A0A096NVK7_PAPAN Loading...

Estrogen receptor beta

AlphaFold DB , UniProt , Accession A0A096NVK7, Species PAPAN (Papio anubis, Olive baboon), Gene ESR2, Length 530 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M34Very low35.8Very low218 Ų218144.1 Ų144.1100%1.07481%0.805SS**  067.10-58-174.8-171.700110.5
2D35.5Very low35.3Very low141 Ų141141.2 Ų141.275%0.75480%0.801SS**  cis-153.5141.3-17.4-73.7-48.3000107
3I37.3Very low36.8Very low130 Ų130139.5 Ų139.567%0.66780%0.799SS**  cis95.7106.934.6-66.7175000113
4K39.7Very low36.2Very low180 Ų180137.2 Ų137.278%0.78380%0.796SS**  trans71.4158.4159.2-71.3179.2176.3177.40117.3
5N35.3Very low35.9Very low138 Ų138134.9 Ų134.974%0.73879%0.79SS**  cis-153.6160.5-1-1307000112.6
6S35.2Very low35.4Very low101 Ų101141.8 Ų141.871%0.70680%0.801SS**  trans-98.4167.4151.7-51.70000110.1
7P49.8Very low34.9Very low133 Ų133142.7 Ų142.786%0.86480%0.804SS**  -142.7179.2124.338.7-25.6000114.1
8S35.3Very low34.5Very low117 Ų117140.3 Ų140.382%0.81880%0.796SS**  trans-142.6148.6-172.452.80000113.6
9S29.9Very low34.2Very low112 Ų112138.7 Ų138.778%0.78380%0.795SS**  trans-158.3129161.349.40000108.1
10L33.1Very low34Very low154 Ų154140.8 Ų140.881%0.80680%0.797SS**  64.799.153.4-71.2169.3000114
11N28.3Very low33.7Very low161 Ų161139 Ų13986%0.86179%0.794SS**  -179.6159.9112.5-87.1-16.1000113.6
12S30.1Very low33.5Very low109 Ų109135.8 Ų135.876%0.76278%0.779SS**  trans-160.8-170.1176.168.80000107.6
13P54.3Low33.3Very low119 Ų119136.4 Ų136.477%0.77378%0.782SS**  cis-127.5165-36.336.7-22.3000113.4
14S28.7Very low33.4Very low108 Ų108136.5 Ų136.576%0.75579%0.791SS**  trans-173.1135.1155.551.70000109.9
15S31.4Very low32.9Very low102 Ų102135 Ų13571%0.71379%0.79SS**  cis89.1106.825.880.70000115.9
16Y28.1Very low32.6Very low246 Ų246135.7 Ų135.797%0.96579%0.789SS**  trans-158.5174.4151-104.6-66.1000111.2
17N28Very low32.5Very low157 Ų157139 Ų13984%0.8479%0.793SS**  trans-133.7167-143.4-149.1-4.9000116.5
18C26.2Very low31.6Very low99 Ų99135.7 Ų135.767%0.66978%0.784SS**  trans-54.9155.1-179.1177.20000117.2
19S29.8Very low31.3Very low110 Ų110136.6 Ų136.677%0.76979%0.79SS**  trans-168.1118.1136.3-81.50000115.1
20Q30.7Very low31.4Very low180 Ų180138.4 Ų138.484%0.84179%0.789SS**  trans42.9152.7130.8-64-177.1-0.800121.9
21S28Very low31.1Very low104 Ų104141.3 Ų141.373%0.72779%0.791SS**  cis-142.5-1515.431.90000109.1
22I29.1Very low31.2Very low151 Ų151140.8 Ų140.877%0.77479%0.787SS**  cis-149.2164.416.1-61.5170.6000108.3
23L31Very low31.2Very low154 Ų154140.3 Ų140.381%0.80678%0.781SS**  trans-116.4156.9170.5-72.2173000112.2
24P38.5Very low29.8Very low131 Ų131140.6 Ų140.685%0.85179%0.786SS**  -132.6177.9108.523.3-5000114.6
25L31.1Very low29.8Very low148 Ų148140.3 Ų140.378%0.77578%0.784SS**  trans-107.1146.6-165.4-176.778.1000112.1
26E28.8Very low29.6Very low154 Ų154146.2 Ų146.272%0.7279%0.792SS**  trans178.8172.5133.2-100-65.2140.900112
27H32.4Very low29.8Very low169 Ų169139.9 Ų139.978%0.78278%0.779SS**  trans-83.6145.5-156.9-70.6-75.5000117.9
28G29.8Very low29.9Very low65 Ų65140.8 Ų140.867%0.6778%0.778SS**  trans-172.5116164.500000114.1I30G28-I30 PolarHBondContact O-N 3.41Å
29S30.9Very low29.8Very low135 Ų135140.2 Ų140.294%0.94478%0.775SS**  trans-83.8100.8178.2-58.90000111.3
30I30.2Very low29.7Very low150 Ų150144.3 Ų144.377%0.76978%0.782SS**  trans-97.9125.4-174.4-64178.7000112.2G28G28-I30 PolarHBondContact O-N 3.41Å
31Y27.3Very low29.7Very low216 Ų216144.6 Ų144.685%0.84778%0.783SS**  trans-81.2138172-143.8-100.4000109.5
32I30.5Very low29.6Very low149 Ų149148.1 Ų148.176%0.76479%0.788SS**  trans-119.5114.5174.3-60.1-178.4000109
33P29.8Very low29.7Very low99 Ų99151.8 Ų151.864%0.64379%0.793SS**  trans-71.3147.9174.7-1630.7000112.2
34S24.9Very low29.9Very low125 Ų125149.8 Ų149.887%0.87479%0.79SS**  trans-82.4135.2163.8-174.60000109.9
35S28.6Very low29.4Very low103 Ų103148.2 Ų148.272%0.7279%0.788SS**  trans-148.394.2177.846.10000112.3
36Y28.7Very low29.4Very low225 Ų225148 Ų14888%0.88279%0.785SS**  trans-156.3139.8135.7-131.4-91.3000111.8
37V32.3Very low29.5Very low114 Ų114147 Ų14769%0.69179%0.789SS**  trans-135.3134.9172178.40000102.1
38E28.6Very low29.3Very low175 Ų175146.9 Ų146.982%0.81879%0.787SS**  cis-157-171.843.9-134.3148.5165.800106.8
39S25Very low29.2Very low87 Ų87154.9 Ų154.961%0.60880%0.798SS**  cis-156.3143.14.847.90000109.5
40H27.6Very low29.1Very low196 Ų196153.9 Ų153.991%0.90779%0.791SS**  trans-151.6137158.5-89.8-66.2000109.6
41H29.9Very low29.1Very low187 Ų187152.9 Ų152.987%0.86679%0.794SS**  trans-76.3158-173-70.3-72.1000113.8
42E27.3Very low29.2Very low177 Ų177147.3 Ų147.383%0.82779%0.793SS**  trans-86.7142.3-160-55.8163.2113.200113.9
43Y30.4Very low29.3Very low228 Ų228146.7 Ų146.789%0.89480%0.796SS**  trans-143.7133145.6-102-84.3000108.3A45Y43-A45 PolarHBondContact O-N 3.11Å
44P34.4Very low29.3Very low112 Ų112149 Ų14973%0.72780%0.8SS**  trans-78124-168.328.7-34.8000113.2M46P44-M46 PolarHBondContact O-N 3.31Å
45A29.3Very low29.3Very low99 Ų99150.5 Ų150.582%0.81880%0.798SS**  trans-75.3102.517000000110.4Y43 T47Y43-A45 PolarHBondContact O-N 3.11Å; A45-T47 PolarHBondContact O-N 3.31Å
46M30.2Very low29.3Very low143 Ų143154.9 Ų154.970%0.70480%0.8SS**  trans-80.2111.1-175.5-155.7176.4-5800111.7P44 F48P44-M46 PolarHBondContact O-N 3.31Å; M46-F48 HydrophobicContact CB-CE2 4.35Å; M46-F48 HydrophobicContact CG-CD2 4.27Å; M46-F48 HydrophobicContact CG-CE2 3.7Å; M46-F48 HydrophobicContact CG-CZ 4.1Å; M46-F48 HydrophobicContact SD-CD2 4.45Å; M46-F48 HydrophobicContact SD-CE2 3.37Å; M46-F48 WeakPolarHBondContact SD-CE2 3.36Å; M46-F48 HydrophobicContact SD-CZ 3.54Å; M46-F48 VanDerWaalsContact SD-CZ 3.54Å
47T30.8Very low29.2Very low133 Ų133149.6 Ų149.682%0.81680%0.796SS**  trans-77.9120.9177.9510000111.8A45A45-T47 PolarHBondContact O-N 3.31Å
48F28.7Very low29.3Very low166 Ų166151.5 Ų151.573%0.72880%0.801SS**  trans-127.3114.9171.5-77.6-66.5000112.3M46M46-F48 HydrophobicContact CB-CE2 4.35Å; M46-F48 HydrophobicContact CG-CD2 4.27Å; M46-F48 HydrophobicContact CG-CE2 3.7Å; M46-F48 HydrophobicContact CG-CZ 4.1Å; M46-F48 HydrophobicContact SD-CD2 4.45Å; M46-F48 HydrophobicContact SD-CE2 3.37Å; M46-F48 WeakPolarHBondContact SD-CE2 3.36Å; M46-F48 HydrophobicContact SD-CZ 3.54Å; M46-F48 VanDerWaalsContact SD-CZ 3.54Å
49Y28.4Very low29.4Very low234 Ų234149.1 Ų149.192%0.91880%0.801SS**  trans-16592.7141.3-117.7-69.5000111.3
50S28.5Very low29.6Very low113 Ų113150.6 Ų150.679%0.7981%0.811SS**SBendtrans-167.2144.6153.2-850000110.1
51P30.9Very low29.6Very low129 Ų129149 Ų14984%0.83881%0.81SS**PPolyproline II helixtrans-81.9130-170.131.6-34.4000112.7
52A29.3Very low29.7Very low100 Ų100145.8 Ų145.883%0.82680%0.802SS**PPolyproline II helixtrans-88.3129.817000000110.8
53V32.1Very low29.8Very low136 Ų136144 Ų14482%0.82480%0.804SS**PPolyproline II helixtrans-80.2125.8170.2178.60000108.4N55V53-N55 PolarHBondContact O-N 3.24Å
54M28.5Very low29.8Very low147 Ų147139.7 Ų139.772%0.72480%0.797SS**PPolyproline II helixtrans-67.8122.5174.7-81.5-174.4165.200111Y56M54-Y56 HydrophobicContact CE-CE2 4.49Å; M54-Y56 HydrophobicContact CG-CE2 4.49Å; M54-Y56 HydrophobicContact SD-CE2 3.85Å
55N26.4Very low29.6Very low157 Ų157142.1 Ų142.184%0.8480%0.803SS**  trans-131.8108.6162.8-117.3-4.3000107.1V53V53-N55 PolarHBondContact O-N 3.24Å
56Y27.8Very low29.6Very low194 Ų194146.2 Ų146.276%0.76181%0.805SS**  trans-83124.3177-79-88.3000110.2M54M54-Y56 HydrophobicContact CE-CE2 4.49Å; M54-Y56 HydrophobicContact CG-CE2 4.49Å; M54-Y56 HydrophobicContact SD-CE2 3.85Å
57S26.8Very low29.6Very low114 Ų114143.3 Ų143.380%0.79781%0.811SS**  trans-117.4117.6166.943.20000109.7
58I34.4Very low29.6Very low155 Ų155140.6 Ų140.680%0.79581%0.81SS**PPolyproline II helixtrans-93.5132.4176.1-63.6176.2000108.1
59P31.1Very low30.3Very low125 Ų125139 Ų13981%0.81282%0.816SS**PPolyproline II helixtrans-70.6133.5175.329.4-33.9000110.8
60S28.4Very low30.3Very low118 Ų118131.6 Ų131.683%0.82581%0.81SS**PPolyproline II helixtrans-90.9151.8179.346.90000112.4
61N27.6Very low30.4Very low163 Ų163138.6 Ų138.687%0.87282%0.82SS**  trans-142.8160.7164.3-130.8-13.9000109.9
62V31.3Very low30.3Very low118 Ų118141.4 Ų141.472%0.71582%0.822SS**  trans-105.6135.7-148.9175.50000114.5
63T29.8Very low30.2Very low140 Ų140143.9 Ų143.986%0.85983%0.827SS**  trans-164.6153.9131.620.30000114.1
64N30.2Very low30Very low138 Ų138142.1 Ų142.174%0.73883%0.827SS**  trans-72.5154.6-167.9-46.2-40.8000116.1
65L30.8Very low30Very low163 Ų163140.7 Ų140.785%0.85383%0.831SS**  -163.6-175104.8-12882.3000112.7
66E30.2Very low30.4Very low185 Ų185138.9 Ų138.986%0.86483%0.828SS**  trans-94.5164.7-158.7-54.6167.9103.600116.2
67G30.1Very low30.4Very low81 Ų81137 Ų13784%0.83583%0.831SS**  trans14594.8146.300000120.6
68G31.1Very low30.6Very low77 Ų77137.1 Ų137.179%0.79483%0.827SS**  trans89.2162.7146.500000119.6
69P41.8Very low30.5Very low133 Ų133137 Ų13786%0.86483%0.827SS**  trans-128.9133-15336.7-18.4000118
70G28.2Very low30.4Very low77 Ų77142 Ų14279%0.79483%0.83SS**  84.7115.2116.500000121.7
71R32.1Very low30.6Very low260 Ų260141.9 Ų141.998%0.98183%0.826SS**  -156.8162.1123.7-114.1177.7-175.6-130.3-1.1111.7
72Q27.8Very low30.6Very low188 Ų188140.6 Ų140.688%0.87982%0.824SS**  trans-113.3150.2-168.8-57168.94.100112.2
73T27.5Very low31Very low152 Ų152141.2 Ų141.293%0.93383%0.831SS**  trans-143.5145.914629.50000108.6
74A28.5Very low30.8Very low100 Ų100138 Ų13883%0.82683%0.826SS**  trans-112.4155.6-168.400000113.2
75S28.1Very low31Very low116 Ų116140 Ų14081%0.81183%0.83SS**  trans-130.6138.5165-69.80000109.1
76P34.3Very low30.8Very low120 Ų120140.5 Ų140.578%0.77983%0.833SS**  trans-85148.4-173.333.2-35.1000113.3
77N27.6Very low30.7Very low155 Ų155136.6 Ų136.683%0.82983%0.826SS**  trans-73145.8169.1-71.7-52.2000111.5
78V31Very low31.3Very low116 Ų116138.3 Ų138.370%0.70382%0.822SS**  trans-125.6121.7161.6178.70000107.5
79L32.4Very low31.1Very low153 Ų153143 Ų14380%0.80183%0.828SS**  trans-86.4140.9177.7-66.687.3000110.2
80W29.1Very low30.5Very low229 Ų229140.8 Ų140.887%0.86782%0.821SS**  trans-105.6131.8165.9-71.9123.9000110.7
81P32.3Very low30.5Very low115 Ų115144 Ų14475%0.74783%0.825SS**PPolyproline II helixtrans-79.8151.4167.48.46.9000111.6
82T28.2Very low30.2Very low137 Ų137139.5 Ų139.584%0.8482%0.815SS**PPolyproline II helixtrans-76.2160.1174.124.80000112.9
83P39.6Very low30.1Very low130 Ų130142 Ų14284%0.84482%0.816SS**PPolyproline II helixtrans-85153.1-163.533.4-36.9000115
84G26.6Very low30.1Very low73 Ų73142.6 Ų142.675%0.75381%0.808SS**  trans-134.7152.3169.600000111.7
85H33.3Very low29.9Very low180 Ų180145.9 Ų145.983%0.83381%0.811SS**  trans-51143.4-172.2-77.9-115.6000116.2
86L28Very low29.9Very low173 Ų173145.1 Ų145.191%0.90681%0.806SS**  -169.5171115.1-98.2164.5000110.7
87S27.5Very low29.6Very low103 Ų103148.8 Ų148.872%0.7281%0.812SS**  trans-122.3-163.3-167.2-51.10000113.2
88P42.4Very low29.7Very low118 Ų118148.7 Ų148.777%0.76681%0.811SS**  -111.8-165.8-111.137.8-21000114.1
89L27.3Very low29.6Very low174 Ų174153.9 Ų153.991%0.91182%0.82SS**  trans108.1138-179.1-63.7165.9000112.7
90A28.1Very low29.2Very low87 Ų87151.4 Ų151.472%0.71982%0.821SS**  cis-155.5148.5-15.400000110.3
91V29Very low29Very low146 Ų146148.2 Ų148.289%0.88582%0.816SS**  trans-109.2113.8168.3176.70000108.8R93V91-R93 PolarHBondContact O-N 3.12Å
92H26.6Very low29.1Very low165 Ų165147.6 Ų147.676%0.76481%0.812SS**  trans-81110.4-175.1-167.172.5000111
93R25.1Very low28.8Very low239 Ų239148.6 Ų148.690%0.90281%0.807SS**  trans-129.7107.3174.6-172.9-178.1-170.8177.54.2109.1V91V91-R93 PolarHBondContact O-N 3.12Å
94Q26.7Very low28.1Very low165 Ų165152.1 Ų152.177%0.77181%0.809SS**  trans-105.6135.5-176.6-156.9169.412.700110.5
95L24.4Very low27.9Very low169 Ų169153.1 Ų153.189%0.88581%0.805SS**  trans-128145.3175.2-158.176.2000109.1
96S29.5Very low28Very low101 Ų101149.9 Ų149.971%0.70680%0.8SS**  trans-76153-168.4-43.60000114.4
97H27.6Very low28Very low196 Ų196151.4 Ų151.491%0.90779%0.794SS**  trans-136.2165.4154.1-102.1-92.3000110.4
98L29.6Very low27.9Very low153 Ų153151 Ų15180%0.80179%0.79SS**  trans-124.2151.2-159.3-73.6165.8000114.2
99Y28.1Very low27.1Very low225 Ų225152.9 Ų152.988%0.88279%0.788SS**  trans62117.2151.6-99.8-91.4000121.5
100A24.2Very low27Very low101 Ų101149 Ų14984%0.83578%0.782SS**  trans-159.4145.7143.100000111.5
101E24.7Very low26.8Very low162 Ų162156.4 Ų156.476%0.75779%0.791SS**  trans-143.1166165.8-130-127.1112.200105.4Q103E101-Q103 PolarHBondContact OE1-N 3.43Å; E101-Q103 VanDerWaalsContact OE1-N 3.11Å
102P33.8Very low26.5Very low103 Ų103154.6 Ų154.667%0.66979%0.785SS**  cis-146175.52842.5-21.6000120
103Q23.2Very low26.3Very low158 Ų158154 Ų15474%0.73879%0.787SS**  trans41.6129.4152.5-72.1-161.6-0.900123.5E101E101-Q103 PolarHBondContact OE1-N 3.43Å; E101-Q103 VanDerWaalsContact OE1-N 3.11Å
104K24.2Very low26.3Very low203 Ų203150.9 Ų150.988%0.88378%0.782SS**  -171.8160.599.3-101.5177-176.8178.20113.4
105S23.6Very low26.3Very low95 Ų95151 Ų15166%0.66478%0.782SS**  trans-116175.1179.461.10000112.5
106P35.2Very low26.3Very low111 Ų111148.9 Ų148.972%0.72178%0.776SS**  -150136.2108.734.7-16.5000117.8
107W28.1Very low26.3Very low206 Ų206151.5 Ų151.578%0.7878%0.782SS**  trans44151.7133.2-56.7102.2000122.9E109W107-E109 HydrophobicContact CE3-CG 4.24Å; W107-E109 HydrophobicContact CZ3-CG 4.27Å
108C25.4Very low26.5Very low94 Ų94148.3 Ų148.364%0.63578%0.779SS**  cis-139.6145.69.3-105.10000109.1
109E24.8Very low26.5Very low157 Ų157147.3 Ų147.373%0.73478%0.778SS**  65.514690.2-61-171.2118.200116.3W107W107-E109 HydrophobicContact CE3-CG 4.24Å; W107-E109 HydrophobicContact CZ3-CG 4.27Å
110A25.5Very low26.4Very low94 Ų94143.8 Ų143.878%0.77778%0.775SS**  cis-144.4178.223.300000115.7
111R23.2Very low26.7Very low241 Ų241148.4 Ų148.491%0.90977%0.771SS**  trans-87-177162.9-50.9178180174-0.9109.2
112S23.1Very low26.8Very low108 Ų108147 Ų14776%0.75576%0.764SS**  cis-165.1164.78.9-158.90000109.5
113L22.8Very low26.6Very low154 Ų154147.6 Ų147.681%0.80677%0.766SS**  157.9150.9126.1-163.261.6000111.8
114E24.1Very low26.9Very low173 Ų173148.3 Ų148.381%0.80877%0.774SS**  trans-87.4165176.8-55.3175.7110.600112.2
115H27.3Very low27.2Very low168 Ų168147.6 Ų147.678%0.77877%0.771SS**  trans-179.3127.1131.4-103.5-68000115.5
116T23.9Very low27.5Very low123 Ų123155.4 Ų155.476%0.75579%0.786SS**  trans50.4141.5143-2.50000124.3
117L29.3Very low27.1Very low156 Ų156159.2 Ų159.282%0.81779%0.791SS**  trans-79.3164.4166-61170.5000112.3
118P32.6Very low27.1Very low130 Ų130156.1 Ų156.184%0.84480%0.795SS**  -143.9-173.3106.138.6-23.6000115.9
119V28.3Very low27.2Very low132 Ų132156.6 Ų156.680%0.880%0.799SS**  trans-105.1154.1-167.6170.90000112.7
120N26.9Very low27.4Very low151 Ų151152 Ų15281%0.80779%0.793SS**  trans-145.8165.8147.4-149.2-6.6000113.9
121R29.9Very low27.8Very low197 Ų197154.5 Ų154.574%0.74379%0.794SS**  trans-97.9-169.3179.5-64.3159139.5-155.112.3109.1
122E28.6Very low28.2Very low134 Ų134151 Ų15163%0.62679%0.787SS**  cis-161157.216-151.7137.7-13100113.7
123T28.3Very low28.6Very low114 Ų114150.8 Ų150.870%0.69979%0.785SS**  trans16.2138.4159.656.90000124.1
124L30.6Very low28.9Very low174 Ų174150.1 Ų150.191%0.91179%0.787SS**  -148157.5115.4-15466.2000112.1
125K28.9Very low29.4Very low188 Ų188146.3 Ų146.382%0.81778%0.78SS**  trans-122.7145.5179.9-61.3173.6-177.2170.30111.7
126R29.9Very low30.2Very low258 Ų258144.9 Ų144.997%0.97479%0.785SS**  trans-156.4171.1135.5-117.7169.9178.7130.30.1112
127K27.9Very low30.9Very low191 Ų191144.9 Ų144.983%0.8379%0.785SS**  trans-154.3141-153.8170.7-166.1177.7-171.30110.2
128V28.7Very low31.1Very low142 Ų142143.9 Ų143.986%0.86179%0.785SS**  trans167.8153.2151.8142.90000108.7
129S27.6Very low31.1Very low104 Ų104141.9 Ų141.973%0.72777%0.774SS**  cis-171.4156.1-42.1-153.30000109.3
130G29.1Very low31.9Very low59 Ų59142.3 Ų142.361%0.60878%0.78SS**  trans106.8106.3174.600000113.2
131N31.9Very low32.4Very low148 Ų148139.3 Ų139.379%0.79177%0.771SS**  96.1127.264.7-77.115000110.5
132H33.3Very low32.9Very low166 Ų166134.4 Ų134.477%0.76977%0.767SS**  cis-147164.42.5-134.7-81.3000112.5
133C30Very low33.9Very low104 Ų104138.3 Ų138.370%0.70378%0.782SS**  trans-71.6165.3-178-420000112.5
134T29.8Very low35.1Very low140 Ų140143 Ų14386%0.85979%0.786SS**  -142.1156.95843.20000115.5
135S33.8Very low36.7Very low93 Ų93141 Ų14165%0.6578%0.777SS**  trans-120.8172.7174.8-45.80000110.2
136P44.4Very low39Very low138 Ų138134.9 Ų134.990%0.89676%0.762SS**  -109.6154.8110.6-15.732.3000113.3
137V38.8Very low41.9Very low124 Ų124126.7 Ų126.775%0.75273%0.734SS**  trans-115.8133-178.9173.80000110.7
138T33.3Very low45.2Very low134 Ų134123.1 Ų123.182%0.82272%0.719SS**  trans-151.6118.8155.110000113.7
139S32.5Very low48.4Very low88 Ų88116.4 Ų116.462%0.61568%0.678SS**  trans62.9121.716475.70000119.9
140P46.3Very low51.7Low141 Ų141114 Ų11492%0.91666%0.664SS**  trans-85.4102.7159.432.7-28.7000109.8
141S36.8Very low55Low89 Ų89111.3 Ų111.362%0.62264%0.636SS**  trans-116.7108.5-177.949.20000113
142S40.9Very low58.1Low94 Ų94104.3 Ų104.366%0.65760%0.599SS**  trans59.5130.8171.263.50000118.1R144S142-R144 VanDerWaalsContact C-N 3.3Å; S142-R144 PolarHBondContact O-N 2.99Å; S142-R144 VanDerWaalsContact OG-CG 3.29Å; S142-R144 WeakPolarHBondContact OG-CG 3.47Å
143K48.5Very low61.1Low215 Ų215100.8 Ų100.894%0.93559%0.593SS**  trans-67.194152.8-71.4-178179.6179.30107
144R54.2Low64.2Low212 Ų21296.9 Ų96.980%0.857%0.565SS**  trans-78.9126.9169.8-64-173.3-70.2-161.8-3.9108.1S142 A146S142-R144 VanDerWaalsContact C-N 3.3Å; S142-R144 PolarHBondContact O-N 2.99Å; S142-R144 VanDerWaalsContact OG-CG 3.29Å; S142-R144 WeakPolarHBondContact OG-CG 3.47Å; R144-A146 PolarHBondContact O-N 3.11Å; R144-A146 VanDerWaalsContact O-N 3.13Å
145D65.1Low67.4Low133 Ų13397.4 Ų97.471%0.71155%0.552SS**  trans-59.5117.4177-63.5-58.5000110.1H147D145-H147 VanDerWaalsContact C-N 3.35Å; D145-H147 PolarHBondContact O-N 3.15Å
146A76.5Confident70.4Confident60 Ų6094.1 Ų94.150%0.49653%0.531SS..  trans-78.184.5-173.800000110.1R144 F148 Y155R144-A146 PolarHBondContact O-N 3.11Å; R144-A146 VanDerWaalsContact O-N 3.13Å; A146-F148 WeakPolarHBondContact O-CD2 3.4Å; A146-F148 WeakPolarHBondContact O-CE2 3.4Å; A146-F148 PolarHBondContact O-N 3.46Å; A146-Y155 HydrophobicContact CB-CD1 4.44Å; A146-Y155 HydrophobicContact CB-CE1 4.23Å
