact O-N 3.18Å; F296-F302 HydrophobicContact CD1-CB 3.55Å; F296-F302 HydrophobicContact CD1-CD2 4.13Å; F296-F302 HydrophobicContact CD1-CG 4.3Å; F296-F302 HydrophobicContact CE1-CB 3.92Å; F296-F302 HydrophobicContact CE1-CD2 4.3Å; F296-F302 HydrophobicContact CE1-CG 4.44Å; F296-F302 HydrophobicContact CG-CB 4.15Å; F296-K303 HydrophobicContact CB-CB 3.89Å; F296-K303 WeakPolarHBondContact O-CE 3.38Å; F296-Y306 HydrophobicContact CD2-CD2 4.23Å; F296-Y306 HydrophobicContact CE1-CD2 4.48Å; F296-Y306 HydrophobicContact CE1-CE2 4.09Å; F296-Y306 AromaticContact CE2-CD2 3.8Å; F296-Y306 HydrophobicContact CE2-CD2 3.8Å; F296-Y306 AromaticContact CE2-CE2 3.95Å; F296-Y306 HydrophobicContact CE2-CE2 3.95Å; F296-Y306 AromaticContact CZ-CD2 3.93Å; F296-Y306 HydrophobicContact CZ-CD2 3.93Å; F296-Y306 AromaticContact CZ-CE2 3.59Å; F296-Y306 HydrophobicContact CZ-CE2 3.59Å; F296-P349 HydrophobicContact CE2-CB 3.93Å; F296-P349 HydrophobicContact CZ-CB 4.34Å; F296-P349 WeakPolarHBondContact CZ-O 3.35Å; F296-H352 HydrophobicContact CZ-CB 4.28Å; F296-I356 HydrophobicContact CE1-CD1 4.16Å
297Y92.2Very high95.5Very high65 Ų6536.4 Ų36.426%0.25519%0.192SC..THydrogen-bonded Turntrans-52.5-45.2-171.3-167.8-92000112.4E237 H293 Y294 K303 R430E237-Y297 WeakPolarHBondContact OE1-CE2 3.4Å; E237-Y297 PolarHBondContact OE1-OH 3.4Å; H293-Y297 AromaticContact CE1-CD2 3.73Å; H293-Y297 AromaticContact CE1-CE2 3.65Å; H293-Y297 AromaticContact NE2-CD2 3.53Å; H293-Y297 AromaticContact NE2-CE2 3.35Å; H293-Y297 WeakPolarHBondContact NE2-CE2 3.41Å; H293-Y297 WeakPolarHBondContact O-CA 3.41Å; H293-Y297 WeakPolarHBondContact O-CB 3.25Å; H293-Y297 PolarHBondContact O-N 3.24Å; Y294-Y297 HydrophobicContact CD1-CD2 4.3Å; Y297-K303 PolarHBondContact O-NZ 3.45Å; Y297-R430 HydrophobicContact CD1-CG 4.28Å; Y297-R430 HydrophobicContact CD2-CG 4.03Å; Y297-R430 HydrophobicContact CG-CG 3.76Å
298C91Very high95.6Very high21 Ų2140.3 Ų40.314%0.14221%0.211CC..THydrogen-bonded Turntrans-90.9-9.5179.2-580000114.5F296 C436F296-C298 VanDerWaalsContact C-N 3.26Å; F296-C298 PolarHBondContact O-N 3.1Å; C298-C436 WeakPolarHBondContact CA-SG 3.24Å; C298-C436 HydrophobicContact CB-CB 3.63Å; C298-C436 WeakPolarHBondContact CB-SG 3.34Å; C298-C436 VanDerWaalsContact SG-CA 3.56Å; C298-C436 WeakPolarHBondContact SG-CB 3.26Å; C298-C436 CovalentContact SG-SG 2.04Å; C298-C436 PolarHBondContact SG-SG 3.42Å
299Y92.3Very high95.6Very high39 Ų3941.3 Ų41.315%0.15322%0.221CC..  trans-108.773.2-177.7-58.8-79.3000110.6F296 S301 F302 K303 I356 L440F296-Y299 CarbonylContact O-C 3.53Å; F296-Y299 PolarHBondContact O-N 3.18Å; Y299-S301 VanDerWaalsContact C-N 3.29Å; Y299-S301 PolarHBondContact O-N 3.04Å; Y299-F302 HydrophobicContact CD1-CD2 4.36Å; Y299-F302 HydrophobicContact CD1-CE2 4.35Å; Y299-F302 HydrophobicContact CG-CD2 4.17Å; Y299-F302 PolarHBondContact O-N 3.09Å; Y299-K303 PolarHBondContact O-N 3.28Å; Y299-I356 HydrophobicContact CD2-CG2 4.47Å; Y299-I356 HydrophobicContact CE1-CG2 4.09Å; Y299-I356 HydrophobicContact CE2-CG2 3.69Å; Y299-I356 VanDerWaalsContact CZ-CG2 3.46Å; Y299-I356 WeakPolarHBondContact OH-CG2 3.05Å; Y299-L440 HydrophobicContact CD1-CD2 4.29Å; Y299-L440 HydrophobicContact CE1-CD2 3.69Å
300N93.3Very high95.6Very high97 Ų9740.7 Ų40.752%0.51922%0.217SC..Hα-helixtrans-57.2-38.4-170.9-168.753000113.7K303 I304N300-K303 WeakPolarHBondContact O-CB 3.34Å; N300-K303 PolarHBondContact O-N 2.89Å; N300-I304 WeakPolarHBondContact ND2-CD1 3.12Å; N300-I304 WeakPolarHBondContact O-CG1 3.33Å; N300-I304 PolarHBondContact O-N 3.44Å
301S95.9Very high95.7Very high91 Ų9144.5 Ų44.564%0.63624%0.237SC*.Hα-helixtrans-60.8-48178.4-54.30000112Y299 I304 V305Y299-S301 VanDerWaalsContact C-N 3.29Å; Y299-S301 PolarHBondContact O-N 3.04Å; S301-I304 PolarHBondContact O-N 3.43Å; S301-V305 VanDerWaalsContact O-CG2 3.31Å; S301-V305 WeakPolarHBondContact O-CG2 3.44Å; S301-V305 PolarHBondContact O-N 3.36Å; S301-V305 VanDerWaalsContact O-N 3.09Å
302F95.7Very high95.8Very high78 Ų7849.6 Ų49.634%0.34226%0.264SS..Hα-helixtrans-66.9-41.1178.4-59.4-37.9000111.7F296 Y299 I304 V305 Y306 H352 I356F296-F302 HydrophobicContact CD1-CB 3.55Å; F296-F302 HydrophobicContact CD1-CD2 4.13Å; F296-F302 HydrophobicContact CD1-CG 4.3Å; F296-F302 HydrophobicContact CE1-CB 3.92Å; F296-F302 HydrophobicContact CE1-CD2 4.3Å; F296-F302 HydrophobicContact CE1-CG 4.44Å; F296-F302 HydrophobicContact CG-CB 4.15Å; Y299-F302 HydrophobicContact CD1-CD2 4.36Å; Y299-F302 HydrophobicContact CD1-CE2 4.35Å; Y299-F302 HydrophobicContact CG-CD2 4.17Å; Y299-F302 PolarHBondContact O-N 3.09Å; F302-I304 PolarHBondContact O-N 2.84Å; F302-V305 PolarHBondContact O-N 3.37Å; F302-Y306 HydrophobicContact CB-CD2 4.36Å; F302-Y306 HydrophobicContact CB-CE2 4.28Å; F302-Y306 WeakPolarHBondContact O-CD2 3.14Å; F302-Y306 PolarHBondContact O-N 2.91Å; F302-H352 AromaticContact CD1-CE1 3.62Å; F302-H352 AromaticContact CD2-CE1 3.87Å; F302-H352 AromaticContact CE1-CE1 3.65Å; F302-H352 AromaticContact CE2-CE1 3.91Å; F302-H352 AromaticContact CE2-NE2 3.96Å; F302-H352 AromaticContact CG-CE1 3.75Å; F302-H352 AromaticContact CZ-CE1 3.8Å; F302-H352 AromaticContact CZ-NE2 3.94Å; F302-I356 HydrophobicContact CD2-CD1 3.79Å; F302-I356 HydrophobicContact CE2-CD1 3.61Å
303K96.6Very high95.9Very high25 Ų2553 Ų5311%0.10928%0.282CS..Hα-helixtrans-53.6-51.4174.7-170.1-169.5-50.7-172.90111.6I292 H293 F296 Y297 Y299 N300 Y306 I307I292-K303 HydrophobicContact CG2-CG 4.14Å; H293-K303 PolarHBondContact ND1-NZ 3.05Å; F296-K303 HydrophobicContact CB-CB 3.89Å; F296-K303 WeakPolarHBondContact O-CE 3.38Å; Y297-K303 PolarHBondContact O-NZ 3.45Å; Y299-K303 PolarHBondContact O-N 3.28Å; N300-K303 WeakPolarHBondContact O-CB 3.34Å; N300-K303 PolarHBondContact O-N 2.89Å; K303-Y306 PolarHBondContact O-N 3.48Å; K303-I307 HydrophobicContact CG-CD1 4Å; K303-I307 WeakPolarHBondContact O-CB 3.28Å; K303-I307 VanDerWaalsContact O-CG1 3.31Å; K303-I307 WeakPolarHBondContact O-CG1 3.32Å; K303-I307 PolarHBondContact O-N 3.42Å
304I97.8Very high96Very high82 Ų8252 Ų5242%0.42128%0.277SS..Hα-helixtrans-63.2-48.1-179.6-69.2168.8000110.8N300 S301 F302 Y306 I307 L308N300-I304 WeakPolarHBondContact ND2-CD1 3.12Å; N300-I304 WeakPolarHBondContact O-CG1 3.33Å; N300-I304 PolarHBondContact O-N 3.44Å; S301-I304 PolarHBondContact O-N 3.43Å; F302-I304 PolarHBondContact O-N 2.84Å; I304-Y306 VanDerWaalsContact C-N 3.33Å; I304-Y306 PolarHBondContact O-N 2.86Å; I304-I307 PolarHBondContact O-N 2.9Å; I304-L308 HydrophobicContact CG2-CD1 3.8Å; I304-L308 HydrophobicContact CG2-CG 4.27Å; I304-L308 WeakPolarHBondContact O-CB 3.3Å; I304-L308 VanDerWaalsContact O-CG 3.31Å; I304-L308 WeakPolarHBondContact O-CG 3.45Å; I304-L308 PolarHBondContact O-N 2.71Å
305V98.2Very high96.2Very high90 Ų9054.8 Ų54.855%0.54530%0.301SS..Hα-helixtrans-57.7-46.5-179.41690000111.2S301 F302 L308 A309S301-V305 VanDerWaalsContact O-CG2 3.31Å; S301-V305 WeakPolarHBondContact O-CG2 3.44Å; S301-V305 PolarHBondContact O-N 3.36Å; S301-V305 VanDerWaalsContact O-N 3.09Å; F302-V305 PolarHBondContact O-N 3.37Å; V305-L308 PolarHBondContact O-N 3.06Å; V305-A309 WeakPolarHBondContact O-CB 3.47Å; V305-A309 PolarHBondContact O-N 2.78Å
306Y98.2Very high96.5Very high36 Ų3660 Ų6014%0.14132%0.324CS..Hα-helixtrans-71.5-37.5-179-71.8-54.8000113.5F296 F302 K303 I304 A309 V310 V348 P349 H352F296-Y306 HydrophobicContact CD2-CD2 4.23Å; F296-Y306 HydrophobicContact CE1-CD2 4.48Å; F296-Y306 HydrophobicContact CE1-CE2 4.09Å; F296-Y306 AromaticContact CE2-CD2 3.8Å; F296-Y306 HydrophobicContact CE2-CD2 3.8Å; F296-Y306 AromaticContact CE2-CE2 3.95Å; F296-Y306 HydrophobicContact CE2-CE2 3.95Å; F296-Y306 AromaticContact CZ-CD2 3.93Å; F296-Y306 HydrophobicContact CZ-CD2 3.93Å; F296-Y306 AromaticContact CZ-CE2 3.59Å; F296-Y306 HydrophobicContact CZ-CE2 3.59Å; F302-Y306 HydrophobicContact CB-CD2 4.36Å; F302-Y306 HydrophobicContact CB-CE2 4.28Å; F302-Y306 WeakPolarHBondContact O-CD2 3.14Å; F302-Y306 PolarHBondContact O-N 2.91Å; K303-Y306 PolarHBondContact O-N 3.48Å; I304-Y306 VanDerWaalsContact C-N 3.33Å; I304-Y306 PolarHBondContact O-N 2.86Å; Y306-A309 PolarHBondContact O-N 2.95Å; Y306-V310 WeakPolarHBondContact O-CG2 3.31Å; Y306-V310 PolarHBondContact O-N 3.08Å; Y306-V348 HydrophobicContact CE1-CG1 4.24Å; Y306-P349 HydrophobicContact CD1-CB 3.86Å; Y306-P349 HydrophobicContact CD1-CG 4.15Å; Y306-P349 HydrophobicContact CD2-CB 3.85Å; Y306-P349 HydrophobicContact CE1-CB 3.94Å; Y306-P349 HydrophobicContact CE1-CG 4.38Å; Y306-P349 HydrophobicContact CE2-CB 3.92Å; Y306-P349 HydrophobicContact CG-CB 3.83Å; Y306-P349 HydrophobicContact CG-CG 4.44Å; Y306-H352 HydrophobicContact CE2-CB 4.48Å; Y306-H352 AromaticContact CE2-ND1 3.46Å; Y306-H352 WeakPolarHBondContact CE2-ND1 3.21Å; Y306-H352 AromaticContact CZ-ND1 3.53Å; Y306-H352 WeakPolarHBondContact OH-CB 3.44Å; Y306-H352 PolarHBondContact OH-ND1 3.01Å
307I98Very high96.7Very high43 Ų4360.2 Ų60.222%0.22133%0.325CS..Hα-helixtrans-62-46.4173.8-71.8172.6000110.3I292 K303 I304 A309 V310 L311I292-I307 HydrophobicContact CB-CG1 4.36Å; I292-I307 HydrophobicContact CD1-CG1 4.42Å; I292-I307 HydrophobicContact CG2-CD1 4.43Å; I292-I307 HydrophobicContact CG2-CG1 3.92Å; K303-I307 HydrophobicContact CG-CD1 4Å; K303-I307 WeakPolarHBondContact O-CB 3.28Å; K303-I307 VanDerWaalsContact O-CG1 3.31Å; K303-I307 WeakPolarHBondContact O-CG1 3.32Å; K303-I307 PolarHBondContact O-N 3.42Å; I304-I307 PolarHBondContact O-N 2.9Å; I307-A309 PolarHBondContact O-N 3.38Å; I307-V310 PolarHBondContact O-N 3.38Å; I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 VanDerWaalsContact O-CG 3.31Å; I307-L311 WeakPolarHBondContact O-CG 3.48Å; I307-L311 PolarHBondContact O-N 2.88Å
308L98.4Very high96.9Very high94 Ų9458 Ų5849%0.49232%0.32SS..Hα-helixtrans-62.1-42.6177-69.7176.9000111.9I304 V305 V310 L311 I312I304-L308 HydrophobicContact CG2-CD1 3.8Å; I304-L308 HydrophobicContact CG2-CG 4.27Å; I304-L308 WeakPolarHBondContact O-CB 3.3Å; I304-L308 VanDerWaalsContact O-CG 3.31Å; I304-L308 WeakPolarHBondContact O-CG 3.45Å; I304-L308 PolarHBondContact O-N 2.71Å; V305-L308 PolarHBondContact O-N 3.06Å; L308-V310 PolarHBondContact O-N 3.44Å; L308-L311 PolarHBondContact O-N 3.01Å; L308-I312 VanDerWaalsContact O-CG1 3.29Å; L308-I312 WeakPolarHBondContact O-CG1 3.4Å; L308-I312 PolarHBondContact O-N 3.45Å
309A98.1Very high97.2Very high38 Ų3863.3 Ų63.331%0.31434%0.341SS..Hα-helixtrans-59.9-45.8177.300000111.9V305 Y306 I307 L311 I312 L313V305-A309 WeakPolarHBondContact O-CB 3.47Å; V305-A309 PolarHBondContact O-N 2.78Å; Y306-A309 PolarHBondContact O-N 2.95Å; I307-A309 PolarHBondContact O-N 3.38Å; A309-L311 PolarHBondContact O-N 3.4Å; A309-I312 PolarHBondContact O-N 2.89Å; A309-L313 WeakPolarHBondContact O-CB 3.25Å; A309-L313 WeakPolarHBondContact O-CG 3.43Å; A309-L313 PolarHBondContact O-N 3.24Å
310V98.2Very high97.4Very high12 Ų1262.7 Ų62.77%0.07334%0.341CS..Hα-helixtrans-64.4-39.5177.6170.20000111.6I285 I292 Y306 I307 L308 G314 F342I285-V310 HydrophobicContact CB-CG1 4.32Å; I285-V310 HydrophobicContact CG1-CG1 4.08Å; I292-V310 HydrophobicContact CD1-CG2 4.03Å; Y306-V310 WeakPolarHBondContact O-CG2 3.31Å; Y306-V310 PolarHBondContact O-N 3.08Å; I307-V310 PolarHBondContact O-N 3.38Å; L308-V310 PolarHBondContact O-N 3.44Å; V310-G314 PolarHBondContact O-N 3.18Å; V310-F342 HydrophobicContact CG1-CE2 4.16Å; V310-F342 HydrophobicContact CG1-CZ 4.09Å
311L98.3Very high97.5Very high80 Ų8058 Ų5842%0.41932%0.316SS..Hα-helixtrans-62.9-44.7175.6-71.8169.7000111.9I285 I307 L308 A309 G314 A315I285-L311 HydrophobicContact CD1-CD2 4.47Å; I285-L311 HydrophobicContact CG2-CD2 3.6Å; I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 VanDerWaalsContact O-CG 3.31Å; I307-L311 WeakPolarHBondContact O-CG 3.48Å; I307-L311 PolarHBondContact O-N 2.88Å; L308-L311 PolarHBondContact O-N 3.01Å; A309-L311 PolarHBondContact O-N 3.4Å; L311-G314 PolarHBondContact O-N 3.33Å; L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.46Å; L311-A315 PolarHBondContact O-N 3.01Å
312I98.3Very high97.5Very high121 Ų12155.3 Ų55.362%0.62130%0.296SS*.Hα-helixtrans-64.2-48.1178.1-68.4165.6000110.6L308 A309 G314 A315 F316L308-I312 VanDerWaalsContact O-CG1 3.29Å; L308-I312 WeakPolarHBondContact O-CG1 3.4Å; L308-I312 PolarHBondContact O-N 3.45Å; A309-I312 PolarHBondContact O-N 2.89Å; I312-G314 VanDerWaalsContact C-N 3.34Å; I312-G314 PolarHBondContact O-N 3.46Å; I312-A315 PolarHBondContact O-N 3.46Å; I312-F316 WeakPolarHBondContact O-CB 3.27Å; I312-F316 PolarHBondContact O-N 3.03Å
313L98Very high97.5Very high72 Ų7254.4 Ų54.438%0.37729%0.293SS..Hα-helixtrans-62.4-41.3178.3-73.2173.8000111.9A309 F316 C317 F342A309-L313 WeakPolarHBondContact O-CB 3.25Å; A309-L313 WeakPolarHBondContact O-CG 3.43Å; A309-L313 PolarHBondContact O-N 3.24Å; L313-F316 PolarHBondContact O-N 3.19Å; L313-C317 PolarHBondContact O-N 3.34Å; L313-C317 PolarHBondContact O-SG 3.09Å; L313-F342 HydrophobicContact CB-CD2 3.72Å; L313-F342 HydrophobicContact CB-CE2 3.55Å; L313-F342 HydrophobicContact CB-CZ 4.5Å; L313-F342 HydrophobicContact CD1-CD2 4.48Å
314G98.2Very high97.4Very high1 Ų157.7 Ų57.71%0.0131%0.311CS..Hα-helixtrans-68.6-38.9178.100000113S281 V310 L311 I312 C317 A318 F342S281-G314 PolarHBondContact OG-O 3.41Å; V310-G314 PolarHBondContact O-N 3.18Å; L311-G314 PolarHBondContact O-N 3.33Å; I312-G314 VanDerWaalsContact C-N 3.34Å; I312-G314 PolarHBondContact O-N 3.46Å; G314-C317 PolarHBondContact O-N 2.73Å; G314-A318 WeakPolarHBondContact O-CB 3.46Å; G314-A318 PolarHBondContact O-N 3.42Å; G314-F342 VanDerWaalsContact CA-CE1 3.47Å
315A98Very high97.1Very high61 Ų6160 Ų6050%0.50432%0.316SS..Hα-helixtrans-63.3-42.4172.400000111.6L311 I312 A318 F319L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.46Å; L311-A315 PolarHBondContact O-N 3.01Å; I312-A315 PolarHBondContact O-N 3.46Å; A315-A318 PolarHBondContact O-N 3.45Å; A315-F319 WeakPolarHBondContact O-CB 3.2Å; A315-F319 PolarHBondContact O-N 2.82Å
316F97.9Very high96.9Very high114 Ų11456.4 Ų56.450%0.529%0.293SS..Hα-helixtrans-60.7-48.3173.6174.1-100.5000111.9I312 L313 A318 F319 V320 L338I312-F316 WeakPolarHBondContact O-CB 3.27Å; I312-F316 PolarHBondContact O-N 3.03Å; L313-F316 PolarHBondContact O-N 3.19Å; F316-A318 PolarHBondContact O-N 2.65Å; F316-F319 PolarHBondContact O-N 3.01Å; F316-V320 HydrophobicContact CD1-CG2 4.47Å; F316-V320 HydrophobicContact CD2-CG2 4.31Å; F316-V320 HydrophobicContact CE1-CG2 4.06Å; F316-V320 HydrophobicContact CE2-CG2 3.89Å; F316-V320 HydrophobicContact CZ-CG2 3.75Å; F316-V320 WeakPolarHBondContact O-CG2 3.48Å; F316-V320 PolarHBondContact O-N 3.44Å; F316-L338 HydrophobicContact CE1-CD1 4.42Å
317C97.4Very high96.5Very high4 Ų455.6 Ų55.63%0.02729%0.291CS..Hα-helixtrans-61.1-43.9177.7-67.50000111.8L313 G314 F319 V320 C321 F339 F342L313-C317 PolarHBondContact O-N 3.34Å; L313-C317 PolarHBondContact O-SG 3.09Å; G314-C317 PolarHBondContact O-N 2.73Å; C317-F319 PolarHBondContact O-N 3.37Å; C317-V320 PolarHBondContact O-N 3.28Å; C317-C321 WeakPolarHBondContact O-CB 3.37Å; C317-C321 PolarHBondContact O-N 3.29Å; C317-C321 PolarHBondContact O-SG 3.27Å; C317-C321 VanDerWaalsContact O-SG 3.37Å; C317-F339 HydrophobicContact CB-CE1 4.3Å; C317-F342 HydrophobicContact CB-CD1 4.41Å
318A97.2Very high96.2Very high19 Ų1955.5 Ų55.516%0.15729%0.294CS..Hα-helixtrans-61.6-43.1175.900000111.6V278 S281 G314 A315 F316 C321 T322V278-A318 HydrophobicContact CG2-CB 4.37Å; S281-A318 PolarHBondContact OG-N 3.28Å; G314-A318 WeakPolarHBondContact O-CB 3.46Å; G314-A318 PolarHBondContact O-N 3.42Å; A315-A318 PolarHBondContact O-N 3.45Å; F316-A318 PolarHBondContact O-N 2.65Å; A318-C321 PolarHBondContact O-N 3.35Å; A318-T322 WeakPolarHBondContact O-CB 3.01Å; A318-T322 WeakPolarHBondContact O-CG2 3.36Å; A318-T322 PolarHBondContact O-N 3.43Å; A318-T322 VanDerWaalsContact O-N 3.08Å; A318-T322 PolarHBondContact O-OG1 2.9Å
319F97.1Very high95.8Very high133 Ų13353.2 Ų53.258%0.58329%0.285SS*.Hα-helixtrans-61.8-46.5177.1174.2-98.7000112.5A315 F316 C317 T322 Q323A315-F319 WeakPolarHBondContact O-CB 3.2Å; A315-F319 PolarHBondContact O-N 2.82Å; F316-F319 PolarHBondContact O-N 3.01Å; C317-F319 PolarHBondContact O-N 3.37Å; F319-T322 PolarHBondContact O-OG1 2.99Å; F319-T322 VanDerWaalsContact O-OG1 3.06Å; F319-Q323 WeakPolarHBondContact O-CG 3.21Å; F319-Q323 PolarHBondContact O-NE2 2.98Å
320V96.7Very high95.6Very high25 Ų2556.7 Ų56.715%0.15230%0.302CS..Hα-helixtrans-64.6-46.4178.8173.10000110.8F316 C317 T322 Q323 F326 L338F316-V320 HydrophobicContact CD1-CG2 4.47Å; F316-V320 HydrophobicContact CD2-CG2 4.31Å; F316-V320 HydrophobicContact CE1-CG2 4.06Å; F316-V320 HydrophobicContact CE2-CG2 3.89Å; F316-V320 HydrophobicContact CZ-CG2 3.75Å; F316-V320 WeakPolarHBondContact O-CG2 3.48Å; F316-V320 PolarHBondContact O-N 3.44Å; C317-V320 PolarHBondContact O-N 3.28Å; V320-T322 VanDerWaalsContact C-N 3.25Å; V320-T322 PolarHBondContact O-N 3.38Å; V320-Q323 WeakPolarHBondContact O-CB 3.43Å; V320-Q323 WeakPolarHBondContact O-CG 3.35Å; V320-Q323 PolarHBondContact O-N 3.16Å; V320-F326 HydrophobicContact CG1-CD1 4.39Å; V320-F326 HydrophobicContact CG1-CD2 4.33Å; V320-F326 HydrophobicContact CG1-CE1 4.12Å; V320-F326 HydrophobicContact CG1-CE2 4.16Å; V320-F326 HydrophobicContact CG1-CG 4.44Å; V320-F326 HydrophobicContact CG1-CZ 4.04Å; V320-L338 HydrophobicContact CB-CD2 4.14Å; V320-L338 HydrophobicContact CG1-CD2 3.88Å
321C94.7Very high95.4Very high0 Ų060.4 Ų60.40%032%0.316CS..Hα-helixtrans-70.5-20.1-176.4-70.20000114.1Y277 C317 A318 Q323 F326 F339Y277-C321 HydrophobicContact CD2-CB 3.94Å; Y277-C321 WeakPolarHBondContact CD2-O 3.5Å; Y277-C321 HydrophobicContact CG-CB 4.12Å; C317-C321 WeakPolarHBondContact O-CB 3.37Å; C317-C321 PolarHBondContact O-N 3.29Å; C317-C321 PolarHBondContact O-SG 3.27Å; C317-C321 VanDerWaalsContact O-SG 3.37Å; A318-C321 PolarHBondContact O-N 3.35Å; C321-Q323 VanDerWaalsContact C-N 3.33Å; C321-F326 HydrophobicContact CB-CD1 4.33Å; C321-F326 VanDerWaalsContact SG-CE1 3.59Å; C321-F339 HydrophobicContact CB-CZ 4.11Å; C321-F339 VanDerWaalsContact SG-CE2 3.55Å; C321-F339 WeakPolarHBondContact SG-CZ 3.15Å
322T96Very high95.2Very high34 Ų3457.4 Ų57.421%0.20930%0.299CS..THydrogen-bonded Turntrans-87.3-1.3178.353.20000113.9K274 V278 A318 F319 V320K274-T322 HydrophobicContact CB-CG2 4.04Å; K274-T322 WeakPolarHBondContact CD-O 3.14Å; K274-T322 WeakPolarHBondContact CE-O 3.22Å; K274-T322 HydrophobicContact CG-CG2 4.3Å; K274-T322 PolarHBondContact NZ-O 2.9Å; V278-T322 HydrophobicContact CG2-CG2 3.79Å; A318-T322 WeakPolarHBondContact O-CB 3.01Å; A318-T322 WeakPolarHBondContact O-CG2 3.36Å; A318-T322 PolarHBondContact O-N 3.43Å; A318-T322 VanDerWaalsContact O-N 3.08Å; A318-T322 PolarHBondContact O-OG1 2.9Å; F319-T322 PolarHBondContact O-OG1 2.99Å; F319-T322 VanDerWaalsContact O-OG1 3.06Å; V320-T322 VanDerWaalsContact C-N 3.25Å; V320-T322 PolarHBondContact O-N 3.38Å
323Q96.8Very high95Very high59 Ų5954.3 Ų54.328%0.27629%0.292SS..SBendtrans-72.5134.5172.6-56.8-53.4-51.900111.4F319 V320 C321 Y325 F326 L327F319-Q323 WeakPolarHBondContact O-CG 3.21Å; F319-Q323 PolarHBondContact O-NE2 2.98Å; V320-Q323 WeakPolarHBondContact O-CB 3.43Å; V320-Q323 WeakPolarHBondContact O-CG 3.35Å; V320-Q323 PolarHBondContact O-N 3.16Å; C321-Q323 VanDerWaalsContact C-N 3.33Å; Q323-Y325 VanDerWaalsContact C-N 3.28Å; Q323-Y325 HydrophobicContact CB-CD1 3.81Å; Q323-Y325 HydrophobicContact CB-CE1 3.38Å; Q323-Y325 HydrophobicContact CG-CE1 3.87Å; Q323-Y325 PolarHBondContact O-N 3.45Å; Q323-F326 HydrophobicContact CB-CB 4.41Å; Q323-F326 WeakPolarHBondContact O-CB 3.47Å; Q323-F326 PolarHBondContact O-N 3.09Å; Q323-L327 PolarHBondContact O-N 2.81Å
324D93.8Very high94.9Very high93 Ų9353.5 Ų53.550%0.49729%0.292SS..G310 helixtrans-59.8-34.8-172.5-73.6-20000113.7K274 F326 L327K274-D324 WeakPolarHBondContact CE-OD1 3.16Å; K274-D324 IonicContact NZ-OD1 2.65Å; K274-D324 PolarHBondContact NZ-OD1 3.46Å; D324-F326 VanDerWaalsContact C-N 3.29Å; D324-F326 PolarHBondContact O-N 2.9Å; D324-L327 WeakPolarHBondContact O-CB 3.35Å; D324-L327 PolarHBondContact O-N 2.53Å
325Y92.7Very high94.8Very high130 Ų13053.6 Ų53.651%0.5129%0.292SS..G310 helixtrans-67.9-31.5177.467.1-94.7000112.1Q323 L327 S328 Y331Q323-Y325 VanDerWaalsContact C-N 3.28Å; Q323-Y325 HydrophobicContact CB-CD1 3.81Å; Q323-Y325 HydrophobicContact CB-CE1 3.38Å; Q323-Y325 HydrophobicContact CG-CE1 3.87Å; Q323-Y325 PolarHBondContact O-N 3.45Å; Y325-L327 VanDerWaalsContact C-N 3.26Å; Y325-L327 PolarHBondContact O-N 2.82Å; Y325-S328 VanDerWaalsContact O-CB 3.25Å; Y325-S328 WeakPolarHBondContact O-CB 3.37Å; Y325-S328 PolarHBondContact O-N 2.97Å; Y325-Y331 HydrophobicContact CD2-CE2 4.13Å; Y325-Y331 VanDerWaalsContact O-CD2 3.23Å; Y325-Y331 WeakPolarHBondContact O-CD2 3.3Å
326F92.3Very high94.6Very high16 Ų1651.2 Ų51.27%0.0727%0.272CS..G310 helixtrans-76.9-14.8-178.3-150.5-107.5000112.6V320 C321 Q323 D324 S328 Y331 R335 L338V320-F326 HydrophobicContact CG1-CD1 4.39Å; V320-F326 HydrophobicContact CG1-CD2 4.33Å; V320-F326 HydrophobicContact CG1-CE1 4.12Å; V320-F326 HydrophobicContact CG1-CE2 4.16Å; V320-F326 HydrophobicContact CG1-CG 4.44Å; V320-F326 HydrophobicContact CG1-CZ 4.04Å; C321-F326 HydrophobicContact CB-CD1 4.33Å; C321-F326 VanDerWaalsContact SG-CE1 3.59Å; Q323-F326 HydrophobicContact CB-CB 4.41Å; Q323-F326 WeakPolarHBondContact O-CB 3.47Å; Q323-F326 PolarHBondContact O-N 3.09Å; D324-F326 VanDerWaalsContact C-N 3.29Å; D324-F326 PolarHBondContact O-N 2.9Å; F326-S328 PolarHBondContact O-N 3.36Å; F326-Y331 AromaticContact CD2-CD1 3.8Å; F326-Y331 HydrophobicContact CD2-CD1 3.8Å; F326-Y331 HydrophobicContact CD2-CE1 4.48Å; F326-Y331 AromaticContact CD2-CG 3.93Å; F326-Y331 HydrophobicContact CD2-CG 3.93Å; F326-Y331 AromaticContact CE2-CD1 3.86Å; F326-Y331 HydrophobicContact CE2-CD1 3.86Å; F326-Y331 HydrophobicContact CE2-CG 4.28Å; F326-R335 HydrophobicContact CD1-CG 3.53Å; F326-R335 HydrophobicContact CE1-CB 4.19Å; F326-R335 HydrophobicContact CE1-CG 3.24Å; F326-R335 HydrophobicContact CZ-CG 4.02Å; F326-R335 PolarHBondContact O-NH1 3.27Å; F326-L338 HydrophobicContact CE1-CD2 4.14Å; F326-L338 HydrophobicContact CZ-CD2 4.18Å
327L91.2Very high94.6Very high18 Ų1851.7 Ų51.79%0.09428%0.279CS..G310 helixtrans-70.3-18.8170.1-56.7-178.5000112.5K270 N273 K274 Y277 Q323 D324 Y325K270-L327 HydrophobicContact CB-CD1 4.16Å; K270-L327 HydrophobicContact CG-CD1 3.99Å; N273-L327 HydrophobicContact CB-CD2 4.44Å; K274-L327 HydrophobicContact CG-CD1 4.28Å; K274-L327 HydrophobicContact CG-CD2 4.13Å; Y277-L327 HydrophobicContact CD2-CD2 3.89Å; Y277-L327 HydrophobicContact CE2-CD2 3.56Å; Q323-L327 PolarHBondContact O-N 2.81Å; D324-L327 WeakPolarHBondContact O-CB 3.35Å; D324-L327 PolarHBondContact O-N 2.53Å; Y325-L327 VanDerWaalsContact C-N 3.26Å; Y325-L327 PolarHBondContact O-N 2.82Å
328S91.2Very high94.5Very high42 Ų4253.2 Ų53.229%0.29429%0.287SS..SBendtrans-61143.4-178177.20000111.7Y325 F326 T330 Y331 R335Y325-S328 VanDerWaalsContact O-CB 3.25Å; Y325-S328 WeakPolarHBondContact O-CB 3.37Å; Y325-S328 PolarHBondContact O-N 2.97Å; F326-S328 PolarHBondContact O-N 3.36Å; S328-T330 WeakPolarHBondContact CB-OG1 3.39Å; S328-T330 PolarHBondContact O-N 3.11Å; S328-T330 PolarHBondContact OG-N 3.06Å; S328-T330 PolarHBondContact OG-OG1 3.24Å; S328-Y331 PolarHBondContact O-N 3.49Å; S328-Y331 VanDerWaalsContact O-N 3.08Å; S328-R335 PolarHBondContact O-NH1 3.25Å
329P90.3Very high94.5Very high46 Ų4653.4 Ų53.430%0.29928%0.284SS..G310 helixtrans-56.9-23.4175-26.335.4000114D176 Y331 R332D176-P329 WeakPolarHBondContact O-CB 3.49Å; P329-Y331 VanDerWaalsContact C-N 3.27Å; P329-Y331 PolarHBondContact O-N 3.42Å; P329-R332 VanDerWaalsContact O-CB 3.25Å; P329-R332 WeakPolarHBondContact O-CB 3.31Å; P329-R332 PolarHBondContact O-N 3.42Å
330T93Very high94.5Very high110 Ų11048.4 Ų48.468%0.67527%0.266SS*.G310 helixtrans-59.5-34.117654.50000113S328 R332S328-T330 WeakPolarHBondContact CB-OG1 3.39Å; S328-T330 PolarHBondContact O-N 3.11Å; S328-T330 PolarHBondContact OG-N 3.06Å; S328-T330 PolarHBondContact OG-OG1 3.24Å; T330-R332 VanDerWaalsContact C-N 3.34Å