147H90.3Very high72.8Confident86 Ų8690.5 Ų90.540%0.39851%0.509SS..  trans-60.9136.7177.8-60.5-59.2000111.7D145 A156 W164D145-H147 VanDerWaalsContact C-N 3.35Å; D145-H147 PolarHBondContact O-N 3.15Å; H147-A156 HydrophobicContact CB-CB 4.27Å; H147-A156 VanDerWaalsContact O-CB 3.24Å; H147-A156 WeakPolarHBondContact O-CB 3.26Å; H147-A156 PolarHBondContact O-N 2.96Å; H147-W164 HydrophobicContact CB-CB 4.49Å; H147-W164 HydrophobicContact CB-CD2 3.82Å; H147-W164 HydrophobicContact CB-CE3 3.81Å; H147-W164 HydrophobicContact CB-CG 4.13Å; H147-W164 HydrophobicContact CB-CZ3 4.33Å; H147-W164 AromaticContact CD2-CD2 3.92Å; H147-W164 AromaticContact CD2-CE2 3.67Å; H147-W164 AromaticContact CD2-CE3 3.85Å; H147-W164 AromaticContact CD2-CH2 3.35Å; H147-W164 WeakPolarHBondContact CD2-CH2 3.28Å; H147-W164 AromaticContact CD2-CZ2 3.4Å; H147-W164 VanDerWaalsContact CD2-CZ2 3.4Å; H147-W164 WeakPolarHBondContact CD2-CZ2 3.3Å; H147-W164 AromaticContact CD2-CZ3 3.57Å; H147-W164 AromaticContact CG-CD2 3.83Å; H147-W164 AromaticContact CG-CE2 3.84Å; H147-W164 AromaticContact NE2-CE2 3.95Å; H147-W164 AromaticContact NE2-CH2 3.77Å; H147-W164 AromaticContact NE2-CZ2 3.5Å; H147-W164 WeakPolarHBondContact NE2-CZ2 3.28Å
148F96.6Very high75.4Confident116 Ų11685.3 Ų85.351%0.50948%0.48SS..BIsolated β-bridgetrans-98.7152.7176.9-65.5-80.8000111.6A146 A150 S153 Y155A146-F148 WeakPolarHBondContact O-CD2 3.4Å; A146-F148 WeakPolarHBondContact O-CE2 3.4Å; A146-F148 PolarHBondContact O-N 3.46Å; F148-A150 PolarHBondContact O-N 3.37Å; F148-S153 WeakPolarHBondContact CD1-O 3.46Å; F148-Y155 HydrophobicContact CD1-CD1 4.34Å; F148-Y155 AromaticContact CE1-CD1 3.91Å; F148-Y155 HydrophobicContact CE1-CD1 3.91Å; F148-Y155 AromaticContact CE1-CE1 3.67Å; F148-Y155 HydrophobicContact CE1-CE1 3.67Å; F148-Y155 HydrophobicContact CZ-CE1 4.04Å
149C97.6Very high78.3Confident1 Ų186 Ų861%0.00747%0.469CS..  trans-72.8112.3179.4176.20000110.7V151 C152 S153 D154 W164 C166C149-V151 PolarHBondContact O-N 3.18Å; C149-C152 PolarHBondContact O-N 2.89Å; C149-S153 WeakPolarHBondContact O-CA 3.39Å; C149-S153 PolarHBondContact O-N 3.2Å; C149-D154 WeakPolarHBondContact CB-O 3.4Å; C149-D154 PolarHBondContact N-O 3.42Å; C149-W164 WeakPolarHBondContact CA-O 3.38Å; C149-C166 HydrophobicContact CB-CB 3.98Å; C149-C166 PolarHBondContact SG-N 3.02Å
150A96.9Very high81.2Confident52 Ų5283.6 Ų83.643%0.4345%0.448SS..THydrogen-bonded Turntrans-54.4-26.3-176.500000114.2F148 W164 V212F148-A150 PolarHBondContact O-N 3.37Å; A150-W164 PolarHBondContact N-O 3.26Å; A150-V212 HydrophobicContact CB-CB 4Å; A150-V212 HydrophobicContact CB-CG1 4.08Å; A150-V212 HydrophobicContact CB-CG2 4.16Å
151V97.6Very high83.5Confident3 Ų379.8 Ų79.82%0.01842%0.416CS..THydrogen-bonded Turntrans-80.1-28.5-178.6-177.10000113.7C149 C169 I193 R205 K208 V212 M214C149-V151 PolarHBondContact O-N 3.18Å; V151-C169 HydrophobicContact CB-CB 4.31Å; V151-C169 HydrophobicContact CG1-CB 4.45Å; V151-C169 HydrophobicContact CG2-CB 4.46Å; V151-I193 HydrophobicContact CG1-CG2 4.38Å; V151-I193 VanDerWaalsContact O-CG2 3.26Å; V151-I193 WeakPolarHBondContact O-CG2 3.47Å; V151-R205 HydrophobicContact CG1-CG 4.43Å; V151-K208 HydrophobicContact CG1-CB 4.38Å; V151-K208 HydrophobicContact CG1-CG 4.36Å; V151-V212 HydrophobicContact CG2-CG2 3.63Å; V151-M214 HydrophobicContact CG2-SD 3.67Å
152C96.9Very high86.1Confident2 Ų277.1 Ų77.11%0.01440%0.402CS..THydrogen-bonded Turntrans-156.610.4-168.268.70000116.5C149 D154 I193 D194 K195 R198C149-C152 PolarHBondContact O-N 2.89Å; C152-D154 PolarHBondContact O-N 3.11Å; C152-I193 HydrophobicContact CB-CG2 4.06Å; C152-D194 CarbonylContact O-C 3.59Å; C152-K195 PolarHBondContact O-N 3.33Å; C152-K195 VanDerWaalsContact O-N 3.11Å; C152-R198 HydrophobicContact CB-CB 4.43Å; C152-R198 PolarHBondContact SG-NH1 2.95Å
153S95.9Very high88.7Confident91 Ų9173.1 Ų73.164%0.63637%0.374SS*.SBendtrans57.511.6176.9-50.10000117.1F148 C149F148-S153 WeakPolarHBondContact CD1-O 3.46Å; C149-S153 WeakPolarHBondContact O-CA 3.39Å; C149-S153 PolarHBondContact O-N 3.2Å
154D96Very high91Very high22 Ų2268 Ų6812%0.11835%0.348CS..SBendtrans-72160.4165.5-162.27.9000110.7C149 C152 A156 C166 K195 R198C149-D154 WeakPolarHBondContact CB-O 3.4Å; C149-D154 PolarHBondContact N-O 3.42Å; C152-D154 PolarHBondContact O-N 3.11Å; D154-A156 PolarHBondContact O-N 3.32Å; D154-C166 HydrophobicContact CB-CB 4.37Å; D154-K195 HydrophobicContact CB-CB 4.31Å; D154-K195 HydrophobicContact CB-CD 4.18Å; D154-K195 HydrophobicContact CB-CG 4.15Å; D154-K195 WeakPolarHBondContact OD1-CD 3.23Å; D154-K195 WeakPolarHBondContact OD1-CE 3.41Å; D154-K195 IonicContact OD1-NZ 2.65Å; D154-K195 PolarHBondContact OD1-NZ 3.25Å; D154-R198 IonicContact OD2-CZ 2.77Å; D154-R198 IonicContact OD2-NH1 3.84Å; D154-R198 PolarHBondContact OD2-NH1 3.48Å; D154-R198 IonicContact OD2-NH2 2.98Å; D154-R198 PolarHBondContact OD2-NH2 3.27Å
155Y96.8Very high93.1Very high151 Ų15157.9 Ų57.959%0.59231%0.31SS*.BIsolated β-bridgetrans-59.1131.2179.5-71-76000111.7A146 F148 C166A146-Y155 HydrophobicContact CB-CD1 4.44Å; A146-Y155 HydrophobicContact CB-CE1 4.23Å; F148-Y155 HydrophobicContact CD1-CD1 4.34Å; F148-Y155 AromaticContact CE1-CD1 3.91Å; F148-Y155 HydrophobicContact CE1-CD1 3.91Å; F148-Y155 AromaticContact CE1-CE1 3.67Å; F148-Y155 HydrophobicContact CE1-CE1 3.67Å; F148-Y155 HydrophobicContact CZ-CE1 4.04Å; Y155-C166 WeakPolarHBondContact O-CB 3.32Å
156A96.6Very high94.6Very high24 Ų2451.8 Ų51.820%0.19828%0.278CS..PPolyproline II helixtrans-75137.5177.200000110.6H147 D154 W164 S165H147-A156 HydrophobicContact CB-CB 4.27Å; H147-A156 VanDerWaalsContact O-CB 3.24Å; H147-A156 WeakPolarHBondContact O-CB 3.26Å; H147-A156 PolarHBondContact O-N 2.96Å; D154-A156 PolarHBondContact O-N 3.32Å; A156-W164 HydrophobicContact CB-CB 4.24Å; A156-W164 HydrophobicContact CB-CE3 4.24Å; A156-S165 WeakPolarHBondContact CA-O 3.41Å
157S95.1Very high95.6Very high62 Ų6253.3 Ų53.343%0.43428%0.275SS..  trans-88.7-12.4172.356.30000112.4H160 S165 E167S157-H160 PolarHBondContact OG-NE2 3.16Å; S157-S165 PolarHBondContact N-O 3.3Å; S157-S165 PolarHBondContact OG-O 3.49Å; S157-E167 VanDerWaalsContact CB-OE1 3.3Å; S157-E167 WeakPolarHBondContact CB-OE1 3.44Å; S157-E167 PolarHBondContact OG-N 3.48Å; S157-E167 PolarHBondContact OG-OE1 3.18Å
158G92.9Very high95.9Very high15 Ų1550.9 Ų50.916%0.15527%0.273CS..EExtended strand (participates in β ladder)trans164.7-170.8-179.100000112.1H160 S165G158-H160 PolarHBondContact N-NE2 3.17Å; G158-H160 PolarHBondContact O-CD2 3.45Å; G158-S165 PolarHBondContact O-N 3.17Å
159Y94Very high96Very high149 Ų14945.3 Ų45.358%0.58425%0.249SC*.EExtended strand (participates in β ladder)trans-97.8102.4175.1-168.6-99.5000108.8G162 V163 W164Y159-G162 WeakPolarHBondContact CE2-O 3.46Å; Y159-G162 PolarHBondContact OH-O 3.35Å; Y159-V163 CarbonylContact C-O 3.56Å; Y159-V163 WeakPolarHBondContact CA-O 3.44Å; Y159-V163 VanDerWaalsContact CD2-C 3.47Å; Y159-W164 HydrophobicContact CD2-CD2 4.18Å; Y159-W164 HydrophobicContact CD2-CG 4.11Å
160H94.4Very high96Very high38 Ų3848 Ų4818%0.17626%0.26CS..EExtended strand (participates in β ladder)trans-119.9138.5-175.3-47.2-82.3000109.9S157 G158 G162 V163 S165 E167 K170S157-H160 PolarHBondContact OG-NE2 3.16Å; G158-H160 PolarHBondContact N-NE2 3.17Å; G158-H160 PolarHBondContact O-CD2 3.45Å; H160-G162 PolarHBondContact O-N 2.86Å; H160-V163 PolarHBondContact N-O 3.2Å; H160-V163 PolarHBondContact O-N 2.99Å; H160-V163 VanDerWaalsContact O-N 3.09Å; H160-V163 VanDerWaalsContact O-O 3.07Å; H160-S165 WeakPolarHBondContact CB-OG 3.48Å; H160-S165 PolarHBondContact CD2-O 3.19Å; H160-S165 PolarHBondContact CD2-OG 2.93Å; H160-E167 IonicContact CE1-OE1 3.12Å; H160-E167 IonicContact NE2-OE1 3.01Å; H160-K170 HydrophobicContact CB-CB 4.24Å; H160-K170 HydrophobicContact CB-CD 4.38Å; H160-K170 HydrophobicContact CB-CG 3.92Å; H160-K170 VanDerWaalsContact ND1-CE 3.31Å; H160-K170 WeakPolarHBondContact ND1-CE 3.32Å
161Y93.8Very high95.9Very high61 Ų6147.5 Ų47.524%0.23926%0.256CS..THydrogen-bonded Turntrans54.923.4178.8-57.4-74000114.8K170 F173 K174 I177 M214 V215Y161-K170 HydrophobicContact CD2-CG 4.49Å; Y161-K170 HydrophobicContact CE2-CG 3.96Å; Y161-F173 AromaticContact CD1-CD1 3.98Å; Y161-F173 HydrophobicContact CD1-CD1 3.98Å; Y161-F173 AromaticContact CD1-CE1 3.97Å; Y161-F173 HydrophobicContact CD1-CE1 3.97Å; Y161-F173 AromaticContact CD2-CD1 3.75Å; Y161-F173 HydrophobicContact CD2-CD1 3.75Å; Y161-F173 HydrophobicContact CD2-CE1 4.43Å; Y161-F173 HydrophobicContact CE1-CD1 4.41Å; Y161-F173 HydrophobicContact CE2-CD1 4.19Å; Y161-F173 AromaticContact CG-CD1 3.63Å; Y161-F173 HydrophobicContact CG-CD1 3.63Å; Y161-F173 AromaticContact CG-CE1 3.85Å; Y161-F173 HydrophobicContact CG-CE1 3.85Å; Y161-K174 WeakPolarHBondContact OH-CB 3.36Å; Y161-K174 WeakPolarHBondContact OH-CG 3.46Å; Y161-I177 HydrophobicContact CE1-CD1 4.13Å; Y161-M214 HydrophobicContact CD2-CE 3.83Å; Y161-M214 HydrophobicContact CG-CE 4.31Å; Y161-M214 CarbonylContact O-C 3.23Å; Y161-M214 WeakPolarHBondContact O-CA 3.37Å; Y161-V215 WeakPolarHBondContact CB-O 3.4Å; Y161-V215 WeakPolarHBondContact CD1-O 3.35Å; Y161-V215 PolarHBondContact O-N 2.97Å
162G91.4Very high95.9Very high33 Ų3347.8 Ų47.834%0.3426%0.257SS..THydrogen-bonded Turntrans96.24.2-179.100000115.8Y159 H160Y159-G162 WeakPolarHBondContact CE2-O 3.46Å; Y159-G162 PolarHBondContact OH-O 3.35Å; H160-G162 PolarHBondContact O-N 2.86Å
163V95.8Very high95.8Very high9 Ų947.7 Ų47.76%0.05526%0.256CS..EExtended strand (participates in β ladder)trans-141.2153.2177.8-450000113.3Y159 H160 S165 V212 M214Y159-V163 CarbonylContact C-O 3.56Å; Y159-V163 WeakPolarHBondContact CA-O 3.44Å; Y159-V163 VanDerWaalsContact CD2-C 3.47Å; H160-V163 PolarHBondContact N-O 3.2Å; H160-V163 PolarHBondContact O-N 2.99Å; H160-V163 VanDerWaalsContact O-N 3.09Å; H160-V163 VanDerWaalsContact O-O 3.07Å; V163-S165 PolarHBondContact O-N 2.89Å; V163-S165 PolarHBondContact O-OG 3.2Å; V163-V212 HydrophobicContact CG1-CG2 4.11Å; V163-V212 WeakPolarHBondContact CG1-O 3.38Å; V163-V212 HydrophobicContact CG2-CG2 4.28Å; V163-M214 HydrophobicContact CB-CG 4.43Å; V163-M214 HydrophobicContact CG1-CG 4.03Å; V163-M214 HydrophobicContact CG2-CE 4.14Å; V163-M214 HydrophobicContact CG2-CG 3.48Å; V163-M214 VanDerWaalsContact CG2-CG 3.48Å; V163-M214 HydrophobicContact CG2-SD 3.99Å
164W97.2Very high95.7Very high108 Ų10848.5 Ų48.541%0.40925%0.248SC..EExtended strand (participates in β ladder)trans-61.5116.2163.9-71.7109.1000109.7H147 C149 A150 A156 Y159H147-W164 HydrophobicContact CB-CB 4.49Å; H147-W164 HydrophobicContact CB-CD2 3.82Å; H147-W164 HydrophobicContact CB-CE3 3.81Å; H147-W164 HydrophobicContact CB-CG 4.13Å; H147-W164 HydrophobicContact CB-CZ3 4.33Å; H147-W164 AromaticContact CD2-CD2 3.92Å; H147-W164 AromaticContact CD2-CE2 3.67Å; H147-W164 AromaticContact CD2-CE3 3.85Å; H147-W164 AromaticContact CD2-CH2 3.35Å; H147-W164 WeakPolarHBondContact CD2-CH2 3.28Å; H147-W164 AromaticContact CD2-CZ2 3.4Å; H147-W164 VanDerWaalsContact CD2-CZ2 3.4Å; H147-W164 WeakPolarHBondContact CD2-CZ2 3.3Å; H147-W164 AromaticContact CD2-CZ3 3.57Å; H147-W164 AromaticContact CG-CD2 3.83Å; H147-W164 AromaticContact CG-CE2 3.84Å; H147-W164 AromaticContact NE2-CE2 3.95Å; H147-W164 AromaticContact NE2-CH2 3.77Å; H147-W164 AromaticContact NE2-CZ2 3.5Å; H147-W164 WeakPolarHBondContact NE2-CZ2 3.28Å; C149-W164 WeakPolarHBondContact CA-O 3.38Å; A150-W164 PolarHBondContact N-O 3.26Å; A156-W164 HydrophobicContact CB-CB 4.24Å; A156-W164 HydrophobicContact CB-CE3 4.24Å; Y159-W164 HydrophobicContact CD2-CD2 4.18Å; Y159-W164 HydrophobicContact CD2-CG 4.11Å
165S97.2Very high95.6Very high0 Ų054.9 Ų54.90%027%0.271CS..EExtended strand (participates in β ladder)trans-147.4154.7-174.148.20000112.7A156 S157 G158 H160 V163A156-S165 WeakPolarHBondContact CA-O 3.41Å; S157-S165 PolarHBondContact N-O 3.3Å; S157-S165 PolarHBondContact OG-O 3.49Å; G158-S165 PolarHBondContact O-N 3.17Å; H160-S165 WeakPolarHBondContact CB-OG 3.48Å; H160-S165 PolarHBondContact CD2-O 3.19Å; H160-S165 PolarHBondContact CD2-OG 2.93Å; V163-S165 PolarHBondContact O-N 2.89Å; V163-S165 PolarHBondContact O-OG 3.2Å
166C97.8Very high95.5Very high4 Ų448.2 Ų48.23%0.02725%0.246CC..  trans-85.6155.8173.867.80000111C149 D154 Y155 G168 C169 K170 R198C149-C166 HydrophobicContact CB-CB 3.98Å; C149-C166 PolarHBondContact SG-N 3.02Å; D154-C166 HydrophobicContact CB-CB 4.37Å; Y155-C166 WeakPolarHBondContact O-CB 3.32Å; C166-G168 PolarHBondContact O-N 3.36Å; C166-G168 VanDerWaalsContact O-N 3.09Å; C166-C169 PolarHBondContact O-N 3.39Å; C166-K170 PolarHBondContact O-N 3.28Å; C166-R198 PolarHBondContact SG-NH1 2.88Å
167E97.3Very high95.1Very high92 Ų9248.6 Ų48.643%0.4325%0.245SC..Hα-helixtrans-49.8-38.2175.6-68.7-55.8117.400112.4S157 H160 C169 K170 A171S157-E167 VanDerWaalsContact CB-OE1 3.3Å; S157-E167 WeakPolarHBondContact CB-OE1 3.44Å; S157-E167 PolarHBondContact OG-N 3.48Å; S157-E167 PolarHBondContact OG-OE1 3.18Å; H160-E167 IonicContact CE1-OE1 3.12Å; H160-E167 IonicContact NE2-OE1 3.01Å; E167-C169 VanDerWaalsContact C-N 3.33Å; E167-C169 PolarHBondContact O-N 2.97Å; E167-K170 PolarHBondContact O-N 2.88Å; E167-K170 VanDerWaalsContact OE1-CD 3.31Å; E167-K170 WeakPolarHBondContact OE1-CD 3.5Å; E167-K170 IonicContact OE1-NZ 3.54Å; E167-K170 PolarHBondContact OE1-NZ 3.49Å; E167-K170 VanDerWaalsContact OE2-CD 3.29Å; E167-K170 WeakPolarHBondContact OE2-CD 3.39Å; E167-K170 WeakPolarHBondContact OE2-CE 3.19Å; E167-K170 IonicContact OE2-NZ 2.65Å; E167-K170 PolarHBondContact OE2-NZ 3.5Å; E167-A171 VanDerWaalsContact O-CB 3.23Å; E167-A171 WeakPolarHBondContact O-CB 3.45Å; E167-A171 PolarHBondContact O-N 2.96Å
168G97.1Very high94.5Very high35 Ų3552.5 Ų52.536%0.36126%0.256SS..Hα-helixtrans-61.5-34178.900000114.3C166 F172 R205C166-G168 PolarHBondContact O-N 3.36Å; C166-G168 VanDerWaalsContact O-N 3.09Å; G168-F172 WeakPolarHBondContact O-CB 3.4Å; G168-F172 PolarHBondContact O-N 3.44Å; G168-R205 PolarHBondContact O-NH2 2.66Å
169C97.8Very high93.6Very high0 Ų053.6 Ų53.60%027%0.267CS..Hα-helixtrans-89.2-39.2176.7-72.80000112.3V151 C166 E167 A171 F172 F173 R205V151-C169 HydrophobicContact CB-CB 4.31Å; V151-C169 HydrophobicContact CG1-CB 4.45Å; V151-C169 HydrophobicContact CG2-CB 4.46Å; C166-C169 PolarHBondContact O-N 3.39Å; E167-C169 VanDerWaalsContact C-N 3.33Å; E167-C169 PolarHBondContact O-N 2.97Å; C169-A171 PolarHBondContact O-N 3.24Å; C169-F172 PolarHBondContact O-N 2.97Å; C169-F173 VanDerWaalsContact O-CB 3.31Å; C169-F173 WeakPolarHBondContact O-CB 3.29Å; C169-F173 PolarHBondContact O-N 3.47Å; C169-R205 PolarHBondContact SG-NH2 2.96Å
170K96.8Very high91.9Very high57 Ų5754.5 Ų54.525%0.24828%0.276CS..Hα-helixtrans-51.8-51.6169.7172-157.9-174.1-174.40112.1H160 Y161 C166 E167 K174H160-K170 HydrophobicContact CB-CB 4.24Å; H160-K170 HydrophobicContact CB-CD 4.38Å; H160-K170 HydrophobicContact CB-CG 3.92Å; H160-K170 VanDerWaalsContact ND1-CE 3.31Å; H160-K170 WeakPolarHBondContact ND1-CE 3.32Å; Y161-K170 HydrophobicContact CD2-CG 4.49Å; Y161-K170 HydrophobicContact CE2-CG 3.96Å; C166-K170 PolarHBondContact O-N 3.28Å; E167-K170 PolarHBondContact O-N 2.88Å; E167-K170 VanDerWaalsContact OE1-CD 3.31Å; E167-K170 WeakPolarHBondContact OE1-CD 3.5Å; E167-K170 IonicContact OE1-NZ 3.54Å; E167-K170 PolarHBondContact OE1-NZ 3.49Å; E167-K170 VanDerWaalsContact OE2-CD 3.29Å; E167-K170 WeakPolarHBondContact OE2-CD 3.39Å; E167-K170 WeakPolarHBondContact OE2-CE 3.19Å; E167-K170 IonicContact OE2-NZ 2.65Å; E167-K170 PolarHBondContact OE2-NZ 3.5Å; K170-K174 PolarHBondContact O-N 3.38Å
171A95.8Very high90.9Very high41 Ų4155.5 Ų55.534%0.33928%0.283SS..Hα-helixtrans-73.9-28.4-178.600000113.5E167 C169 R175E167-A171 VanDerWaalsContact O-CB 3.23Å; E167-A171 WeakPolarHBondContact O-CB 3.45Å; E167-A171 PolarHBondContact O-N 2.96Å; C169-A171 PolarHBondContact O-N 3.24Å; A171-R175 PolarHBondContact O-NH1 3.45Å
172F97.1Very high90.3Very high9 Ų958.4 Ų58.44%0.03930%0.303CS..Hα-helixtrans-65.4-57.6169.7170.8-102.7000110.1G168 C169 K174 R175 S176 Y183 Q202 R205 L206G168-F172 WeakPolarHBondContact O-CB 3.4Å; G168-F172 PolarHBondContact O-N 3.44Å; C169-F172 PolarHBondContact O-N 2.97Å; F172-K174 VanDerWaalsContact C-N 3.31Å; F172-K174 PolarHBondContact O-N 3.5Å; F172-R175 PolarHBondContact O-N 3.24Å; F172-S176 PolarHBondContact O-N 2.9Å; F172-S176 PolarHBondContact O-OG 3.34Å; F172-S176 VanDerWaalsContact O-OG 3.08Å; F172-Y183 AromaticContact CE2-CE2 3.87Å; F172-Y183 HydrophobicContact CE2-CE2 3.87Å; F172-Y183 HydrophobicContact CZ-CD2 4.3Å; F172-Y183 AromaticContact CZ-CE2 3.64Å; F172-Y183 HydrophobicContact CZ-CE2 3.64Å; F172-Q202 HydrophobicContact CE2-CB 4.2Å; F172-Q202 HydrophobicContact CE2-CG 4.25Å; F172-Q202 HydrophobicContact CZ-CB 4.28Å; F172-Q202 WeakPolarHBondContact CZ-O 3.37Å; F172-R205 HydrophobicContact CD1-CG 3.92Å; F172-R205 HydrophobicContact CE1-CB 3.96Å; F172-R205 HydrophobicContact CE1-CG 3.61Å; F172-R205 HydrophobicContact CZ-CB 4.15Å; F172-R205 HydrophobicContact CZ-CG 4.19Å; F172-L206 HydrophobicContact CE1-CB 4.02Å; F172-L206 HydrophobicContact CE1-CD1 4.49Å; F172-L206 HydrophobicContact CZ-CB 4.13Å
173F95.8Very high90.4Very high0 Ų059 Ų590%030%0.295CS..Hα-helixtrans-53.7-45.2-179.7-170.6-109.9000112Y161 C169 R175 S176 I177 L206 C209 Y210 M214Y161-F173 AromaticContact CD1-CD1 3.98Å; Y161-F173 HydrophobicContact CD1-CD1 3.98Å; Y161-F173 AromaticContact CD1-CE1 3.97Å; Y161-F173 HydrophobicContact CD1-CE1 3.97Å; Y161-F173 AromaticContact CD2-CD1 3.75Å; Y161-F173 HydrophobicContact CD2-CD1 3.75Å; Y161-F173 HydrophobicContact CD2-CE1 4.43Å; Y161-F173 HydrophobicContact CE1-CD1 4.41Å; Y161-F173 HydrophobicContact CE2-CD1 4.19Å; Y161-F173 AromaticContact CG-CD1 3.63Å; Y161-F173 HydrophobicContact CG-CD1 3.63Å; Y161-F173 AromaticContact CG-CE1 3.85Å; Y161-F173 HydrophobicContact CG-CE1 3.85Å; C169-F173 VanDerWaalsContact O-CB 3.31Å; C169-F173 WeakPolarHBondContact O-CB 3.29Å; C169-F173 PolarHBondContact O-N 3.47Å; F173-R175 VanDerWaalsContact C-N 3.32Å; F173-R175 PolarHBondContact O-N 3.34Å; F173-S176 PolarHBondContact O-N 3.08Å; F173-I177 HydrophobicContact CD1-CD1 3.86Å; F173-I177 HydrophobicContact CD1-CG2 4.32Å; F173-I177 HydrophobicContact CD2-CG2 4.13Å; F173-I177 HydrophobicContact CE1-CD1 3.72Å; F173-I177 HydrophobicContact CE1-CG2 4.01Å; F173-I177 HydrophobicContact CE2-CG2 3.8Å; F173-I177 HydrophobicContact CG-CG2 4.38Å; F173-I177 HydrophobicContact CZ-CD1 4.44Å; F173-I177 HydrophobicContact CZ-CG2 3.73Å; F173-I177 WeakPolarHBondContact O-CG1 3.38Å; F173-I177 WeakPolarHBondContact O-CG2 3.36Å; F173-I177 PolarHBondContact O-N 3.46Å; F173-L206 HydrophobicContact CD2-CD1 4.02Å; F173-L206 HydrophobicContact CE2-CD1 4.28Å; F173-C209 HydrophobicContact CD2-CB 3.51Å; F173-C209 HydrophobicContact CE2-CB 3.88Å; F173-C209 HydrophobicContact CG-CB 4.43Å; F173-Y210 AromaticContact CE2-CD1 3.85Å; F173-Y210 HydrophobicContact CE2-CD1 3.85Å; F173-Y210 AromaticContact CE2-CE1 3.52Å; F173-Y210 HydrophobicContact CE2-CE1 3.52Å; F173-Y210 HydrophobicContact CZ-CD1 4.18Å; F173-Y210 AromaticContact CZ-CE1 3.79Å; F173-Y210 HydrophobicContact CZ-CE1 3.79Å; F173-M214 HydrophobicContact CB-CE 4.16Å; F173-M214 HydrophobicContact CB-SD 4.43Å; F173-M214 HydrophobicContact CD1-CB 4.12Å; F173-M214 HydrophobicContact CD1-CE 4.19Å; F173-M214 HydrophobicContact CD2-CB 4.12Å; F173-M214 HydrophobicContact CE1-CB 3.79Å; F173-M214 HydrophobicContact CE2-CB 3.79Å; F173-M214 HydrophobicContact CG-CB 4.27Å; F173-M214 HydrophobicContact CG-CE 4.21Å; F173-M214 HydrophobicContact CG-SD 4.32Å; F173-M214 VanDerWaalsContact CZ-C 3.47Å; F173-M214 HydrophobicContact CZ-CB 3.62Å; F173-M214 WeakPolarHBondContact CZ-O 3.43Å
174K93.4Very high90.2Very high109 Ų10965.9 Ų65.947%0.47433%0.33SS..Hα-helixtrans-53.4-44.7175.5-171-177.2175-173.30113Y161 K170 F172 Q178Y161-K174 WeakPolarHBondContact OH-CB 3.36Å; Y161-K174 WeakPolarHBondContact OH-CG 3.46Å; K170-K174 PolarHBondContact O-N 3.38Å; F172-K174 VanDerWaalsContact C-N 3.31Å; F172-K174 PolarHBondContact O-N 3.5Å; K174-Q178 WeakPolarHBondContact O-CB 3.32Å; K174-Q178 PolarHBondContact O-N 2.85Å
175R94.1Very high90.1Very high155 Ų15561.5 Ų61.559%0.58532%0.315SS*.Hα-helixtrans-70.3-43.1179.8-69.9-171.1-61.9-93.62111.2A171 F172 F173 I177 Q178 G179 N181A171-R175 PolarHBondContact O-NH1 3.45Å; F172-R175 PolarHBondContact O-N 3.24Å; F173-R175 VanDerWaalsContact C-N 3.32Å; F173-R175 PolarHBondContact O-N 3.34Å; R175-I177 VanDerWaalsContact C-N 3.29Å; R175-I177 PolarHBondContact O-N 2.83Å; R175-Q178 PolarHBondContact O-N 3.15Å; R175-G179 PolarHBondContact O-N 3.31Å; R175-G179 VanDerWaalsContact O-N 3.07Å; R175-N181 PolarHBondContact O-ND2 3.23Å
176S93.4Very high89.7Confident11 Ų1166.8 Ų66.88%0.07735%0.35CS..Hα-helixtrans-66.2-26-178.7-49.20000114.1F172 F173 Y183F172-S176 PolarHBondContact O-N 2.9Å; F172-S176 PolarHBondContact O-OG 3.34Å; F172-S176 VanDerWaalsContact O-OG 3.08Å; F173-S176 PolarHBondContact O-N 3.08Å; S176-Y183 VanDerWaalsContact OG-CE2 3.32Å; S176-Y183 WeakPolarHBondContact OG-CE2 3.39Å; S176-Y183 PolarHBondContact OG-OH 3.13Å
177I88.8Confident89.4Confident32 Ų3269.2 Ų69.216%0.16437%0.37CS..THydrogen-bonded Turntrans-95.53175.272.4-173.1000114.2Y161 F173 R175 K216Y161-I177 HydrophobicContact CE1-CD1 4.13Å; F173-I177 HydrophobicContact CD1-CD1 3.86Å; F173-I177 HydrophobicContact CD1-CG2 4.32Å; F173-I177 HydrophobicContact CD2-CG2 4.13Å; F173-I177 HydrophobicContact CE1-CD1 3.72Å; F173-I177 HydrophobicContact CE1-CG2 4.01Å; F173-I177 HydrophobicContact CE2-CG2 3.8Å; F173-I177 HydrophobicContact CG-CG2 4.38Å; F173-I177 HydrophobicContact CZ-CD1 4.44Å; F173-I177 HydrophobicContact CZ-CG2 3.73Å; F173-I177 WeakPolarHBondContact O-CG1 3.38Å; F173-I177 WeakPolarHBondContact O-CG2 3.36Å; F173-I177 PolarHBondContact O-N 3.46Å; R175-I177 VanDerWaalsContact C-N 3.29Å; R175-I177 PolarHBondContact O-N 2.83Å; I177-K216 HydrophobicContact CD1-CB 4.05Å; I177-K216 HydrophobicContact CD1-CD 4.47Å; I177-K216 HydrophobicContact CD1-CG 4.07Å
178Q82.9Confident89.2Confident145 Ų14570 Ų7068%0.67838%0.382SS*.THydrogen-bonded Turntrans-128.1-8.8-174.5-167.9162.713.600114.2K174 R175K174-Q178 WeakPolarHBondContact O-CB 3.32Å; K174-Q178 PolarHBondContact O-N 2.85Å; R175-Q178 PolarHBondContact O-N 3.15Å
179G73.8Confident88.8Confident38 Ų3872 Ų7239%0.39238%0.384SS..SBendtrans-131159.2167.200000111.6R175 N181R175-G179 PolarHBondContact O-N 3.31Å; R175-G179 VanDerWaalsContact O-N 3.07Å; G179-N181 PolarHBondContact O-N 3.37Å; G179-N181 PolarHBondContact O-ND2 2.98Å
180H57.8Low88.6Confident167 Ų16779.6 Ų79.677%0.77342%0.42SS*.  trans-67.3102.2174.4-149.4-71.5000109.1D182H180-D182 IonicContact CE1-OD1 3.1Å; H180-D182 IonicContact CE1-OD2 3.28Å; H180-D182 PolarHBondContact CE1-OD2 2.7Å; H180-D182 VanDerWaalsContact CE1-OD2 3.26Å; H180-D182 IonicContact CG-OD2 2.65Å; H180-D182 IonicContact ND1-OD1 2.74Å; H180-D182 IonicContact ND1-OD2 2.84Å; H180-D182 PolarHBondContact ND1-OD2 3.26Å
181N74Confident88.5Confident59 Ų5978.8 Ų78.832%0.31642%0.421SS..  trans-126.682.5-171.4-79.9-100.1000110.3R175 G179 Y183R175-N181 PolarHBondContact O-ND2 3.23Å; G179-N181 PolarHBondContact O-N 3.37Å; G179-N181 PolarHBondContact O-ND2 2.98Å; N181-Y183 HydrophobicContact CB-CD1 4.21Å; N181-Y183 HydrophobicContact CB-CE1 3.64Å; N181-Y183 HydrophobicContact CB-CE2 4.1Å; N181-Y183 VanDerWaalsContact CG-OH 3.3Å; N181-Y183 PolarHBondContact O-N 2.83Å; N181-Y183 VanDerWaalsContact OD1-CE1 3.32Å; N181-Y183 WeakPolarHBondContact OD1-CE1 3.43Å; N181-Y183 PolarHBondContact OD1-OH 3.08Å
182D81.3Confident88.5Confident122 Ų12281 Ų8165%0.65243%0.43SS*.  trans-78.371.9-179.5-53.3-73.4000111.1H180 I184H180-D182 IonicContact CE1-OD1 3.1Å; H180-D182 IonicContact CE1-OD2 3.28Å; H180-D182 PolarHBondContact CE1-OD2 2.7Å; H180-D182 VanDerWaalsContact CE1-OD2 3.26Å; H180-D182 IonicContact CG-OD2 2.65Å; H180-D182 IonicContact ND1-OD1 2.74Å; H180-D182 IonicContact ND1-OD2 2.84Å; H180-D182 PolarHBondContact ND1-OD2 3.26Å; D182-I184 PolarHBondContact O-N 3.13Å
183Y93.2Very high88.5Confident47 Ų4781.9 Ų81.918%0.18444%0.435CS..  trans-69.8103.9-179.6-57.9-37.2000111.3F172 S176 N181 Q202 A203 L206F172-Y183 AromaticContact CE2-CE2 3.87Å; F172-Y183 HydrophobicContact CE2-CE2 3.87Å; F172-Y183 HydrophobicContact CZ-CD2 4.3Å; F172-Y183 AromaticContact CZ-CE2 3.64Å; F172-Y183 HydrophobicContact CZ-CE2 3.64Å; S176-Y183 VanDerWaalsContact OG-CE2 3.32Å; S176-Y183 WeakPolarHBondContact OG-CE2 3.39Å; S176-Y183 PolarHBondContact OG-OH 3.13Å; N181-Y183 HydrophobicContact CB-CD1 4.21Å; N181-Y183 HydrophobicContact CB-CE1 3.64Å; N181-Y183 HydrophobicContact CB-CE2 4.1Å; N181-Y183 VanDerWaalsContact CG-OH 3.3Å; N181-Y183 PolarHBondContact O-N 2.83Å; N181-Y183 VanDerWaalsContact OD1-CE1 3.32Å; N181-Y183 WeakPolarHBondContact OD1-CE1 3.43Å; N181-Y183 PolarHBondContact OD1-OH 3.08Å; Y183-Q202 HydrophobicContact CD1-CB 3.68Å; Y183-Q202 HydrophobicContact CD1-CG 4.48Å; Y183-Q202 HydrophobicContact CD2-CB 3.78Å; Y183-Q202 HydrophobicContact CE1-CB 4.01Å; Y183-Q202 HydrophobicContact CE1-CG 4.48Å; Y183-Q202 HydrophobicContact CE2-CB 4.07Å; Y183-Q202 HydrophobicContact CG-CB 3.59Å; Y183-A203 WeakPolarHBondContact O-CB 3.45Å; Y183-L206 HydrophobicContact CD2-CB 4.07Å; Y183-L206 HydrophobicContact CD2-CD2 3.83Å; Y183-L206 HydrophobicContact CE2-CB 4.3Å; Y183-L206 HydrophobicContact CE2-CD2 3.97Å
184I90.8Very high88.5Confident153 Ų15384 Ų8479%0.78545%0.446SS*.  trans-77.1143.4167.4-57.3175.3000109.3D182D182-I184 PolarHBondContact O-N 3.13Å
185C95.3Very high88.5Confident15 Ų1583.7 Ų83.710%0.10145%0.445CS..  trans-88.3127.8172-174.40000109.9A187 N189 C191 A203C185-A187 PolarHBondContact O-N 2.88Å; C185-A187 PolarHBondContact SG-O 3.08Å; C185-N189 WeakPolarHBondContact CB-OD1 3.28Å; C185-C191 VanDerWaalsContact SG-SG 3.65Å; C185-A203 HydrophobicContact CB-CB 3.98Å
186P90.1Very high88.5Confident111 Ų11182.6 Ų82.672%0.72145%0.45SS*.SBendtrans-76.521.4177.234.5-37.9000113.2
187A90.9Very high88.4Confident55 Ų5587.9 Ų87.946%0.45547%0.469SS..SBendtrans-165.2-173.1-169.300000109.9C185 N189C185-A187 PolarHBondContact O-N 2.88Å; C185-A187 PolarHBondContact SG-O 3.08Å; A187-N189 PolarHBondContact O-N 3.26Å
188T92.1Very high88.7Confident109 Ų10988.3 Ų88.367%0.66947%0.468SS*.SBendtrans-67.525-173.957.20000116.8Q190T188-Q190 WeakPolarHBondContact O-CG 3.5Å; T188-Q190 PolarHBondContact O-N 3.28Å; T188-Q190 PolarHBondContact O-NE2 2.71Å
189N90.3Very high89.2Confident78 Ų7890 Ų9042%0.41747%0.473SS..SBendtrans59.111.6-177.5-82.8-65000116.4C185 A187 C204 R207C185-N189 WeakPolarHBondContact CB-OD1 3.28Å; A187-N189 PolarHBondContact O-N 3.26Å; N189-C204 PolarHBondContact O-SG 2.87Å; N189-R207 PolarHBondContact O-NH1 2.7Å; N189-R207 PolarHBondContact OD1-NH1 3.3Å; N189-R207 PolarHBondContact OD1-NH2 3.34Å
190Q92.8Very high90.3Very high159 Ų15992.3 Ų92.374%0.74348%0.483SS*.  trans-115.831.5-175.2-68.8168.767.100113T188 T192T188-Q190 WeakPolarHBondContact O-CG 3.5Å; T188-Q190 PolarHBondContact O-N 3.28Å; T188-Q190 PolarHBondContact O-NE2 2.71Å; Q190-T192 PolarHBondContact O-N 2.77Å
191C95.4Very high92.1Very high40 Ų4084.6 Ų84.627%0.2745%0.449SS..  trans-68.3125.7-178.7-54.70000111.7C185 C201 C204C185-C191 VanDerWaalsContact SG-SG 3.65Å; C191-C201 HydrophobicContact CB-CB 3.9Å; C191-C204 HydrophobicContact CB-CB 3.76Å
192T95Very high93.1Very high87 Ų8786.8 Ų86.853%0.53446%0.457SS..  trans-68.2132.2175.134.80000111.6Q190 R197Q190-T192 PolarHBondContact O-N 2.77Å; T192-R197 PolarHBondContact OG1-NH1 2.95Å; T192-R197 VanDerWaalsContact OG1-NH1 3.17Å; T192-R197 PolarHBondContact OG1-NH2 2.96Å; T192-R197 VanDerWaalsContact OG1-NH2 3.1Å
193I96.9Very high93.8Very high28 Ų2881.3 Ų81.314%0.14443%0.429CS..  trans-110.7108.2-173.3-52.6-58.4000110.3V151 C152 R198 C204 R205 K208V151-I193 HydrophobicContact CG1-CG2 4.38Å; V151-I193 VanDerWaalsContact O-CG2 3.26Å; V151-I193 WeakPolarHBondContact O-CG2 3.47Å; C152-I193 HydrophobicContact CB-CG2 4.06Å; I193-R198 HydrophobicContact CG2-CB 3.9Å; I193-C204 HydrophobicContact CD1-CB 4.04Å; I193-R205 HydrophobicContact CD1-CB 4.07Å; I193-R205 HydrophobicContact CG2-CG 4.23Å; I193-K208 HydrophobicContact CG1-CB 4.19Å; I193-K208 HydrophobicContact CG1-CG 4.5Å
194D96.2Very high94Very high44 Ų4479.3 Ų79.324%0.23542%0.422CS..  trans-129.8177.2175.161.957.8000111.3C152 N196 R197 R198C152-D194 CarbonylContact O-C 3.59Å; D194-N196 PolarHBondContact O-N 2.91Å; D194-N196 WeakPolarHBondContact OD1-CA 3.47Å; D194-N196 WeakPolarHBondContact OD1-CB 3.45Å; D194-N196 PolarHBondContact OD1-N 2.82Å; D194-R197 PolarHBondContact O-N 3.27Å; D194-R197 PolarHBondContact OD1-N 3.49Å; D194-R197 IonicContact OD2-CZ 2.75Å; D194-R197 IonicContact OD2-NE 2.7Å; D194-R197 PolarHBondContact OD2-NE 3.27Å; D194-R197 IonicContact OD2-NH2 2.73Å; D194-R197 PolarHBondContact OD2-NH2 3.22Å; D194-R198 WeakPolarHBondContact O-CB 3.25Å; D194-R198 VanDerWaalsContact O-CG 3.23Å; D194-R198 WeakPolarHBondContact O-CG 3.32Å; D194-R198 PolarHBondContact O-N 2.85Å
195K93.9Very high94.3Very high102 Ų10273.1 Ų73.144%0.44339%0.388SS..THydrogen-bonded Turntrans-50.6-32.9-179.2-177.3171-177.6152.10114.1C152 D154 R198C152-K195 PolarHBondContact O-N 3.33Å; C152-K195 VanDerWaalsContact O-N 3.11Å; D154-K195 HydrophobicContact CB-CB 4.31Å; D154-K195 HydrophobicContact CB-CD 4.18Å; D154-K195 HydrophobicContact CB-CG 4.15Å; D154-K195 WeakPolarHBondContact OD1-CD 3.23Å; D154-K195 WeakPolarHBondContact OD1-CE 3.41Å; D154-K195 IonicContact OD1-NZ 2.65Å; D154-K195 PolarHBondContact OD1-NZ 3.25Å; K195-R198 PolarHBondContact O-NE 3.39Å
196N93.9Very high94.4Very high132 Ų13273.5 Ų73.571%0.70639%0.389SS*.THydrogen-bonded Turntrans-94.8-46.7-173-6323.4000110.5D194D194-N196 PolarHBondContact O-N 2.91Å; D194-N196 WeakPolarHBondContact OD1-CA 3.47Å; D194-N196 WeakPolarHBondContact OD1-CB 3.45Å; D194-N196 PolarHBondContact OD1-N 2.82Å
197R91.9Very high94.7Very high123 Ų12372.9 Ų72.946%0.46437%0.372SS..THydrogen-bonded Turntrans-89.8-5-174.6-64.5-177.4-64.7160.87.6114.9T192 D194 K199 S200T192-R197 PolarHBondContact OG1-NH1 2.95Å; T192-R197 VanDerWaalsContact OG1-NH1 3.17Å; T192-R197 PolarHBondContact OG1-NH2 2.96Å; T192-R197 VanDerWaalsContact OG1-NH2 3.1Å; D194-R197 PolarHBondContact O-N 3.27Å; D194-R197 PolarHBondContact OD1-N 3.49Å; D194-R197 IonicContact OD2-CZ 2.75Å; D194-R197 IonicContact OD2-NE 2.7Å; D194-R197 PolarHBondContact OD2-NE 3.27Å; D194-R197 IonicContact OD2-NH2 2.73Å; D194-R197 PolarHBondContact OD2-NH2 3.22Å; R197-K199 PolarHBondContact O-N 3.39Å; R197-S200 WeakPolarHBondContact O-CB 3.47Å; R197-S200 PolarHBondContact O-N 3.49Å; R197-S200 PolarHBondContact O-OG 3.28Å
198R94.3Very high95Very high40 Ų4073.8 Ų73.815%0.15137%0.366CS..THydrogen-bonded Turntrans-59.80.4169.966.6-173.8175.1-179.7-1.3115.8C152 D154 C166 I193 D194 K195 R205C152-R198 HydrophobicContact CB-CB 4.43Å; C152-R198 PolarHBondContact SG-NH1 2.95Å; D154-R198 IonicContact OD2-CZ 2.77Å; D154-R198 IonicContact OD2-NH1 3.84Å; D154-R198 PolarHBondContact OD2-NH1 3.48Å; D154-R198 IonicContact OD2-NH2 2.98Å; D154-R198 PolarHBondContact OD2-NH2 3.27Å; C166-R198 PolarHBondContact SG-NH1 2.88Å; I193-R198 HydrophobicContact CG2-CB 3.9Å; D194-R198 WeakPolarHBondContact O-CB 3.25Å; D194-R198 VanDerWaalsContact O-CG 3.23Å; D194-R198 WeakPolarHBondContact O-CG 3.32Å; D194-R198 PolarHBondContact O-N 2.85Å; K195-R198 PolarHBondContact O-NE 3.39Å; R198-R205 WeakPolarHBondContact O-CD 3.4Å; R198-R205 PolarHBondContact O-NH1 3.41Å
199K94.4Very high95.2Very high181 Ų18168.6 Ų68.679%0.78733%0.334SS*.THydrogen-bonded Turntrans-97.5-22.8167.1-67.6-172.2-178.8-1790112.9R197R197-K199 PolarHBondContact O-N 3.39Å
200S94.9Very high95.4Very high86 Ų8670.7 Ų70.760%0.60134%0.337SS*.THydrogen-bonded Turntrans-75.5-24.3-168.2-50.40000114.6R197R197-S200 WeakPolarHBondContact O-CB 3.47Å; R197-S200 PolarHBondContact O-N 3.49Å; R197-S200 PolarHBondContact O-OG 3.28Å
201C96.4Very high95.5Very high6 Ų668.4 Ų68.44%0.04133%0.327CS..  trans-144.2113.8172.9-177.20000110.9C191 C204 R205C191-C201 HydrophobicContact CB-CB 3.9Å; C201-C204 HydrophobicContact CB-CB 4.31Å; C201-C204 PolarHBondContact SG-N 3.4Å; C201-C204 VanDerWaalsContact SG-N 3.42Å; C201-R205 WeakPolarHBondContact O-CB 3.46Å; C201-R205 PolarHBondContact O-N 2.88Å
202Q95.8Very high95.5Very high104 Ų10468.7 Ų68.749%0.48633%0.327SS..Hα-helixtrans-73.6-37.8178.5-64.8172.3-15.700111.3F172 Y183 R205 L206F172-Q202 HydrophobicContact CE2-CB 4.2Å; F172-Q202 HydrophobicContact CE2-CG 4.25Å; F172-Q202 HydrophobicContact CZ-CB 4.28Å; F172-Q202 WeakPolarHBondContact CZ-O 3.37Å; Y183-Q202 HydrophobicContact CD1-CB 3.68Å; Y183-Q202 HydrophobicContact CD1-CG 4.48Å; Y183-Q202 HydrophobicContact CD2-CB 3.78Å; Y183-Q202 HydrophobicContact CE1-CB 4.01Å; Y183-Q202 HydrophobicContact CE1-CG 4.48Å; Y183-Q202 HydrophobicContact CE2-CB 4.07Å; Y183-Q202 HydrophobicContact CG-CB 3.59Å; Q202-R205 PolarHBondContact O-N 2.89Å; Q202-L206 PolarHBondContact O-N 3.01Å
203A96.3Very high95.4Very high8 Ų866.2 Ų66.27%0.06632%0.319CS..Hα-helixtrans-59.2-56.1-18000000112.4Y183 C185 R205 L206 R207Y183-A203 WeakPolarHBondContact O-CB 3.45Å; C185-A203 HydrophobicContact CB-CB 3.98Å; A203-R205 VanDerWaalsContact C-N 3.26Å; A203-R205 PolarHBondContact O-N 3.16Å; A203-L206 PolarHBondContact O-N 3.34Å; A203-R207 PolarHBondContact O-N 3Å
204C96.9Very high95.3Very high5 Ų564.9 Ų64.93%0.03431%0.312CS..Hα-helixtrans-65.7-30.8179.4-63.70000111.9N189 C191 I193 C201 R207 K208N189-C204 PolarHBondContact O-SG 2.87Å; C191-C204 HydrophobicContact CB-CB 3.76Å; I193-C204 HydrophobicContact CD1-CB 4.04Å; C201-C204 HydrophobicContact CB-CB 4.31Å; C201-C204 PolarHBondContact SG-N 3.4Å; C201-C204 VanDerWaalsContact SG-N 3.42Å; C204-R207 PolarHBondContact SG-NH1 3.01Å; C204-K208 WeakPolarHBondContact O-CB 3.39Å; C204-K208 PolarHBondContact O-N 2.79Å
205R97.6Very high95Very high22 Ų2266.2 Ų66.28%0.08332%0.322CS..Hα-helixtrans-68.7-42.5174-173.2-179.3-173.4-174.1-8.1112.8V151 G168 C169 F172 I193 R198 C201 Q202 A203 K208 C209V151-R205 HydrophobicContact CG1-CG 4.43Å; G168-R205 PolarHBondContact O-NH2 2.66Å; C169-R205 PolarHBondContact SG-NH2 2.96Å; F172-R205 HydrophobicContact CD1-CG 3.92Å; F172-R205 HydrophobicContact CE1-CB 3.96Å; F172-R205 HydrophobicContact CE1-CG 3.61Å; F172-R205 HydrophobicContact CZ-CB 4.15Å; F172-R205 HydrophobicContact CZ-CG 4.19Å; I193-R205 HydrophobicContact CD1-CB 4.07Å; I193-R205 HydrophobicContact CG2-CG 4.23Å; R198-R205 WeakPolarHBondContact O-CD 3.4Å; R198-R205 PolarHBondContact O-NH1 3.41Å; C201-R205 WeakPolarHBondContact O-CB 3.46Å; C201-R205 PolarHBondContact O-N 2.88Å; Q202-R205 PolarHBondContact O-N 2.89Å; A203-R205 VanDerWaalsContact C-N 3.26Å; A203-R205 PolarHBondContact O-N 3.16Å; R205-K208 PolarHBondContact O-N 2.97Å; R205-C209 PolarHBondContact O-N 2.94Å; R205-C209 PolarHBondContact O-SG 2.73Å; R205-C209 VanDerWaalsContact O-SG 3.42Å
206L96.4Very high94.5Very high23 Ų2368 Ų6812%0.1233%0.33CS..Hα-helixtrans-66.5-42.8177-17959.5000110.7F172 F173 Y183 Q202 A203 K208 C209 Y210F172-L206 HydrophobicContact CE1-CB 4.02Å; F172-L206 HydrophobicContact CE1-CD1 4.49Å; F172-L206 HydrophobicContact CZ-CB 4.13Å; F173-L206 HydrophobicContact CD2-CD1 4.02Å; F173-L206 HydrophobicContact CE2-CD1 4.28Å; Y183-L206 HydrophobicContact CD2-CB 4.07Å; Y183-L206 HydrophobicContact CD2-CD2 3.83Å; Y183-L206 HydrophobicContact CE2-CB 4.3Å; Y183-L206 HydrophobicContact CE2-CD2 3.97Å; Q202-L206 PolarHBondContact O-N 3.01Å; A203-L206 PolarHBondContact O-N 3.34Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 2.95Å; L206-C209 WeakPolarHBondContact O-CB 3.47Å; L206-C209 PolarHBondContact O-N 3.26Å; L206-C209 VanDerWaalsContact O-N 3.16Å; L206-Y210 HydrophobicContact CD1-CD2 4.42Å; L206-Y210 HydrophobicContact CD1-CE2 3.79Å; L206-Y210 HydrophobicContact CD2-CE2 4.23Å; L206-Y210 HydrophobicContact CG-CD2 4.25Å; L206-Y210 HydrophobicContact CG-CE2 3.69Å; L206-Y210 WeakPolarHBondContact O-CD2 3.37Å; L206-Y210 PolarHBondContact O-N 3.26Å; L206-Y210 VanDerWaalsContact O-N 3.15Å
207R95.5Very high92.8Very high98 Ų9867.5 Ų67.537%0.3734%0.335SS..Hα-helixtrans-54.2-47.9169.6-165.8-177.6-65.7114.49.8110.9N189 A203 C204 C209 Y210 E211N189-R207 PolarHBondContact O-NH1 2.7Å; N189-R207 PolarHBondContact OD1-NH1 3.3Å; N189-R207 PolarHBondContact OD1-NH2 3.34Å; A203-R207 PolarHBondContact O-N 3Å; C204-R207 PolarHBondContact SG-NH1 3.01Å; R207-C209 VanDerWaalsContact C-N 3.32Å; R207-C209 PolarHBondContact O-N 3.41Å; R207-Y210 PolarHBondContact O-N 2.99Å; R207-E211 WeakPolarHBondContact CG-OE1 3.43Å; R207-E211 WeakPolarHBondContact O-CG 3.38Å; R207-E211 PolarHBondContact O-N 2.85Å
208K97.1Very high91Very high75 Ų7565.3 Ų65.333%0.32635%0.351SS..Hα-helixtrans-64.7-31.2178.6-162.252.4165177.80113.9V151 I193 C204 R205 L206 E211 V212V151-K208 HydrophobicContact CG1-CB 4.38Å; V151-K208 HydrophobicContact CG1-CG 4.36Å; I193-K208 HydrophobicContact CG1-CB 4.19Å; I193-K208 HydrophobicContact CG1-CG 4.5Å; C204-K208 WeakPolarHBondContact O-CB 3.39Å; C204-K208 PolarHBondContact O-N 2.79Å; R205-K208 PolarHBondContact O-N 2.97Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 2.95Å; K208-E211 HydrophobicContact CD-CB 4.12Å; K208-E211 WeakPolarHBondContact CD-OE2 3.32Å; K208-E211 WeakPolarHBondContact CE-OE2 3.33Å; K208-E211 IonicContact NZ-OE2 2.75Å; K208-E211 PolarHBondContact NZ-OE2 3.23Å; K208-V212 HydrophobicContact CD-CG1 4.49Å; K208-V212 WeakPolarHBondContact O-CG2 3.46Å; K208-V212 PolarHBondContact O-N 2.81Å