331Y94.7Very high94.5Very high91 Ų9149.8 Ų49.836%0.35728%0.28SS..G310 helixtrans-91.211.8-180-68.5-85.8000113.4Y325 F326 S328 P329 A333 S334 R335Y325-Y331 HydrophobicContact CD2-CE2 4.13Å; Y325-Y331 VanDerWaalsContact O-CD2 3.23Å; Y325-Y331 WeakPolarHBondContact O-CD2 3.3Å; F326-Y331 AromaticContact CD2-CD1 3.8Å; F326-Y331 HydrophobicContact CD2-CD1 3.8Å; F326-Y331 HydrophobicContact CD2-CE1 4.48Å; F326-Y331 AromaticContact CD2-CG 3.93Å; F326-Y331 HydrophobicContact CD2-CG 3.93Å; F326-Y331 AromaticContact CE2-CD1 3.86Å; F326-Y331 HydrophobicContact CE2-CD1 3.86Å; F326-Y331 HydrophobicContact CE2-CG 4.28Å; S328-Y331 PolarHBondContact O-N 3.49Å; S328-Y331 VanDerWaalsContact O-N 3.08Å; P329-Y331 VanDerWaalsContact C-N 3.27Å; P329-Y331 PolarHBondContact O-N 3.42Å; Y331-A333 PolarHBondContact O-N 2.9Å; Y331-S334 WeakPolarHBondContact O-CB 3.41Å; Y331-S334 PolarHBondContact O-N 2.67Å; Y331-S334 VanDerWaalsContact O-N 3.1Å; Y331-R335 PolarHBondContact O-N 2.91Å
332R93.9Very high94.7Very high16 Ų1650.1 Ų50.16%0.0628%0.281CS..Hα-helixtrans-53.4-49.4-179.1-177.6-178.6-67.5110.2-7.5113.1D176 P329 T330 S334 R335 A336 Y385D176-R332 VanDerWaalsContact C-NH2 3.34Å; D176-R332 PolarHBondContact O-NH2 3.41Å; D176-R332 IonicContact OD1-CZ 2.69Å; D176-R332 IonicContact OD1-NH2 3.65Å; D176-R332 PolarHBondContact OD1-NH2 3.03Å; D176-R332 IonicContact OD2-CZ 2.67Å; D176-R332 IonicContact OD2-NH2 3.57Å; D176-R332 PolarHBondContact OD2-NH2 3.16Å; P329-R332 VanDerWaalsContact O-CB 3.25Å; P329-R332 WeakPolarHBondContact O-CB 3.31Å; P329-R332 PolarHBondContact O-N 3.42Å; T330-R332 VanDerWaalsContact C-N 3.34Å; R332-S334 VanDerWaalsContact C-N 3.34Å; R332-R335 PolarHBondContact O-N 3.01Å; R332-A336 PolarHBondContact O-N 2.93Å; R332-A336 VanDerWaalsContact O-N 3.1Å; R332-Y385 HydrophobicContact CG-CD1 4.11Å; R332-Y385 HydrophobicContact CG-CE1 3.4Å; R332-Y385 HydrophobicContact CG-CE2 4.44Å
333A94.4Very high94.7Very high57 Ų5750.4 Ų50.447%0.47129%0.291SS..Hα-helixtrans-66.8-37.5178.900000111.6Y331 A336 L337 A386Y331-A333 PolarHBondContact O-N 2.9Å; A333-A336 PolarHBondContact O-N 3.18Å; A333-L337 WeakPolarHBondContact O-CB 3.25Å; A333-L337 PolarHBondContact O-N 3.05Å; A333-A386 HydrophobicContact CB-CB 4.47Å
334S95.8Very high94.7Very high54 Ų5451.3 Ų51.338%0.37830%0.297SS..Hα-helixtrans-63.7-40.8175.5-52.80000112.2Y331 R332 L337 L338Y331-S334 WeakPolarHBondContact O-CB 3.41Å; Y331-S334 PolarHBondContact O-N 2.67Å; Y331-S334 VanDerWaalsContact O-N 3.1Å; R332-S334 VanDerWaalsContact C-N 3.34Å; S334-L337 PolarHBondContact O-N 3.49Å; S334-L338 VanDerWaalsContact O-CB 3.29Å; S334-L338 WeakPolarHBondContact O-CB 3.09Å; S334-L338 PolarHBondContact O-N 2.88Å
335R95.1Very high94.8Very high3 Ų348.4 Ų48.41%0.01128%0.284CS..Hα-helixtrans-59.8-50172.9-75.4-171.9-56-96.711.1111.5Y277 F326 S328 Y331 R332 L337 L338 F339 Y385Y277-R335 VanDerWaalsContact CE2-CD 3.5Å; Y277-R335 WeakPolarHBondContact OH-CD 3.48Å; Y277-R335 PolarHBondContact OH-NE 3.07Å; F326-R335 HydrophobicContact CD1-CG 3.53Å; F326-R335 HydrophobicContact CE1-CB 4.19Å; F326-R335 HydrophobicContact CE1-CG 3.24Å; F326-R335 HydrophobicContact CZ-CG 4.02Å; F326-R335 PolarHBondContact O-NH1 3.27Å; S328-R335 PolarHBondContact O-NH1 3.25Å; Y331-R335 PolarHBondContact O-N 2.91Å; R332-R335 PolarHBondContact O-N 3.01Å; R335-L337 VanDerWaalsContact C-N 3.34Å; R335-L337 PolarHBondContact O-N 2.97Å; R335-L338 PolarHBondContact O-N 3.13Å; R335-F339 VanDerWaalsContact O-CD2 3.27Å; R335-F339 WeakPolarHBondContact O-CD2 3.29Å; R335-F339 PolarHBondContact O-N 3.29Å; R335-Y385 PolarHBondContact NH2-OH 3.47Å
336A95.2Very high94.9Very high12 Ų1243.1 Ų43.110%0.09927%0.27CS..Hα-helixtrans-57.8-48.7178.200000110.9R332 A333 L338 F339 S340 Y385 A386R332-A336 PolarHBondContact O-N 2.93Å; R332-A336 VanDerWaalsContact O-N 3.1Å; A333-A336 PolarHBondContact O-N 3.18Å; A336-L338 PolarHBondContact O-N 3.22Å; A336-F339 PolarHBondContact O-N 3.43Å; A336-S340 VanDerWaalsContact O-CB 3.27Å; A336-S340 WeakPolarHBondContact O-CB 3.4Å; A336-S340 PolarHBondContact O-N 3.04Å; A336-S340 PolarHBondContact O-OG 3.23Å; A336-Y385 HydrophobicContact CB-CD1 4.06Å; A336-Y385 HydrophobicContact CB-CE1 4.38Å; A336-A386 HydrophobicContact CB-CB 3.89Å
337L96.2Very high95Very high124 Ų12446.1 Ų46.165%0.64929%0.289SS*.Hα-helixtrans-61.5-43.3178.2-179.261.8000112.5A333 S334 R335 S340 A341A333-L337 WeakPolarHBondContact O-CB 3.25Å; A333-L337 PolarHBondContact O-N 3.05Å; S334-L337 PolarHBondContact O-N 3.49Å; R335-L337 VanDerWaalsContact C-N 3.34Å; R335-L337 PolarHBondContact O-N 2.97Å; L337-S340 PolarHBondContact O-N 3.13Å; L337-A341 VanDerWaalsContact O-CB 3.23Å; L337-A341 WeakPolarHBondContact O-CB 3.44Å; L337-A341 PolarHBondContact O-N 3.13Å
338L97Very high95.3Very high35 Ų3549.6 Ų49.618%0.18331%0.311CS..Hα-helixtrans-60.8-49.8179.5179.163.8000111.3F316 V320 F326 S334 R335 A336 A341 F342F316-L338 HydrophobicContact CE1-CD1 4.42Å; V320-L338 HydrophobicContact CB-CD2 4.14Å; V320-L338 HydrophobicContact CG1-CD2 3.88Å; F326-L338 HydrophobicContact CE1-CD2 4.14Å; F326-L338 HydrophobicContact CZ-CD2 4.18Å; S334-L338 VanDerWaalsContact O-CB 3.29Å; S334-L338 WeakPolarHBondContact O-CB 3.09Å; S334-L338 PolarHBondContact O-N 2.88Å; R335-L338 PolarHBondContact O-N 3.13Å; A336-L338 PolarHBondContact O-N 3.22Å; L338-A341 PolarHBondContact O-N 2.69Å; L338-F342 WeakPolarHBondContact O-CB 3.42Å; L338-F342 PolarHBondContact O-N 3.22Å
339F96.7Very high95.5Very high24 Ų2447.9 Ų47.911%0.10530%0.299CS..Hα-helixtrans-70.6-35.8179-72.4-60000112.8Y277 I280 C317 C321 R335 A336 F342 G343Y277-F339 HydrophobicContact CD1-CE2 4.42Å; I280-F339 HydrophobicContact CB-CD1 4.18Å; I280-F339 HydrophobicContact CB-CE1 3.89Å; I280-F339 HydrophobicContact CB-CE2 4.43Å; I280-F339 HydrophobicContact CB-CZ 4.02Å; I280-F339 HydrophobicContact CD1-CD2 4.21Å; I280-F339 HydrophobicContact CD1-CE2 3.97Å; I280-F339 HydrophobicContact CD1-CZ 4.32Å; I280-F339 HydrophobicContact CG2-CB 4.21Å; I280-F339 HydrophobicContact CG2-CD1 3.47Å; I280-F339 VanDerWaalsContact CG2-CD1 3.47Å; I280-F339 HydrophobicContact CG2-CD2 4.18Å; I280-F339 HydrophobicContact CG2-CE1 3.72Å; I280-F339 HydrophobicContact CG2-CE2 4.39Å; I280-F339 HydrophobicContact CG2-CG 3.71Å; I280-F339 HydrophobicContact CG2-CZ 4.17Å; C317-F339 HydrophobicContact CB-CE1 4.3Å; C321-F339 HydrophobicContact CB-CZ 4.11Å; C321-F339 VanDerWaalsContact SG-CE2 3.55Å; C321-F339 WeakPolarHBondContact SG-CZ 3.15Å; R335-F339 VanDerWaalsContact O-CD2 3.27Å; R335-F339 WeakPolarHBondContact O-CD2 3.29Å; R335-F339 PolarHBondContact O-N 3.29Å; A336-F339 PolarHBondContact O-N 3.43Å; F339-F342 PolarHBondContact O-N 3.48Å; F339-G343 PolarHBondContact O-N 3.32Å
340S96.5Very high95.6Very high27 Ų2746.6 Ų46.619%0.18929%0.291CS..Hα-helixtrans-63.5-43.4172.4-66.60000111.6A336 L337 F342 G343 L344 A382A336-S340 VanDerWaalsContact O-CB 3.27Å; A336-S340 WeakPolarHBondContact O-CB 3.4Å; A336-S340 PolarHBondContact O-N 3.04Å; A336-S340 PolarHBondContact O-OG 3.23Å; L337-S340 PolarHBondContact O-N 3.13Å; S340-F342 VanDerWaalsContact C-N 3.32Å; S340-F342 PolarHBondContact O-N 2.95Å; S340-G343 PolarHBondContact O-N 3.17Å; S340-L344 VanDerWaalsContact O-CB 3.25Å; S340-L344 WeakPolarHBondContact O-CB 3.23Å; S340-L344 VanDerWaalsContact O-CG 3.23Å; S340-L344 WeakPolarHBondContact O-CG 3.41Å; S340-L344 PolarHBondContact O-N 3.49Å; S340-A382 WeakPolarHBondContact OG-CB 3.44Å
341A97.2Very high95.6Very high54 Ų5444.9 Ų44.945%0.44628%0.28SS..Hα-helixtrans-63.6-39.4174.900000111.5L337 L338 L344 S345L337-A341 VanDerWaalsContact O-CB 3.23Å; L337-A341 WeakPolarHBondContact O-CB 3.44Å; L337-A341 PolarHBondContact O-N 3.13Å; L338-A341 PolarHBondContact O-N 2.69Å; A341-L344 PolarHBondContact O-N 3.26Å; A341-S345 PolarHBondContact O-N 3.43Å
342F97.9Very high95.6Very high7 Ų742.9 Ų42.93%0.03127%0.274CS..Hα-helixtrans-62.6-47.6174.7-178.8-147.4000111.7V284 I285 V310 L313 G314 C317 L338 F339 S340 L344 S345V284-F342 HydrophobicContact CB-CD1 3.86Å; V284-F342 HydrophobicContact CB-CE1 3.51Å; V284-F342 HydrophobicContact CB-CZ 4.08Å; V284-F342 HydrophobicContact CG1-CD1 3.66Å; V284-F342 HydrophobicContact CG1-CD2 4.23Å; V284-F342 HydrophobicContact CG1-CE1 3.46Å; V284-F342 VanDerWaalsContact CG1-CE1 3.46Å; V284-F342 HydrophobicContact CG1-CE2 4.04Å; V284-F342 HydrophobicContact CG1-CG 4.04Å; V284-F342 HydrophobicContact CG1-CZ 3.65Å; V284-F342 HydrophobicContact CG2-CD1 4.23Å; V284-F342 HydrophobicContact CG2-CE1 4.33Å; I285-F342 HydrophobicContact CG1-CE1 4.45Å; I285-F342 HydrophobicContact CG1-CZ 3.97Å; V310-F342 HydrophobicContact CG1-CE2 4.16Å; V310-F342 HydrophobicContact CG1-CZ 4.09Å; L313-F342 HydrophobicContact CB-CD2 3.72Å; L313-F342 HydrophobicContact CB-CE2 3.55Å; L313-F342 HydrophobicContact CB-CZ 4.5Å; L313-F342 HydrophobicContact CD1-CD2 4.48Å; G314-F342 VanDerWaalsContact CA-CE1 3.47Å; C317-F342 HydrophobicContact CB-CD1 4.41Å; L338-F342 WeakPolarHBondContact O-CB 3.42Å; L338-F342 PolarHBondContact O-N 3.22Å; F339-F342 PolarHBondContact O-N 3.48Å; S340-F342 VanDerWaalsContact C-N 3.32Å; S340-F342 PolarHBondContact O-N 2.95Å; F342-L344 PolarHBondContact O-N 2.99Å; F342-S345 VanDerWaalsContact O-CB 3.31Å; F342-S345 WeakPolarHBondContact O-CB 3.15Å; F342-S345 PolarHBondContact O-N 2.8Å; F342-S345 PolarHBondContact O-OG 3.33Å
343G96.7Very high95.5Very high41 Ų4143.2 Ų43.242%0.42328%0.275SS..Hα-helixtrans-61.6-43.3174.100000113F339 S340 S345 G346F339-G343 PolarHBondContact O-N 3.32Å; S340-G343 PolarHBondContact O-N 3.17Å; G343-S345 PolarHBondContact O-N 3.44Å; G343-G346 PolarHBondContact O-N 3.5Å
344L96Very high95.3Very high77 Ų7742.9 Ų42.940%0.40327%0.265SS..Hα-helixtrans-68.7-16.8178.6-75171.9000113.7S340 A341 F342 G346 V347 I379S340-L344 VanDerWaalsContact O-CB 3.25Å; S340-L344 WeakPolarHBondContact O-CB 3.23Å; S340-L344 VanDerWaalsContact O-CG 3.23Å; S340-L344 WeakPolarHBondContact O-CG 3.41Å; S340-L344 PolarHBondContact O-N 3.49Å; A341-L344 PolarHBondContact O-N 3.26Å; F342-L344 PolarHBondContact O-N 2.99Å; L344-G346 PolarHBondContact O-N 3.35Å; L344-G346 VanDerWaalsContact O-N 3.11Å; L344-V347 HydrophobicContact CD2-CG2 4.3Å; L344-V347 VanDerWaalsContact O-CB 3.3Å; L344-V347 WeakPolarHBondContact O-CB 3.33Å; L344-V347 VanDerWaalsContact O-CG2 3.28Å; L344-V347 WeakPolarHBondContact O-CG2 3.41Å; L344-V347 PolarHBondContact O-N 2.96Å; L344-I379 HydrophobicContact CD2-CD1 4.02Å
345S96.7Very high95Very high32 Ų3245.6 Ų45.622%0.22427%0.274CS..THydrogen-bonded Turntrans-57.7-24171.476.50000112.3A341 F342 G343 V347 V348 P349A341-S345 PolarHBondContact O-N 3.43Å; F342-S345 VanDerWaalsContact O-CB 3.31Å; F342-S345 WeakPolarHBondContact O-CB 3.15Å; F342-S345 PolarHBondContact O-N 2.8Å; F342-S345 PolarHBondContact O-OG 3.33Å; G343-S345 PolarHBondContact O-N 3.44Å; S345-V347 PolarHBondContact O-N 3.41Å; S345-V348 PolarHBondContact O-N 2.97Å; S345-V348 VanDerWaalsContact O-N 3.16Å; S345-P349 VanDerWaalsContact O-CD 3.26Å; S345-P349 WeakPolarHBondContact O-CD 3.47Å
346G94.8Very high94.6Very high20 Ų2047 Ų4721%0.20628%0.282CS..THydrogen-bonded Turntrans-62.2-16172.300000114.9W291 G343 L344 V348 P349 C350W291-G346 WeakPolarHBondContact CH2-O 3.36Å; G343-G346 PolarHBondContact O-N 3.5Å; L344-G346 PolarHBondContact O-N 3.35Å; L344-G346 VanDerWaalsContact O-N 3.11Å; G346-V348 VanDerWaalsContact C-N 3.26Å; G346-V348 PolarHBondContact O-N 3.47Å; G346-P349 WeakPolarHBondContact O-CD 3.3Å; G346-P349 WeakPolarHBondContact O-CG 3.17Å; G346-C350 VanDerWaalsContact O-CB 3.3Å; G346-C350 WeakPolarHBondContact O-CB 3.48Å; G346-C350 PolarHBondContact O-N 3.48Å; G346-C350 VanDerWaalsContact O-N 3.13Å
347V94.9Very high94Very high79 Ų7946.7 Ų46.748%0.47928%0.278SS..Hα-helixtrans-62.1-36.1172.5174.90000111L344 S345 C350 V351L344-V347 HydrophobicContact CD2-CG2 4.3Å; L344-V347 VanDerWaalsContact O-CB 3.3Å; L344-V347 WeakPolarHBondContact O-CB 3.33Å; L344-V347 VanDerWaalsContact O-CG2 3.28Å; L344-V347 WeakPolarHBondContact O-CG2 3.41Å; L344-V347 PolarHBondContact O-N 2.96Å; S345-V347 PolarHBondContact O-N 3.41Å; V347-C350 WeakPolarHBondContact O-CB 3.14Å; V347-C350 PolarHBondContact O-N 3.43Å; V347-V351 HydrophobicContact CG1-CG2 4.03Å; V347-V351 WeakPolarHBondContact O-CG2 3.37Å; V347-V351 PolarHBondContact O-N 3.26Å
348V96.6Very high92.7Very high91 Ų9145.3 Ų45.355%0.55227%0.272SS*.Hα-helixtrans-61.5-56.9-179.6177.50000112.2Y306 S345 G346 C350 V351 H352Y306-V348 HydrophobicContact CE1-CG1 4.24Å; S345-V348 PolarHBondContact O-N 2.97Å; S345-V348 VanDerWaalsContact O-N 3.16Å; G346-V348 VanDerWaalsContact C-N 3.26Å; G346-V348 PolarHBondContact O-N 3.47Å; V348-C350 PolarHBondContact O-N 3.05Å; V348-V351 PolarHBondContact O-N 3.34Å; V348-H352 PolarHBondContact O-N 3.42Å