209C96.4Very high88.4Confident0 Ų068.7 Ų68.70%038%0.38CS..Hα-helixtrans-61-46.9169.6-72.80000111.6F173 R205 L206 R207 V212 M214F173-C209 HydrophobicContact CD2-CB 3.51Å; F173-C209 HydrophobicContact CE2-CB 3.88Å; F173-C209 HydrophobicContact CG-CB 4.43Å; R205-C209 PolarHBondContact O-N 2.94Å; R205-C209 PolarHBondContact O-SG 2.73Å; R205-C209 VanDerWaalsContact O-SG 3.42Å; L206-C209 WeakPolarHBondContact O-CB 3.47Å; L206-C209 PolarHBondContact O-N 3.26Å; L206-C209 VanDerWaalsContact O-N 3.16Å; R207-C209 VanDerWaalsContact C-N 3.32Å; R207-C209 PolarHBondContact O-N 3.41Å; C209-V212 WeakPolarHBondContact O-CG2 3.43Å; C209-M214 HydrophobicContact CB-CB 4.18Å; C209-M214 HydrophobicContact CB-CG 4.21Å; C209-M214 HydrophobicContact CB-SD 3.77Å; C209-M214 WeakPolarHBondContact O-CB 3.49Å; C209-M214 VanDerWaalsContact O-CG 3.3Å; C209-M214 WeakPolarHBondContact O-CG 3.5Å; C209-M214 PolarHBondContact O-N 3.28Å; C209-M214 VanDerWaalsContact SG-SD 3.64Å
210Y95.5Very high85.8Confident122 Ų12271.2 Ų71.248%0.47839%0.385SS..Hα-helixtrans-67.8-42.6177.5-64.6-54.3000112.5F173 L206 R207 V212 G213F173-Y210 AromaticContact CE2-CD1 3.85Å; F173-Y210 HydrophobicContact CE2-CD1 3.85Å; F173-Y210 AromaticContact CE2-CE1 3.52Å; F173-Y210 HydrophobicContact CE2-CE1 3.52Å; F173-Y210 HydrophobicContact CZ-CD1 4.18Å; F173-Y210 AromaticContact CZ-CE1 3.79Å; F173-Y210 HydrophobicContact CZ-CE1 3.79Å; L206-Y210 HydrophobicContact CD1-CD2 4.42Å; L206-Y210 HydrophobicContact CD1-CE2 3.79Å; L206-Y210 HydrophobicContact CD2-CE2 4.23Å; L206-Y210 HydrophobicContact CG-CD2 4.25Å; L206-Y210 HydrophobicContact CG-CE2 3.69Å; L206-Y210 WeakPolarHBondContact O-CD2 3.37Å; L206-Y210 PolarHBondContact O-N 3.26Å; L206-Y210 VanDerWaalsContact O-N 3.15Å; R207-Y210 PolarHBondContact O-N 2.99Å; Y210-V212 VanDerWaalsContact C-N 3.27Å; Y210-V212 PolarHBondContact O-N 3.07Å; Y210-G213 PolarHBondContact O-N 3.22Å
211E95.4Very high83.1Confident111 Ų11178.3 Ų78.352%0.51940%0.399SS..Hα-helixtrans-54.5-38.4177.5-75.6169.7-130.500113.4R207 K208 G213R207-E211 WeakPolarHBondContact CG-OE1 3.43Å; R207-E211 WeakPolarHBondContact O-CG 3.38Å; R207-E211 PolarHBondContact O-N 2.85Å; K208-E211 HydrophobicContact CD-CB 4.12Å; K208-E211 WeakPolarHBondContact CD-OE2 3.32Å; K208-E211 WeakPolarHBondContact CE-OE2 3.33Å; K208-E211 IonicContact NZ-OE2 2.75Å; K208-E211 PolarHBondContact NZ-OE2 3.23Å; E211-G213 VanDerWaalsContact C-N 3.28Å
212V95.6Very high80.6Confident45 Ų4586.7 Ų86.727%0.27344%0.437SS..THydrogen-bonded Turntrans-83.4-3.3178.6-57.20000113.5A150 V151 V163 K208 C209 Y210 M214A150-V212 HydrophobicContact CB-CB 4Å; A150-V212 HydrophobicContact CB-CG1 4.08Å; A150-V212 HydrophobicContact CB-CG2 4.16Å; V151-V212 HydrophobicContact CG2-CG2 3.63Å; V163-V212 HydrophobicContact CG1-CG2 4.11Å; V163-V212 WeakPolarHBondContact CG1-O 3.38Å; V163-V212 HydrophobicContact CG2-CG2 4.28Å; K208-V212 HydrophobicContact CD-CG1 4.49Å; K208-V212 WeakPolarHBondContact O-CG2 3.46Å; K208-V212 PolarHBondContact O-N 2.81Å; C209-V212 WeakPolarHBondContact O-CG2 3.43Å; Y210-V212 VanDerWaalsContact C-N 3.27Å; Y210-V212 PolarHBondContact O-N 3.07Å; V212-M214 HydrophobicContact CG2-CG 4.04Å
213G92.5Very high78Confident36 Ų3693.9 Ų93.937%0.37146%0.46SS..THydrogen-bonded Turntrans95.122.4178.400000115.9Y210 E211 V215Y210-G213 PolarHBondContact O-N 3.22Å; E211-G213 VanDerWaalsContact C-N 3.28Å; G213-V215 PolarHBondContact O-N 2.95Å
214M94.9Very high74.9Confident0 Ų099.4 Ų99.40%050%0.497CS..  trans-68.7123.9170.9-59.8-168.781.500110.4V151 Y161 V163 F173 C209 V212V151-M214 HydrophobicContact CG2-SD 3.67Å; Y161-M214 HydrophobicContact CD2-CE 3.83Å; Y161-M214 HydrophobicContact CG-CE 4.31Å; Y161-M214 CarbonylContact O-C 3.23Å; Y161-M214 WeakPolarHBondContact O-CA 3.37Å; V163-M214 HydrophobicContact CB-CG 4.43Å; V163-M214 HydrophobicContact CG1-CG 4.03Å; V163-M214 HydrophobicContact CG2-CE 4.14Å; V163-M214 HydrophobicContact CG2-CG 3.48Å; V163-M214 VanDerWaalsContact CG2-CG 3.48Å; V163-M214 HydrophobicContact CG2-SD 3.99Å; F173-M214 HydrophobicContact CB-CE 4.16Å; F173-M214 HydrophobicContact CB-SD 4.43Å; F173-M214 HydrophobicContact CD1-CB 4.12Å; F173-M214 HydrophobicContact CD1-CE 4.19Å; F173-M214 HydrophobicContact CD2-CB 4.12Å; F173-M214 HydrophobicContact CE1-CB 3.79Å; F173-M214 HydrophobicContact CE2-CB 3.79Å; F173-M214 HydrophobicContact CG-CB 4.27Å; F173-M214 HydrophobicContact CG-CE 4.21Å; F173-M214 HydrophobicContact CG-SD 4.32Å; F173-M214 VanDerWaalsContact CZ-C 3.47Å; F173-M214 HydrophobicContact CZ-CB 3.62Å; F173-M214 WeakPolarHBondContact CZ-O 3.43Å; C209-M214 HydrophobicContact CB-CB 4.18Å; C209-M214 HydrophobicContact CB-CG 4.21Å; C209-M214 HydrophobicContact CB-SD 3.77Å; C209-M214 WeakPolarHBondContact O-CB 3.49Å; C209-M214 VanDerWaalsContact O-CG 3.3Å; C209-M214 WeakPolarHBondContact O-CG 3.5Å; C209-M214 PolarHBondContact O-N 3.28Å; C209-M214 VanDerWaalsContact SG-SD 3.64Å; V212-M214 HydrophobicContact CG2-CG 4.04Å
215V89.2Confident72.2Confident72 Ų72102.8 Ų102.844%0.43653%0.532SS..  trans-132.3145-177.8-67.10000111.9Y161 G213 C217Y161-V215 WeakPolarHBondContact CB-O 3.4Å; Y161-V215 WeakPolarHBondContact CD1-O 3.35Å; Y161-V215 PolarHBondContact O-N 2.97Å; G213-V215 PolarHBondContact O-N 2.95Å; V215-C217 PolarHBondContact O-N 3.42Å
216K84.4Confident69.3Low140 Ų140111.8 Ų111.861%0.60957%0.567SS**  trans-65.1117170.9-170.3174.1178178.50108.2I177 G218I177-K216 HydrophobicContact CD1-CB 4.05Å; I177-K216 HydrophobicContact CD1-CD 4.47Å; I177-K216 HydrophobicContact CD1-CG 4.07Å; K216-G218 PolarHBondContact O-N 2.87Å
217C57.1Low66.5Low120 Ų120122 Ų12281%0.81160%0.604SS**THydrogen-bonded Turntrans-64.1124.3-178.9-163.40000109.7V215V215-C217 PolarHBondContact O-N 3.42Å
218G53.3Low63.7Low78 Ų78125.5 Ų125.580%0.80463%0.629SS**THydrogen-bonded Turntrans161.6-23-173.500000114.9K216K216-G218 PolarHBondContact O-N 2.87Å
219S39.8Very low60.8Low110 Ų110128.6 Ų128.677%0.76965%0.654SS**SBendtrans-127.223-17457.70000115.4
220R40Very low58Low235 Ų235140.2 Ų140.289%0.88770%0.698SS**  trans-137.498.4171.9-105.9-174176-178.80.5112.3
221R38.2Very low55.1Low235 Ų235146.4 Ų146.489%0.88772%0.72SS**  trans-85.5172.2149.9-132177.1-173.7-1661.9108.5
222E43.7Very low52.2Low181 Ų181150 Ų15085%0.84674%0.737SS**SBendtrans61.465.3171.8-50.7-150.2155.600117.8
223R41.1Very low49.2Very low256 Ų256159.7 Ų159.797%0.96677%0.769SS**SBend-168.880.6122.3-103.4175.5-162.7-176.37.1111.8
224C33.3Very low46.1Very low124 Ų124163.9 Ų163.984%0.83879%0.792SS**  trans-159.772.8155.4-161.50000110.4Y226C224-Y226 PolarHBondContact O-N 3.4Å
225G40.2Very low43Very low75 Ų75167.8 Ų167.877%0.77383%0.825SS**  trans-81.384.9174.700000111.5
226Y36.2Very low40Very low212 Ų212171.8 Ų171.883%0.83184%0.844SS**  trans-155.1134.4160.5-105.4-72.8000111.7C224C224-Y226 PolarHBondContact O-N 3.4Å
227R37.1Very low37.5Very low237 Ų237174.1 Ų174.189%0.89486%0.857SS**  trans73.777.3179.9-58.7178.4-72.5-131-2116.4
228L36.3Very low36.2Very low171 Ų171175.9 Ų175.990%0.89585%0.853SS**  trans-119.953.7158.6-140.3178.9000110.9
229V36.5Very low35Very low140 Ų140178.7 Ų178.785%0.84885%0.849SS**  trans-140.974.1177.8-169.30000111.8
230R38.2Very low34.5Very low245 Ų245181.6 Ų181.693%0.92585%0.85SS**SBendtrans171.992.3147.4-104.6-179.1162173.1-4.5112
231R33.8Very low33.8Very low251 Ų251176.3 Ų176.395%0.94785%0.848SS**  trans178.573.9137-103.1178171.4-175.6-4111.4
232Q34.6Very low33.5Very low186 Ų186169.9 Ų169.987%0.86985%0.845SS**  trans-129.381.1161.6-162.979.521.800107
233R32Very low32.9Very low250 Ų250166.4 Ų166.494%0.94384%0.841SS**  trans-177.485.8172.8-108.6177.6-165.3-162.34111.4
234S29.2Very low32.8Very low123 Ų123164.8 Ų164.886%0.8684%0.841SS**  trans-178.5107.4151.151.70000106.8
235A29.2Very low32.7Very low83 Ų83163.9 Ų163.969%0.68684%0.842SS**  trans-92.1172.8164.600000109.1
236D27.1Very low32.5Very low156 Ų156169.8 Ų169.883%0.83485%0.847SS**  trans57.4114.4163.6-53-38.5000119
237E30.2Very low32.2Very low189 Ų189171.2 Ų171.288%0.88385%0.851SS**  trans-153.7166.6130.9-117.2177.7147.200110.8
238Q29.9Very low31.8Very low156 Ų156165.4 Ų165.473%0.72985%0.846SS**  trans-74.9138.1-147.8-96.573.5-14.500118.7
239L29.7Very low32.1Very low137 Ų137161.1 Ų161.172%0.71784%0.843SS**  32145.8122.3-73.7169.3000123
240H28.3Very low32.1Very low171 Ų171158.8 Ų158.879%0.79283%0.833SS**  trans65.7113.8156.8-64-58.9000119.8
241C24.9Very low32Very low124 Ų124155.8 Ų155.884%0.83883%0.829SS**  -155.5145.2100.6-152.70000111.3
242A32.4Very low32.4Very low100 Ų100147 Ų14783%0.82681%0.81SS**  trans-116.6104.1-178.100000111.1
243S30.8Very low33Very low109 Ų109142.7 Ų142.776%0.76280%0.799SS**  trans-124.2128.7178.2-72.60000111.2A245S243-A245 PolarHBondContact O-N 3.12Å
244K38.5Very low33.5Very low222 Ų222137.2 Ų137.297%0.96579%0.787SS**  trans-72.6120.1-179.1-65.3172.2-179.5172.10110.6
245A32.7Very low34.2Very low105 Ų105136 Ų13687%0.86878%0.775SS**  trans-126.9151.2165.600000110.1S243S243-A245 PolarHBondContact O-N 3.12Å
246K34.4Very low35Very low199 Ų199139.5 Ų139.587%0.86577%0.77SS**  trans-128.2140.7-165.9-169.2-177.5-176.2176.90110.5
247R31.3Very low35.8Very low242 Ų242137.6 Ų137.691%0.91376%0.756SS**  trans100.8155.1167.5-62.7-179.2151.1164.8-6.5118.2
248S27.9Very low36.6Very low114 Ų114133.8 Ų133.880%0.79774%0.741SS**  trans75.997.7162.4-134.60000117.1
249G42.2Very low37.7Very low81 Ų81131 Ų13184%0.83573%0.73SS**  trans-89.2126.7164.700000110.8
250S35.9Very low38.9Very low92 Ų92127.1 Ų127.164%0.64371%0.71SS**  trans-143.116.4172.652.30000113.4A252S250-A252 PolarHBondContact O-N 3.37Å
251H36.8Very low40.1Very low182 Ų182125.8 Ų125.884%0.84371%0.709SS**  trans-8062.8172-69.3-75.5000111.8
252A43.3Very low41.8Very low66 Ų66123.3 Ų123.355%0.54570%0.697SS.*  trans-115.4-40-179.700000115.7S250S250-A252 PolarHBondContact O-N 3.37Å
253P45.6Very low44.2Very low96 Ų96121.6 Ų121.662%0.62367%0.674SS**Hα-helixtrans-74.3-46.4-172.626.6-32000112.7V255 R256 E257P253-V255 PolarHBondContact O-N 3.03Å; P253-V255 VanDerWaalsContact O-N 3.17Å; P253-R256 PolarHBondContact O-N 2.93Å; P253-R256 VanDerWaalsContact O-N 3.16Å; P253-E257 PolarHBondContact O-N 3.38Å
254L43.2Very low47.1Very low134 Ų134118.6 Ų118.670%0.70265%0.653SS**Hα-helixtrans-63.7-26.4-172.8-157.877.9000113.6L258L254-L258 WeakPolarHBondContact O-CD1 3.29Å; L254-L258 WeakPolarHBondContact O-CG 3.46Å
255V44.1Very low49.8Very low99 Ų99110.4 Ų110.460%0.662%0.622SS**Hα-helixtrans-79.7-27.4-178.7-176.60000111.8P253P253-V255 PolarHBondContact O-N 3.03Å; P253-V255 VanDerWaalsContact O-N 3.17Å
256R45Very low52.7Low156 Ų156109.5 Ų109.559%0.58960%0.601SS**Hα-helixtrans-86-35.9178.2-74.1-168.6177.7-179.4-1113.5P253 L258 L259P253-R256 PolarHBondContact O-N 2.93Å; P253-R256 VanDerWaalsContact O-N 3.16Å; R256-L258 PolarHBondContact O-N 3.34Å; R256-L259 HydrophobicContact CB-CD1 4.48Å; R256-L259 HydrophobicContact CG-CD1 4.29Å; R256-L259 WeakPolarHBondContact O-CB 3.39Å; R256-L259 PolarHBondContact O-N 2.94Å
257E44Very low55.5Low116 Ų116104.5 Ų104.554%0.54258%0.58SS.*Hα-helixtrans-61.6-26.6178.7-162157.7-129.200112P253P253-E257 PolarHBondContact O-N 3.38Å
258L47.8Very low58.6Low108 Ų10893.6 Ų93.657%0.56554%0.54SS*.THydrogen-bonded Turntrans-75.2-12.6173.5-69.4170.3000115.4L254 R256 A262L254-L258 WeakPolarHBondContact O-CD1 3.29Å; L254-L258 WeakPolarHBondContact O-CG 3.46Å; R256-L258 PolarHBondContact O-N 3.34Å; L258-A262 VanDerWaalsContact O-CB 3.26Å; L258-A262 WeakPolarHBondContact O-CB 3.37Å; L258-A262 PolarHBondContact O-N 2.94Å
259L52.9Low61.9Low97 Ų9788.2 Ų88.251%0.50850%0.502SS..THydrogen-bonded Turntrans-73.6-30.4-174.8-72.9168.1000113R256 A262 L263R256-L259 HydrophobicContact CB-CD1 4.48Å; R256-L259 HydrophobicContact CG-CD1 4.29Å; R256-L259 WeakPolarHBondContact O-CB 3.39Å; R256-L259 PolarHBondContact O-N 2.94Å; L259-A262 PolarHBondContact O-N 3.39Å; L259-L263 WeakPolarHBondContact O-CG 3.37Å; L259-L263 PolarHBondContact O-N 3.4Å
260L53.9Low64.4Low56 Ų5688 Ų8829%0.29348%0.481SS..THydrogen-bonded Turntrans-72.9-44.6177.7-76.8162.1000112A262 L263 P317 L429L260-A262 PolarHBondContact O-N 2.76Å; L260-A262 VanDerWaalsContact O-N 3.15Å; L260-L263 PolarHBondContact O-N 3.34Å; L260-P317 HydrophobicContact CD2-CB 4.4Å; L260-L429 HydrophobicContact CD1-CD2 3.52Å; L260-L429 HydrophobicContact CD2-CD2 3.57Å; L260-L429 HydrophobicContact CG-CD2 4.2Å
261D54.8Low67.3Low143 Ų14385.6 Ų85.677%0.76546%0.463SS*.THydrogen-bonded Turntrans-67-9.6174.9-76.9-5.5000113
262A60.9Low70.1Confident72 Ų7277 Ų7760%0.59542%0.424SS*.THydrogen-bonded Turntrans-104.9-17.7-177.700000114.9L258 L259 L260L258-A262 VanDerWaalsContact O-CB 3.26Å; L258-A262 WeakPolarHBondContact O-CB 3.37Å; L258-A262 PolarHBondContact O-N 2.94Å; L259-A262 PolarHBondContact O-N 3.39Å; L260-A262 PolarHBondContact O-N 2.76Å; L260-A262 VanDerWaalsContact O-N 3.15Å
263L81.9Confident72.6Confident65 Ų6577.6 Ų77.634%0.3442%0.417SS..  trans-81.5124.7179.2-77.2171.5000111L259 L260 Q267 P317L259-L263 WeakPolarHBondContact O-CG 3.37Å; L259-L263 PolarHBondContact O-N 3.4Å; L260-L263 PolarHBondContact O-N 3.34Å; L263-Q267 HydrophobicContact CD2-CB 3.95Å; L263-P317 HydrophobicContact CD1-CB 3.64Å; L263-P317 HydrophobicContact CD1-CG 3.84Å
264S91.8Very high75Confident46 Ų4680.3 Ų80.332%0.32242%0.421SS..  trans-71154.5172.780.20000111.3E266 Q267 L268S264-E266 PolarHBondContact O-N 3.04Å; S264-E266 VanDerWaalsContact O-N 3.11Å; S264-Q267 PolarHBondContact O-N 3.29Å; S264-Q267 WeakPolarHBondContact OG-CG 3.38Å; S264-Q267 PolarHBondContact OG-N 2.81Å; S264-Q267 PolarHBondContact OG-OE1 2.9Å; S264-L268 PolarHBondContact O-N 3.09Å
265P94.5Very high77.4Confident49 Ų4973.9 Ų73.932%0.31839%0.388SS..Hα-helixtrans-51.4-34172.7-31.137.7000113.7V269 W439P265-V269 VanDerWaalsContact O-CG2 3.3Å; P265-V269 WeakPolarHBondContact O-CG2 3.42Å; P265-V269 PolarHBondContact O-N 3.44Å; P265-W439 HydrophobicContact CB-CB 3.69Å; P265-W439 HydrophobicContact CB-CD2 4.24Å; P265-W439 HydrophobicContact CB-CG 3.69Å
266E94Very high79.8Confident87 Ų8771.4 Ų71.441%0.40737%0.369SS..Hα-helixtrans-68-45.8176-174.4147.9-14300112.3S264 V269 L270 W439S264-E266 PolarHBondContact O-N 3.04Å; S264-E266 VanDerWaalsContact O-N 3.11Å; E266-V269 PolarHBondContact O-N 3.44Å; E266-L270 WeakPolarHBondContact O-CG 3.46Å; E266-L270 PolarHBondContact O-N 3.03Å; E266-L270 VanDerWaalsContact O-N 3.11Å; E266-W439 HydrophobicContact CB-CH2 3.65Å; E266-W439 HydrophobicContact CB-CZ2 3.41Å; E266-W439 VanDerWaalsContact CB-CZ2 3.41Å; E266-W439 HydrophobicContact CB-CZ3 4.36Å; E266-W439 VanDerWaalsContact CD-CH2 3.45Å; E266-W439 HydrophobicContact CG-CH2 3.49Å; E266-W439 VanDerWaalsContact CG-CH2 3.49Å; E266-W439 HydrophobicContact CG-CZ2 3.57Å; E266-W439 HydrophobicContact CG-CZ3 4.43Å; E266-W439 WeakPolarHBondContact OE1-CH2 3.45Å; E266-W439 WeakPolarHBondContact OE1-CZ2 3.08Å; E266-W439 WeakPolarHBondContact OE2-CZ2 3.44Å
267Q94.3Very high82Confident93 Ų9366 Ų6644%0.43536%0.355SS..Hα-helixtrans-64.8-41.7178-71.7164.9-31.700111.4L263 S264 V269 L270 T271L263-Q267 HydrophobicContact CD2-CB 3.95Å; S264-Q267 PolarHBondContact O-N 3.29Å; S264-Q267 WeakPolarHBondContact OG-CG 3.38Å; S264-Q267 PolarHBondContact OG-N 2.81Å; S264-Q267 PolarHBondContact OG-OE1 2.9Å; Q267-V269 VanDerWaalsContact C-N 3.34Å; Q267-V269 PolarHBondContact O-N 3.08Å; Q267-L270 PolarHBondContact O-N 2.98Å; Q267-L270 VanDerWaalsContact O-N 3.15Å; Q267-T271 PolarHBondContact O-N 3.2Å; Q267-T271 PolarHBondContact O-OG1 3.26Å
268L95.6Very high84.2Confident13 Ų1364.4 Ų64.47%0.06836%0.355CS..Hα-helixtrans-59.9-42.9176.6-178.455.8000111.7S264 L270 T271 L272 P317 A432 V433 A436S264-L268 PolarHBondContact O-N 3.09Å; L268-L270 VanDerWaalsContact C-N 3.34Å; L268-L270 PolarHBondContact O-N 3.3Å; L268-T271 PolarHBondContact O-N 2.84Å; L268-L272 HydrophobicContact CD1-CG 4.49Å; L268-L272 WeakPolarHBondContact O-CG 3.12Å; L268-L272 PolarHBondContact O-N 3.24Å; L268-P317 HydrophobicContact CD1-CB 4.25Å; L268-P317 HydrophobicContact CD1-CG 3.78Å; L268-A432 HydrophobicContact CD2-CB 4.1Å; L268-V433 HydrophobicContact CD2-CG2 4.22Å; L268-A436 HydrophobicContact CD2-CB 4.1Å; L268-A436 HydrophobicContact CG-CB 4.46Å
269V96.8Very high86Confident1 Ų166.2 Ų66.21%0.00636%0.36CS..Hα-helixtrans-65.4-35.2176174.60000112.3P265 E266 Q267 L272 L273 K395 A436 V440P265-V269 VanDerWaalsContact O-CG2 3.3Å; P265-V269 WeakPolarHBondContact O-CG2 3.42Å; P265-V269 PolarHBondContact O-N 3.44Å; E266-V269 PolarHBondContact O-N 3.44Å; Q267-V269 VanDerWaalsContact C-N 3.34Å; Q267-V269 PolarHBondContact O-N 3.08Å; V269-L272 PolarHBondContact O-N 2.97Å; V269-L273 PolarHBondContact O-N 3.45Å; V269-L273 VanDerWaalsContact O-N 3.08Å; V269-K395 HydrophobicContact CG1-CB 3.98Å; V269-K395 HydrophobicContact CG1-CD 3.79Å; V269-K395 HydrophobicContact CG1-CG 3.74Å; V269-A436 HydrophobicContact CG2-CB 3.92Å; V269-V440 HydrophobicContact CG1-CG2 4.29Å; V269-V440 HydrophobicContact CG2-CG2 3.79Å
270L95.8Very high87.7Confident76 Ų7662.2 Ų62.240%0.39834%0.339SS..Hα-helixtrans-68.3-43.6174.3-68.4170.5000111.6E266 Q267 L268 L272 L273 E274E266-L270 WeakPolarHBondContact O-CG 3.46Å; E266-L270 PolarHBondContact O-N 3.03Å; E266-L270 VanDerWaalsContact O-N 3.11Å; Q267-L270 PolarHBondContact O-N 2.98Å; Q267-L270 VanDerWaalsContact O-N 3.15Å; L268-L270 VanDerWaalsContact C-N 3.34Å; L268-L270 PolarHBondContact O-N 3.3Å; L270-L272 VanDerWaalsContact C-N 3.32Å; L270-L272 PolarHBondContact O-N 3.19Å; L270-L273 WeakPolarHBondContact O-CB 3.42Å; L270-L273 PolarHBondContact O-N 3.19Å; L270-L273 VanDerWaalsContact O-N 3.12Å; L270-E274 PolarHBondContact O-N 3.01Å
271T95.6Very high89.3Confident43 Ų4364.6 Ų64.626%0.26435%0.352SS..Hα-helixtrans-63.7-36.6174.2-530000112Q267 L268 L273 E274 A275 P317Q267-T271 PolarHBondContact O-N 3.2Å; Q267-T271 PolarHBondContact O-OG1 3.26Å; L268-T271 PolarHBondContact O-N 2.84Å; T271-L273 VanDerWaalsContact C-N 3.31Å; T271-L273 PolarHBondContact O-N 3.15Å; T271-E274 PolarHBondContact O-N 3.15Å; T271-A275 WeakPolarHBondContact O-CB 3.13Å; T271-A275 PolarHBondContact O-N 2.9Å; T271-P317 HydrophobicContact CG2-CG 3.82Å
272L96.6Very high90.6Very high2 Ų258 Ų581%0.0132%0.316CS..Hα-helixtrans-64.8-33173.1-71.6177000112.7L268 V269 L270 A275 I316 L398 A402L268-L272 HydrophobicContact CD1-CG 4.49Å; L268-L272 WeakPolarHBondContact O-CG 3.12Å; L268-L272 PolarHBondContact O-N 3.24Å; V269-L272 PolarHBondContact O-N 2.97Å; L270-L272 VanDerWaalsContact C-N 3.32Å; L270-L272 PolarHBondContact O-N 3.19Å; L272-A275 WeakPolarHBondContact O-CB 3.23Å; L272-A275 PolarHBondContact O-N 3.26Å; L272-I316 HydrophobicContact CD2-CD1 4.39Å; L272-I316 HydrophobicContact CD2-CG1 3.95Å; L272-I316 HydrophobicContact CD2-CG2 4.4Å; L272-L398 HydrophobicContact CB-CB 4.27Å; L272-A402 HydrophobicContact CD1-CB 4.07Å; L272-A402 HydrophobicContact CD2-CB 3.9Å
273L96.3Very high91.6Very high77 Ų7759.3 Ų59.340%0.40332%0.321SS..Hα-helixtrans-70.2-45.5175.2-179.367000111.5V269 L270 T271 A275 E276 H394 L398V269-L273 PolarHBondContact O-N 3.45Å; V269-L273 VanDerWaalsContact O-N 3.08Å; L270-L273 WeakPolarHBondContact O-CB 3.42Å; L270-L273 PolarHBondContact O-N 3.19Å; L270-L273 VanDerWaalsContact O-N 3.12Å; T271-L273 VanDerWaalsContact C-N 3.31Å; T271-L273 PolarHBondContact O-N 3.15Å; L273-A275 PolarHBondContact O-N 2.91Å; L273-E276 PolarHBondContact O-N 3.04Å; L273-H394 WeakPolarHBondContact CD1-NE2 3.35Å; L273-L398 HydrophobicContact CB-CD1 3.88Å; L273-L398 HydrophobicContact CD1-CD1 3.91Å
274E94.6Very high91.6Very high153 Ų15361.4 Ų61.472%0.71532%0.324SS*.Hα-helixtrans-67.3-19.9172.7-66.9173.8-172.600112.6L270 T271 K315L270-E274 PolarHBondContact O-N 3.01Å; T271-E274 PolarHBondContact O-N 3.15Å; E274-K315 PolarHBondContact O-NZ 3.18Å; E274-K315 VanDerWaalsContact O-NZ 3.13Å
275A95.3Very high91.1Very high0 Ų060.9 Ų60.90%032%0.32CS..Hα-helixtrans-73.8-27.3179.700000113.7T271 L272 L273 K315T271-A275 WeakPolarHBondContact O-CB 3.13Å; T271-A275 PolarHBondContact O-N 2.9Å; L272-A275 WeakPolarHBondContact O-CB 3.23Å; L272-A275 PolarHBondContact O-N 3.26Å; L273-A275 PolarHBondContact O-N 2.91Å; A275-K315 VanDerWaalsContact CA-CD 3.49Å; A275-K315 HydrophobicContact CB-CB 3.89Å; A275-K315 HydrophobicContact CB-CD 3.98Å; A275-K315 WeakPolarHBondContact O-CD 3.4Å; A275-K315 PolarHBondContact O-NZ 3.17Å
276E94.1Very high90.4Very high46 Ų4663.7 Ų63.722%0.21534%0.341CS..PPolyproline II helixtrans-51.8142.9-166.3-80.5-6284.100114.3L273 W312 L398 K401L273-E276 PolarHBondContact O-N 3.04Å; E276-W312 PolarHBondContact OE1-NE1 3.32Å; E276-L398 VanDerWaalsContact CD-CD2 3.42Å; E276-L398 HydrophobicContact CG-CD2 3.4Å; E276-L398 VanDerWaalsContact CG-CD2 3.4Å; E276-K401 IonicContact OE1-NZ 2.73Å; E276-K401 PolarHBondContact OE1-NZ 3.5Å; E276-K401 IonicContact OE2-NZ 3.33Å; E276-K401 PolarHBondContact OE2-NZ 3.33Å
277P91.5Very high89.8Confident43 Ų4362.9 Ų62.928%0.27935%0.349SS..PPolyproline II helixtrans-72.2150.1178.231.3-34.4000111H308P277-H308 HydrophobicContact CB-CB 3.88Å
278P89.4Confident89.4Confident83 Ų8364.1 Ų64.154%0.53937%0.365SS..PPolyproline II helixtrans-66.6157173.531.2-36.1000111.3V280P278-V280 PolarHBondContact O-N 2.96Å
279H86Confident89.1Confident146 Ų14664.5 Ų64.568%0.67637%0.366SS*.PPolyproline II helixtrans-65.1129.3171-64.7-69.3000111P358H279-P358 HydrophobicContact CB-CG 3.96Å
280V88.5Confident88.8Confident13 Ų1368.6 Ų68.68%0.07939%0.391CS..PPolyproline II helixtrans-87.3139.3175.5179.80000110P278 L301 K304 E305 H308 A357 P358P278-V280 PolarHBondContact O-N 2.96Å; V280-L301 HydrophobicContact CB-CD1 4.04Å; V280-L301 HydrophobicContact CG1-CD1 3.72Å; V280-K304 HydrophobicContact CG1-CB 3.75Å; V280-K304 HydrophobicContact CG1-CD 3.44Å; V280-K304 VanDerWaalsContact CG1-CD 3.44Å; V280-K304 HydrophobicContact CG1-CG 4.29Å; V280-K304 HydrophobicContact CG2-CB 4.45Å; V280-E305 HydrophobicContact CB-CG 4.46Å; V280-E305 HydrophobicContact CG2-CG 3.99Å; V280-H308 VanDerWaalsContact CG2-CD2 3.46Å; V280-H308 WeakPolarHBondContact CG2-CD2 3.46Å; V280-A357 WeakPolarHBondContact O-CB 3.35Å; V280-P358 VanDerWaalsContact O-CD 3.24Å; V280-P358 WeakPolarHBondContact O-CD 3.39Å
281L86.3Confident88.5Confident106 Ų10667.8 Ų67.856%0.55539%0.386SS*.  trans-112.4153.8168.3-61.7172.8000110K304 P358 D359L281-K304 PolarHBondContact O-NZ 3.5Å; L281-P358 HydrophobicContact CD2-CB 3.93Å; L281-P358 HydrophobicContact CD2-CG 4.03Å; L281-D359 HydrophobicContact CD2-CB 4.24Å
282I83.3Confident88.2Confident4 Ų467.8 Ų67.82%0.02139%0.39CS..  trans-134.8-14.9-172.4-162.7154.7000116.3S297 K300 L301 D359 L360I282-S297 WeakPolarHBondContact CD1-O 3.48Å; I282-K300 HydrophobicContact CD1-CB 3.91Å; I282-K300 HydrophobicContact CD1-CD 4.03Å; I282-K300 HydrophobicContact CD1-CG 3.85Å; I282-K300 HydrophobicContact CG1-CD 3.9Å; I282-K300 HydrophobicContact CG1-CG 4.16Å; I282-K300 PolarHBondContact O-NZ 2.81Å; I282-K300 VanDerWaalsContact O-NZ 3.13Å; I282-L301 HydrophobicContact CD1-CB 3.61Å; I282-L301 HydrophobicContact CD1-CD1 4.44Å; I282-L301 VanDerWaalsContact CD1-N 3.27Å; I282-D359 PolarHBondContact N-OD1 3.22Å; I282-D359 PolarHBondContact N-OD2 3.34Å; I282-L360 HydrophobicContact CG2-CB 4.22Å; I282-L360 HydrophobicContact CG2-CD2 4.44Å
283S82Confident87.9Confident99 Ų9969.1 Ų69.169%0.69240%0.4SS*.  trans63.999.7-163.4-54.30000111.5D359S283-D359 WeakPolarHBondContact CA-OD2 3.34Å; S283-D359 PolarHBondContact N-OD2 2.95Å
284R82Confident87.7Confident109 Ų10965.6 Ų65.641%0.41138%0.381SS..PPolyproline II helixtrans-54.1132.8177.2-166.2-173-178.1158.81.3111F289 D359 L360 V361 E366R284-F289 HydrophobicContact CG-CZ 4.25Å; R284-D359 WeakPolarHBondContact CB-O 3.4Å; R284-D359 WeakPolarHBondContact CD-O 3.16Å; R284-L360 HydrophobicContact CG-CD1 4.06Å; R284-V361 PolarHBondContact NH2-O 3.2Å; R284-E366 IonicContact CZ-OE1 2.65Å; R284-E366 IonicContact NH2-OE1 3.58Å; R284-E366 PolarHBondContact NH2-OE1 3.33Å; R284-E366 IonicContact NH2-OE2 3.75Å; R284-E366 PolarHBondContact NH2-OE2 2.82Å
285P81.2Confident87.5Confident35 Ų3558.5 Ų58.523%0.22735%0.348CS..PPolyproline II helixtrans-57.4156.8167.4-2534.1000113A287 F289 S297P285-A287 PolarHBondContact O-N 2.92Å; P285-F289 HydrophobicContact CB-CD1 4.31Å; P285-F289 HydrophobicContact CB-CE1 3.94Å; P285-F289 HydrophobicContact CG-CD1 4.38Å; P285-F289 HydrophobicContact CG-CE1 3.81Å; P285-S297 WeakPolarHBondContact CG-OG 3.32Å
286S79.7Confident87.3Confident108 Ų10861.9 Ų61.976%0.75537%0.365SS*.PPolyproline II helixtrans-63.9128.2164.852.20000110.5
287A81.2Confident87.2Confident70 Ų7060.2 Ų60.258%0.57936%0.358SS*.SBendtrans-69.9153.5169.300000111.2P285P285-A287 PolarHBondContact O-N 2.92Å
288P85.4Confident87.3Confident120 Ų12059.3 Ų59.378%0.77935%0.351SS*.SBendcis-74.8149.3-1.532.2-35.8000112.9
289F88.6Confident87.4Confident20 Ų2055.6 Ų55.69%0.08833%0.326CS..PPolyproline II helixtrans-72.2134.9174.1-69.9-79.3000111.7R284 P285 M294 L360 L362 E366 C369R284-F289 HydrophobicContact CG-CZ 4.25Å; P285-F289 HydrophobicContact CB-CD1 4.31Å; P285-F289 HydrophobicContact CB-CE1 3.94Å; P285-F289 HydrophobicContact CG-CD1 4.38Å; P285-F289 HydrophobicContact CG-CE1 3.81Å; F289-M294 HydrophobicContact CB-CB 4.37Å; F289-M294 HydrophobicContact CB-CE 3.99Å; F289-M294 HydrophobicContact CD1-CB 4.2Å; F289-M294 HydrophobicContact CD1-CE 4.19Å; F289-M294 HydrophobicContact CD2-CE 3.76Å; F289-M294 HydrophobicContact CE2-CE 4.22Å; F289-M294 HydrophobicContact CG-CE 3.74Å; F289-L360 HydrophobicContact CE1-CD1 4.45Å; F289-L360 HydrophobicContact CZ-CD1 4.02Å; F289-L362 HydrophobicContact CD2-CD2 4.31Å; F289-L362 HydrophobicContact CE2-CD2 3.52Å; F289-L362 HydrophobicContact CZ-CD2 3.69Å; F289-E366 HydrophobicContact CD2-CB 4.28Å; F289-E366 HydrophobicContact CE2-CB 4.49Å; F289-E366 WeakPolarHBondContact CE2-OE1 3.18Å; F289-C369 HydrophobicContact CB-CB 4.49Å; F289-C369 VanDerWaalsContact CB-SG 3.56Å; F289-C369 WeakPolarHBondContact O-CB 3.33Å
290T91.2Very high87.7Confident87 Ų8752.1 Ų52.153%0.53431%0.31SS..PPolyproline II helixtrans-94157.3158.266.70000110.3A292 S293 M294T290-A292 VanDerWaalsContact C-N 3.33Å; T290-A292 PolarHBondContact O-N 2.75Å; T290-S293 PolarHBondContact N-OG 3.36Å; T290-S293 PolarHBondContact O-N 3.48Å; T290-S293 PolarHBondContact O-OG 2.95Å; T290-S293 WeakPolarHBondContact OG1-CB 3.31Å; T290-S293 PolarHBondContact OG1-N 3.42Å; T290-S293 PolarHBondContact OG1-OG 3.28Å; T290-M294 PolarHBondContact O-N 2.71Å
291E90.6Very high87.9Confident59 Ų5951.7 Ų51.728%0.27631%0.307SS..Hα-helixtrans-46.3-54178.7-173.3166.1-125.600112.7S293 M294 M295 C369 V370 E371 M479 V484E291-S293 PolarHBondContact O-N 3.01Å; E291-M294 PolarHBondContact O-N 2.79Å; E291-M295 WeakPolarHBondContact O-CB 3.43Å; E291-M295 WeakPolarHBondContact O-CG 3.36Å; E291-M295 PolarHBondContact O-N 3.45Å; E291-C369 WeakPolarHBondContact CA-O 3.19Å; E291-C369 WeakPolarHBondContact CB-O 3.3Å; E291-C369 PolarHBondContact N-O 3.41Å; E291-V370 HydrophobicContact CG-CB 4.29Å; E291-V370 HydrophobicContact CG-CG1 4.15Å; E291-V370 HydrophobicContact CG-CG2 4.15Å; E291-E371 PolarHBondContact OE1-N 3.09Å; E291-M479 HydrophobicContact CG-CE 3.76Å; E291-M479 WeakPolarHBondContact OE1-CE 3.42Å; E291-V484 HydrophobicContact CG-CG1 4.2Å
292A88.3Confident88.3Confident43 Ų4347.3 Ų47.336%0.35529%0.286SS..Hα-helixtrans-63.2-38.317900000112.6T290 M296 V484T290-A292 VanDerWaalsContact C-N 3.33Å; T290-A292 PolarHBondContact O-N 2.75Å; A292-M296 WeakPolarHBondContact O-CB 3.34Å; A292-M296 PolarHBondContact O-N 3.46Å; A292-V484 HydrophobicContact CB-CG1 4.32Å
293S90.6Very high88.7Confident31 Ų3148.7 Ų48.722%0.21729%0.293CS..Hα-helixtrans-68.9-37.7179.272.90000113T290 E291 S297T290-S293 PolarHBondContact N-OG 3.36Å; T290-S293 PolarHBondContact O-N 3.48Å; T290-S293 PolarHBondContact O-OG 2.95Å; T290-S293 WeakPolarHBondContact OG1-CB 3.31Å; T290-S293 PolarHBondContact OG1-N 3.42Å; T290-S293 PolarHBondContact OG1-OG 3.28Å; E291-S293 PolarHBondContact O-N 3.01Å; S293-S297 PolarHBondContact O-N 3.43Å; S293-S297 PolarHBondContact O-OG 3.35Å
294M91.6Very high89.2Confident3 Ų347.7 Ų47.72%0.01528%0.276CS..Hα-helixtrans-69.1-52.8175177.6164.2-69.100109.9F289 T290 E291 M296 S297 L298 L362 E366 V370F289-M294 HydrophobicContact CB-CB 4.37Å; F289-M294 HydrophobicContact CB-CE 3.99Å; F289-M294 HydrophobicContact CD1-CB 4.2Å; F289-M294 HydrophobicContact CD1-CE 4.19Å; F289-M294 HydrophobicContact CD2-CE 3.76Å; F289-M294 HydrophobicContact CE2-CE 4.22Å; F289-M294 HydrophobicContact CG-CE 3.74Å; T290-M294 PolarHBondContact O-N 2.71Å; E291-M294 PolarHBondContact O-N 2.79Å; M294-M296 VanDerWaalsContact C-N 3.35Å; M294-M296 PolarHBondContact O-N 3.18Å; M294-S297 WeakPolarHBondContact O-CA 3.46Å; M294-S297 WeakPolarHBondContact O-CB 3.27Å; M294-S297 PolarHBondContact O-N 2.7Å; M294-L298 HydrophobicContact CG-CD1 3.92Å; M294-L298 HydrophobicContact CG-CG 4.35Å; M294-L298 WeakPolarHBondContact O-CG 3.19Å; M294-L298 PolarHBondContact O-N 2.92Å; M294-L362 HydrophobicContact CE-CD1 3.77Å; M294-L362 HydrophobicContact CE-CD2 3.71Å; M294-L362 HydrophobicContact CE-CG 4.37Å; M294-L362 HydrophobicContact CG-CD1 4.48Å; M294-L362 HydrophobicContact SD-CD1 4.05Å; M294-E366 HydrophobicContact CE-CB 4.36Å; M294-E366 VanDerWaalsContact CE-O 3.29Å; M294-E366 WeakPolarHBondContact CE-O 3.5Å; M294-V370 HydrophobicContact CB-CG2 3.99Å; M294-V370 HydrophobicContact CG-CG2 3.98Å; M294-V370 HydrophobicContact SD-CG2 3.83Å
295M91.8Very high89.9Confident4 Ų443.8 Ų43.82%0.0226%0.263CS..Hα-helixtrans-65.4-35.7-177-70-56.2-66.600112.6E291 S297 L298 T299 V370 I373 L476 M479 V485E291-M295 WeakPolarHBondContact O-CB 3.43Å; E291-M295 WeakPolarHBondContact O-CG 3.36Å; E291-M295 PolarHBondContact O-N 3.45Å; M295-S297 VanDerWaalsContact C-N 3.29Å; M295-S297 PolarHBondContact O-N 2.76Å; M295-L298 PolarHBondContact O-N 3.23Å; M295-L298 HydrophobicContact SD-CD1 3.94Å; M295-T299 WeakPolarHBondContact O-CG2 3.43Å; M295-T299 PolarHBondContact O-N 3.35Å; M295-T299 PolarHBondContact O-OG1 3.49Å; M295-V370 HydrophobicContact CG-CG1 3.83Å; M295-V370 HydrophobicContact CG-CG2 3.84Å; M295-V370 HydrophobicContact SD-CG1 3.87Å; M295-V370 HydrophobicContact SD-CG2 4.16Å; M295-I373 HydrophobicContact SD-CD1 4.02Å; M295-L476 HydrophobicContact CE-CD2 3.83Å; M295-M479 HydrophobicContact CE-CB 4.41Å; M295-M479 HydrophobicContact CE-CG 4.19Å; M295-M479 HydrophobicContact CG-CE 4.27Å; M295-V485 HydrophobicContact CB-CB 4.47Å; M295-V485 HydrophobicContact CB-CG2 3.48Å; M295-V485 VanDerWaalsContact CB-CG2 3.48Å
296M90.2Very high90.6Very high70 Ų7042.2 Ų42.235%0.34525%0.252SS..Hα-helixtrans-60.9-37.6171-178.176.773.300111.9A292 M294 T299 K300 V485 P486A292-M296 WeakPolarHBondContact O-CB 3.34Å; A292-M296 PolarHBondContact O-N 3.46Å; M294-M296 VanDerWaalsContact C-N 3.35Å; M294-M296 PolarHBondContact O-N 3.18Å; M296-T299 PolarHBondContact O-OG1 2.76Å; M296-K300 WeakPolarHBondContact O-CB 3.34Å; M296-K300 PolarHBondContact O-N 3.33Å; M296-K300 VanDerWaalsContact O-N 3.15Å; M296-V485 HydrophobicContact CB-CG1 4.28Å; M296-V485 HydrophobicContact SD-CG1 4.23Å; M296-P486 HydrophobicContact CE-CG 3.74Å; M296-P486 HydrophobicContact SD-CG 3.91Å
297S91.6Very high91.3Very high11 Ų1140.5 Ų40.58%0.07724%0.237CC..Hα-helixtrans-70.1-39.6176.1-56.70000111.3I282 P285 S293 M294 M295 L301I282-S297 WeakPolarHBondContact CD1-O 3.48Å; P285-S297 WeakPolarHBondContact CG-OG 3.32Å; S293-S297 PolarHBondContact O-N 3.43Å; S293-S297 PolarHBondContact O-OG 3.35Å; M294-S297 WeakPolarHBondContact O-CA 3.46Å; M294-S297 WeakPolarHBondContact O-CB 3.27Å; M294-S297 PolarHBondContact O-N 2.7Å; M295-S297 VanDerWaalsContact C-N 3.29Å; M295-S297 PolarHBondContact O-N 2.76Å; S297-L301 WeakPolarHBondContact O-CB 3.48Å; S297-L301 PolarHBondContact O-N 2.95Å
298L93.6Very high92Very high24 Ų2440.1 Ų40.113%0.12622%0.223CC..Hα-helixtrans-70.8-41.7179.4-65.2176.9000112.7M294 M295 L301 A302 F356 L360 L362 I373M294-L298 HydrophobicContact CG-CD1 3.92Å; M294-L298 HydrophobicContact CG-CG 4.35Å; M294-L298 WeakPolarHBondContact O-CG 3.19Å; M294-L298 PolarHBondContact O-N 2.92Å; M295-L298 PolarHBondContact O-N 3.23Å; M295-L298 HydrophobicContact SD-CD1 3.94Å; L298-L301 PolarHBondContact O-N 3.02Å; L298-A302 WeakPolarHBondContact O-CB 3.35Å; L298-A302 PolarHBondContact O-N 2.98Å; L298-F356 HydrophobicContact CD2-CD1 3.46Å; L298-F356 VanDerWaalsContact CD2-CD1 3.46Å; L298-F356 HydrophobicContact CD2-CD2 4.49Å; L298-F356 HydrophobicContact CD2-CE1 3.59Å; L298-F356 HydrophobicContact CD2-CG 3.94Å; L298-F356 HydrophobicContact CD2-CZ 4.18Å; L298-L360 HydrophobicContact CD2-CD2 4.24Å; L298-L362 HydrophobicContact CD2-CD1 4.44Å; L298-I373 HydrophobicContact CD1-CD1 3.88Å
299T92.7Very high92.6Very high5 Ų534.7 Ų34.73%0.03119%0.188CC..Hα-helixtrans-67.2-43.2175.857.30000111.9M295 M296 L301 A302 D303 L476 V485 L491M295-T299 WeakPolarHBondContact O-CG2 3.43Å; M295-T299 PolarHBondContact O-N 3.35Å; M295-T299 PolarHBondContact O-OG1 3.49Å; M296-T299 PolarHBondContact O-OG1 2.76Å; T299-L301 PolarHBondContact O-N 2.98Å; T299-A302 PolarHBondContact O-N 3.37Å; T299-D303 WeakPolarHBondContact O-CB 3.36Å; T299-D303 PolarHBondContact O-N 3.13Å; T299-L476 HydrophobicContact CG2-CD2 4.3Å; T299-V485 HydrophobicContact CG2-CG1 3.91Å; T299-V485 WeakPolarHBondContact OG1-CG1 3.24Å; T299-L491 HydrophobicContact CG2-CD2 4.05Å
300K90.7Very high92.9Very high74 Ų7435.6 Ų35.632%0.32219%0.193SC..Hα-helixtrans-64.8-24.9175.1-178.6-170.3174.8-1570112.8I282 M296 K304 Y488I282-K300 HydrophobicContact CD1-CB 3.91Å; I282-K300 HydrophobicContact CD1-CD 4.03Å; I282-K300 HydrophobicContact CD1-CG 3.85Å; I282-K300 HydrophobicContact CG1-CD 3.9Å; I282-K300 HydrophobicContact CG1-CG 4.16Å; I282-K300 PolarHBondContact O-NZ 2.81Å; I282-K300 VanDerWaalsContact O-NZ 3.13Å; M296-K300 WeakPolarHBondContact O-CB 3.34Å; M296-K300 PolarHBondContact O-N 3.33Å; M296-K300 VanDerWaalsContact O-N 3.15Å; K300-K304 WeakPolarHBondContact O-CG 3.46Å; K300-Y488 HydrophobicContact CB-CE2 3.69Å; K300-Y488 HydrophobicContact CG-CE2 4.29Å
301L94.1Very high93.1Very high4 Ų434.3 Ų34.32%0.02119%0.188CC..Hα-helixtrans-77.2-49.2171.3-17861.5000111V280 I282 S297 L298 T299 D303 K304 E305 F356 A357 L360V280-L301 HydrophobicContact CB-CD1 4.04Å; V280-L301 HydrophobicContact CG1-CD1 3.72Å; I282-L301 HydrophobicContact CD1-CB 3.61Å; I282-L301 HydrophobicContact CD1-CD1 4.44Å; I282-L301 VanDerWaalsContact CD1-N 3.27Å; S297-L301 WeakPolarHBondContact O-CB 3.48Å; S297-L301 PolarHBondContact O-N 2.95Å; L298-L301 PolarHBondContact O-N 3.02Å; T299-L301 PolarHBondContact O-N 2.98Å; L301-D303 VanDerWaalsContact C-N 3.3Å; L301-D303 PolarHBondContact O-N 3.18Å; L301-K304 PolarHBondContact O-N 3.33Å; L301-E305 HydrophobicContact CD1-CG 4.16Å; L301-E305 HydrophobicContact CG-CG 4.35Å; L301-E305 PolarHBondContact O-N 3.32Å; L301-F356 HydrophobicContact CD2-CB 3.72Å; L301-F356 HydrophobicContact CD2-CD1 4.41Å; L301-F356 WeakPolarHBondContact CD2-O 3.22Å; L301-A357 HydrophobicContact CD1-CB 4.24Å; L301-A357 HydrophobicContact CD2-CB 4.43Å; L301-L360 HydrophobicContact CD2-CD2 4.49Å
302A94.6Very high93.5Very high13 Ų1331.7 Ų31.711%0.10718%0.175CC..Hα-helixtrans-58.1-41.7-18000000112L298 T299 E305 L306 L339 L491L298-A302 WeakPolarHBondContact O-CB 3.35Å; L298-A302 PolarHBondContact O-N 2.98Å; T299-A302 PolarHBondContact O-N 3.37Å; A302-E305 PolarHBondContact O-N 3.36Å; A302-L306 WeakPolarHBondContact O-CB 3.39Å; A302-L306 VanDerWaalsContact O-CG 3.22Å; A302-L306 WeakPolarHBondContact O-CG 3.32Å; A302-L306 PolarHBondContact O-N 3.49Å; A302-L339 HydrophobicContact CB-CD1 3.89Å; A302-L491 HydrophobicContact CB-CD1 4.02Å; A302-L491 HydrophobicContact CB-CD2 4.19Å
303D92.3Very high93.9Very high34 Ų3429.7 Ų29.718%0.18216%0.158CC..Hα-helixtrans-59.2-46.7175.5-173.877.3000112.6T299 L301 L306 V307 Y488 L491T299-D303 WeakPolarHBondContact O-CB 3.36Å; T299-D303 PolarHBondContact O-N 3.13Å; L301-D303 VanDerWaalsContact C-N 3.3Å; L301-D303 PolarHBondContact O-N 3.18Å; D303-L306 WeakPolarHBondContact O-CB 3.48Å; D303-L306 PolarHBondContact O-N 3.42Å; D303-V307 PolarHBondContact O-N 3.33Å; D303-Y488 HydrophobicContact CB-CD2 3.98Å; D303-Y488 HydrophobicContact CB-CG 4.21Å; D303-Y488 VanDerWaalsContact OD1-CB 3.29Å; D303-Y488 WeakPolarHBondContact OD1-CB 3.48Å; D303-L491 HydrophobicContact CB-CB 4.44Å
304K92.3Very high94.1Very high77 Ų7733.8 Ų33.834%0.33517%0.172SC..Hα-helixtrans-63.5-45.9174.1-70.1-176-178-164.90112.5V280 L281 K300 L301 L306 V307 H308V280-K304 HydrophobicContact CG1-CB 3.75Å; V280-K304 HydrophobicContact CG1-CD 3.44Å; V280-K304 VanDerWaalsContact CG1-CD 3.44Å; V280-K304 HydrophobicContact CG1-CG 4.29Å; V280-K304 HydrophobicContact CG2-CB 4.45Å; L281-K304 PolarHBondContact O-NZ 3.5Å; K300-K304 WeakPolarHBondContact O-CG 3.46Å; L301-K304 PolarHBondContact O-N 3.33Å; K304-L306 VanDerWaalsContact C-N 3.27Å; K304-L306 PolarHBondContact O-N 3.14Å; K304-V307 PolarHBondContact O-N 3.22Å; K304-H308 PolarHBondContact O-CD2 2.9Å; K304-H308 PolarHBondContact O-N 3.12Å
305E95.4Very high94.3Very high28 Ų2838.5 Ų38.513%0.13119%0.193CC..Hα-helixtrans-65.8-30.5178.6-68.3-158.2101.800111.8V280 L301 A302 H308 M309 L339 R346V280-E305 HydrophobicContact CB-CG 4.46Å; V280-E305 HydrophobicContact CG2-CG 3.99Å; L301-E305 HydrophobicContact CD1-CG 4.16Å; L301-E305 HydrophobicContact CG-CG 4.35Å; L301-E305 PolarHBondContact O-N 3.32Å; A302-E305 PolarHBondContact O-N 3.36Å; E305-H308 CarbonylContact O-C 3.56Å; E305-H308 PolarHBondContact O-N 2.83Å; E305-M309 WeakPolarHBondContact O-CB 3.34Å; E305-M309 PolarHBondContact O-N 3.25Å; E305-L339 HydrophobicContact CB-CD2 3.39Å; E305-L339 HydrophobicContact CG-CD2 4.42Å; E305-R346 IonicContact OE1-CZ 2.66Å; E305-R346 VanDerWaalsContact OE1-CZ 3.28Å; E305-R346 IonicContact OE1-NH1 3.28Å; E305-R346 PolarHBondContact OE1-NH1 2.95Å; E305-R346 IonicContact OE1-NH2 3.44Å; E305-R346 PolarHBondContact OE1-NH2 3.31Å; E305-R346 IonicContact OE2-CZ 2.76Å; E305-R346 IonicContact OE2-NH2 2.68Å; E305-R346 PolarHBondContact OE2-NH2 3.43Å