349P95.4Very high90.9Very high6 Ų651 Ų514%0.03930%0.302CS..Hα-helixtrans-62-29.4173.718.4-27.5000113W291 F296 Y306 S345 G346 H352 Y353W291-P349 HydrophobicContact CH2-CB 3.74Å; W291-P349 HydrophobicContact CH2-CG 3.69Å; W291-P349 HydrophobicContact CZ3-CB 3.9Å; W291-P349 HydrophobicContact CZ3-CG 3.62Å; F296-P349 HydrophobicContact CE2-CB 3.93Å; F296-P349 HydrophobicContact CZ-CB 4.34Å; F296-P349 WeakPolarHBondContact CZ-O 3.35Å; Y306-P349 HydrophobicContact CD1-CB 3.86Å; Y306-P349 HydrophobicContact CD1-CG 4.15Å; Y306-P349 HydrophobicContact CD2-CB 3.85Å; Y306-P349 HydrophobicContact CE1-CB 3.94Å; Y306-P349 HydrophobicContact CE1-CG 4.38Å; Y306-P349 HydrophobicContact CE2-CB 3.92Å; Y306-P349 HydrophobicContact CG-CB 3.83Å; Y306-P349 HydrophobicContact CG-CG 4.44Å; S345-P349 VanDerWaalsContact O-CD 3.26Å; S345-P349 WeakPolarHBondContact O-CD 3.47Å; G346-P349 WeakPolarHBondContact O-CD 3.3Å; G346-P349 WeakPolarHBondContact O-CG 3.17Å; P349-H352 PolarHBondContact O-N 2.78Å; P349-Y353 VanDerWaalsContact O-CB 3.27Å; P349-Y353 WeakPolarHBondContact O-CB 3.41Å; P349-Y353 PolarHBondContact O-N 3.04Å
350C93.5Very high89.1Confident19 Ų1953.2 Ų53.213%0.12831%0.312CS..Hα-helixtrans-67.2-48.4178.3-1750000111.1W291 G346 V347 V348 H352 Y353 I354W291-C350 HydrophobicContact CH2-CB 3.91Å; W291-C350 HydrophobicContact CZ2-CB 3.79Å; G346-C350 VanDerWaalsContact O-CB 3.3Å; G346-C350 WeakPolarHBondContact O-CB 3.48Å; G346-C350 PolarHBondContact O-N 3.48Å; G346-C350 VanDerWaalsContact O-N 3.13Å; V347-C350 WeakPolarHBondContact O-CB 3.14Å; V347-C350 PolarHBondContact O-N 3.43Å; V348-C350 PolarHBondContact O-N 3.05Å; C350-H352 VanDerWaalsContact C-N 3.33Å; C350-H352 PolarHBondContact O-N 3.26Å; C350-Y353 PolarHBondContact O-N 3.41Å; C350-I354 VanDerWaalsContact O-CG1 3.31Å; C350-I354 WeakPolarHBondContact O-CG1 3.43Å; C350-I354 PolarHBondContact O-N 3.27Å
351V93.2Very high87.5Confident73 Ų7361 Ų6144%0.44235%0.346SS..Hα-helixtrans-60.8-44.1174.8171.60000110.4V347 V348 Y353 I354 L355V347-V351 HydrophobicContact CG1-CG2 4.03Å; V347-V351 WeakPolarHBondContact O-CG2 3.37Å; V347-V351 PolarHBondContact O-N 3.26Å; V348-V351 PolarHBondContact O-N 3.34Å; V351-Y353 PolarHBondContact O-N 3.32Å; V351-I354 PolarHBondContact O-N 3.36Å; V351-L355 HydrophobicContact CG1-CD1 3.92Å; V351-L355 HydrophobicContact CG1-CG 4.32Å; V351-L355 VanDerWaalsContact O-CG 3.27Å; V351-L355 WeakPolarHBondContact O-CG 3.33Å; V351-L355 PolarHBondContact O-N 3.42Å
352H94.1Very high86Confident49 Ų4961.4 Ų61.423%0.22734%0.336CS..Hα-helixtrans-61.6-43177.2-171.8-170.7000112.3F296 F302 Y306 V348 P349 C350 L355 I356F296-H352 HydrophobicContact CZ-CB 4.28Å; F302-H352 AromaticContact CD1-CE1 3.62Å; F302-H352 AromaticContact CD2-CE1 3.87Å; F302-H352 AromaticContact CE1-CE1 3.65Å; F302-H352 AromaticContact CE2-CE1 3.91Å; F302-H352 AromaticContact CE2-NE2 3.96Å; F302-H352 AromaticContact CG-CE1 3.75Å; F302-H352 AromaticContact CZ-CE1 3.8Å; F302-H352 AromaticContact CZ-NE2 3.94Å; Y306-H352 HydrophobicContact CE2-CB 4.48Å; Y306-H352 AromaticContact CE2-ND1 3.46Å; Y306-H352 WeakPolarHBondContact CE2-ND1 3.21Å; Y306-H352 AromaticContact CZ-ND1 3.53Å; Y306-H352 WeakPolarHBondContact OH-CB 3.44Å; Y306-H352 PolarHBondContact OH-ND1 3.01Å; V348-H352 PolarHBondContact O-N 3.42Å; P349-H352 PolarHBondContact O-N 2.78Å; C350-H352 VanDerWaalsContact C-N 3.33Å; C350-H352 PolarHBondContact O-N 3.26Å; H352-L355 PolarHBondContact O-N 3.5Å; H352-I356 WeakPolarHBondContact CD2-CD1 3.48Å; H352-I356 WeakPolarHBondContact NE2-CD1 3.3Å; H352-I356 WeakPolarHBondContact O-CG1 3.36Å; H352-I356 PolarHBondContact O-N 3.04Å; H352-I356 VanDerWaalsContact O-N 3.09Å
353Y91Very high84.6Confident23 Ų2361.8 Ų61.89%0.0934%0.339CS..Hα-helixtrans-60.7-46.2175.4172.1-107.4000111.9S295 P349 C350 V351 L355 I356 E357S295-Y353 WeakPolarHBondContact O-CD2 3.32Å; S295-Y353 WeakPolarHBondContact O-CE2 3.5Å; P349-Y353 VanDerWaalsContact O-CB 3.27Å; P349-Y353 WeakPolarHBondContact O-CB 3.41Å; P349-Y353 PolarHBondContact O-N 3.04Å; C350-Y353 PolarHBondContact O-N 3.41Å; V351-Y353 PolarHBondContact O-N 3.32Å; Y353-L355 PolarHBondContact O-N 2.69Å; Y353-I356 PolarHBondContact O-N 3.44Å; Y353-E357 HydrophobicContact CD2-CG 3.81Å; Y353-E357 HydrophobicContact CE2-CB 4.48Å; Y353-E357 HydrophobicContact CE2-CG 3.39Å; Y353-E357 PolarHBondContact O-N 3.15Å
354I90.3Very high83.7Confident50 Ų5062.2 Ų62.226%0.25633%0.329SS..Hα-helixtrans-58.8-48.7176-67.7165.1000109.8C350 V351 I356 E357 D358 L368C350-I354 VanDerWaalsContact O-CG1 3.31Å; C350-I354 WeakPolarHBondContact O-CG1 3.43Å; C350-I354 PolarHBondContact O-N 3.27Å; V351-I354 PolarHBondContact O-N 3.36Å; I354-I356 VanDerWaalsContact C-N 3.28Å; I354-I356 PolarHBondContact O-N 2.87Å; I354-E357 PolarHBondContact O-N 3.43Å; I354-D358 HydrophobicContact CG2-CB 4.36Å; I354-D358 WeakPolarHBondContact O-CA 3.21Å; I354-D358 WeakPolarHBondContact O-CB 3.45Å; I354-D358 PolarHBondContact O-N 3.23Å; I354-L368 HydrophobicContact CD1-CD1 4.34Å; I354-L368 HydrophobicContact CD1-CD2 4.15Å
355L90Very high82.9Confident111 Ų11166.5 Ų66.558%0.58134%0.341SS*.Hα-helixtrans-62.2-32.3-178.6-69172.5000113.7V351 H352 Y353 L359V351-L355 HydrophobicContact CG1-CD1 3.92Å; V351-L355 HydrophobicContact CG1-CG 4.32Å; V351-L355 VanDerWaalsContact O-CG 3.27Å; V351-L355 WeakPolarHBondContact O-CG 3.33Å; V351-L355 PolarHBondContact O-N 3.42Å; H352-L355 PolarHBondContact O-N 3.5Å; Y353-L355 PolarHBondContact O-N 2.69Å; L355-L359 WeakPolarHBondContact O-CG 3.37Å
356I87.7Confident82.1Confident32 Ų3267.5 Ų67.516%0.16435%0.348CS..Hα-helixtrans-78.6-43.6177.9-66.7165000111.5F296 Y299 F302 H352 Y353 I354F296-I356 HydrophobicContact CE1-CD1 4.16Å; Y299-I356 HydrophobicContact CD2-CG2 4.47Å; Y299-I356 HydrophobicContact CE1-CG2 4.09Å; Y299-I356 HydrophobicContact CE2-CG2 3.69Å; Y299-I356 VanDerWaalsContact CZ-CG2 3.46Å; Y299-I356 WeakPolarHBondContact OH-CG2 3.05Å; F302-I356 HydrophobicContact CD2-CD1 3.79Å; F302-I356 HydrophobicContact CE2-CD1 3.61Å; H352-I356 WeakPolarHBondContact CD2-CD1 3.48Å; H352-I356 WeakPolarHBondContact NE2-CD1 3.3Å; H352-I356 WeakPolarHBondContact O-CG1 3.36Å; H352-I356 PolarHBondContact O-N 3.04Å; H352-I356 VanDerWaalsContact O-N 3.09Å; Y353-I356 PolarHBondContact O-N 3.44Å; I354-I356 VanDerWaalsContact C-N 3.28Å; I354-I356 PolarHBondContact O-N 2.87Å
357E82.3Confident81.8Confident6 Ų666.8 Ų66.83%0.02834%0.341CS..Hα-helixtrans-87-22.5-174.6-66.2-73158.900113.8Y353 I354 L359 Q360 E361 R362 V363Y353-E357 HydrophobicContact CD2-CG 3.81Å; Y353-E357 HydrophobicContact CE2-CB 4.48Å; Y353-E357 HydrophobicContact CE2-CG 3.39Å; Y353-E357 PolarHBondContact O-N 3.15Å; I354-E357 PolarHBondContact O-N 3.43Å; E357-L359 PolarHBondContact O-N 3.44Å; E357-Q360 CarbonylContact O-C 3.32Å; E357-Q360 WeakPolarHBondContact O-CA 3.42Å; E357-Q360 PolarHBondContact O-N 3.22Å; E357-E361 PolarHBondContact O-N 3.49Å; E357-E361 VanDerWaalsContact O-N 3.11Å; E357-R362 HydrophobicContact CB-CB 4.18Å; E357-R362 PolarHBondContact O-N 3.03Å; E357-R362 WeakPolarHBondContact OE2-CB 3.2Å; E357-R362 VanDerWaalsContact OE2-CD 3.24Å; E357-R362 WeakPolarHBondContact OE2-CD 3.35Å; E357-V363 HydrophobicContact CB-CG2 3.81Å
358D67.7Low81.5Confident95 Ų9565 Ų6551%0.50833%0.328SS..Hα-helixtrans-68.7-26.5175-16853.4000111.3I354 Q360I354-D358 HydrophobicContact CG2-CB 4.36Å; I354-D358 WeakPolarHBondContact O-CA 3.21Å; I354-D358 WeakPolarHBondContact O-CB 3.45Å; I354-D358 PolarHBondContact O-N 3.23Å; D358-Q360 PolarHBondContact O-N 2.88Å; D358-Q360 VanDerWaalsContact O-N 3.08Å
359L58.9Low81.3Confident155 Ų15562.4 Ų62.481%0.81232%0.32SS*.THydrogen-bonded Turntrans-63.3-9.9165-64.3173.9000112.9L355 E357L355-L359 WeakPolarHBondContact O-CG 3.37Å; E357-L359 PolarHBondContact O-N 3.44Å
360Q59.9Low81.3Confident71 Ų7165.8 Ų65.833%0.33233%0.332SS..THydrogen-bonded Turntrans-129.98.5-175.1-61.9-169.6-19.200115E357 D358 R362E357-Q360 CarbonylContact O-C 3.32Å; E357-Q360 WeakPolarHBondContact O-CA 3.42Å; E357-Q360 PolarHBondContact O-N 3.22Å; D358-Q360 PolarHBondContact O-N 2.88Å; D358-Q360 VanDerWaalsContact O-N 3.08Å; Q360-R362 VanDerWaalsContact C-N 3.29Å; Q360-R362 HydrophobicContact CB-CG 4.16Å; Q360-R362 WeakPolarHBondContact O-CG 3.32Å; Q360-R362 PolarHBondContact O-N 2.89Å
361E63.5Low81.3Confident190 Ų19066 Ų6689%0.88833%0.332SS*.THydrogen-bonded Turntrans57.227.4-175.7-62.2-170.5172.400115.8E357E357-E361 PolarHBondContact O-N 3.49Å; E357-E361 VanDerWaalsContact O-N 3.11Å
362R64.8Low81.4Confident63 Ų6367.6 Ų67.624%0.23834%0.337CS..  trans-103.9-3.7-165.1-83.2170.8-171.6-165.80.2116.7E357 Q360 H364 H429 K433E357-R362 HydrophobicContact CB-CB 4.18Å; E357-R362 PolarHBondContact O-N 3.03Å; E357-R362 WeakPolarHBondContact OE2-CB 3.2Å; E357-R362 VanDerWaalsContact OE2-CD 3.24Å; E357-R362 WeakPolarHBondContact OE2-CD 3.35Å; Q360-R362 VanDerWaalsContact C-N 3.29Å; Q360-R362 HydrophobicContact CB-CG 4.16Å; Q360-R362 WeakPolarHBondContact O-CG 3.32Å; Q360-R362 PolarHBondContact O-N 2.89Å; R362-H364 PolarHBondContact O-N 3.02Å; R362-H429 PolarHBondContact O-NE2 3Å; R362-K433 VanDerWaalsContact CB-NZ 3.33Å; R362-K433 VanDerWaalsContact CG-NZ 3.33Å; R362-K433 PolarHBondContact O-NZ 3.26Å
363V68.2Low81.5Confident15 Ų1568.9 Ų68.99%0.09135%0.345CS..  trans-67.8126-176.3179.80000111E357 Y365E357-V363 HydrophobicContact CB-CG2 3.81Å; V363-Y365 PolarHBondContact O-N 2.79Å
364H77.4Confident81.8Confident50 Ų5069.4 Ų69.423%0.23135%0.349CS..  trans-84.893.1175.3-161.6-106.2000110.4R362 S366 A367 L368 E425 H429R362-H364 PolarHBondContact O-N 3.02Å; H364-S366 PolarHBondContact O-N 3.45Å; H364-S366 VanDerWaalsContact O-N 3.14Å; H364-A367 HydrophobicContact CB-CB 4.35Å; H364-A367 PolarHBondContact O-N 3.13Å; H364-L368 PolarHBondContact O-N 3.41Å; H364-E425 IonicContact CE1-OE2 3.3Å; H364-E425 PolarHBondContact CE1-OE2 3.36Å; H364-E425 VanDerWaalsContact CE1-OE2 3.3Å; H364-H429 HydrophobicContact CB-CB 4.4Å; H364-H429 AromaticContact CD2-CE1 3.93Å; H364-H429 AromaticContact CD2-CG 3.77Å; H364-H429 AromaticContact CD2-ND1 3.6Å
365Y79.7Confident82Confident167 Ų16768.5 Ų68.566%0.65535%0.348SS*.Hα-helixtrans-56.1-31.3-175.4-69.9-75.4000114.2V363 L368 G369V363-Y365 PolarHBondContact O-N 2.79Å; Y365-L368 PolarHBondContact O-N 3.31Å; Y365-G369 PolarHBondContact O-N 3.12Å
366S81.1Confident82.4Confident53 Ų5365.7 Ų65.737%0.37134%0.341SS..Hα-helixtrans-61.6-45.6175.1179.30000111.6H364 L368 G369 W370H364-S366 PolarHBondContact O-N 3.45Å; H364-S366 VanDerWaalsContact O-N 3.14Å; S366-L368 VanDerWaalsContact C-N 3.31Å; S366-L368 PolarHBondContact O-N 3.46Å; S366-G369 PolarHBondContact O-N 3.33Å; S366-G369 VanDerWaalsContact O-N 3.16Å; S366-W370 PolarHBondContact O-N 3.13Å
367A86.8Confident82.9Confident5 Ų565.5 Ų65.54%0.04134%0.341CS..Hα-helixtrans-63.9-38.1177.900000111.5H364 W370 L371 E425 I426H364-A367 HydrophobicContact CB-CB 4.35Å; H364-A367 PolarHBondContact O-N 3.13Å; A367-W370 PolarHBondContact O-N 2.76Å; A367-L371 WeakPolarHBondContact O-CG 3.48Å; A367-L371 PolarHBondContact O-N 2.93Å; A367-L371 VanDerWaalsContact O-N 3.08Å; A367-E425 HydrophobicContact CB-CB 4.18Å; A367-I426 HydrophobicContact CB-CB 4.16Å
368L89.4Confident83.5Confident40 Ų4067.9 Ų67.921%0.20935%0.349CS..Hα-helixtrans-64.5-40.7174.2-175.862000112I354 H364 Y365 S366 W370 L371 I372I354-L368 HydrophobicContact CD1-CD1 4.34Å; I354-L368 HydrophobicContact CD1-CD2 4.15Å; H364-L368 PolarHBondContact O-N 3.41Å; Y365-L368 PolarHBondContact O-N 3.31Å; S366-L368 VanDerWaalsContact C-N 3.31Å; S366-L368 PolarHBondContact O-N 3.46Å; L368-W370 VanDerWaalsContact C-N 3.33Å; L368-W370 PolarHBondContact O-N 3.15Å; L368-L371 WeakPolarHBondContact O-CB 3.24Å; L368-L371 PolarHBondContact O-N 3.46Å; L368-L371 VanDerWaalsContact O-N 3.17Å; L368-I372 HydrophobicContact CG-CD1 4.23Å; L368-I372 WeakPolarHBondContact O-CG1 3.49Å; L368-I372 PolarHBondContact O-N 2.86Å