306L96Very high94.5Very high1 Ų138.5 Ų38.51%0.00519%0.193CC..Hα-helixtrans-62.4-45.8172-80.5170.4000112.2A302 D303 K304 H308 M309 I310 W335 L490 L491 M494A302-L306 WeakPolarHBondContact O-CB 3.39Å; A302-L306 VanDerWaalsContact O-CG 3.22Å; A302-L306 WeakPolarHBondContact O-CG 3.32Å; A302-L306 PolarHBondContact O-N 3.49Å; D303-L306 WeakPolarHBondContact O-CB 3.48Å; D303-L306 PolarHBondContact O-N 3.42Å; K304-L306 VanDerWaalsContact C-N 3.27Å; K304-L306 PolarHBondContact O-N 3.14Å; L306-H308 VanDerWaalsContact C-N 3.27Å; L306-H308 PolarHBondContact O-N 3.46Å; L306-M309 WeakPolarHBondContact O-CB 3.5Å; L306-M309 PolarHBondContact O-N 3.23Å; L306-M309 VanDerWaalsContact O-N 3.12Å; L306-I310 WeakPolarHBondContact O-CG1 3.39Å; L306-I310 PolarHBondContact O-N 2.95Å; L306-W335 HydrophobicContact CD1-CE3 4.41Å; L306-W335 HydrophobicContact CD2-CB 3.64Å; L306-W335 HydrophobicContact CD2-CD2 4.09Å; L306-W335 HydrophobicContact CD2-CE3 3.95Å; L306-W335 HydrophobicContact CD2-CG 4.02Å; L306-W335 HydrophobicContact CG-CE3 4.43Å; L306-L490 HydrophobicContact CB-CD2 3.87Å; L306-L490 HydrophobicContact CB-CG 4.37Å; L306-L490 HydrophobicContact CD1-CG 4.41Å; L306-L491 HydrophobicContact CD1-CB 4.05Å; L306-L491 HydrophobicContact CD1-CD1 3.65Å; L306-L491 HydrophobicContact CD1-CG 4.46Å; L306-M494 HydrophobicContact CD1-CB 4.48Å; L306-M494 HydrophobicContact CD1-CG 4.34Å; L306-M494 HydrophobicContact CD2-CE 3.99Å; L306-M494 HydrophobicContact CD2-CG 4.4Å
307V94.6Very high94.6Very high72 Ų7236.4 Ų36.444%0.43619%0.185SC..Hα-helixtrans-59.5-40.5175.51760000111.1D303 K304 S311 L490D303-V307 PolarHBondContact O-N 3.33Å; K304-V307 PolarHBondContact O-N 3.22Å; V307-S311 PolarHBondContact O-N 3.28Å; V307-S311 PolarHBondContact O-OG 2.91Å; V307-L490 HydrophobicContact CG2-CD2 3.71Å
308H96.2Very high94.5Very high62 Ų6236.2 Ų36.229%0.28718%0.184SC..Hα-helixtrans-71.4-34.1174.4-68.2-59.4000113.1P277 V280 K304 E305 L306 S311 W312P277-H308 HydrophobicContact CB-CB 3.88Å; V280-H308 VanDerWaalsContact CG2-CD2 3.46Å; V280-H308 WeakPolarHBondContact CG2-CD2 3.46Å; K304-H308 PolarHBondContact O-CD2 2.9Å; K304-H308 PolarHBondContact O-N 3.12Å; E305-H308 CarbonylContact O-C 3.56Å; E305-H308 PolarHBondContact O-N 2.83Å; L306-H308 VanDerWaalsContact C-N 3.27Å; L306-H308 PolarHBondContact O-N 3.46Å; H308-S311 WeakPolarHBondContact O-CB 3.47Å; H308-S311 PolarHBondContact O-N 3.46Å; H308-W312 WeakPolarHBondContact O-CB 3.33Å; H308-W312 PolarHBondContact O-N 3.45Å
309M96.9Very high94.6Very high7 Ų735.1 Ų35.13%0.03418%0.178CC..Hα-helixtrans-64.9-44.7174.7176.6178.1170.800112E305 L306 S311 W312 A313 L331 W335 V338 L405E305-M309 WeakPolarHBondContact O-CB 3.34Å; E305-M309 PolarHBondContact O-N 3.25Å; L306-M309 WeakPolarHBondContact O-CB 3.5Å; L306-M309 PolarHBondContact O-N 3.23Å; L306-M309 VanDerWaalsContact O-N 3.12Å; M309-S311 PolarHBondContact O-N 3.11Å; M309-W312 HydrophobicContact CG-CE3 4.13Å; M309-W312 HydrophobicContact CG-CZ3 4.45Å; M309-W312 PolarHBondContact O-N 3.25Å; M309-A313 WeakPolarHBondContact O-CB 3.4Å; M309-A313 PolarHBondContact O-N 3.23Å; M309-L331 HydrophobicContact CE-CD2 3.8Å; M309-L331 HydrophobicContact CG-CD2 4.3Å; M309-W335 HydrophobicContact CE-CB 4.21Å; M309-W335 HydrophobicContact SD-CB 3.95Å; M309-V338 HydrophobicContact CE-CB 3.7Å; M309-V338 HydrophobicContact CE-CG1 4.05Å; M309-V338 HydrophobicContact CE-CG2 3.57Å; M309-V338 HydrophobicContact CG-CG1 4.1Å; M309-V338 HydrophobicContact SD-CB 3.69Å; M309-V338 HydrophobicContact SD-CG1 3.77Å; M309-V338 HydrophobicContact SD-CG2 4.27Å; M309-L405 HydrophobicContact CE-CD1 4.32Å
310I95.7Very high94.6Very high39 Ų3937.9 Ų37.920%0.220%0.195CC..Hα-helixtrans-60.3-37175.2-65.5162.8000110.3L306 K314 L331 L490L306-I310 WeakPolarHBondContact O-CG1 3.39Å; L306-I310 PolarHBondContact O-N 2.95Å; I310-K314 WeakPolarHBondContact O-CD 3.34Å; I310-K314 WeakPolarHBondContact O-CG 3.37Å; I310-K314 PolarHBondContact O-N 3.06Å; I310-L331 HydrophobicContact CG1-CD1 4.25Å; I310-L490 HydrophobicContact CD1-CD1 4.01Å; I310-L490 HydrophobicContact CD1-CD2 3.92Å
311S96.1Very high94.5Very high60 Ų6037 Ų3742%0.4219%0.192SC..Hα-helixtrans-72.7-38.6177.4-56.50000112.5V307 H308 M309V307-S311 PolarHBondContact O-N 3.28Å; V307-S311 PolarHBondContact O-OG 2.91Å; H308-S311 WeakPolarHBondContact O-CB 3.47Å; H308-S311 PolarHBondContact O-N 3.46Å; M309-S311 PolarHBondContact O-N 3.11Å
312W97.9Very high94.3Very high4 Ų437.2 Ų37.22%0.01519%0.193CC..Hα-helixtrans-64.8-47.8174.5163.585000111.9E276 H308 M309 K314 K315 I316 V338 K401 L405E276-W312 PolarHBondContact OE1-NE1 3.32Å; H308-W312 WeakPolarHBondContact O-CB 3.33Å; H308-W312 PolarHBondContact O-N 3.45Å; M309-W312 HydrophobicContact CG-CE3 4.13Å; M309-W312 HydrophobicContact CG-CZ3 4.45Å; M309-W312 PolarHBondContact O-N 3.25Å; W312-K314 VanDerWaalsContact C-N 3.27Å; W312-K314 PolarHBondContact O-N 2.84Å; W312-K315 WeakPolarHBondContact O-CB 3.35Å; W312-K315 PolarHBondContact O-N 3.09Å; W312-I316 HydrophobicContact CD2-CD1 4.26Å; W312-I316 HydrophobicContact CE3-CD1 4.34Å; W312-I316 HydrophobicContact CH2-CD1 3.86Å; W312-I316 HydrophobicContact CZ2-CD1 3.76Å; W312-I316 HydrophobicContact CZ3-CD1 4.16Å; W312-V338 HydrophobicContact CE3-CG1 4.44Å; W312-V338 HydrophobicContact CH2-CG1 4.21Å; W312-V338 HydrophobicContact CZ3-CG1 3.91Å; W312-V338 HydrophobicContact CZ3-CG2 4.37Å; W312-K401 HydrophobicContact CH2-CD 4.3Å; W312-K401 HydrophobicContact CH2-CG 3.9Å; W312-K401 HydrophobicContact CZ2-CB 4.37Å; W312-K401 HydrophobicContact CZ2-CD 3.6Å; W312-K401 HydrophobicContact CZ2-CG 3.62Å; W312-L405 HydrophobicContact CH2-CB 4.15Å; W312-L405 HydrophobicContact CH2-CD2 4.29Å; W312-L405 HydrophobicContact CZ3-CB 4.19Å; W312-L405 HydrophobicContact CZ3-CD2 3.91Å; W312-L405 HydrophobicContact CZ3-CG 4.48Å
313A97.2Very high94Very high0 Ų039 Ų390%021%0.205CC..Hα-helixtrans-57.7-39.917900000112.1M309 K315 I316 F319 L331 L405M309-A313 WeakPolarHBondContact O-CB 3.4Å; M309-A313 PolarHBondContact O-N 3.23Å; A313-K315 PolarHBondContact O-N 2.89Å; A313-I316 WeakPolarHBondContact O-CB 3.39Å; A313-I316 PolarHBondContact O-N 2.99Å; A313-I316 VanDerWaalsContact O-N 3.07Å; A313-F319 HydrophobicContact CB-CD1 4.12Å; A313-F319 HydrophobicContact CB-CE1 3.79Å; A313-F319 HydrophobicContact CB-CE2 4.42Å; A313-F319 HydrophobicContact CB-CZ 3.96Å; A313-F319 WeakPolarHBondContact O-CB 3.43Å; A313-F319 VanDerWaalsContact O-CD1 3.29Å; A313-F319 WeakPolarHBondContact O-CD1 3.49Å; A313-F319 WeakPolarHBondContact O-CG 3.32Å; A313-L331 HydrophobicContact CB-CD2 3.85Å; A313-L405 HydrophobicContact CB-CD2 3.76Å
314K95.6Very high93.9Very high117 Ų11743.5 Ų43.551%0.50923%0.228SC..THydrogen-bonded Turntrans-65.9-15175.8-71.7170.3-176.8174.10114.7I310 W312 V320I310-K314 WeakPolarHBondContact O-CD 3.34Å; I310-K314 WeakPolarHBondContact O-CG 3.37Å; I310-K314 PolarHBondContact O-N 3.06Å; W312-K314 VanDerWaalsContact C-N 3.27Å; W312-K314 PolarHBondContact O-N 2.84Å; K314-V320 HydrophobicContact CB-CG1 4.16Å; K314-V320 HydrophobicContact CG-CG1 4.24Å
315K95.1Very high93.7Very high102 Ų10245.7 Ų45.744%0.44324%0.238SC..THydrogen-bonded Turntrans-89.2-14.8172.4-60.7179.9-173.9175.10113.2E274 A275 W312 A313 P317E274-K315 PolarHBondContact O-NZ 3.18Å; E274-K315 VanDerWaalsContact O-NZ 3.13Å; A275-K315 VanDerWaalsContact CA-CD 3.49Å; A275-K315 HydrophobicContact CB-CB 3.89Å; A275-K315 HydrophobicContact CB-CD 3.98Å; A275-K315 WeakPolarHBondContact O-CD 3.4Å; A275-K315 PolarHBondContact O-NZ 3.17Å; W312-K315 WeakPolarHBondContact O-CB 3.35Å; W312-K315 PolarHBondContact O-N 3.09Å; A313-K315 PolarHBondContact O-N 2.89Å; K315-P317 WeakPolarHBondContact O-CD 3.39Å
316I95Very high93.3Very high4 Ų445.5 Ų45.52%0.02124%0.238CC..SBendtrans-71.9124.1-179.1-64.6174.4000108.7L272 W312 A313 G318 F319 A402 L405L272-I316 HydrophobicContact CD2-CD1 4.39Å; L272-I316 HydrophobicContact CD2-CG1 3.95Å; L272-I316 HydrophobicContact CD2-CG2 4.4Å; W312-I316 HydrophobicContact CD2-CD1 4.26Å; W312-I316 HydrophobicContact CE3-CD1 4.34Å; W312-I316 HydrophobicContact CH2-CD1 3.86Å; W312-I316 HydrophobicContact CZ2-CD1 3.76Å; W312-I316 HydrophobicContact CZ3-CD1 4.16Å; A313-I316 WeakPolarHBondContact O-CB 3.39Å; A313-I316 PolarHBondContact O-N 2.99Å; A313-I316 VanDerWaalsContact O-N 3.07Å; I316-G318 PolarHBondContact O-N 3.43Å; I316-F319 HydrophobicContact CB-CB 4.27Å; I316-F319 WeakPolarHBondContact O-CB 3.24Å; I316-F319 PolarHBondContact O-N 2.9Å; I316-F319 VanDerWaalsContact O-N 3.12Å; I316-A402 HydrophobicContact CD1-CB 4.46Å; I316-L405 HydrophobicContact CD1-CD2 3.59Å
317P92.7Very high93.2Very high27 Ų2746.6 Ų46.618%0.17524%0.243CC..THydrogen-bonded Turntrans-53.4130.5-179.2-29.537.1000112.4L260 L263 L268 T271 K315 F319L260-P317 HydrophobicContact CD2-CB 4.4Å; L263-P317 HydrophobicContact CD1-CB 3.64Å; L263-P317 HydrophobicContact CD1-CG 3.84Å; L268-P317 HydrophobicContact CD1-CB 4.25Å; L268-P317 HydrophobicContact CD1-CG 3.78Å; T271-P317 HydrophobicContact CG2-CG 3.82Å; K315-P317 WeakPolarHBondContact O-CD 3.39Å; P317-F319 VanDerWaalsContact C-N 3.3Å; P317-F319 PolarHBondContact O-N 2.91Å
318G90.8Very high93Very high6 Ų646.1 Ų46.16%0.06224%0.24CC..THydrogen-bonded Turntrans83.8-11.7179.100000116.1I316 E321I316-G318 PolarHBondContact O-N 3.43Å; G318-E321 VanDerWaalsContact C-OE2 3.29Å; G318-E321 WeakPolarHBondContact CA-OE2 3.35Å; G318-E321 PolarHBondContact N-OE2 2.9Å; G318-E321 PolarHBondContact O-N 3.47Å
319F93.7Very high92.7Very high1 Ų144.9 Ų44.90%0.00423%0.233CC..THydrogen-bonded Turntrans-67.5-38.9179.6-175.8-95.2000111.9A313 I316 P317 E321 L322 Q327 L330 L331 L405A313-F319 HydrophobicContact CB-CD1 4.12Å; A313-F319 HydrophobicContact CB-CE1 3.79Å; A313-F319 HydrophobicContact CB-CE2 4.42Å; A313-F319 HydrophobicContact CB-CZ 3.96Å; A313-F319 WeakPolarHBondContact O-CB 3.43Å; A313-F319 VanDerWaalsContact O-CD1 3.29Å; A313-F319 WeakPolarHBondContact O-CD1 3.49Å; A313-F319 WeakPolarHBondContact O-CG 3.32Å; I316-F319 HydrophobicContact CB-CB 4.27Å; I316-F319 WeakPolarHBondContact O-CB 3.24Å; I316-F319 PolarHBondContact O-N 2.9Å; I316-F319 VanDerWaalsContact O-N 3.12Å; P317-F319 VanDerWaalsContact C-N 3.3Å; P317-F319 PolarHBondContact O-N 2.91Å; F319-E321 VanDerWaalsContact C-N 3.25Å; F319-E321 PolarHBondContact O-N 3.06Å; F319-L322 HydrophobicContact CD2-CD1 4.27Å; F319-L322 WeakPolarHBondContact O-CB 3.4Å; F319-L322 PolarHBondContact O-N 2.64Å; F319-Q327 HydrophobicContact CD1-CG 4.09Å; F319-Q327 HydrophobicContact CE1-CB 3.79Å; F319-Q327 HydrophobicContact CE1-CG 3.68Å; F319-Q327 HydrophobicContact CZ-CB 3.78Å; F319-Q327 HydrophobicContact CZ-CG 3.95Å; F319-Q327 WeakPolarHBondContact O-CG 3.31Å; F319-Q327 PolarHBondContact O-NE2 3.28Å; F319-L330 HydrophobicContact CD2-CD1 4.43Å; F319-L330 HydrophobicContact CE2-CB 4.31Å; F319-L330 HydrophobicContact CE2-CD1 3.84Å; F319-L331 HydrophobicContact CZ-CD1 4.25Å; F319-L331 HydrophobicContact CZ-CG 4.14Å; F319-L405 HydrophobicContact CD2-CD2 3.86Å; F319-L405 HydrophobicContact CD2-CG 4.43Å; F319-L405 HydrophobicContact CE2-CD1 4.04Å; F319-L405 HydrophobicContact CE2-CD2 3.81Å; F319-L405 HydrophobicContact CE2-CG 4.05Å
320V92.8Very high92.5Very high64 Ų6444.5 Ų44.539%0.38823%0.231SC..THydrogen-bonded Turntrans-77-11.4179.7-59.30000113.3K314 Q327K314-V320 HydrophobicContact CB-CG1 4.16Å; K314-V320 HydrophobicContact CG-CG1 4.24Å; V320-Q327 PolarHBondContact O-NE2 3.23Å
321E89.4Confident92.4Very high54 Ų5443.4 Ų43.425%0.25223%0.225SC..THydrogen-bonded Turntrans-86.7-6.6173.7-71.768.7-154.600113.9G318 F319 K425G318-E321 VanDerWaalsContact C-OE2 3.29Å; G318-E321 WeakPolarHBondContact CA-OE2 3.35Å; G318-E321 PolarHBondContact N-OE2 2.9Å; G318-E321 PolarHBondContact O-N 3.47Å; F319-E321 VanDerWaalsContact C-N 3.25Å; F319-E321 PolarHBondContact O-N 3.06Å; E321-K425 PolarHBondContact O-NZ 3.33Å
322L89.8Confident92.2Very high10 Ų1042.8 Ų42.85%0.05222%0.216CC..SBendtrans-76.4162.2165.4-58179000110.6F319 D326 Q327 L330 K425 L426 L429F319-L322 HydrophobicContact CD2-CD1 4.27Å; F319-L322 WeakPolarHBondContact O-CB 3.4Å; F319-L322 PolarHBondContact O-N 2.64Å; L322-D326 HydrophobicContact CB-CB 4.12Å; L322-Q327 HydrophobicContact CB-CG 4.09Å; L322-Q327 PolarHBondContact O-NE2 2.58Å; L322-L330 HydrophobicContact CD1-CD1 3.53Å; L322-K425 HydrophobicContact CD2-CB 3.78Å; L322-L426 HydrophobicContact CD1-CD1 4.36Å; L322-L429 HydrophobicContact CD1-CD1 3.88Å; L322-L429 HydrophobicContact CD2-CD1 4.02Å; L322-L429 HydrophobicContact CG-CD1 4.01Å
323S89.4Confident91.9Very high49 Ų4942.9 Ų42.934%0.34322%0.217SC..  trans-66.1153.9173.982.30000110.9F325 D326 Q327S323-F325 PolarHBondContact O-N 2.65Å; S323-F325 PolarHBondContact OG-N 3.01Å; S323-D326 VanDerWaalsContact CB-OD2 3.27Å; S323-D326 WeakPolarHBondContact CB-OD2 3.41Å; S323-D326 PolarHBondContact N-OD2 3.22Å; S323-D326 PolarHBondContact O-N 3.46Å; S323-D326 PolarHBondContact OG-N 3.49Å; S323-D326 VanDerWaalsContact OG-N 3.09Å; S323-D326 PolarHBondContact OG-OD2 3.34Å; S323-Q327 WeakPolarHBondContact O-CG 3.3Å; S323-Q327 PolarHBondContact O-N 3.39Å
324L89.7Confident91.7Very high130 Ų13043 Ų4368%0.68122%0.218SC*.Hα-helixtrans-58.6-33.9176.4-178.961.5000111.8Q327 V328L324-Q327 PolarHBondContact O-N 2.94Å; L324-V328 HydrophobicContact CD1-CG2 4.27Å; L324-V328 WeakPolarHBondContact O-CB 3.47Å; L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.49Å; L324-V328 PolarHBondContact O-N 2.68Å
325F87.6Confident91.7Very high123 Ų12337.4 Ų37.454%0.53919%0.193SC..Hα-helixtrans-63.8-43.6174.4177.1-109.2000112S323 R329S323-F325 PolarHBondContact O-N 2.65Å; S323-F325 PolarHBondContact OG-N 3.01Å; F325-R329 HydrophobicContact CE2-CG 4.36Å; F325-R329 HydrophobicContact CZ-CG 4.38Å; F325-R329 WeakPolarHBondContact O-CB 3.4Å; F325-R329 VanDerWaalsContact O-CG 3.31Å; F325-R329 WeakPolarHBondContact O-CG 3.32Å; F325-R329 PolarHBondContact O-N 2.94Å
326D87.9Confident91.7Very high23 Ų2333.7 Ų33.712%0.12318%0.178CC..Hα-helixtrans-65.3-46.8174.7-59.8-53.2000111L322 S323 V328 R329 L330 S422L322-D326 HydrophobicContact CB-CB 4.12Å; S323-D326 VanDerWaalsContact CB-OD2 3.27Å; S323-D326 WeakPolarHBondContact CB-OD2 3.41Å; S323-D326 PolarHBondContact N-OD2 3.22Å; S323-D326 PolarHBondContact O-N 3.46Å; S323-D326 PolarHBondContact OG-N 3.49Å; S323-D326 VanDerWaalsContact OG-N 3.09Å; S323-D326 PolarHBondContact OG-OD2 3.34Å; D326-V328 PolarHBondContact O-N 2.74Å; D326-R329 PolarHBondContact O-N 2.76Å; D326-L330 WeakPolarHBondContact O-CB 3.29Å; D326-L330 WeakPolarHBondContact O-CD1 3.14Å; D326-L330 WeakPolarHBondContact O-CG 3.31Å; D326-L330 PolarHBondContact O-N 2.77Å; D326-S422 VanDerWaalsContact OD2-CB 3.28Å; D326-S422 WeakPolarHBondContact OD2-CB 3.5Å; D326-S422 PolarHBondContact OD2-OG 3.26Å
327Q93.1Very high91.8Very high24 Ų2433.8 Ų33.811%0.11218%0.178CC..Hα-helixtrans-56-48.7178.7-69.5176.444.900111.6F319 V320 L322 S323 L324 L331F319-Q327 HydrophobicContact CD1-CG 4.09Å; F319-Q327 HydrophobicContact CE1-CB 3.79Å; F319-Q327 HydrophobicContact CE1-CG 3.68Å; F319-Q327 HydrophobicContact CZ-CB 3.78Å; F319-Q327 HydrophobicContact CZ-CG 3.95Å; F319-Q327 WeakPolarHBondContact O-CG 3.31Å; F319-Q327 PolarHBondContact O-NE2 3.28Å; V320-Q327 PolarHBondContact O-NE2 3.23Å; L322-Q327 HydrophobicContact CB-CG 4.09Å; L322-Q327 PolarHBondContact O-NE2 2.58Å; S323-Q327 WeakPolarHBondContact O-CG 3.3Å; S323-Q327 PolarHBondContact O-N 3.39Å; L324-Q327 PolarHBondContact O-N 2.94Å; Q327-L331 WeakPolarHBondContact O-CD1 3.49Å; Q327-L331 VanDerWaalsContact O-CG 3.31Å; Q327-L331 WeakPolarHBondContact O-CG 3.3Å; Q327-L331 PolarHBondContact O-N 3.04Å
328V91.3Very high92Very high63 Ų6332.8 Ų32.838%0.38217%0.172SC..Hα-helixtrans-64.4-49176.1171.80000110.6L324 D326 L330 L331 E332L324-V328 HydrophobicContact CD1-CG2 4.27Å; L324-V328 WeakPolarHBondContact O-CB 3.47Å; L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.49Å; L324-V328 PolarHBondContact O-N 2.68Å; D326-V328 PolarHBondContact O-N 2.74Å; V328-L330 VanDerWaalsContact C-N 3.27Å; V328-L330 PolarHBondContact O-N 3.42Å; V328-L331 PolarHBondContact O-N 3.13Å; V328-E332 HydrophobicContact CG1-CG 4.01Å; V328-E332 WeakPolarHBondContact CG1-OE1 3.41Å; V328-E332 WeakPolarHBondContact O-CB 3.4Å; V328-E332 WeakPolarHBondContact O-CG 3.39Å; V328-E332 PolarHBondContact O-N 3.13Å
329R88.4Confident92.3Very high35 Ų3533.4 Ų33.413%0.13217%0.173CC..Hα-helixtrans-58.6-34.2179.9-87.6-174.5146.1-139.2-2.5114.2F325 D326 S333 M410 Y411 R501F325-R329 HydrophobicContact CE2-CG 4.36Å; F325-R329 HydrophobicContact CZ-CG 4.38Å; F325-R329 WeakPolarHBondContact O-CB 3.4Å; F325-R329 VanDerWaalsContact O-CG 3.31Å; F325-R329 WeakPolarHBondContact O-CG 3.32Å; F325-R329 PolarHBondContact O-N 2.94Å; D326-R329 PolarHBondContact O-N 2.76Å; R329-S333 VanDerWaalsContact O-CB 3.3Å; R329-S333 WeakPolarHBondContact O-CB 3.49Å; R329-S333 PolarHBondContact O-N 3.49Å; R329-S333 PolarHBondContact O-OG 3.24Å; R329-M410 HydrophobicContact CB-CE 3.98Å; R329-M410 HydrophobicContact CB-SD 4.12Å; R329-Y411 PolarHBondContact NH1-O 2.83Å; R329-R501 PolarHBondContact O-NH2 3.07Å; R329-R501 VanDerWaalsContact O-NH2 3.13Å
330L92.9Very high92.5Very high0 Ų033.7 Ų33.70%018%0.175CC..Hα-helixtrans-67.8-55.6175.6-71.3165.5000109.8F319 L322 D326 V328 E332 S333 C334 L405 M410 L426F319-L330 HydrophobicContact CD2-CD1 4.43Å; F319-L330 HydrophobicContact CE2-CB 4.31Å; F319-L330 HydrophobicContact CE2-CD1 3.84Å; L322-L330 HydrophobicContact CD1-CD1 3.53Å; D326-L330 WeakPolarHBondContact O-CB 3.29Å; D326-L330 WeakPolarHBondContact O-CD1 3.14Å; D326-L330 WeakPolarHBondContact O-CG 3.31Å; D326-L330 PolarHBondContact O-N 2.77Å; V328-L330 VanDerWaalsContact C-N 3.27Å; V328-L330 PolarHBondContact O-N 3.42Å; L330-E332 PolarHBondContact O-N 3.24Å; L330-S333 PolarHBondContact O-N 3.38Å; L330-S333 PolarHBondContact O-OG 3.48Å; L330-C334 PolarHBondContact O-N 3.1Å; L330-C334 PolarHBondContact O-SG 2.67Å; L330-L405 HydrophobicContact CB-CD1 4.35Å; L330-L405 WeakPolarHBondContact CD2-O 3.49Å; L330-M410 HydrophobicContact CD2-CE 4Å; L330-M410 HydrophobicContact CG-CE 4.39Å; L330-L426 HydrophobicContact CD1-CD1 3.96Å; L330-L426 HydrophobicContact CD2-CD1 4.01Å; L330-L426 HydrophobicContact CD2-CD2 3.97Å
331L94.6Very high92.8Very high15 Ų1530.7 Ų30.78%0.07916%0.157CC..Hα-helixtrans-54.3-51.7176.9-69.2165000111.6M309 I310 A313 F319 Q327 V328 S333 C334 W335 L405 M494M309-L331 HydrophobicContact CE-CD2 3.8Å; M309-L331 HydrophobicContact CG-CD2 4.3Å; I310-L331 HydrophobicContact CG1-CD1 4.25Å; A313-L331 HydrophobicContact CB-CD2 3.85Å; F319-L331 HydrophobicContact CZ-CD1 4.25Å; F319-L331 HydrophobicContact CZ-CG 4.14Å; Q327-L331 WeakPolarHBondContact O-CD1 3.49Å; Q327-L331 VanDerWaalsContact O-CG 3.31Å; Q327-L331 WeakPolarHBondContact O-CG 3.3Å; Q327-L331 PolarHBondContact O-N 3.04Å; V328-L331 PolarHBondContact O-N 3.13Å; L331-S333 PolarHBondContact O-N 3.29Å; L331-C334 PolarHBondContact O-N 3.39Å; L331-W335 WeakPolarHBondContact O-CB 3.34Å; L331-W335 PolarHBondContact O-N 2.9Å; L331-L405 HydrophobicContact CD2-CD1 3.97Å; L331-L405 HydrophobicContact CG-CD1 4.44Å; L331-M494 VanDerWaalsContact C-CE 3.47Å; L331-M494 HydrophobicContact CB-CE 4.11Å; L331-M494 WeakPolarHBondContact O-CE 3.36Å
332E91.9Very high93.1Very high48 Ų4828.3 Ų28.322%0.22415%0.147CC..Hα-helixtrans-49.8-29.5176-82-178.9-175.500113.5V328 L330 M494 A497 H498 R501V328-E332 HydrophobicContact CG1-CG 4.01Å; V328-E332 WeakPolarHBondContact CG1-OE1 3.41Å; V328-E332 WeakPolarHBondContact O-CB 3.4Å; V328-E332 WeakPolarHBondContact O-CG 3.39Å; V328-E332 PolarHBondContact O-N 3.13Å; L330-E332 PolarHBondContact O-N 3.24Å; E332-M494 HydrophobicContact CG-SD 4.4Å; E332-A497 HydrophobicContact CB-CB 4.05Å; E332-A497 HydrophobicContact CG-CB 3.68Å; E332-H498 PolarHBondContact O-CD2 2.89Å; E332-H498 PolarHBondContact O-NE2 2.68Å; E332-R501 IonicContact OE2-CZ 2.94Å; E332-R501 IonicContact OE2-NE 2.74Å; E332-R501 IonicContact OE2-NH2 3.72Å; E332-R501 PolarHBondContact OE2-NH2 3.47Å
333S90.4Very high93.5Very high6 Ų628.3 Ų28.34%0.04215%0.147CC..Hα-helixtrans-102.6-10.4-167.670.70000116R329 L330 L331 S408R329-S333 VanDerWaalsContact O-CB 3.3Å; R329-S333 WeakPolarHBondContact O-CB 3.49Å; R329-S333 PolarHBondContact O-N 3.49Å; R329-S333 PolarHBondContact O-OG 3.24Å; L330-S333 PolarHBondContact O-N 3.38Å; L330-S333 PolarHBondContact O-OG 3.48Å; L331-S333 PolarHBondContact O-N 3.29Å; S333-S408 WeakPolarHBondContact CB-OG 3.49Å; S333-S408 WeakPolarHBondContact OG-CB 3.46Å; S333-S408 PolarHBondContact OG-OG 3.46Å
334C93.7Very high93.9Very high1 Ų126 Ų261%0.00713%0.131CC..Hα-helixtrans-133.3-3.1-172.570.90000114.1L330 L331 M336 E337 V338 I404L330-C334 PolarHBondContact O-N 3.1Å; L330-C334 PolarHBondContact O-SG 2.67Å; L331-C334 PolarHBondContact O-N 3.39Å; C334-M336 VanDerWaalsContact C-N 3.33Å; C334-M336 PolarHBondContact O-N 2.85Å; C334-E337 WeakPolarHBondContact CA-OE1 3.27Å; C334-E337 WeakPolarHBondContact O-CA 3.32Å; C334-E337 WeakPolarHBondContact O-CB 3.45Å; C334-E337 PolarHBondContact O-N 2.89Å; C334-V338 PolarHBondContact O-N 2.99Å; C334-I404 HydrophobicContact CB-CG2 4.11Å
335W95.5Very high94.3Very high0 Ų022.3 Ų22.30%011%0.108CC..Hα-helixtrans-55.7-45.6-170.667.2-90.8000113.5L306 M309 L331 E337 V338 L339 M473 L476 L491 M494 L495 H498L306-W335 HydrophobicContact CD1-CE3 4.41Å; L306-W335 HydrophobicContact CD2-CB 3.64Å; L306-W335 HydrophobicContact CD2-CD2 4.09Å; L306-W335 HydrophobicContact CD2-CE3 3.95Å; L306-W335 HydrophobicContact CD2-CG 4.02Å; L306-W335 HydrophobicContact CG-CE3 4.43Å; M309-W335 HydrophobicContact CE-CB 4.21Å; M309-W335 HydrophobicContact SD-CB 3.95Å; L331-W335 WeakPolarHBondContact O-CB 3.34Å; L331-W335 PolarHBondContact O-N 2.9Å; W335-E337 VanDerWaalsContact C-N 3.28Å; W335-E337 PolarHBondContact O-N 3.04Å; W335-V338 PolarHBondContact O-N 3.43Å; W335-V338 VanDerWaalsContact O-N 3.15Å; W335-L339 HydrophobicContact CE3-CD1 3.87Å; W335-L339 HydrophobicContact CE3-CG 4.48Å; W335-L339 HydrophobicContact CZ3-CD1 4.05Å; W335-L339 WeakPolarHBondContact O-CG 3.19Å; W335-L339 PolarHBondContact O-N 3.4Å; W335-M473 HydrophobicContact CH2-CE 4.48Å; W335-M473 HydrophobicContact CH2-SD 4.36Å; W335-M473 HydrophobicContact CZ2-CE 3.66Å; W335-M473 HydrophobicContact CZ2-SD 3.56Å; W335-M473 VanDerWaalsContact CZ2-SD 3.56Å; W335-L476 HydrophobicContact CH2-CD1 3.98Å; W335-L491 HydrophobicContact CE3-CD1 4.49Å; W335-L491 HydrophobicContact CH2-CD1 3.51Å; W335-L491 HydrophobicContact CZ2-CD1 4.3Å; W335-L491 HydrophobicContact CZ3-CD1 3.62Å; W335-M494 HydrophobicContact CB-CE 3.66Å; W335-M494 HydrophobicContact CD2-CB 4.37Å; W335-M494 HydrophobicContact CG-CB 4.38Å; W335-M494 HydrophobicContact CG-CE 3.76Å; W335-M494 PolarHBondContact NE1-O 2.67Å; W335-L495 HydrophobicContact CZ2-CB 4.49Å; W335-L495 HydrophobicContact CZ2-CD1 4.47Å; W335-H498 AromaticContact NE1-CD2 3.92Å
336M95.8Very high94.7Very high24 Ų2419 Ų1912%0.1189%0.092CC..Hα-helixtrans-66.3-29.6179.4-163.463.1166.700112.4C334 M340 M473 L476C334-M336 VanDerWaalsContact C-N 3.33Å; C334-M336 PolarHBondContact O-N 2.85Å; M336-M340 HydrophobicContact CE-CE 3.78Å; M336-M340 HydrophobicContact CG-CE 4.31Å; M336-M340 VanDerWaalsContact O-CB 3.27Å; M336-M340 WeakPolarHBondContact O-CB 3.48Å; M336-M340 VanDerWaalsContact O-CG 3.25Å; M336-M340 WeakPolarHBondContact O-CG 3.47Å; M336-M340 PolarHBondContact O-N 3.01Å; M336-M473 HydrophobicContact CB-CE 3.77Å; M336-M473 HydrophobicContact CG-CE 4.47Å; M336-L476 HydrophobicContact CE-CD1 3.64Å; M336-L476 HydrophobicContact CE-CG 4.48Å; M336-L476 HydrophobicContact SD-CD1 4.23Å
337E96.6Very high95.2Very high6 Ų618 Ų183%0.0289%0.086CC..Hα-helixtrans-69.8-41.1172.2-64.6167.1-86.900111.8C334 W335 M340 V341 I404 V465 R466 S469C334-E337 WeakPolarHBondContact CA-OE1 3.27Å; C334-E337 WeakPolarHBondContact O-CA 3.32Å; C334-E337 WeakPolarHBondContact O-CB 3.45Å; C334-E337 PolarHBondContact O-N 2.89Å; W335-E337 VanDerWaalsContact C-N 3.28Å; W335-E337 PolarHBondContact O-N 3.04Å; E337-M340 PolarHBondContact O-N 3.01Å; E337-V341 WeakPolarHBondContact O-CB 3.29Å; E337-V341 WeakPolarHBondContact O-CG1 3.36Å; E337-V341 PolarHBondContact O-N 3.02Å; E337-I404 HydrophobicContact CB-CG2 3.41Å; E337-I404 VanDerWaalsContact CB-CG2 3.41Å; E337-I404 HydrophobicContact CG-CG2 4.37Å; E337-V465 HydrophobicContact CB-CG1 3.72Å; E337-V465 HydrophobicContact CG-CG1 4.07Å; E337-R466 IonicContact OE1-CZ 3.56Å; E337-R466 IonicContact OE1-NE 3.63Å; E337-R466 PolarHBondContact OE1-NE 3.29Å; E337-R466 IonicContact OE1-NH1 3.26Å; E337-R466 IonicContact OE1-NH2 2.73Å; E337-R466 PolarHBondContact OE1-NH2 3.42Å; E337-R466 IonicContact OE2-CZ 2.74Å; E337-R466 IonicContact OE2-NE 3.88Å; E337-R466 PolarHBondContact OE2-NE 3.26Å; E337-R466 IonicContact OE2-NH2 2.76Å; E337-R466 PolarHBondContact OE2-NH2 2.73Å; E337-S469 WeakPolarHBondContact CG-OG 3.49Å
338V97.3Very high95.4Very high7 Ų717.6 Ų17.64%0.0429%0.085CC..Hα-helixtrans-69.3-37.4178.8177.10000111.3M309 W312 C334 W335 G342 K401 I404M309-V338 HydrophobicContact CE-CB 3.7Å; M309-V338 HydrophobicContact CE-CG1 4.05Å; M309-V338 HydrophobicContact CE-CG2 3.57Å; M309-V338 HydrophobicContact CG-CG1 4.1Å; M309-V338 HydrophobicContact SD-CB 3.69Å; M309-V338 HydrophobicContact SD-CG1 3.77Å; M309-V338 HydrophobicContact SD-CG2 4.27Å; W312-V338 HydrophobicContact CE3-CG1 4.44Å; W312-V338 HydrophobicContact CH2-CG1 4.21Å; W312-V338 HydrophobicContact CZ3-CG1 3.91Å; W312-V338 HydrophobicContact CZ3-CG2 4.37Å; C334-V338 PolarHBondContact O-N 2.99Å; W335-V338 PolarHBondContact O-N 3.43Å; W335-V338 VanDerWaalsContact O-N 3.15Å; V338-G342 PolarHBondContact O-N 2.9Å; V338-G342 VanDerWaalsContact O-N 3.15Å; V338-K401 HydrophobicContact CG1-CG 4.43Å; V338-I404 HydrophobicContact CG2-CB 4.39Å; V338-I404 HydrophobicContact CG2-CG2 3.6Å
339L97.4Very high95.6Very high18 Ų1820.9 Ų20.99%0.09410%0.1CC..Hα-helixtrans-65.4-48.8171.1-63.7-168.1000111.3A302 E305 W335 G342 L343A302-L339 HydrophobicContact CB-CD1 3.89Å; E305-L339 HydrophobicContact CB-CD2 3.39Å; E305-L339 HydrophobicContact CG-CD2 4.42Å; W335-L339 HydrophobicContact CE3-CD1 3.87Å; W335-L339 HydrophobicContact CE3-CG 4.48Å; W335-L339 HydrophobicContact CZ3-CD1 4.05Å; W335-L339 WeakPolarHBondContact O-CG 3.19Å; W335-L339 PolarHBondContact O-N 3.4Å; L339-G342 PolarHBondContact O-N 2.9Å; L339-L343 PolarHBondContact O-N 3.44Å
340M97.5Very high96Very high8 Ų823.9 Ų23.94%0.03912%0.115CC..Hα-helixtrans-65.7-40.3-179.9-76.4-164.3178.800113.4M336 E337 G342 L343 M344 I376 L380 A468 S469M336-M340 HydrophobicContact CE-CE 3.78Å; M336-M340 HydrophobicContact CG-CE 4.31Å; M336-M340 VanDerWaalsContact O-CB 3.27Å; M336-M340 WeakPolarHBondContact O-CB 3.48Å; M336-M340 VanDerWaalsContact O-CG 3.25Å; M336-M340 WeakPolarHBondContact O-CG 3.47Å; M336-M340 PolarHBondContact O-N 3.01Å; E337-M340 PolarHBondContact O-N 3.01Å; M340-G342 VanDerWaalsContact C-N 3.28Å; M340-G342 PolarHBondContact O-N 3.04Å; M340-L343 WeakPolarHBondContact O-CB 3.49Å; M340-L343 PolarHBondContact O-N 3.17Å; M340-M344 HydrophobicContact CB-CE 4.23Å; M340-M344 WeakPolarHBondContact O-CE 3.47Å; M340-M344 VanDerWaalsContact O-CG 3.31Å; M340-M344 WeakPolarHBondContact O-CG 3.43Å; M340-M344 PolarHBondContact O-N 3.29Å; M340-I376 HydrophobicContact CE-CG2 3.85Å; M340-L380 HydrophobicContact CB-CD2 4.1Å; M340-L380 HydrophobicContact CG-CD2 4.02Å; M340-L380 HydrophobicContact SD-CD2 3.84Å; M340-A468 VanDerWaalsContact CE-O 3.22Å; M340-A468 WeakPolarHBondContact CE-O 3.43Å; M340-A468 HydrophobicContact SD-CB 3.65Å; M340-S469 VanDerWaalsContact SD-CA 3.58Å; M340-S469 PolarHBondContact SD-N 3.31Å; M340-S469 VanDerWaalsContact SD-N 3.42Å
341V97.8Very high96.1Very high0 Ų028.4 Ų28.40%015%0.145CC..Hα-helixtrans-67-33.4176.483.10000111.2E337 W345 F387 Y397 K401 I404 V465E337-V341 WeakPolarHBondContact O-CB 3.29Å; E337-V341 WeakPolarHBondContact O-CG1 3.36Å; E337-V341 PolarHBondContact O-N 3.02Å; V341-W345 WeakPolarHBondContact O-CB 3.4Å; V341-W345 PolarHBondContact O-N 2.96Å; V341-F387 HydrophobicContact CG2-CE2 4.14Å; V341-F387 HydrophobicContact CG2-CZ 3.99Å; V341-Y397 HydrophobicContact CG1-CE2 4.27Å; V341-Y397 HydrophobicContact CG2-CD2 4.39Å; V341-Y397 HydrophobicContact CG2-CE2 4.2Å; V341-K401 HydrophobicContact CG1-CB 4.34Å; V341-K401 HydrophobicContact CG1-CG 3.95Å; V341-I404 HydrophobicContact CB-CD1 3.94Å; V341-I404 HydrophobicContact CG1-CD1 3.89Å; V341-I404 HydrophobicContact CG2-CD1 4.03Å; V341-V465 HydrophobicContact CB-CG1 4.32Å; V341-V465 HydrophobicContact CG2-CG2 4.24Å
342G97.6Very high96.1Very high5 Ų529.6 Ų29.65%0.05216%0.161CC..Hα-helixtrans-62.8-48.6170.200000112.4V338 L339 M340 M344 W345 R346V338-G342 PolarHBondContact O-N 2.9Å; V338-G342 VanDerWaalsContact O-N 3.15Å; L339-G342 PolarHBondContact O-N 2.9Å; M340-G342 VanDerWaalsContact C-N 3.28Å; M340-G342 PolarHBondContact O-N 3.04Å; G342-M344 PolarHBondContact O-N 3.29Å; G342-W345 PolarHBondContact O-N 2.81Å; G342-R346 WeakPolarHBondContact O-CG 3.36Å; G342-R346 PolarHBondContact O-N 2.98Å
343L97.8Very high96.3Very high9 Ų931.4 Ų31.45%0.04717%0.168CC..Hα-helixtrans-56.8-48.5174.7174.458.4000112.4L339 M340 W345 R346 S347 L354 I355 F356 L380L339-L343 PolarHBondContact O-N 3.44Å; M340-L343 WeakPolarHBondContact O-CB 3.49Å; M340-L343 PolarHBondContact O-N 3.17Å; L343-W345 PolarHBondContact O-N 2.77Å; L343-R346 PolarHBondContact O-N 3.27Å; L343-S347 WeakPolarHBondContact O-CB 3.41Å; L343-S347 PolarHBondContact O-N 2.92Å; L343-S347 PolarHBondContact O-OG 3.36Å; L343-L354 HydrophobicContact CD1-CB 4.23Å; L343-I355 VanDerWaalsContact CD1-C 3.48Å; L343-I355 WeakPolarHBondContact CD1-O 3.07Å; L343-F356 HydrophobicContact CD1-CB 4.43Å; L343-F356 HydrophobicContact CD1-CD1 4.04Å; L343-F356 HydrophobicContact CD1-CD2 4.19Å; L343-F356 HydrophobicContact CD1-CE1 4.35Å; L343-F356 HydrophobicContact CD1-CE2 4.48Å; L343-F356 HydrophobicContact CD1-CG 3.96Å; L343-F356 HydrophobicContact CD2-CD1 3.92Å; L343-F356 HydrophobicContact CD2-CE1 3.48Å; L343-F356 VanDerWaalsContact CD2-CE1 3.48Å; L343-F356 HydrophobicContact CD2-CE2 4.39Å; L343-F356 HydrophobicContact CD2-CZ 3.75Å; L343-L380 HydrophobicContact CD2-CD1 3.86Å; L343-L380 HydrophobicContact CD2-CD2 4.46Å
344M97.9Very high96.6Very high0 Ų031.1 Ų31.10%017%0.166CC..Hα-helixtrans-66.6-36.9179.9-67.8-174.7-77.100112M340 G342 S347 I348 L380 T383 T384 F387 V465M340-M344 HydrophobicContact CB-CE 4.23Å; M340-M344 WeakPolarHBondContact O-CE 3.47Å; M340-M344 VanDerWaalsContact O-CG 3.31Å; M340-M344 WeakPolarHBondContact O-CG 3.43Å; M340-M344 PolarHBondContact O-N 3.29Å; G342-M344 PolarHBondContact O-N 3.29Å; M344-S347 PolarHBondContact O-N 3.01Å; M344-I348 PolarHBondContact O-N 2.74Å; M344-L380 HydrophobicContact CE-CD2 4.18Å; M344-L380 HydrophobicContact CG-CD2 3.74Å; M344-L380 HydrophobicContact SD-CD2 3.76Å; M344-T383 HydrophobicContact CE-CG2 4.04Å; M344-T383 WeakPolarHBondContact SD-CB 3.38Å; M344-T383 HydrophobicContact SD-CG2 3.47Å; M344-T383 WeakPolarHBondContact SD-CG2 3.36Å; M344-T384 WeakPolarHBondContact CB-OG1 3.46Å; M344-T384 WeakPolarHBondContact CG-OG1 3.34Å; M344-F387 HydrophobicContact CB-CD2 4.21Å; M344-F387 HydrophobicContact CB-CE2 3.71Å; M344-F387 HydrophobicContact CB-CZ 4.23Å; M344-F387 HydrophobicContact CE-CZ 4.26Å; M344-F387 HydrophobicContact SD-CZ 4.49Å; M344-V465 HydrophobicContact CE-CB 4.48Å; M344-V465 HydrophobicContact CE-CG1 4.43Å; M344-V465 HydrophobicContact CE-CG2 3.8Å
345W97.7Very high96.8Very high53 Ų5332.1 Ų32.120%0.20117%0.171CC..Hα-helixtrans-64.5-46172.1-179.2-99.9000112.3V341 G342 L343 S347 I348 L392 H394 Y397V341-W345 WeakPolarHBondContact O-CB 3.4Å; V341-W345 PolarHBondContact O-N 2.96Å; G342-W345 PolarHBondContact O-N 2.81Å; L343-W345 PolarHBondContact O-N 2.77Å; W345-S347 PolarHBondContact O-N 3.15Å; W345-I348 HydrophobicContact CE3-CD1 4.33Å; W345-I348 HydrophobicContact CZ3-CD1 3.99Å; W345-I348 VanDerWaalsContact O-CG2 3.31Å; W345-I348 WeakPolarHBondContact O-CG2 3.46Å; W345-I348 PolarHBondContact O-N 3.13Å; W345-L392 HydrophobicContact CE3-CD2 3.98Å; W345-L392 HydrophobicContact CE3-CG 4.39Å; W345-L392 HydrophobicContact CZ3-CB 4.24Å; W345-L392 HydrophobicContact CZ3-CD2 3.98Å; W345-L392 HydrophobicContact CZ3-CG 3.9Å; W345-L392 WeakPolarHBondContact CZ3-O 3.3Å; W345-H394 AromaticContact CE2-ND1 3.37Å; W345-H394 HydrophobicContact CH2-CB 3.94Å; W345-H394 HydrophobicContact CZ2-CB 3.66Å; W345-H394 AromaticContact CZ2-CG 3.81Å; W345-H394 AromaticContact CZ2-ND1 3.23Å; W345-H394 WeakPolarHBondContact CZ2-ND1 3.31Å; W345-H394 AromaticContact NE1-CE1 3.86Å; W345-H394 AromaticContact NE1-ND1 3.39Å; W345-H394 PolarHBondContact NE1-ND1 3.4Å; W345-Y397 HydrophobicContact CB-CD2 3.73Å; W345-Y397 HydrophobicContact CB-CE1 4.27Å; W345-Y397 HydrophobicContact CB-CE2 3.37Å; W345-Y397 HydrophobicContact CB-CG 4.32Å; W345-Y397 AromaticContact CD1-CE1 3.68Å; W345-Y397 AromaticContact CD1-CZ 3.84Å; W345-Y397 AromaticContact CD2-CD1 3.7Å; W345-Y397 HydrophobicContact CD2-CD1 3.7Å; W345-Y397 AromaticContact CD2-CD2 3.87Å; W345-Y397 HydrophobicContact CD2-CD2 3.87Å; W345-Y397 HydrophobicContact CD2-CE1 4.1Å; W345-Y397 HydrophobicContact CD2-CE2 4.26Å; W345-Y397 AromaticContact CD2-CG 3.56Å; W345-Y397 HydrophobicContact CD2-CG 3.56Å; W345-Y397 AromaticContact CE2-CD1 3.95Å; W345-Y397 HydrophobicContact CE3-CD1 4.16Å; W345-Y397 AromaticContact CE3-CD2 3.88Å; W345-Y397 HydrophobicContact CE3-CD2 3.88Å; W345-Y397 AromaticContact CE3-CG 3.58Å; W345-Y397 HydrophobicContact CE3-CG 3.58Å; W345-Y397 AromaticContact CG-CD1 3.83Å; W345-Y397 HydrophobicContact CG-CD1 3.83Å; W345-Y397 AromaticContact CG-CD2 3.79Å; W345-Y397 HydrophobicContact CG-CD2 3.79Å; W345-Y397 AromaticContact CG-CE1 3.72Å; W345-Y397 HydrophobicContact CG-CE1 3.72Å; W345-Y397 AromaticContact CG-CE2 3.68Å; W345-Y397 HydrophobicContact CG-CE2 3.68Å; W345-Y397 AromaticContact CG-CG 3.86Å; W345-Y397 HydrophobicContact CG-CG 3.86Å; W345-Y397 AromaticContact CG-CZ 3.62Å; W345-Y397 HydrophobicContact CZ3-CG 4.27Å
346R96.7Very high96.8Very high55 Ų5533.5 Ų33.521%0.20818%0.177CC..Hα-helixtrans-59.8-25.3173.8-70-171-64.7-106.119.9113.2E305 G342 L343 I355 F356E305-R346 IonicContact OE1-CZ 2.66Å; E305-R346 VanDerWaalsContact OE1-CZ 3.28Å; E305-R346 IonicContact OE1-NH1 3.28Å; E305-R346 PolarHBondContact OE1-NH1 2.95Å; E305-R346 IonicContact OE1-NH2 3.44Å; E305-R346 PolarHBondContact OE1-NH2 3.31Å; E305-R346 IonicContact OE2-CZ 2.76Å; E305-R346 IonicContact OE2-NH2 2.68Å; E305-R346 PolarHBondContact OE2-NH2 3.43Å; G342-R346 WeakPolarHBondContact O-CG 3.36Å; G342-R346 PolarHBondContact O-N 2.98Å; L343-R346 PolarHBondContact O-N 3.27Å; R346-I355 HydrophobicContact CB-CB 4.08Å; R346-I355 HydrophobicContact CB-CG2 4.37Å; R346-I355 PolarHBondContact NE-O 2.81Å; R346-I355 WeakPolarHBondContact O-CG1 3.34Å; R346-F356 PolarHBondContact NE-O 3.15Å; R346-F356 PolarHBondContact NH2-O 3.25Å
347S97.9Very high96.8Very high0 Ų032.4 Ų32.40%017%0.172CC..THydrogen-bonded Turntrans-99.62.6-175.1-48.40000114.1L343 M344 W345 D349 H350 I355 T384L343-S347 WeakPolarHBondContact O-CB 3.41Å; L343-S347 PolarHBondContact O-N 2.92Å; L343-S347 PolarHBondContact O-OG 3.36Å; M344-S347 PolarHBondContact O-N 3.01Å; W345-S347 PolarHBondContact O-N 3.15Å; S347-D349 VanDerWaalsContact C-N 3.35Å; S347-D349 PolarHBondContact O-N 3.26Å; S347-H350 PolarHBondContact O-N 3.19Å; S347-I355 PolarHBondContact OG-N 3.18Å; S347-T384 WeakPolarHBondContact O-CG2 3.3Å
348I96.7Very high96.5Very high17 Ų1735.7 Ų35.79%0.08719%0.194CC..THydrogen-bonded Turntrans-58.4-43.6-169.7-164171.5000112.5M344 W345 H350 F387 R388 L392M344-I348 PolarHBondContact O-N 2.74Å; W345-I348 HydrophobicContact CE3-CD1 4.33Å; W345-I348 HydrophobicContact CZ3-CD1 3.99Å; W345-I348 VanDerWaalsContact O-CG2 3.31Å; W345-I348 WeakPolarHBondContact O-CG2 3.46Å; W345-I348 PolarHBondContact O-N 3.13Å; I348-H350 VanDerWaalsContact C-N 3.31Å; I348-H350 PolarHBondContact O-N 3.36Å; I348-F387 HydrophobicContact CD1-CB 3.86Å; I348-F387 HydrophobicContact CG1-CB 4.19Å; I348-R388 HydrophobicContact CG1-CG 3.79Å; I348-R388 WeakPolarHBondContact O-CD 3.29Å; I348-R388 WeakPolarHBondContact O-CG 3.46Å; I348-R388 PolarHBondContact O-NH1 2.94Å; I348-L392 HydrophobicContact CD1-CB 4.46Å
349D95.9Very high96.3Very high132 Ų13237.4 Ų37.471%0.70620%0.203SC*.THydrogen-bonded Turntrans-86.74.8-179.6-60.3-53.4000114.1S347 P351S347-D349 VanDerWaalsContact C-N 3.35Å; S347-D349 PolarHBondContact O-N 3.26Å; D349-P351 VanDerWaalsContact O-CD 3.23Å; D349-P351 WeakPolarHBondContact O-CD 3.44Å
350H96.4Very high96.2Very high97 Ų9736.6 Ų36.645%0.44920%0.199SC..  trans-117.675-174.7-63.6-67.5000111.9S347 I348 G352 K353 I355S347-H350 PolarHBondContact O-N 3.19Å; I348-H350 VanDerWaalsContact C-N 3.31Å; I348-H350 PolarHBondContact O-N 3.36Å; H350-G352 PolarHBondContact O-N 2.88Å; H350-K353 PolarHBondContact O-N 3.32Å; H350-K353 VanDerWaalsContact O-O 3.09Å; H350-I355 HydrophobicContact CB-CD1 4.09Å; H350-I355 HydrophobicContact CB-CG1 4.23Å