369G92.8Very high84.9Confident38 Ų3866.7 Ų66.739%0.39234%0.343SS..Hα-helixtrans-58.6-43.3174.200000112.5Y365 S366 L371 I372 L373Y365-G369 PolarHBondContact O-N 3.12Å; S366-G369 PolarHBondContact O-N 3.33Å; S366-G369 VanDerWaalsContact O-N 3.16Å; G369-L371 PolarHBondContact O-N 3.16Å; G369-I372 PolarHBondContact O-N 2.95Å; G369-L373 PolarHBondContact O-N 3.18Å
370W94.9Very high86.8Confident77 Ų7761.3 Ų61.329%0.29232%0.318SS..Hα-helixtrans-62.7-39.4173.9-69.3116.7000112.7S366 A367 L368 L373 M374 V418 N421 A422S366-W370 PolarHBondContact O-N 3.13Å; A367-W370 PolarHBondContact O-N 2.76Å; L368-W370 VanDerWaalsContact C-N 3.33Å; L368-W370 PolarHBondContact O-N 3.15Å; W370-L373 HydrophobicContact CE3-CD2 4.1Å; W370-L373 HydrophobicContact CZ3-CD2 4.04Å; W370-L373 PolarHBondContact O-N 3.14Å; W370-M374 WeakPolarHBondContact O-CB 3.33Å; W370-M374 PolarHBondContact O-N 2.83Å; W370-V418 HydrophobicContact CE3-CG1 3.93Å; W370-V418 HydrophobicContact CZ3-CG2 4.41Å; W370-V418 VanDerWaalsContact O-CG1 3.25Å; W370-V418 WeakPolarHBondContact O-CG1 3.35Å; W370-N421 HydrophobicContact CD2-CB 4.04Å; W370-N421 HydrophobicContact CE3-CB 4.33Å; W370-N421 HydrophobicContact CG-CB 4.41Å; W370-N421 HydrophobicContact CZ2-CB 4.37Å; W370-A422 HydrophobicContact CB-CB 3.61Å
371L93.4Very high88.6Confident23 Ų2358 Ų5812%0.1230%0.302CS..Hα-helixtrans-65-40.1175.5-68.4169.1000112.4W291 A367 L368 G369 M374 A375 A422W291-L371 HydrophobicContact CZ2-CD1 4.38Å; A367-L371 WeakPolarHBondContact O-CG 3.48Å; A367-L371 PolarHBondContact O-N 2.93Å; A367-L371 VanDerWaalsContact O-N 3.08Å; L368-L371 WeakPolarHBondContact O-CB 3.24Å; L368-L371 PolarHBondContact O-N 3.46Å; L368-L371 VanDerWaalsContact O-N 3.17Å; G369-L371 PolarHBondContact O-N 3.16Å; L371-M374 HydrophobicContact CD2-CE 3.89Å; L371-M374 PolarHBondContact O-N 2.88Å; L371-A375 WeakPolarHBondContact O-CB 3.5Å; L371-A375 PolarHBondContact O-N 2.83Å; L371-A422 HydrophobicContact CD2-CB 4.06Å; L371-A422 HydrophobicContact CG-CB 4.18Å
372I94.9Very high90.1Very high106 Ų10649.3 Ų49.354%0.54426%0.263SS..Hα-helixtrans-64.3-44.1175.9-67.9167.1000110.3L368 G369 M374 A375 A376L368-I372 HydrophobicContact CG-CD1 4.23Å; L368-I372 WeakPolarHBondContact O-CG1 3.49Å; L368-I372 PolarHBondContact O-N 2.86Å; G369-I372 PolarHBondContact O-N 2.95Å; I372-M374 VanDerWaalsContact C-N 3.34Å; I372-M374 PolarHBondContact O-N 2.87Å; I372-A375 PolarHBondContact O-N 2.67Å; I372-A376 WeakPolarHBondContact O-CB 3.45Å; I372-A376 PolarHBondContact O-N 3.18Å
373L96.8Very high91.7Very high77 Ų7749.6 Ų49.640%0.40327%0.272SS..Hα-helixtrans-62-42.7176.2-18059.4000111.5G369 W370 A376 L377 V418G369-L373 PolarHBondContact O-N 3.18Å; W370-L373 HydrophobicContact CE3-CD2 4.1Å; W370-L373 HydrophobicContact CZ3-CD2 4.04Å; W370-L373 PolarHBondContact O-N 3.14Å; L373-A376 PolarHBondContact O-N 3.35Å; L373-L377 HydrophobicContact CD1-CG 4.49Å; L373-L377 HydrophobicContact CG-CD1 4.31Å; L373-L377 WeakPolarHBondContact O-CG 3.27Å; L373-L377 PolarHBondContact O-N 3.1Å; L373-V418 HydrophobicContact CB-CG1 4.02Å; L373-V418 HydrophobicContact CD2-CG1 4.05Å; L373-V418 HydrophobicContact CD2-CG2 4.03Å; L373-V418 HydrophobicContact CG-CG1 3.93Å; L373-V418 HydrophobicContact CG-CG2 4.36Å
374M96.8Very high93.1Very high34 Ų3450.8 Ų50.817%0.16728%0.278CS..Hα-helixtrans-59.2-47.1174.9172.1-81.6-69.500111.2W370 L371 I372 A376 L377 Y378 A415 V418 H419W370-M374 WeakPolarHBondContact O-CB 3.33Å; W370-M374 PolarHBondContact O-N 2.83Å; L371-M374 HydrophobicContact CD2-CE 3.89Å; L371-M374 PolarHBondContact O-N 2.88Å; I372-M374 VanDerWaalsContact C-N 3.34Å; I372-M374 PolarHBondContact O-N 2.87Å; M374-A376 PolarHBondContact O-N 3.26Å; M374-L377 PolarHBondContact O-N 2.79Å; M374-Y378 HydrophobicContact CG-CD2 3.88Å; M374-Y378 HydrophobicContact CG-CE2 3.69Å; M374-Y378 WeakPolarHBondContact O-CD2 3.29Å; M374-Y378 PolarHBondContact O-N 2.84Å; M374-Y378 HydrophobicContact SD-CD2 3.33Å; M374-Y378 WeakPolarHBondContact SD-CD2 3.46Å; M374-Y378 HydrophobicContact SD-CE2 3.48Å; M374-Y378 WeakPolarHBondContact SD-CE2 3.35Å; M374-A415 HydrophobicContact CG-CB 4.44Å; M374-V418 HydrophobicContact CB-CG1 3.77Å; M374-H419 HydrophobicContact CG-CB 4.04Å
375A96.1Very high94Very high30 Ų3049.2 Ų49.225%0.24827%0.27CS..Hα-helixtrans-62.4-43177.500000111.6L371 I372 L377 Y378 I379L371-A375 WeakPolarHBondContact O-CB 3.5Å; L371-A375 PolarHBondContact O-N 2.83Å; I372-A375 PolarHBondContact O-N 2.67Å; A375-L377 VanDerWaalsContact C-N 3.34Å; A375-L377 PolarHBondContact O-N 2.74Å; A375-Y378 PolarHBondContact O-N 2.95Å; A375-I379 WeakPolarHBondContact O-CB 3.36Å; A375-I379 WeakPolarHBondContact O-CD1 3.4Å; A375-I379 WeakPolarHBondContact O-CG1 3.38Å; A375-I379 PolarHBondContact O-N 3.05Å
376A97.8Very high94.8Very high52 Ų5242.3 Ų42.343%0.4325%0.247SC..Hα-helixtrans-59.7-43.9176.400000111.7I372 L373 M374 S380I372-A376 WeakPolarHBondContact O-CB 3.45Å; I372-A376 PolarHBondContact O-N 3.18Å; L373-A376 PolarHBondContact O-N 3.35Å; M374-A376 PolarHBondContact O-N 3.26Å; A376-S380 VanDerWaalsContact O-CB 3.25Å; A376-S380 WeakPolarHBondContact O-CB 3.48Å; A376-S380 PolarHBondContact O-N 3.12Å; A376-S380 PolarHBondContact O-OG 2.96Å
377L98Very high95.5Very high29 Ų2943.2 Ų43.215%0.15225%0.247CC..Hα-helixtrans-63.1-49.6175.5-70.8168.7000111.6L373 M374 A375 I379 S380 G381 F411 L414 A415 V418L373-L377 HydrophobicContact CD1-CG 4.49Å; L373-L377 HydrophobicContact CG-CD1 4.31Å; L373-L377 WeakPolarHBondContact O-CG 3.27Å; L373-L377 PolarHBondContact O-N 3.1Å; M374-L377 PolarHBondContact O-N 2.79Å; A375-L377 VanDerWaalsContact C-N 3.34Å; A375-L377 PolarHBondContact O-N 2.74Å; L377-I379 PolarHBondContact O-N 3.18Å; L377-S380 PolarHBondContact O-OG 3.38Å; L377-S380 VanDerWaalsContact O-OG 3.05Å; L377-G381 PolarHBondContact O-N 3.02Å; L377-F411 HydrophobicContact CD2-CD1 4.21Å; L377-F411 HydrophobicContact CD2-CE1 4.35Å; L377-F411 VanDerWaalsContact O-CD1 3.31Å; L377-F411 WeakPolarHBondContact O-CD1 3.05Å; L377-L414 HydrophobicContact CD1-CB 4.23Å; L377-A415 HydrophobicContact CB-CB 3.86Å; L377-A415 HydrophobicContact CD1-CB 4.32Å; L377-V418 HydrophobicContact CD1-CB 4.38Å; L377-V418 HydrophobicContact CD1-CG2 3.87Å
378Y95.8Very high96Very high55 Ų5544.9 Ų44.922%0.21625%0.253CS..Hα-helixtrans-63.8-43.7179.5-79.1-54000113.2M374 A375 A382 V412 A415M374-Y378 HydrophobicContact CG-CD2 3.88Å; M374-Y378 HydrophobicContact CG-CE2 3.69Å; M374-Y378 WeakPolarHBondContact O-CD2 3.29Å; M374-Y378 PolarHBondContact O-N 2.84Å; M374-Y378 HydrophobicContact SD-CD2 3.33Å; M374-Y378 WeakPolarHBondContact SD-CD2 3.46Å; M374-Y378 HydrophobicContact SD-CE2 3.48Å; M374-Y378 WeakPolarHBondContact SD-CE2 3.35Å; A375-Y378 PolarHBondContact O-N 2.95Å; Y378-A382 WeakPolarHBondContact O-CB 3.4Å; Y378-A382 PolarHBondContact O-N 3.37Å; Y378-V412 HydrophobicContact CE1-CB 4.49Å; Y378-V412 HydrophobicContact CE1-CG1 4.46Å; Y378-V412 HydrophobicContact CE1-CG2 4.29Å; Y378-A415 HydrophobicContact CD1-CB 3.9Å; Y378-A415 HydrophobicContact CD2-CB 3.86Å; Y378-A415 HydrophobicContact CE1-CB 3.65Å; Y378-A415 HydrophobicContact CE2-CB 3.62Å; Y378-A415 HydrophobicContact CG-CB 3.99Å
379I96.6Very high96.4Very high71 Ų7146 Ų4636%0.36426%0.258SS..Hα-helixtrans-65.8-45.8-178.7-65.4166.2000110.5L344 A375 L377 A382 T383L344-I379 HydrophobicContact CD2-CD1 4.02Å; A375-I379 WeakPolarHBondContact O-CB 3.36Å; A375-I379 WeakPolarHBondContact O-CD1 3.4Å; A375-I379 WeakPolarHBondContact O-CG1 3.38Å; A375-I379 PolarHBondContact O-N 3.05Å; L377-I379 PolarHBondContact O-N 3.18Å; I379-A382 PolarHBondContact O-N 3.06Å; I379-T383 VanDerWaalsContact O-CB 3.25Å; I379-T383 WeakPolarHBondContact O-CB 3.24Å; I379-T383 PolarHBondContact O-N 3Å; I379-T383 PolarHBondContact O-OG1 3.47Å
380S97.8Very high96.7Very high42 Ų4245.3 Ų45.329%0.29425%0.247SC..Hα-helixtrans-64.5-44.8178.654.60000111.4A376 L377 T383 I384 F411A376-S380 VanDerWaalsContact O-CB 3.25Å; A376-S380 WeakPolarHBondContact O-CB 3.48Å; A376-S380 PolarHBondContact O-N 3.12Å; A376-S380 PolarHBondContact O-OG 2.96Å; L377-S380 PolarHBondContact O-OG 3.38Å; L377-S380 VanDerWaalsContact O-OG 3.05Å; S380-T383 PolarHBondContact O-N 3.45Å; S380-I384 WeakPolarHBondContact O-CB 3.35Å; S380-I384 VanDerWaalsContact O-CG1 3.23Å; S380-I384 WeakPolarHBondContact O-CG1 3.31Å; S380-I384 PolarHBondContact O-N 2.94Å; S380-F411 WeakPolarHBondContact OG-CD1 3.36Å; S380-F411 WeakPolarHBondContact OG-CE1 3.32Å
381G97.6Very high96.8Very high0 Ų041.7 Ų41.70%023%0.233CC..Hα-helixtrans-59.5-47.9175.100000112.5L377 T383 I384 Y385L377-G381 PolarHBondContact O-N 3.02Å; G381-T383 VanDerWaalsContact C-N 3.32Å; G381-T383 PolarHBondContact O-N 3.4Å; G381-I384 PolarHBondContact O-N 2.84Å; G381-Y385 WeakPolarHBondContact O-CB 3.18Å; G381-Y385 PolarHBondContact O-N 3.32Å
382A96.6Very high97Very high9 Ų945.2 Ų45.27%0.07425%0.245CC..Hα-helixtrans-64.2-36.9178.100000112.3S340 Y378 I379 Y385 A386S340-A382 WeakPolarHBondContact OG-CB 3.44Å; Y378-A382 WeakPolarHBondContact O-CB 3.4Å; Y378-A382 PolarHBondContact O-N 3.37Å; I379-A382 PolarHBondContact O-N 3.06Å; A382-Y385 PolarHBondContact O-N 3.46Å; A382-A386 VanDerWaalsContact O-CB 3.31Å; A382-A386 WeakPolarHBondContact O-CB 3.44Å; A382-A386 PolarHBondContact O-N 3.22Å
383T97.4Very high97.1Very high68 Ų6845.3 Ų45.342%0.41725%0.246SC..Hα-helixtrans-65.9-46.1175.7-59.90000110.9I379 S380 G381 Y385 A386 L387I379-T383 VanDerWaalsContact O-CB 3.25Å; I379-T383 WeakPolarHBondContact O-CB 3.24Å; I379-T383 PolarHBondContact O-N 3Å; I379-T383 PolarHBondContact O-OG1 3.47Å; S380-T383 PolarHBondContact O-N 3.45Å; G381-T383 VanDerWaalsContact C-N 3.32Å; G381-T383 PolarHBondContact O-N 3.4Å; T383-Y385 VanDerWaalsContact C-N 3.34Å; T383-Y385 PolarHBondContact O-N 3.38Å; T383-A386 PolarHBondContact O-N 3.27Å; T383-L387 HydrophobicContact CG2-CD1 3.76Å; T383-L387 HydrophobicContact CG2-CG 4.31Å; T383-L387 VanDerWaalsContact O-CB 3.3Å; T383-L387 WeakPolarHBondContact O-CB 3.19Å; T383-L387 VanDerWaalsContact O-CG 3.3Å; T383-L387 WeakPolarHBondContact O-CG 3.38Å; T383-L387 PolarHBondContact O-N 2.84Å
384I97.5Very high97.1Very high41 Ų4148.4 Ų48.421%0.2125%0.253CS..Hα-helixtrans-58.6-46.9175.8-72.1168.8000110.4S380 G381 L387 R388 I389 S404 I407 F411S380-I384 WeakPolarHBondContact O-CB 3.35Å; S380-I384 VanDerWaalsContact O-CG1 3.23Å; S380-I384 WeakPolarHBondContact O-CG1 3.31Å; S380-I384 PolarHBondContact O-N 2.94Å; G381-I384 PolarHBondContact O-N 2.84Å; I384-L387 CarbonylContact O-C 3.59Å; I384-L387 PolarHBondContact O-N 3.49Å; I384-R388 PolarHBondContact O-N 3.43Å; I384-I389 VanDerWaalsContact CG2-O 3.26Å; I384-I389 WeakPolarHBondContact CG2-O 3.46Å; I384-I389 PolarHBondContact O-N 2.84Å; I384-S404 WeakPolarHBondContact O-CB 3.27Å; I384-I407 HydrophobicContact CD1-CG2 3.94Å; I384-I407 HydrophobicContact CG2-CB 4.14Å; I384-I407 HydrophobicContact CG2-CD1 4.3Å; I384-I407 HydrophobicContact CG2-CG2 4.1Å; I384-F411 HydrophobicContact CD1-CE1 4.48Å
385Y96.5Very high97.1Very high17 Ų1749.8 Ų49.87%0.06727%0.265CS..Hα-helixtrans-59.2-50.3175.2169.3-96.5000112.8R332 R335 A336 G381 A382 T383 L387 R388 H405 F408R332-Y385 HydrophobicContact CG-CD1 4.11Å; R332-Y385 HydrophobicContact CG-CE1 3.4Å; R332-Y385 HydrophobicContact CG-CE2 4.44Å; R335-Y385 PolarHBondContact NH2-OH 3.47Å; A336-Y385 HydrophobicContact CB-CD1 4.06Å; A336-Y385 HydrophobicContact CB-CE1 4.38Å; G381-Y385 WeakPolarHBondContact O-CB 3.18Å; G381-Y385 PolarHBondContact O-N 3.32Å; A382-Y385 PolarHBondContact O-N 3.46Å; T383-Y385 VanDerWaalsContact C-N 3.34Å; T383-Y385 PolarHBondContact O-N 3.38Å; Y385-L387 VanDerWaalsContact C-N 3.32Å; Y385-L387 PolarHBondContact O-N 3.48Å; Y385-R388 PolarHBondContact O-N 2.83Å; Y385-H405 AromaticContact CE2-CE1 3.68Å; Y385-H405 AromaticContact CE2-ND1 3.66Å; Y385-F408 HydrophobicContact CD2-CD1 4.28Å; Y385-F408 HydrophobicContact CG-CG 4.48Å
386A96.4Very high97.1Very high21 Ų2149.7 Ų49.717%0.17427%0.266CS..Hα-helixtrans-64-39.9-178.500000111.8A333 A336 A382 T383A333-A386 HydrophobicContact CB-CB 4.47Å; A336-A386 HydrophobicContact CB-CB 3.89Å; A382-A386 VanDerWaalsContact O-CB 3.31Å; A382-A386 WeakPolarHBondContact O-CB 3.44Å; A382-A386 PolarHBondContact O-N 3.22Å; T383-A386 PolarHBondContact O-N 3.27Å
387L96.8Very high97.1Very high73 Ų7355.3 Ų55.338%0.38228%0.281SS..Hα-helixtrans-85.1-6.1180-60.9-178.3000113.5T383 I384 Y385 I389 R392T383-L387 HydrophobicContact CG2-CD1 3.76Å; T383-L387 HydrophobicContact CG2-CG 4.31Å; T383-L387 VanDerWaalsContact O-CB 3.3Å; T383-L387 WeakPolarHBondContact O-CB 3.19Å; T383-L387 VanDerWaalsContact O-CG 3.3Å; T383-L387 WeakPolarHBondContact O-CG 3.38Å; T383-L387 PolarHBondContact O-N 2.84Å; I384-L387 CarbonylContact O-C 3.59Å; I384-L387 PolarHBondContact O-N 3.49Å; Y385-L387 VanDerWaalsContact C-N 3.32Å; Y385-L387 PolarHBondContact O-N 3.48Å; L387-I389 HydrophobicContact CB-CD1 3.77Å; L387-I389 HydrophobicContact CB-CG1 3.89Å; L387-I389 HydrophobicContact CD1-CD1 4.05Å; L387-I389 PolarHBondContact O-N 3.27Å; L387-R392 VanDerWaalsContact C-NH2 3.28Å; L387-R392 PolarHBondContact O-NE 3.22Å; L387-R392 PolarHBondContact O-NH1 2.85Å; L387-R392 PolarHBondContact O-NH2 2.94Å
388R97.2Very high97Very high40 Ų4056.2 Ų56.215%0.15128%0.284CS..THydrogen-bonded Turntrans53.139.6179-57.5-173.7-80.2160.4-1.1113.2N177 D178 F179 I384 Y385 E391 R392N177-R388 WeakPolarHBondContact OD1-CD 3.34Å; N177-R388 PolarHBondContact OD1-NH1 3.33Å; D178-R388 IonicContact OD1-CZ 2.69Å; D178-R388 IonicContact OD1-NH1 3.76Å; D178-R388 PolarHBondContact OD1-NH1 3.01Å; D178-R388 IonicContact OD1-NH2 3.86Å; F179-R388 HydrophobicContact CD2-CB 4.04Å; F179-R388 HydrophobicContact CE2-CB 4.18Å; F179-R388 VanDerWaalsContact CE2-NH1 3.31Å; I384-R388 PolarHBondContact O-N 3.43Å; Y385-R388 PolarHBondContact O-N 2.83Å; R388-E391 HydrophobicContact CB-CG 4.5Å; R388-E391 PolarHBondContact O-N 2.85Å; R388-R392 HydrophobicContact CB-CB 4.44Å; R388-R392 WeakPolarHBondContact O-CB 3.48Å; R388-R392 PolarHBondContact O-N 3.13Å
389I97.5Very high97.1Very high63 Ų6354.2 Ų54.232%0.32328%0.277SS..THydrogen-bonded Turntrans-94.9136.1179.3-64.5174.5000107.9I384 L387 L393 S404I384-I389 VanDerWaalsContact CG2-O 3.26Å; I384-I389 WeakPolarHBondContact CG2-O 3.46Å; I384-I389 PolarHBondContact O-N 2.84Å; L387-I389 HydrophobicContact CB-CD1 3.77Å; L387-I389 HydrophobicContact CB-CG1 3.89Å; L387-I389 HydrophobicContact CD1-CD1 4.05Å; L387-I389 PolarHBondContact O-N 3.27Å; I389-L393 HydrophobicContact CG2-CD1 4.35Å; I389-S404 WeakPolarHBondContact O-CA 3.35Å; I389-S404 VanDerWaalsContact O-CB 3.23Å; I389-S404 WeakPolarHBondContact O-CB 3.44Å
390P97.8Very high97.1Very high23 Ų2352.4 Ų52.415%0.14927%0.268CS..THydrogen-bonded Turncis-93.7-710.437-36.2000115.5R392 L393 Y394 F398 F402P390-R392 PolarHBondContact O-N 2.9Å; P390-L393 WeakPolarHBondContact O-CB 3.26Å; P390-L393 PolarHBondContact O-N 3.37Å; P390-Y394 PolarHBondContact O-N 2.84Å; P390-F398 HydrophobicContact CB-CD2 4.19Å; P390-F398 HydrophobicContact CB-CE1 4.46Å; P390-F398 HydrophobicContact CB-CE2 3.86Å; P390-F398 HydrophobicContact CB-CZ 4Å; P390-F398 HydrophobicContact CG-CD1 3.78Å; P390-F398 HydrophobicContact CG-CD2 3.88Å; P390-F398 HydrophobicContact CG-CE1 3.76Å; P390-F398 HydrophobicContact CG-CE2 3.85Å; P390-F398 HydrophobicContact CG-CG 3.83Å; P390-F398 HydrophobicContact CG-CZ 3.79Å; P390-F402 WeakPolarHBondContact CD-O 3.37Å; P390-F402 WeakPolarHBondContact CG-O 3.49Å
391E97.9Very high97.1Very high1 Ų157 Ų571%0.00528%0.279CS..THydrogen-bonded Turntrans-63.4-26.8-172.769.4-85.1-16100113.6N177 F179 L180 R388 L393 Y394 P395 F398 S404N177-E391 PolarHBondContact ND2-OE1 3.2Å; F179-E391 HydrophobicContact CB-CB 4.12Å; F179-E391 HydrophobicContact CB-CG 3.76Å; F179-E391 HydrophobicContact CD2-CG 4.34Å; L180-E391 HydrophobicContact CD2-CB 4.16Å; L180-E391 HydrophobicContact CD2-CG 4.16Å; R388-E391 HydrophobicContact CB-CG 4.5Å; R388-E391 PolarHBondContact O-N 2.85Å; E391-L393 VanDerWaalsContact C-N 3.28Å; E391-L393 PolarHBondContact O-N 3.3Å; E391-Y394 CarbonylContact O-C 3.47Å; E391-Y394 VanDerWaalsContact O-C 3.25Å; E391-Y394 PolarHBondContact O-N 2.86Å; E391-P395 WeakPolarHBondContact O-CA 3.37Å; E391-P395 VanDerWaalsContact O-N 3.09Å; E391-F398 HydrophobicContact CB-CB 4.08Å; E391-S404 VanDerWaalsContact OE1-CB 3.25Å; E391-S404 WeakPolarHBondContact OE1-CB 3.45Å; E391-S404 PolarHBondContact OE1-N 2.56Å; E391-S404 PolarHBondContact OE1-OG 3.16Å; E391-S404 WeakPolarHBondContact OE2-CB 3.43Å; E391-S404 PolarHBondContact OE2-N 3.28Å
392R97.2Very high97.1Very high97 Ų9763.9 Ų63.937%0.36631%0.309SS..THydrogen-bonded Turntrans-59.6-38.1170177.7179.7-64.7-1777.2112.4F179 L387 R388 P390F179-R392 HydrophobicContact CD2-CB 3.82Å; F179-R392 HydrophobicContact CD2-CG 4.41Å; F179-R392 HydrophobicContact CE2-CB 3.54Å; F179-R392 HydrophobicContact CE2-CG 3.66Å; F179-R392 HydrophobicContact CZ-CB 4.08Å; F179-R392 HydrophobicContact CZ-CG 3.74Å; L387-R392 VanDerWaalsContact C-NH2 3.28Å; L387-R392 PolarHBondContact O-NE 3.22Å; L387-R392 PolarHBondContact O-NH1 2.85Å; L387-R392 PolarHBondContact O-NH2 2.94Å; R388-R392 HydrophobicContact CB-CB 4.44Å; R388-R392 WeakPolarHBondContact O-CB 3.48Å; R388-R392 PolarHBondContact O-N 3.13Å; P390-R392 PolarHBondContact O-N 2.9Å
393L97.5Very high97.1Very high109 Ų10963.7 Ų63.757%0.57131%0.306SS*.THydrogen-bonded Turntrans-79-32.4-177.2-58.8177.8000111.5I389 P390 E391I389-L393 HydrophobicContact CG2-CD1 4.35Å; P390-L393 WeakPolarHBondContact O-CB 3.26Å; P390-L393 PolarHBondContact O-N 3.37Å; E391-L393 VanDerWaalsContact C-N 3.28Å; E391-L393 PolarHBondContact O-N 3.3Å
394Y97Very high97.1Very high142 Ų14260.6 Ų60.656%0.55729%0.288SS*.SBendtrans-134.974-179.5-51-84.1000111.4P390 E391 G396 K397 F398P390-Y394 PolarHBondContact O-N 2.84Å; E391-Y394 CarbonylContact O-C 3.47Å; E391-Y394 VanDerWaalsContact O-C 3.25Å; E391-Y394 PolarHBondContact O-N 2.86Å; Y394-G396 PolarHBondContact O-N 2.95Å; Y394-K397 WeakPolarHBondContact O-CB 3.21Å; Y394-K397 PolarHBondContact O-N 3.08Å; Y394-K397 VanDerWaalsContact O-N 3.13Å; Y394-F398 AromaticContact CD2-CE2 3.77Å; Y394-F398 HydrophobicContact CD2-CE2 3.77Å; Y394-F398 HydrophobicContact CG-CE2 4.15Å
395P96.9Very high97.1Very high63 Ų6359.9 Ų59.941%0.40928%0.283SS..THydrogen-bonded Turntrans-55.6135.6-179.8-26.435.6000112F179 L181 E391 K397F179-P395 HydrophobicContact CD1-CB 4.4Å; F179-P395 HydrophobicContact CD1-CG 3.98Å; F179-P395 WeakPolarHBondContact O-CA 3.32Å; L181-P395 HydrophobicContact CD1-CB 4.46Å; E391-P395 WeakPolarHBondContact O-CA 3.37Å; E391-P395 VanDerWaalsContact O-N 3.09Å; P395-K397 VanDerWaalsContact C-N 3.28Å; P395-K397 PolarHBondContact O-N 3.02Å
396G95.8Very high97.2Very high27 Ų2759.6 Ų59.628%0.27828%0.282SS..THydrogen-bonded Turntrans80.6-7.9-178.900000116.2F179 Y394 D399F179-G396 PolarHBondContact O-N 3.32Å; Y394-G396 PolarHBondContact O-N 2.95Å; G396-D399 VanDerWaalsContact CA-OD1 3.26Å; G396-D399 WeakPolarHBondContact CA-OD1 3.26Å
397K96.9Very high97.3Very high170 Ų17060.3 Ų60.374%0.73928%0.283SS*.THydrogen-bonded Turntrans-89.5-26.8178.7-66.4-65.1-173.11750113.4Y394 P395Y394-K397 WeakPolarHBondContact O-CB 3.21Å; Y394-K397 PolarHBondContact O-N 3.08Å; Y394-K397 VanDerWaalsContact O-N 3.13Å; P395-K397 VanDerWaalsContact C-N 3.28Å; P395-K397 PolarHBondContact O-N 3.02Å
398F97.3Very high97.3Very high49 Ų4958.4 Ų58.422%0.21527%0.272CS..SBendtrans-111.728.3-176.4-62.9-81.8000112P390 E391 Y394 I400 W401 F402P390-F398 HydrophobicContact CB-CD2 4.19Å; P390-F398 HydrophobicContact CB-CE1 4.46Å; P390-F398 HydrophobicContact CB-CE2 3.86Å; P390-F398 HydrophobicContact CB-CZ 4Å; P390-F398 HydrophobicContact CG-CD1 3.78Å; P390-F398 HydrophobicContact CG-CD2 3.88Å; P390-F398 HydrophobicContact CG-CE1 3.76Å; P390-F398 HydrophobicContact CG-CE2 3.85Å; P390-F398 HydrophobicContact CG-CG 3.83Å; P390-F398 HydrophobicContact CG-CZ 3.79Å; E391-F398 HydrophobicContact CB-CB 4.08Å; Y394-F398 AromaticContact CD2-CE2 3.77Å; Y394-F398 HydrophobicContact CD2-CE2 3.77Å; Y394-F398 HydrophobicContact CG-CE2 4.15Å; F398-I400 VanDerWaalsContact C-N 3.29Å; F398-I400 PolarHBondContact O-N 3.49Å; F398-W401 WeakPolarHBondContact CA-O 3.31Å; F398-W401 WeakPolarHBondContact CD1-O 3.37Å; F398-F402 HydrophobicContact CD1-CB 3.96Å; F398-F402 HydrophobicContact CE1-CB 4.3Å
399D97Very high97.4Very high13 Ų1356.6 Ų56.67%0.0727%0.265CS..SBendtrans-60.1-36.9-175.5-77.1-6.9000112.8L180 L181 R182 T203 G396L180-D399 VanDerWaalsContact CA-OD1 3.24Å; L180-D399 WeakPolarHBondContact CA-OD1 3.41Å; L181-D399 PolarHBondContact N-OD1 3.28Å; R182-D399 WeakPolarHBondContact CA-OD2 3.43Å; R182-D399 WeakPolarHBondContact CB-OD2 3.29Å; R182-D399 PolarHBondContact N-OD2 2.83Å; T203-D399 WeakPolarHBondContact CA-O 3.18Å; T203-D399 VanDerWaalsContact CG2-O 3.24Å; T203-D399 WeakPolarHBondContact CG2-O 3.19Å; G396-D399 VanDerWaalsContact CA-OD1 3.26Å; G396-D399 WeakPolarHBondContact CA-OD1 3.26Å
400I96.7Very high97.4Very high33 Ų3356.5 Ų56.517%0.16927%0.267CS..SBendtrans-108.7-38.8-175.1-56.5-60.1000112.4L201 F398 Q406L201-I400 HydrophobicContact CD1-CG2 3.48Å; L201-I400 VanDerWaalsContact CD1-CG2 3.48Å; L201-I400 HydrophobicContact CD2-CG2 4.2Å; L201-I400 HydrophobicContact CG-CG2 3.76Å; F398-I400 VanDerWaalsContact C-N 3.29Å; F398-I400 PolarHBondContact O-N 3.49Å; I400-Q406 PolarHBondContact O-NE2 2.75Å; I400-Q406 PolarHBondContact O-OE1 3.04Å
401W97.7Very high97.5Very high138 Ų13857.8 Ų57.852%0.52327%0.27SS..SBendtrans-127.3143.9-172.4-58.8117.9000111.4L201 F398 Q403L201-W401 HydrophobicContact CD1-CH2 4.42Å; L201-W401 HydrophobicContact CD1-CZ2 3.78Å; F398-W401 WeakPolarHBondContact CA-O 3.31Å; F398-W401 WeakPolarHBondContact CD1-O 3.37Å; W401-Q403 VanDerWaalsContact C-N 3.27Å; W401-Q403 PolarHBondContact O-N 3.46Å
402F97.2Very high97.5Very high145 Ų14558.4 Ų58.464%0.63627%0.274SS*.SBendtrans60.326.8174.4-51.1-74.3000115.4P390 F398P390-F402 WeakPolarHBondContact CD-O 3.37Å; P390-F402 WeakPolarHBondContact CG-O 3.49Å; F398-F402 HydrophobicContact CD1-CB 3.96Å; F398-F402 HydrophobicContact CE1-CB 4.3Å
403Q96.7Very high97.6Very high5 Ų554.8 Ų54.82%0.02326%0.263CS..  trans-66.4154.1165.556163.1-29.100111.1L180 T203 N207 W401 H405 Q406 I407L180-Q403 HydrophobicContact CD2-CB 4Å; T203-Q403 PolarHBondContact O-NE2 2.83Å; N207-Q403 PolarHBondContact ND2-NE2 3.48Å; W401-Q403 VanDerWaalsContact C-N 3.27Å; W401-Q403 PolarHBondContact O-N 3.46Å; Q403-H405 PolarHBondContact O-N 3.07Å; Q403-H405 VanDerWaalsContact O-N 3.09Å; Q403-Q406 HydrophobicContact CG-CB 4.04Å; Q403-Q406 HydrophobicContact CG-CG 3.57Å; Q403-Q406 WeakPolarHBondContact O-CB 3.2Å; Q403-Q406 PolarHBondContact O-N 3.47Å; Q403-I407 PolarHBondContact O-N 2.73Å; Q403-I407 VanDerWaalsContact O-N 3.11Å
404S97.9Very high97.6Very high3 Ų353.3 Ų53.32%0.02126%0.255CS..Hα-helixtrans-49.6-39.6-179.265.70000114.2I384 I389 E391 I407 F408I384-S404 WeakPolarHBondContact O-CB 3.27Å; I389-S404 WeakPolarHBondContact O-CA 3.35Å; I389-S404 VanDerWaalsContact O-CB 3.23Å; I389-S404 WeakPolarHBondContact O-CB 3.44Å; E391-S404 VanDerWaalsContact OE1-CB 3.25Å; E391-S404 WeakPolarHBondContact OE1-CB 3.45Å; E391-S404 PolarHBondContact OE1-N 2.56Å; E391-S404 PolarHBondContact OE1-OG 3.16Å; E391-S404 WeakPolarHBondContact OE2-CB 3.43Å; E391-S404 PolarHBondContact OE2-N 3.28Å; S404-I407 PolarHBondContact O-N 3.23Å; S404-F408 WeakPolarHBondContact O-CB 3.23Å; S404-F408 PolarHBondContact O-N 3.03Å
405H97.8Very high97.7Very high25 Ų2546.6 Ų46.612%0.11623%0.229CC..Hα-helixtrans-65.4-40.4-180-149125.3000111.9H259 Y385 Q403 F408 H409H259-H405 AromaticContact CE1-CD2 3.97Å; H259-H405 AromaticContact CE1-CE1 3.91Å; H259-H405 AromaticContact CE1-NE2 3.49Å; H259-H405 PolarHBondContact CE1-NE2 3.46Å; H259-H405 AromaticContact NE2-NE2 3.52Å; Y385-H405 AromaticContact CE2-CE1 3.68Å; Y385-H405 AromaticContact CE2-ND1 3.66Å; Q403-H405 PolarHBondContact O-N 3.07Å; Q403-H405 VanDerWaalsContact O-N 3.09Å; H405-F408 WeakPolarHBondContact O-CB 3.2Å; H405-F408 PolarHBondContact O-N 2.95Å; H405-H409 AromaticContact CD2-CD2 3.56Å; H405-H409 AromaticContact CD2-NE2 3.27Å; H405-H409 PolarHBondContact CD2-NE2 2.98Å; H405-H409 VanDerWaalsContact CD2-NE2 3.27Å; H405-H409 AromaticContact NE2-NE2 3.37Å; H405-H409 PolarHBondContact NE2-NE2 3.4Å; H405-H409 PolarHBondContact O-CD2 3.22Å; H405-H409 VanDerWaalsContact O-CD2 3.28Å; H405-H409 PolarHBondContact O-N 3.24Å
406Q98.2Very high97.8Very high11 Ų1143.7 Ų43.75%0.05121%0.21CC..Hα-helixtrans-67.2-41.8176.3-72.3175.7-7.200111.2N207 I400 Q403 F408 H409 V410N207-Q406 WeakPolarHBondContact OD1-CA 3.4Å; N207-Q406 WeakPolarHBondContact OD1-CG 3.3Å; N207-Q406 PolarHBondContact OD1-N 3.32Å; I400-Q406 PolarHBondContact O-NE2 2.75Å; I400-Q406 PolarHBondContact O-OE1 3.04Å; Q403-Q406 HydrophobicContact CG-CB 4.04Å; Q403-Q406 HydrophobicContact CG-CG 3.57Å; Q403-Q406 WeakPolarHBondContact O-CB 3.2Å; Q403-Q406 PolarHBondContact O-N 3.47Å; Q406-F408 VanDerWaalsContact C-N 3.31Å; Q406-F408 PolarHBondContact O-N 2.86Å; Q406-H409 WeakPolarHBondContact O-CB 3.24Å; Q406-H409 PolarHBondContact O-N 2.83Å; Q406-V410 WeakPolarHBondContact O-CG2 3.21Å; Q406-V410 PolarHBondContact O-N 2.83Å
407I98.1Very high97.9Very high37 Ų3744.7 Ų44.719%0.1921%0.209CC..Hα-helixtrans-62.3-44.3177-61.4169.6000109.6I384 Q403 S404 H409 V410 F411I384-I407 HydrophobicContact CD1-CG2 3.94Å; I384-I407 HydrophobicContact CG2-CB 4.14Å; I384-I407 HydrophobicContact CG2-CD1 4.3Å; I384-I407 HydrophobicContact CG2-CG2 4.1Å; Q403-I407 PolarHBondContact O-N 2.73Å; Q403-I407 VanDerWaalsContact O-N 3.11Å; S404-I407 PolarHBondContact O-N 3.23Å; I407-H409 PolarHBondContact O-N 3.46Å; I407-V410 PolarHBondContact O-N 3.42Å; I407-F411 HydrophobicContact CG2-CD2 3.86Å; I407-F411 HydrophobicContact CG2-CE2 3.63Å; I407-F411 HydrophobicContact CG2-CZ 4.22Å; I407-F411 WeakPolarHBondContact O-CD2 3.22Å; I407-F411 PolarHBondContact O-N 3.06Å
408F98.1Very high97.9Very high33 Ų3337.5 Ų37.515%0.14518%0.179CC..Hα-helixtrans-57.2-46.3174.6172.4-113.1000112.3Y385 S404 H405 Q406 V410 F411 V412Y385-F408 HydrophobicContact CD2-CD1 4.28Å; Y385-F408 HydrophobicContact CG-CG 4.48Å; S404-F408 WeakPolarHBondContact O-CB 3.23Å; S404-F408 PolarHBondContact O-N 3.03Å; H405-F408 WeakPolarHBondContact O-CB 3.2Å; H405-F408 PolarHBondContact O-N 2.95Å; Q406-F408 VanDerWaalsContact C-N 3.31Å; Q406-F408 PolarHBondContact O-N 2.86Å; F408-V410 VanDerWaalsContact C-N 3.34Å; F408-V410 PolarHBondContact O-N 3.36Å; F408-F411 PolarHBondContact O-N 2.83Å; F408-F411 VanDerWaalsContact O-N 3.1Å; F408-V412 HydrophobicContact CD2-CG2 4.14Å; F408-V412 HydrophobicContact CE1-CG2 4.07Å; F408-V412 HydrophobicContact CE2-CG2 3.67Å; F408-V412 HydrophobicContact CZ-CG2 3.63Å; F408-V412 WeakPolarHBondContact O-CG2 3.48Å; F408-V412 PolarHBondContact O-N 3.49Å
409H98.5Very high97.9Very high2 Ų235.5 Ų35.51%0.00917%0.17CC..Hα-helixtrans-57.5-45.3176.2-79.6-151.1000112.8N207 T210 H211 H259 H405 Q406 I407 F411 V412 V413N207-H409 PolarHBondContact O-CE1 3.38Å; N207-H409 PolarHBondContact O-ND1 2.89Å; T210-H409 VanDerWaalsContact OG1-CB 3.31Å; T210-H409 WeakPolarHBondContact OG1-CB 3.49Å; T210-H409 PolarHBondContact OG1-ND1 2.86Å; H211-H409 AromaticContact CD2-CG 3.74Å; H211-H409 AromaticContact CD2-ND1 3.73Å; H211-H409 AromaticContact CE1-CD2 3.42Å; H211-H409 PolarHBondContact CE1-CD2 3.37Å; H211-H409 VanDerWaalsContact CE1-CD2 3.42Å; H211-H409 AromaticContact CE1-CE1 3.57Å; H211-H409 AromaticContact CE1-CG 3.42Å; H211-H409 VanDerWaalsContact CE1-CG 3.42Å; H211-H409 AromaticContact CE1-ND1 3.52Å; H211-H409 AromaticContact CE1-NE2 3.53Å; H211-H409 AromaticContact CG-CE1 3.96Å; H211-H409 AromaticContact CG-ND1 3.55Å; H211-H409 AromaticContact ND1-CE1 3.38Å; H211-H409 PolarHBondContact ND1-CE1 2.9Å; H211-H409 AromaticContact ND1-CG 3.8Å; H211-H409 AromaticContact ND1-ND1 3.4Å; H211-H409 PolarHBondContact ND1-ND1 3.37Å; H211-H409 AromaticContact ND1-NE2 3.78Å; H211-H409 VanDerWaalsContact NE2-CA 3.3Å; H211-H409 WeakPolarHBondContact NE2-CA 3.49Å; H211-H409 WeakPolarHBondContact NE2-CB 3.48Å; H211-H409 AromaticContact NE2-CD2 3.74Å; H211-H409 AromaticContact NE2-CG 3.38Å; H211-H409 AromaticContact NE2-ND1 3.74Å; H211-H409 PolarHBondContact NE2-O 2.82Å; H259-H409 AromaticContact CD2-CE1 3.48Å; H259-H409 PolarHBondContact CD2-CE1 3.19Å; H259-H409 VanDerWaalsContact CD2-CE1 3.48Å; H259-H409 AromaticContact NE2-CE1 3.26Å; H259-H409 PolarHBondContact NE2-CE1 3.44Å; H259-H409 VanDerWaalsContact NE2-CE1 3.26Å; H259-H409 AromaticContact NE2-NE2 3.43Å; H259-H409 PolarHBondContact NE2-NE2 3.08Å; H405-H409 AromaticContact CD2-CD2 3.56Å; H405-H409 AromaticContact CD2-NE2 3.27Å; H405-H409 PolarHBondContact CD2-NE2 2.98Å; H405-H409 VanDerWaalsContact CD2-NE2 3.27Å; H405-H409 AromaticContact NE2-NE2 3.37Å; H405-H409 PolarHBondContact NE2-NE2 3.4Å; H405-H409 PolarHBondContact O-CD2 3.22Å; H405-H409 VanDerWaalsContact O-CD2 3.28Å; H405-H409 PolarHBondContact O-N 3.24Å; Q406-H409 WeakPolarHBondContact O-CB 3.24Å; Q406-H409 PolarHBondContact O-N 2.83Å; I407-H409 PolarHBondContact O-N 3.46Å; H409-F411 VanDerWaalsContact C-N 3.3Å; H409-F411 PolarHBondContact O-N 2.76Å; H409-V412 PolarHBondContact O-N 3.41Å; H409-V413 PolarHBondContact O-N 2.87Å; H409-V413 VanDerWaalsContact O-N 3.16Å
410V98.5Very high97.9Very high61 Ų6135.8 Ų35.837%0.3717%0.172SC..Hα-helixtrans-60.4-43.6175.91740000110.6T210 Q406 I407 F408 V412 V413 L414T210-V410 HydrophobicContact CG2-CG2 3.68Å; Q406-V410 WeakPolarHBondContact O-CG2 3.21Å; Q406-V410 PolarHBondContact O-N 2.83Å; I407-V410 PolarHBondContact O-N 3.42Å; F408-V410 VanDerWaalsContact C-N 3.34Å; F408-V410 PolarHBondContact O-N 3.36Å; V410-V412 VanDerWaalsContact C-N 3.34Å; V410-V412 PolarHBondContact O-N 2.91Å; V410-V413 PolarHBondContact O-N 3.26Å; V410-L414 HydrophobicContact CG1-CD1 3.87Å; V410-L414 HydrophobicContact CG1-CG 4.26Å; V410-L414 WeakPolarHBondContact O-CG 3.44Å; V410-L414 PolarHBondContact O-N 3.42Å
411F98.5Very high97.9Very high49 Ų4937.7 Ų37.722%0.21518%0.183CC..Hα-helixtrans-66.3-36.2-179.1-82-135000111.9L377 S380 I384 I407 F408 H409 L414 A415L377-F411 HydrophobicContact CD2-CD1 4.21Å; L377-F411 HydrophobicContact CD2-CE1 4.35Å; L377-F411 VanDerWaalsContact O-CD1 3.31Å; L377-F411 WeakPolarHBondContact O-CD1 3.05Å; S380-F411 WeakPolarHBondContact OG-CD1 3.36Å; S380-F411 WeakPolarHBondContact OG-CE1 3.32Å; I384-F411 HydrophobicContact CD1-CE1 4.48Å; I407-F411 HydrophobicContact CG2-CD2 3.86Å; I407-F411 HydrophobicContact CG2-CE2 3.63Å; I407-F411 HydrophobicContact CG2-CZ 4.22Å; I407-F411 WeakPolarHBondContact O-CD2 3.22Å; I407-F411 PolarHBondContact O-N 3.06Å; F408-F411 PolarHBondContact O-N 2.83Å; F408-F411 VanDerWaalsContact O-N 3.1Å; H409-F411 VanDerWaalsContact C-N 3.3Å; H409-F411 PolarHBondContact O-N 2.76Å; F411-L414 PolarHBondContact O-N 3.06Å; F411-A415 WeakPolarHBondContact O-CB 3.11Å; F411-A415 PolarHBondContact O-N 3.45Å
412V98.4Very high97.7Very high14 Ų1431.2 Ų31.29%0.08516%0.158CC..Hα-helixtrans-61.4-47.1173.6170.80000111.1L283 Y378 F408 H409 V410 A415 A416L283-V412 HydrophobicContact CD2-CG1 4.11Å; Y378-V412 HydrophobicContact CE1-CB 4.49Å; Y378-V412 HydrophobicContact CE1-CG1 4.46Å; Y378-V412 HydrophobicContact CE1-CG2 4.29Å; F408-V412 HydrophobicContact CD2-CG2 4.14Å; F408-V412 HydrophobicContact CE1-CG2 4.07Å; F408-V412 HydrophobicContact CE2-CG2 3.67Å; F408-V412 HydrophobicContact CZ-CG2 3.63Å; F408-V412 WeakPolarHBondContact O-CG2 3.48Å; F408-V412 PolarHBondContact O-N 3.49Å; H409-V412 PolarHBondContact O-N 3.41Å; V410-V412 VanDerWaalsContact C-N 3.34Å; V410-V412 PolarHBondContact O-N 2.91Å; V412-A415 PolarHBondContact O-N 3.37Å; V412-A416 WeakPolarHBondContact O-CB 3.38Å; V412-A416 PolarHBondContact O-N 3.44Å
413V98.6Very high97.6Very high21 Ų2124.3 Ų24.313%0.12713%0.128CC..Hα-helixtrans-63.5-46.5178.4175.80000111.2L252 H409 V410 A416 L417L252-V413 HydrophobicContact CD2-CG2 3.96Å; H409-V413 PolarHBondContact O-N 2.87Å; H409-V413 VanDerWaalsContact O-N 3.16Å; V410-V413 PolarHBondContact O-N 3.26Å; V413-A416 PolarHBondContact O-N 2.92Å; V413-L417 HydrophobicContact CG1-CD1 4.25Å; V413-L417 WeakPolarHBondContact O-CG 3.46Å; V413-L417 PolarHBondContact O-N 2.93Å
414L98.5Very high97.4Very high79 Ų7925.9 Ų25.941%0.41414%0.136SC..Hα-helixtrans-62.7-45177.8-68.3177000111.8L377 V410 F411 A416 L417 V418L377-L414 HydrophobicContact CD1-CB 4.23Å; V410-L414 HydrophobicContact CG1-CD1 3.87Å; V410-L414 HydrophobicContact CG1-CG 4.26Å; V410-L414 WeakPolarHBondContact O-CG 3.44Å; V410-L414 PolarHBondContact O-N 3.42Å; F411-L414 PolarHBondContact O-N 3.06Å; L414-A416 VanDerWaalsContact C-N 3.31Å; L414-A416 PolarHBondContact O-N 3.23Å; L414-L417 PolarHBondContact O-N 3.41Å; L414-V418 WeakPolarHBondContact O-CB 3.41Å; L414-V418 VanDerWaalsContact O-CG2 3.29Å; L414-V418 WeakPolarHBondContact O-CG2 3.3Å; L414-V418 PolarHBondContact O-N 2.85Å
415A98.4Very high97.2Very high0 Ų028.5 Ų28.50%015%0.148CC..Hα-helixtrans-62.3-39178.200000111.7M374 L377 Y378 F411 V412 V418 H419M374-A415 HydrophobicContact CG-CB 4.44Å; L377-A415 HydrophobicContact CB-CB 3.86Å; L377-A415 HydrophobicContact CD1-CB 4.32Å; Y378-A415 HydrophobicContact CD1-CB 3.9Å; Y378-A415 HydrophobicContact CD2-CB 3.86Å; Y378-A415 HydrophobicContact CE1-CB 3.65Å; Y378-A415 HydrophobicContact CE2-CB 3.62Å; Y378-A415 HydrophobicContact CG-CB 3.99Å; F411-A415 WeakPolarHBondContact O-CB 3.11Å; F411-A415 PolarHBondContact O-N 3.45Å; V412-A415 PolarHBondContact O-N 3.37Å; A415-V418 PolarHBondContact O-N 3.14Å; A415-H419 VanDerWaalsContact O-CB 3.3Å; A415-H419 WeakPolarHBondContact O-CB 3.22Å; A415-H419 PolarHBondContact O-N 2.95Å
416A98.4Very high96.9Very high2 Ų227.6 Ų27.62%0.01714%0.143CC..Hα-helixtrans-65.8-40175.100000112.2F218 F244 V412 V413 L414 H419 L420F218-A416 HydrophobicContact CE1-CB 4.3Å; F218-A416 HydrophobicContact CE2-CB 3.88Å; F218-A416 HydrophobicContact CZ-CB 3.4Å; F218-A416 VanDerWaalsContact CZ-CB 3.4Å; F244-A416 HydrophobicContact CZ-CB 4.28Å; F244-A416 WeakPolarHBondContact CZ-O 3.45Å; V412-A416 WeakPolarHBondContact O-CB 3.38Å; V412-A416 PolarHBondContact O-N 3.44Å; V413-A416 PolarHBondContact O-N 2.92Å; L414-A416 VanDerWaalsContact C-N 3.31Å; L414-A416 PolarHBondContact O-N 3.23Å; A416-H419 PolarHBondContact O-N 3.46Å; A416-L420 PolarHBondContact O-N 2.92Å
417L98.2Very high96.6Very high49 Ų4927.2 Ų27.226%0.25714%0.142SC..Hα-helixtrans-66-42.1174.9-70.3169.6000112F218 L221 V413 L414 H419 L420 N421F218-L417 HydrophobicContact CE2-CD2 4.13Å; F218-L417 HydrophobicContact CE2-CG 4.23Å; F218-L417 HydrophobicContact CZ-CD2 4.06Å; F218-L417 HydrophobicContact CZ-CG 4.25Å; L221-L417 HydrophobicContact CD1-CD2 3.77Å; V413-L417 HydrophobicContact CG1-CD1 4.25Å; V413-L417 WeakPolarHBondContact O-CG 3.46Å; V413-L417 PolarHBondContact O-N 2.93Å; L414-L417 PolarHBondContact O-N 3.41Å; L417-H419 VanDerWaalsContact C-N 3.33Å; L417-L420 WeakPolarHBondContact O-CB 3.44Å; L417-L420 PolarHBondContact O-N 2.9Å; L417-N421 PolarHBondContact O-N 2.98Å; L417-N421 PolarHBondContact O-ND2 3.49Å
418V97.9Very high96.1Very high18 Ų1830.6 Ų30.611%0.10916%0.157CC..Hα-helixtrans-61.3-42.9173.7164.50000110.6W370 L373 M374 L377 L414 A415 L420 N421 A422W370-V418 HydrophobicContact CE3-CG1 3.93Å; W370-V418 HydrophobicContact CZ3-CG2 4.41Å; W370-V418 VanDerWaalsContact O-CG1 3.25Å; W370-V418 WeakPolarHBondContact O-CG1 3.35Å; L373-V418 HydrophobicContact CB-CG1 4.02Å; L373-V418 HydrophobicContact CD2-CG1 4.05Å; L373-V418 HydrophobicContact CD2-CG2 4.03Å; L373-V418 HydrophobicContact CG-CG1 3.93Å; L373-V418 HydrophobicContact CG-CG2 4.36Å; M374-V418 HydrophobicContact CB-CG1 3.77Å; L377-V418 HydrophobicContact CD1-CB 4.38Å; L377-V418 HydrophobicContact CD1-CG2 3.87Å; L414-V418 WeakPolarHBondContact O-CB 3.41Å; L414-V418 VanDerWaalsContact O-CG2 3.29Å; L414-V418 WeakPolarHBondContact O-CG2 3.3Å; L414-V418 PolarHBondContact O-N 2.85Å; A415-V418 PolarHBondContact O-N 3.14Å; V418-L420 VanDerWaalsContact C-N 3.35Å; V418-L420 PolarHBondContact O-N 2.97Å; V418-N421 WeakPolarHBondContact O-CB 3.22Å; V418-N421 PolarHBondContact O-N 3.23Å; V418-A422 PolarHBondContact O-N 3.04Å; V418-A422 VanDerWaalsContact O-N 3.07Å
419H97.5Very high95.7Very high7 Ų731.1 Ų31.13%0.03216%0.16CC..Hα-helixtrans-65.1-37.1176.7-164.972.8000112.7S287 M374 A415 A416 L417 N421 A422 I423S287-H419 PolarHBondContact O-NE2 2.83Å; M374-H419 HydrophobicContact CG-CB 4.04Å; A415-H419 VanDerWaalsContact O-CB 3.3Å; A415-H419 WeakPolarHBondContact O-CB 3.22Å; A415-H419 PolarHBondContact O-N 2.95Å; A416-H419 PolarHBondContact O-N 3.46Å; L417-H419 VanDerWaalsContact C-N 3.33Å; H419-N421 VanDerWaalsContact C-N 3.29Å; H419-N421 PolarHBondContact O-N 3.4Å; H419-A422 WeakPolarHBondContact O-CB 3.33Å; H419-A422 PolarHBondContact O-N 2.93Å; H419-A422 VanDerWaalsContact O-N 3.16Å; H419-I423 WeakPolarHBondContact CD2-CD1 3.24Å; H419-I423 WeakPolarHBondContact O-CG1 3.23Å; H419-I423 PolarHBondContact O-N 2.92Å
420L96.8Very high95.2Very high19 Ų1931.8 Ų31.810%0.09916%0.162CC..Hα-helixtrans-57.5-45.2172.9-177.257000110.8L221 F244 F245 A416 L417 V418 A422 I423 M424L221-L420 HydrophobicContact CD1-CD2 4.23Å; F244-L420 HydrophobicContact CD1-CD1 4.06Å; F244-L420 HydrophobicContact CE1-CB 3.85Å; F244-L420 HydrophobicContact CE1-CD1 3.93Å; F244-L420 HydrophobicContact CE1-CG 4.38Å; F245-L420 HydrophobicContact CE1-CD1 4.29Å; F245-L420 HydrophobicContact CE1-CD2 4Å; F245-L420 HydrophobicContact CE2-CD1 4.29Å; F245-L420 HydrophobicContact CZ-CD1 3.78Å; F245-L420 HydrophobicContact CZ-CD2 3.97Å; A416-L420 PolarHBondContact O-N 2.92Å; L417-L420 WeakPolarHBondContact O-CB 3.44Å; L417-L420 PolarHBondContact O-N 2.9Å; V418-L420 VanDerWaalsContact C-N 3.35Å; V418-L420 PolarHBondContact O-N 2.97Å; L420-A422 VanDerWaalsContact C-N 3.33Å; L420-A422 PolarHBondContact O-N 3.3Å; L420-I423 PolarHBondContact O-N 3.48Å; L420-M424 HydrophobicContact CD1-CG 4.22Å; L420-M424 HydrophobicContact CG-CG 4.43Å; L420-M424 VanDerWaalsContact O-CG 3.29Å; L420-M424 WeakPolarHBondContact O-CG 3.47Å; L420-M424 PolarHBondContact O-N 3.41Å
421N95.3Very high94.7Very high74 Ų7431.7 Ų31.740%0.39616%0.16SC..Hα-helixtrans-60.8-43.3175.8-74.2-84.9000111.3W370 L417 V418 H419 I423 M424 E425W370-N421 HydrophobicContact CD2-CB 4.04Å; W370-N421 HydrophobicContact CE3-CB 4.33Å; W370-N421 HydrophobicContact CG-CB 4.41Å; W370-N421 HydrophobicContact CZ2-CB 4.37Å; L417-N421 PolarHBondContact O-N 2.98Å; L417-N421 PolarHBondContact O-ND2 3.49Å; V418-N421 WeakPolarHBondContact O-CB 3.22Å; V418-N421 PolarHBondContact O-N 3.23Å; H419-N421 VanDerWaalsContact C-N 3.29Å; H419-N421 PolarHBondContact O-N 3.4Å; N421-I423 VanDerWaalsContact C-N 3.35Å; N421-I423 PolarHBondContact O-N 3.21Å; N421-M424 PolarHBondContact O-N 2.75Å; N421-E425 WeakPolarHBondContact O-CB 3.31Å; N421-E425 VanDerWaalsContact O-CG 3.23Å; N421-E425 WeakPolarHBondContact O-CG 3.42Å; N421-E425 PolarHBondContact O-N 2.89Å
422A95Very high94.1Very high1 Ų133.9 Ų33.91%0.00818%0.181CC..Hα-helixtrans-57.1-46.1174.900000112.4W370 L371 V418 H419 L420 I426W370-A422 HydrophobicContact CB-CB 3.61Å; L371-A422 HydrophobicContact CD2-CB 4.06Å; L371-A422 HydrophobicContact CG-CB 4.18Å; V418-A422 PolarHBondContact O-N 3.04Å; V418-A422 VanDerWaalsContact O-N 3.07Å; H419-A422 WeakPolarHBondContact O-CB 3.33Å; H419-A422 PolarHBondContact O-N 2.93Å; H419-A422 VanDerWaalsContact O-N 3.16Å; L420-A422 VanDerWaalsContact C-N 3.33Å; L420-A422 PolarHBondContact O-N 3.3Å; A422-I426 VanDerWaalsContact O-CG2 3.31Å; A422-I426 WeakPolarHBondContact O-CG2 3.36Å; A422-I426 PolarHBondContact O-N 3.33Å
423I94.7Very high93.4Very high0 Ų036 Ų360%019%0.189CC..Hα-helixtrans-62.2-45.1177.1-69.3163.3000110.8V241 F244 P290 Y294 H419 L420 N421 I426 A427V241-I423 HydrophobicContact CG2-CG2 4.17Å; F244-I423 HydrophobicContact CB-CD1 4.19Å; F244-I423 HydrophobicContact CD1-CD1 3.9Å; F244-I423 HydrophobicContact CD2-CD1 4.4Å; F244-I423 HydrophobicContact CE1-CD1 4.4Å; F244-I423 HydrophobicContact CG-CD1 3.89Å; P290-I423 HydrophobicContact CB-CD1 4.26Å; P290-I423 HydrophobicContact CB-CG1 4.37Å; P290-I423 HydrophobicContact CB-CG2 3.9Å; P290-I423 HydrophobicContact CG-CD1 3.51Å; P290-I423 HydrophobicContact CG-CG1 4.06Å; P290-I423 HydrophobicContact CG-CG2 4.33Å; Y294-I423 HydrophobicContact CD2-CG2 4.42Å; Y294-I423 HydrophobicContact CE2-CG2 4.25Å; H419-I423 WeakPolarHBondContact CD2-CD1 3.24Å; H419-I423 WeakPolarHBondContact O-CG1 3.23Å; H419-I423 PolarHBondContact O-N 2.92Å; L420-I423 PolarHBondContact O-N 3.48Å; N421-I423 VanDerWaalsContact C-N 3.35Å; N421-I423 PolarHBondContact O-N 3.21Å; I423-I426 VanDerWaalsContact O-CG2 3.27Å; I423-I426 WeakPolarHBondContact O-CG2 3.47Å; I423-A427 WeakPolarHBondContact O-CB 3.33Å; I423-A427 PolarHBondContact O-N 3.35Å
424M93.1Very high92.5Very high38 Ų3837 Ų3719%0.18720%0.204CC..Hα-helixtrans-66.4-42.6-177.8-68.5-51.9-57.900111.9F225 L420 N421 A427 Q428F225-M424 HydrophobicContact CD2-SD 4.49Å; F225-M424 HydrophobicContact CE2-CE 3.98Å; F225-M424 HydrophobicContact CE2-SD 4.01Å; L420-M424 HydrophobicContact CD1-CG 4.22Å; L420-M424 HydrophobicContact CG-CG 4.43Å; L420-M424 VanDerWaalsContact O-CG 3.29Å; L420-M424 WeakPolarHBondContact O-CG 3.47Å; L420-M424 PolarHBondContact O-N 3.41Å; N421-M424 PolarHBondContact O-N 2.75Å; M424-A427 PolarHBondContact O-N 3.07Å; M424-Q428 WeakPolarHBondContact O-CB 3.41Å; M424-Q428 VanDerWaalsContact O-CG 3.23Å; M424-Q428 WeakPolarHBondContact O-CG 3.43Å; M424-Q428 PolarHBondContact O-N 3.2Å
425E92.1Very high91.6Very high59 Ų5935.8 Ų35.828%0.27620%0.202SC..Hα-helixtrans-62.6-48.3176.7-72.3-77.7178.400111.7H364 A367 N421 A427 Q428 H429H364-E425 IonicContact CE1-OE2 3.3Å; H364-E425 PolarHBondContact CE1-OE2 3.36Å; H364-E425 VanDerWaalsContact CE1-OE2 3.3Å; A367-E425 HydrophobicContact CB-CB 4.18Å; N421-E425 WeakPolarHBondContact O-CB 3.31Å; N421-E425 VanDerWaalsContact O-CG 3.23Å; N421-E425 WeakPolarHBondContact O-CG 3.42Å; N421-E425 PolarHBondContact O-N 2.89Å; E425-A427 PolarHBondContact O-N 2.92Å; E425-Q428 PolarHBondContact O-N 2.94Å; E425-H429 WeakPolarHBondContact O-CB 3.39Å; E425-H429 PolarHBondContact O-N 3.44Å
426I91.5Very high90.9Very high5 Ų537.3 Ų37.33%0.02621%0.212CC..Hα-helixtrans-67.6-36.7179-163.1173.3000111.8Y294 S295 A367 A422 I423 R430Y294-I426 HydrophobicContact CD2-CG2 4.24Å; Y294-I426 HydrophobicContact CG-CG2 4.31Å; S295-I426 WeakPolarHBondContact OG-CD1 3.41Å; A367-I426 HydrophobicContact CB-CB 4.16Å; A422-I426 VanDerWaalsContact O-CG2 3.31Å; A422-I426 WeakPolarHBondContact O-CG2 3.36Å; A422-I426 PolarHBondContact O-N 3.33Å; I423-I426 VanDerWaalsContact O-CG2 3.27Å; I423-I426 WeakPolarHBondContact O-CG2 3.47Å; I426-R430 WeakPolarHBondContact O-CB 3.39Å; I426-R430 PolarHBondContact O-N 2.94Å
427A91.7Very high89.5Confident3 Ų343.4 Ų43.43%0.02525%0.245CC..Hα-helixtrans-64.2-48175.700000111.3Y294 I423 M424 E425 R430 L431Y294-A427 HydrophobicContact CD1-CB 3.95Å; Y294-A427 HydrophobicContact CD2-CB 3.77Å; Y294-A427 HydrophobicContact CE1-CB 3.72Å; Y294-A427 HydrophobicContact CE2-CB 3.54Å; Y294-A427 HydrophobicContact CG-CB 4Å; I423-A427 WeakPolarHBondContact O-CB 3.33Å; I423-A427 PolarHBondContact O-N 3.35Å; M424-A427 PolarHBondContact O-N 3.07Å; E425-A427 PolarHBondContact O-N 2.92Å; A427-R430 PolarHBondContact O-N 3.37Å; A427-L431 VanDerWaalsContact O-CB 3.31Å; A427-L431 WeakPolarHBondContact O-CB 3.27Å; A427-L431 WeakPolarHBondContact O-CG 3.38Å; A427-L431 PolarHBondContact O-N 3.18Å
428Q89.2Confident87.5Confident109 Ų10950.5 Ų50.551%0.50927%0.269SS..Hα-helixtrans-60.6-47.1177.9-75.9175-8.700111.6M424 E425 R430 S432M424-Q428 WeakPolarHBondContact O-CB 3.41Å; M424-Q428 VanDerWaalsContact O-CG 3.23Å; M424-Q428 WeakPolarHBondContact O-CG 3.43Å; M424-Q428 PolarHBondContact O-N 3.2Å; E425-Q428 PolarHBondContact O-N 2.94Å; Q428-R430 VanDerWaalsContact C-N 3.34Å; Q428-R430 PolarHBondContact O-N 3.35Å; Q428-S432 WeakPolarHBondContact O-CB 3.26Å; Q428-S432 PolarHBondContact O-N 3.48Å; Q428-S432 PolarHBondContact O-OG 2.95Å
429H88Confident85.5Confident44 Ų4450.6 Ų50.620%0.20427%0.269CS..Hα-helixtrans-62.3-39176.5-179.769.2000112.8R362 H364 E425 S432 K433R362-H429 PolarHBondContact O-NE2 3Å; H364-H429 HydrophobicContact CB-CB 4.4Å; H364-H429 AromaticContact CD2-CE1 3.93Å; H364-H429 AromaticContact CD2-CG 3.77Å; H364-H429 AromaticContact CD2-ND1 3.6Å; E425-H429 WeakPolarHBondContact O-CB 3.39Å; E425-H429 PolarHBondContact O-N 3.44Å; H429-S432 PolarHBondContact O-OG 3.45Å; H429-K433 WeakPolarHBondContact NE2-CE 3.3Å; H429-K433 PolarHBondContact NE2-NZ 3Å; H429-K433 VanDerWaalsContact NE2-NZ 3.14Å
430R88.2Confident83.3Confident15 Ų1558.3 Ų58.36%0.05731%0.309CS..Hα-helixtrans-71.4-45.8179.5-176.355.5-95.1-174.1-10111.7Y294 Y297 I426 A427 Q428 S432 K433 G434Y294-R430 HydrophobicContact CD1-CB 4.33Å; Y294-R430 HydrophobicContact CD1-CG 4.4Å; Y297-R430 HydrophobicContact CD1-CG 4.28Å; Y297-R430 HydrophobicContact CD2-CG 4.03Å; Y297-R430 HydrophobicContact CG-CG 3.76Å; I426-R430 WeakPolarHBondContact O-CB 3.39Å; I426-R430 PolarHBondContact O-N 2.94Å; A427-R430 PolarHBondContact O-N 3.37Å; Q428-R430 VanDerWaalsContact C-N 3.34Å; Q428-R430 PolarHBondContact O-N 3.35Å; R430-S432 VanDerWaalsContact C-N 3.3Å; R430-S432 PolarHBondContact O-N 2.88Å; R430-K433 VanDerWaalsContact NH2-CB 3.33Å; R430-K433 PolarHBondContact O-N 2.92Å; R430-G434 PolarHBondContact NH2-O 3.46Å
431L88.1Confident82.6Confident59 Ų5960.3 Ų60.331%0.30932%0.32SS..Hα-helixtrans-70.4-27.7-177.2-65.9174.8000112.1I233 E237 A427 K433 G434I233-L431 HydrophobicContact CG1-CD1 4.39Å; I233-L431 HydrophobicContact CG2-CD1 4.42Å; E237-L431 HydrophobicContact CG-CD2 4.21Å; A427-L431 VanDerWaalsContact O-CB 3.31Å; A427-L431 WeakPolarHBondContact O-CB 3.27Å; A427-L431 WeakPolarHBondContact O-CG 3.38Å; A427-L431 PolarHBondContact O-N 3.18Å; L431-K433 VanDerWaalsContact C-N 3.27Å; L431-K433 PolarHBondContact O-N 3.4Å; L431-G434 PolarHBondContact O-N 3.04Å
432S86.6Confident82Confident95 Ų9559.6 Ų59.666%0.66432%0.316SS*.Hα-helixtrans-67.8-24.8174.971.40000113.7Q428 H429 R430 G434Q428-S432 WeakPolarHBondContact O-CB 3.26Å; Q428-S432 PolarHBondContact O-N 3.48Å; Q428-S432 PolarHBondContact O-OG 2.95Å; H429-S432 PolarHBondContact O-OG 3.45Å; R430-S432 VanDerWaalsContact C-N 3.3Å; R430-S432 PolarHBondContact O-N 2.88Å; S432-G434 VanDerWaalsContact C-N 3.32Å; S432-G434 PolarHBondContact O-N 3.07Å
433K83.6Confident81.2Confident59 Ų5962.8 Ų62.826%0.25733%0.333SS..THydrogen-bonded Turntrans-78-9.2179.4-72.1178.5179.7177.60114.5R362 H429 R430 L431R362-K433 VanDerWaalsContact CB-NZ 3.33Å; R362-K433 VanDerWaalsContact CG-NZ 3.33Å; R362-K433 PolarHBondContact O-NZ 3.26Å; H429-K433 WeakPolarHBondContact NE2-CE 3.3Å; H429-K433 PolarHBondContact NE2-NZ 3Å; H429-K433 VanDerWaalsContact NE2-NZ 3.14Å; R430-K433 VanDerWaalsContact NH2-CB 3.33Å; R430-K433 PolarHBondContact O-N 2.92Å; L431-K433 VanDerWaalsContact C-N 3.27Å; L431-K433 PolarHBondContact O-N 3.4Å
434G80.6Confident80.4Confident43 Ų4366.5 Ų66.544%0.44335%0.352SS..  trans74-157.4-179.700000114.6R430 L431 S432R430-G434 PolarHBondContact NH2-O 3.46Å; L431-G434 PolarHBondContact O-N 3.04Å; S432-G434 VanDerWaalsContact C-N 3.32Å; S432-G434 PolarHBondContact O-N 3.07Å
435S79.5Confident79.6Confident53 Ų5368.3 Ų68.337%0.37136%0.363SS..  trans-66.8157.5-173.374.70000113D437S435-D437 WeakPolarHBondContact CB-OD2 3.45Å; S435-D437 PolarHBondContact O-N 2.99Å; S435-D437 PolarHBondContact OG-OD2 2.97Å
436C83.5Confident78.8Confident31 Ų3168.9 Ų68.921%0.20937%0.369CS..G310 helixtrans-73.1-11.2179.9-660000113.8C298 Y438 Q439C298-C436 WeakPolarHBondContact CA-SG 3.24Å; C298-C436 HydrophobicContact CB-CB 3.63Å; C298-C436 WeakPolarHBondContact CB-SG 3.34Å; C298-C436 VanDerWaalsContact SG-CA 3.56Å; C298-C436 WeakPolarHBondContact SG-CB 3.26Å; C298-C436 CovalentContact SG-SG 2.04Å; C298-C436 PolarHBondContact SG-SG 3.42Å; C436-Y438 PolarHBondContact O-N 3.39Å; C436-Y438 VanDerWaalsContact O-N 3.1Å; C436-Q439 PolarHBondContact O-N 3.06Å
437D69.2Low77.9Confident131 Ų13173.5 Ų73.570%0.70139%0.393SS*.G310 helixtrans-65.3-16.5-173.6-48.2-51.7000113.2S435S435-D437 WeakPolarHBondContact CB-OD2 3.45Å; S435-D437 PolarHBondContact O-N 2.99Å; S435-D437 PolarHBondContact OG-OD2 2.97Å
438Y55.6Low76.9Confident197 Ų19778.9 Ų78.977%0.77342%0.421SS*.G310 helixtrans-98.47.3177.3-62.9-78.5000113.6C436C436-Y438 PolarHBondContact O-N 3.39Å; C436-Y438 VanDerWaalsContact O-N 3.1Å
439Q55.8Low75.8Confident21 Ų2176.4 Ų76.410%0.09841%0.414CS..THydrogen-bonded Turntrans-130.4-10.9-165.9-62.2-168.1-29.100115.9C436C436-Q439 PolarHBondContact O-N 3.06Å
440L51.2Low74.7Confident169 Ų16979.4 Ų79.489%0.88543%0.433SS*.  trans-108.30163.8-68.9168.5000108Y299Y299-L440 HydrophobicContact CD1-CD2 4.29Å; Y299-L440 HydrophobicContact CE1-CD2 3.69Å

Retrieved 440 of 440 residues in 120.8 ms (Link to these results)