351P94.9Very high96.1Very high95 Ų9538.1 Ų38.162%0.61721%0.208SC*.THydrogen-bonded Turntrans-59.8132.9-179.625.8-34.5000111.9D349 K353D349-P351 VanDerWaalsContact O-CD 3.23Å; D349-P351 WeakPolarHBondContact O-CD 3.44Å; P351-K353 VanDerWaalsContact C-N 3.29Å; P351-K353 PolarHBondContact O-N 3.33Å
352G94.4Very high95.9Very high40 Ų4038.3 Ų38.341%0.41221%0.209SC..THydrogen-bonded Turntrans79.4-2-179.900000115.8H350H350-G352 PolarHBondContact O-N 2.88Å
353K96.4Very high95.8Very high86 Ų8639.6 Ų39.637%0.37422%0.215SC..EExtended strand (participates in β ladder)trans-128.8156.4179.7-53.9-152.9174.3-136.90111.7H350 P351 V361 L362 D363H350-K353 PolarHBondContact O-N 3.32Å; H350-K353 VanDerWaalsContact O-O 3.09Å; P351-K353 VanDerWaalsContact C-N 3.29Å; P351-K353 PolarHBondContact O-N 3.33Å; K353-V361 HydrophobicContact CB-CG1 4.24Å; K353-V361 HydrophobicContact CD-CG1 4.12Å; K353-L362 WeakPolarHBondContact CA-O 2.98Å; K353-D363 HydrophobicContact CD-CB 4.06Å; K353-D363 HydrophobicContact CG-CB 3.94Å; K353-D363 IonicContact NZ-OD2 3.72Å; K353-D363 PolarHBondContact NZ-OD2 3Å
354L97.6Very high95.6Very high0 Ų044 Ų440%023%0.231CC..EExtended strand (participates in β ladder)trans-121.3124.8177.1-67.6-179.8000110.2L343 F356 L362 F377 L380 L381L343-L354 HydrophobicContact CD1-CB 4.23Å; L354-F356 HydrophobicContact CB-CD2 4Å; L354-F356 HydrophobicContact CB-CE2 3.59Å; L354-F356 HydrophobicContact CB-CZ 4.42Å; L354-F356 HydrophobicContact CD1-CE2 4.13Å; L354-F356 HydrophobicContact CD1-CZ 4.27Å; L354-F356 PolarHBondContact O-N 3.15Å; L354-L362 PolarHBondContact N-O 3.33Å; L354-L362 PolarHBondContact O-N 3.21Å; L354-F377 HydrophobicContact CB-CE2 4.45Å; L354-F377 HydrophobicContact CB-CZ 4.05Å; L354-F377 HydrophobicContact CD1-CD1 3.88Å; L354-F377 HydrophobicContact CD1-CD2 3.88Å; L354-F377 HydrophobicContact CD1-CE1 3.78Å; L354-F377 HydrophobicContact CD1-CE2 3.79Å; L354-F377 HydrophobicContact CD1-CG 3.92Å; L354-F377 HydrophobicContact CD1-CZ 3.73Å; L354-F377 HydrophobicContact CG-CD1 4.41Å; L354-F377 HydrophobicContact CG-CE1 3.87Å; L354-F377 HydrophobicContact CG-CE2 4.33Å; L354-F377 HydrophobicContact CG-CZ 3.82Å; L354-L380 HydrophobicContact CD1-CB 3.87Å; L354-L380 HydrophobicContact CD1-CD1 3.91Å; L354-L380 HydrophobicContact CD2-CB 4.14Å; L354-L381 HydrophobicContact CD2-CD2 3.96Å; L354-L381 HydrophobicContact CG-CD2 4.13Å
355I96.7Very high95.3Very high22 Ų2249 Ų4911%0.11326%0.257CS..EExtended strand (participates in β ladder)trans-94.877.2-176.2-45.8-59.4000109L343 R346 S347 H350 V361L343-I355 VanDerWaalsContact CD1-C 3.48Å; L343-I355 WeakPolarHBondContact CD1-O 3.07Å; R346-I355 HydrophobicContact CB-CB 4.08Å; R346-I355 HydrophobicContact CB-CG2 4.37Å; R346-I355 PolarHBondContact NE-O 2.81Å; R346-I355 WeakPolarHBondContact O-CG1 3.34Å; S347-I355 PolarHBondContact OG-N 3.18Å; H350-I355 HydrophobicContact CB-CD1 4.09Å; H350-I355 HydrophobicContact CB-CG1 4.23Å; I355-V361 HydrophobicContact CD1-CB 4.28Å; I355-V361 HydrophobicContact CD1-CG1 3.84Å; I355-V361 HydrophobicContact CD1-CG2 3.62Å; I355-V361 HydrophobicContact CG2-CG2 4.5Å
356F95.9Very high95Very high29 Ų2948.4 Ų48.413%0.12726%0.257CS..SBendtrans-60.7-50.2177.5-74.7-90.8000110.6L298 L301 L343 R346 L354 L360 L362 F377L298-F356 HydrophobicContact CD2-CD1 3.46Å; L298-F356 VanDerWaalsContact CD2-CD1 3.46Å; L298-F356 HydrophobicContact CD2-CD2 4.49Å; L298-F356 HydrophobicContact CD2-CE1 3.59Å; L298-F356 HydrophobicContact CD2-CG 3.94Å; L298-F356 HydrophobicContact CD2-CZ 4.18Å; L301-F356 HydrophobicContact CD2-CB 3.72Å; L301-F356 HydrophobicContact CD2-CD1 4.41Å; L301-F356 WeakPolarHBondContact CD2-O 3.22Å; L343-F356 HydrophobicContact CD1-CB 4.43Å; L343-F356 HydrophobicContact CD1-CD1 4.04Å; L343-F356 HydrophobicContact CD1-CD2 4.19Å; L343-F356 HydrophobicContact CD1-CE1 4.35Å; L343-F356 HydrophobicContact CD1-CE2 4.48Å; L343-F356 HydrophobicContact CD1-CG 3.96Å; L343-F356 HydrophobicContact CD2-CD1 3.92Å; L343-F356 HydrophobicContact CD2-CE1 3.48Å; L343-F356 VanDerWaalsContact CD2-CE1 3.48Å; L343-F356 HydrophobicContact CD2-CE2 4.39Å; L343-F356 HydrophobicContact CD2-CZ 3.75Å; R346-F356 PolarHBondContact NE-O 3.15Å; R346-F356 PolarHBondContact NH2-O 3.25Å; L354-F356 HydrophobicContact CB-CD2 4Å; L354-F356 HydrophobicContact CB-CE2 3.59Å; L354-F356 HydrophobicContact CB-CZ 4.42Å; L354-F356 HydrophobicContact CD1-CE2 4.13Å; L354-F356 HydrophobicContact CD1-CZ 4.27Å; L354-F356 PolarHBondContact O-N 3.15Å; F356-L360 HydrophobicContact CB-CB 4.34Å; F356-L360 HydrophobicContact CB-CD2 3.97Å; F356-L360 HydrophobicContact CB-CG 4.05Å; F356-L360 WeakPolarHBondContact CB-O 3.43Å; F356-L360 PolarHBondContact N-O 3Å; F356-L362 HydrophobicContact CD2-CB 4.15Å; F356-L362 HydrophobicContact CD2-CD1 3.85Å; F356-L362 HydrophobicContact CD2-CG 4.06Å; F356-L362 HydrophobicContact CE2-CB 4.14Å; F356-L362 HydrophobicContact CE2-CD1 3.8Å; F356-L362 HydrophobicContact CE2-CG 4.3Å; F356-F377 HydrophobicContact CE2-CE2 4.46Å
357A94.9Very high94.7Very high2 Ų245.8 Ų45.82%0.01725%0.248CC..SBendtrans-139.2165.6169.500000109.8V280 L301 D359 L360V280-A357 WeakPolarHBondContact O-CB 3.35Å; L301-A357 HydrophobicContact CD1-CB 4.24Å; L301-A357 HydrophobicContact CD2-CB 4.43Å; A357-D359 WeakPolarHBondContact CB-OD1 3.44Å; A357-D359 PolarHBondContact O-N 3.09Å; A357-D359 VanDerWaalsContact O-N 3.15Å; A357-L360 HydrophobicContact CB-CB 3.92Å; A357-L360 PolarHBondContact N-O 3.21Å; A357-L360 CarbonylContact O-C 3.54Å; A357-L360 VanDerWaalsContact O-C 3.23Å; A357-L360 PolarHBondContact O-N 2.93Å; A357-L360 VanDerWaalsContact O-O 3.11Å
358P92.2Very high94.5Very high74 Ų7451.5 Ų51.548%0.48127%0.272SS..SBendtrans-57-27.1174.7-23.433.8000113.7H279 V280 L281H279-P358 HydrophobicContact CB-CG 3.96Å; V280-P358 VanDerWaalsContact O-CD 3.24Å; V280-P358 WeakPolarHBondContact O-CD 3.39Å; L281-P358 HydrophobicContact CD2-CB 3.93Å; L281-P358 HydrophobicContact CD2-CG 4.03Å
359D92.6Very high94.3Very high43 Ų4352.5 Ų52.523%0.2328%0.28CS..SBendtrans-97.2-19.8173.659.1-27.3000113.9L281 I282 S283 R284 A357L281-D359 HydrophobicContact CD2-CB 4.24Å; I282-D359 PolarHBondContact N-OD1 3.22Å; I282-D359 PolarHBondContact N-OD2 3.34Å; S283-D359 WeakPolarHBondContact CA-OD2 3.34Å; S283-D359 PolarHBondContact N-OD2 2.95Å; R284-D359 WeakPolarHBondContact CB-O 3.4Å; R284-D359 WeakPolarHBondContact CD-O 3.16Å; A357-D359 WeakPolarHBondContact CB-OD1 3.44Å; A357-D359 PolarHBondContact O-N 3.09Å; A357-D359 VanDerWaalsContact O-N 3.15Å
360L94.4Very high94.1Very high2 Ų246.4 Ų46.41%0.0125%0.248CC..  trans-110.383177.1-172.163.6000111I282 R284 F289 L298 L301 F356 A357 L362I282-L360 HydrophobicContact CG2-CB 4.22Å; I282-L360 HydrophobicContact CG2-CD2 4.44Å; R284-L360 HydrophobicContact CG-CD1 4.06Å; F289-L360 HydrophobicContact CE1-CD1 4.45Å; F289-L360 HydrophobicContact CZ-CD1 4.02Å; L298-L360 HydrophobicContact CD2-CD2 4.24Å; L301-L360 HydrophobicContact CD2-CD2 4.49Å; F356-L360 HydrophobicContact CB-CB 4.34Å; F356-L360 HydrophobicContact CB-CD2 3.97Å; F356-L360 HydrophobicContact CB-CG 4.05Å; F356-L360 WeakPolarHBondContact CB-O 3.43Å; F356-L360 PolarHBondContact N-O 3Å; A357-L360 HydrophobicContact CB-CB 3.92Å; A357-L360 PolarHBondContact N-O 3.21Å; A357-L360 CarbonylContact O-C 3.54Å; A357-L360 VanDerWaalsContact O-C 3.23Å; A357-L360 PolarHBondContact O-N 2.93Å; A357-L360 VanDerWaalsContact O-O 3.11Å; L360-L362 HydrophobicContact CD1-CD2 3.98Å; L360-L362 HydrophobicContact CD1-CG 4.24Å; L360-L362 HydrophobicContact CG-CG 4.41Å
361V94.9Very high93.8Very high40 Ų4048 Ų4824%0.24226%0.255CS..EExtended strand (participates in β ladder)trans-92.1131163178.20000108.2R284 K353 I355R284-V361 PolarHBondContact NH2-O 3.2Å; K353-V361 HydrophobicContact CB-CG1 4.24Å; K353-V361 HydrophobicContact CD-CG1 4.12Å; I355-V361 HydrophobicContact CD1-CB 4.28Å; I355-V361 HydrophobicContact CD1-CG1 3.84Å; I355-V361 HydrophobicContact CD1-CG2 3.62Å; I355-V361 HydrophobicContact CG2-CG2 4.5Å
362L95.2Very high93.5Very high3 Ų345.8 Ų45.82%0.01625%0.25CC..EExtended strand (participates in β ladder)trans-120.1144.9172-63.1179.9000110.2F289 M294 L298 K353 L354 F356 L360 E366 F377F289-L362 HydrophobicContact CD2-CD2 4.31Å; F289-L362 HydrophobicContact CE2-CD2 3.52Å; F289-L362 HydrophobicContact CZ-CD2 3.69Å; M294-L362 HydrophobicContact CE-CD1 3.77Å; M294-L362 HydrophobicContact CE-CD2 3.71Å; M294-L362 HydrophobicContact CE-CG 4.37Å; M294-L362 HydrophobicContact CG-CD1 4.48Å; M294-L362 HydrophobicContact SD-CD1 4.05Å; L298-L362 HydrophobicContact CD2-CD1 4.44Å; K353-L362 WeakPolarHBondContact CA-O 2.98Å; L354-L362 PolarHBondContact N-O 3.33Å; L354-L362 PolarHBondContact O-N 3.21Å; F356-L362 HydrophobicContact CD2-CB 4.15Å; F356-L362 HydrophobicContact CD2-CD1 3.85Å; F356-L362 HydrophobicContact CD2-CG 4.06Å; F356-L362 HydrophobicContact CE2-CB 4.14Å; F356-L362 HydrophobicContact CE2-CD1 3.8Å; F356-L362 HydrophobicContact CE2-CG 4.3Å; L360-L362 HydrophobicContact CD1-CD2 3.98Å; L360-L362 HydrophobicContact CD1-CG 4.24Å; L360-L362 HydrophobicContact CG-CG 4.41Å; L362-E366 WeakPolarHBondContact CA-OE2 3.42Å; L362-E366 HydrophobicContact CD2-CB 4.22Å; L362-F377 HydrophobicContact CB-CE2 4.15Å; L362-F377 HydrophobicContact CB-CZ 4.42Å
363D93.9Very high93.4Very high33 Ų3344.7 Ų44.718%0.17623%0.234CC..EExtended strand (participates in β ladder)trans-111.4177.4162.466.243.8000112.8K353 D365 E366 G367 F377K353-D363 HydrophobicContact CD-CB 4.06Å; K353-D363 HydrophobicContact CG-CB 3.94Å; K353-D363 IonicContact NZ-OD2 3.72Å; K353-D363 PolarHBondContact NZ-OD2 3Å; D363-D365 PolarHBondContact O-N 2.73Å; D363-D365 PolarHBondContact OD1-N 2.88Å; D363-E366 PolarHBondContact N-OE2 3.04Å; D363-E366 PolarHBondContact O-N 3.03Å; D363-E366 PolarHBondContact OD1-N 3.23Å; D363-E366 VanDerWaalsContact OD1-N 3.17Å; D363-G367 PolarHBondContact O-N 3.43Å; D363-F377 WeakPolarHBondContact O-CZ 3.49Å
364R93.6Very high93.3Very high100 Ų10042.9 Ų42.938%0.37723%0.229SC..THydrogen-bonded Turntrans-66.1-22.7-174.6-165.2-179-173.1-82.1-2.7113L374 F377 D378R364-L374 HydrophobicContact CG-CD2 4.3Å; R364-F377 HydrophobicContact CB-CD1 4.28Å; R364-F377 HydrophobicContact CB-CE1 4.16Å; R364-F377 HydrophobicContact CG-CD1 4.4Å; R364-D378 WeakPolarHBondContact CD-OD1 3.43Å; R364-D378 IonicContact CZ-OD1 3.18Å; R364-D378 IonicContact CZ-OD2 2.74Å; R364-D378 IonicContact NE-OD1 3.5Å; R364-D378 PolarHBondContact NE-OD1 2.94Å; R364-D378 IonicContact NE-OD2 3.46Å; R364-D378 PolarHBondContact NE-OD2 3Å; R364-D378 IonicContact NH2-OD1 2.74Å; R364-D378 IonicContact NH2-OD2 2.75Å; R364-D378 PolarHBondContact NH2-OD2 3.17Å
365D92.3Very high93.2Very high105 Ų10547.5 Ų47.556%0.56125%0.25SS*.THydrogen-bonded Turntrans-81.6-40.5177.4-72.2-43.6000111D363 G367 K368D363-D365 PolarHBondContact O-N 2.73Å; D363-D365 PolarHBondContact OD1-N 2.88Å; D365-G367 VanDerWaalsContact C-N 3.28Å; D365-G367 PolarHBondContact O-N 2.96Å; D365-K368 WeakPolarHBondContact O-CB 3.31Å; D365-K368 PolarHBondContact O-N 3.24Å; D365-K368 WeakPolarHBondContact OD1-CE 3.34Å; D365-K368 IonicContact OD1-NZ 3.98Å; D365-K368 PolarHBondContact OD1-NZ 3.33Å
366E92.3Very high93.2Very high41 Ų4147.1 Ų47.119%0.19225%0.248CC..G310 helixtrans-60.9-37.8171.5-64.2-176.9107.900112R284 F289 M294 L362 D363 K368 C369R284-E366 IonicContact CZ-OE1 2.65Å; R284-E366 IonicContact NH2-OE1 3.58Å; R284-E366 PolarHBondContact NH2-OE1 3.33Å; R284-E366 IonicContact NH2-OE2 3.75Å; R284-E366 PolarHBondContact NH2-OE2 2.82Å; F289-E366 HydrophobicContact CD2-CB 4.28Å; F289-E366 HydrophobicContact CE2-CB 4.49Å; F289-E366 WeakPolarHBondContact CE2-OE1 3.18Å; M294-E366 HydrophobicContact CE-CB 4.36Å; M294-E366 VanDerWaalsContact CE-O 3.29Å; M294-E366 WeakPolarHBondContact CE-O 3.5Å; L362-E366 WeakPolarHBondContact CA-OE2 3.42Å; L362-E366 HydrophobicContact CD2-CB 4.22Å; D363-E366 PolarHBondContact N-OE2 3.04Å; D363-E366 PolarHBondContact O-N 3.03Å; D363-E366 PolarHBondContact OD1-N 3.23Å; D363-E366 VanDerWaalsContact OD1-N 3.17Å; E366-K368 PolarHBondContact O-N 2.91Å; E366-C369 PolarHBondContact O-SG 2.98Å
367G90.3Very high93.2Very high1 Ų146 Ų461%0.0124%0.243CC..G310 helixtrans-63.5-14.9176.300000115.3D363 D365 C369 V370 I373D363-G367 PolarHBondContact O-N 3.43Å; D365-G367 VanDerWaalsContact C-N 3.28Å; D365-G367 PolarHBondContact O-N 2.96Å; G367-C369 PolarHBondContact O-N 2.76Å; G367-C369 VanDerWaalsContact O-N 3.14Å; G367-V370 PolarHBondContact O-N 3.34Å; G367-I373 WeakPolarHBondContact O-CG2 3.02Å
368K92.9Very high93.3Very high120 Ų12048.7 Ų48.752%0.52226%0.258SS..G310 helixtrans-65.9-13.9-179.7-69.6171.7173.6170.20114.2D365 E366 V370 L374D365-K368 WeakPolarHBondContact O-CB 3.31Å; D365-K368 PolarHBondContact O-N 3.24Å; D365-K368 WeakPolarHBondContact OD1-CE 3.34Å; D365-K368 IonicContact OD1-NZ 3.98Å; D365-K368 PolarHBondContact OD1-NZ 3.33Å; E366-K368 PolarHBondContact O-N 2.91Å; K368-V370 VanDerWaalsContact C-N 3.27Å; K368-V370 PolarHBondContact O-N 3.46Å; K368-L374 HydrophobicContact CG-CD1 4.19Å; K368-L374 HydrophobicContact CG-CD2 4.23Å
369C91.9Very high93.6Very high37 Ų3746.6 Ų46.625%0.2524%0.242CC..G310 helixtrans-77.9-2.6-17868.50000114.9F289 E291 E366 G367F289-C369 HydrophobicContact CB-CB 4.49Å; F289-C369 VanDerWaalsContact CB-SG 3.56Å; F289-C369 WeakPolarHBondContact O-CB 3.33Å; E291-C369 WeakPolarHBondContact CA-O 3.19Å; E291-C369 WeakPolarHBondContact CB-O 3.3Å; E291-C369 PolarHBondContact N-O 3.41Å; E366-C369 PolarHBondContact O-SG 2.98Å; G367-C369 PolarHBondContact O-N 2.76Å; G367-C369 VanDerWaalsContact O-N 3.14Å
370V92.1Very high93.8Very high4 Ų444.8 Ų44.82%0.02423%0.232CC..SBendtrans-122.1132.1178.5-177.90000110.4E291 M294 M295 G367 K368 G372 I373 M479E291-V370 HydrophobicContact CG-CB 4.29Å; E291-V370 HydrophobicContact CG-CG1 4.15Å; E291-V370 HydrophobicContact CG-CG2 4.15Å; M294-V370 HydrophobicContact CB-CG2 3.99Å; M294-V370 HydrophobicContact CG-CG2 3.98Å; M294-V370 HydrophobicContact SD-CG2 3.83Å; M295-V370 HydrophobicContact CG-CG1 3.83Å; M295-V370 HydrophobicContact CG-CG2 3.84Å; M295-V370 HydrophobicContact SD-CG1 3.87Å; M295-V370 HydrophobicContact SD-CG2 4.16Å; G367-V370 PolarHBondContact O-N 3.34Å; K368-V370 VanDerWaalsContact C-N 3.27Å; K368-V370 PolarHBondContact O-N 3.46Å; V370-G372 PolarHBondContact O-N 2.58Å; V370-I373 HydrophobicContact CB-CB 4.03Å; V370-I373 HydrophobicContact CB-CD1 4.41Å; V370-I373 HydrophobicContact CB-CG2 3.81Å; V370-I373 HydrophobicContact CG1-CB 4.04Å; V370-I373 HydrophobicContact CG1-CD1 4.38Å; V370-I373 HydrophobicContact CG1-CG2 4.39Å; V370-M479 HydrophobicContact CG1-CE 4.21Å
371E89.7Confident93.9Very high130 Ų13046.1 Ų46.161%0.60724%0.239SC*.THydrogen-bonded Turntrans-65127.9179.5-170.9-176.9-142.700112E291 I373 H475 K482E291-E371 PolarHBondContact OE1-N 3.09Å; E371-I373 PolarHBondContact O-N 3.13Å; E371-I373 VanDerWaalsContact O-N 3.16Å; E371-H475 PolarHBondContact O-CE1 2.83Å; E371-K482 IonicContact OE2-NZ 2.61Å; E371-K482 PolarHBondContact OE2-NZ 3.31Å
372G88.9Confident94.1Very high49 Ų4947.2 Ų47.251%0.50525%0.252SS..THydrogen-bonded Turntrans77.4-12.8173.900000116.3V370 L374 E375V370-G372 PolarHBondContact O-N 2.58Å; G372-L374 PolarHBondContact O-N 3.07Å; G372-L374 VanDerWaalsContact O-N 3.13Å; G372-E375 PolarHBondContact O-N 2.99Å
373I93.4Very high94.1Very high17 Ų1747.5 Ų47.59%0.08725%0.254CS..Hα-helixtrans-63-24.4-177.5-152.1171000113M295 L298 G367 V370 E371 E375 I376 F377M295-I373 HydrophobicContact SD-CD1 4.02Å; L298-I373 HydrophobicContact CD1-CD1 3.88Å; G367-I373 WeakPolarHBondContact O-CG2 3.02Å; V370-I373 HydrophobicContact CB-CB 4.03Å; V370-I373 HydrophobicContact CB-CD1 4.41Å; V370-I373 HydrophobicContact CB-CG2 3.81Å; V370-I373 HydrophobicContact CG1-CB 4.04Å; V370-I373 HydrophobicContact CG1-CD1 4.38Å; V370-I373 HydrophobicContact CG1-CG2 4.39Å; E371-I373 PolarHBondContact O-N 3.13Å; E371-I373 VanDerWaalsContact O-N 3.16Å; I373-E375 VanDerWaalsContact C-N 3.3Å; I373-E375 PolarHBondContact O-N 3.48Å; I373-I376 WeakPolarHBondContact O-CB 3.06Å; I373-I376 PolarHBondContact O-N 2.96Å; I373-I376 VanDerWaalsContact O-N 3.09Å; I373-F377 PolarHBondContact O-N 3.09Å
374L94.1Very high94.3Very high48 Ų4846 Ų4625%0.25125%0.246SC..Hα-helixtrans-61.6-33-177.3-64.2178000113.2R364 K368 G372 I376 F377 D378R364-L374 HydrophobicContact CG-CD2 4.3Å; K368-L374 HydrophobicContact CG-CD1 4.19Å; K368-L374 HydrophobicContact CG-CD2 4.23Å; G372-L374 PolarHBondContact O-N 3.07Å; G372-L374 VanDerWaalsContact O-N 3.13Å; L374-I376 VanDerWaalsContact C-N 3.33Å; L374-I376 PolarHBondContact O-N 2.85Å; L374-F377 PolarHBondContact O-N 3.32Å; L374-D378 WeakPolarHBondContact O-CB 3.43Å; L374-D378 PolarHBondContact O-N 3.32Å
375E95.6Very high94.5Very high98 Ų9843.1 Ų43.146%0.45824%0.241SC..Hα-helixtrans-61.6-44.9174.6-169.2-169.4-175.700110.3G372 I373 D378 M379 K471G372-E375 PolarHBondContact O-N 2.99Å; I373-E375 VanDerWaalsContact C-N 3.3Å; I373-E375 PolarHBondContact O-N 3.48Å; E375-D378 PolarHBondContact O-N 3.28Å; E375-M379 HydrophobicContact CG-CE 4.02Å; E375-M379 WeakPolarHBondContact O-CE 3.43Å; E375-M379 WeakPolarHBondContact O-CG 3.21Å; E375-M379 PolarHBondContact O-N 3.3Å; E375-K471 WeakPolarHBondContact OE1-CE 3.48Å; E375-K471 IonicContact OE1-NZ 2.62Å; E375-K471 PolarHBondContact OE1-NZ 3.46Å; E375-K471 IonicContact OE2-NZ 3.17Å; E375-K471 PolarHBondContact OE2-NZ 3.42Å
376I96.5Very high94.8Very high13 Ų1342.7 Ų42.77%0.06723%0.232CC..Hα-helixtrans-67.1-40.8177.9-60155.7000110.5M340 I373 L374 D378 M379 L380 K471 H475M340-I376 HydrophobicContact CE-CG2 3.85Å; I373-I376 WeakPolarHBondContact O-CB 3.06Å; I373-I376 PolarHBondContact O-N 2.96Å; I373-I376 VanDerWaalsContact O-N 3.09Å; L374-I376 VanDerWaalsContact C-N 3.33Å; L374-I376 PolarHBondContact O-N 2.85Å; I376-D378 PolarHBondContact O-N 3.44Å; I376-M379 HydrophobicContact CB-CE 4.41Å; I376-M379 HydrophobicContact CG1-CE 4.09Å; I376-M379 PolarHBondContact O-N 3.34Å; I376-L380 HydrophobicContact CG2-CD1 3.88Å; I376-L380 HydrophobicContact CG2-CG 4.38Å; I376-L380 WeakPolarHBondContact O-CB 3.32Å; I376-L380 VanDerWaalsContact O-CG 3.24Å; I376-L380 WeakPolarHBondContact O-CG 3.44Å; I376-L380 PolarHBondContact O-N 3.19Å; I376-K471 HydrophobicContact CG1-CB 4.12Å; I376-H475 HydrophobicContact CD1-CB 3.53Å
377F96.8Very high95Very high6 Ų640.8 Ų40.83%0.02622%0.223CC..Hα-helixtrans-60-46176.6-151.1-73.2000111.3L354 F356 L362 D363 R364 I373 L374 L380 L381L354-F377 HydrophobicContact CB-CE2 4.45Å; L354-F377 HydrophobicContact CB-CZ 4.05Å; L354-F377 HydrophobicContact CD1-CD1 3.88Å; L354-F377 HydrophobicContact CD1-CD2 3.88Å; L354-F377 HydrophobicContact CD1-CE1 3.78Å; L354-F377 HydrophobicContact CD1-CE2 3.79Å; L354-F377 HydrophobicContact CD1-CG 3.92Å; L354-F377 HydrophobicContact CD1-CZ 3.73Å; L354-F377 HydrophobicContact CG-CD1 4.41Å; L354-F377 HydrophobicContact CG-CE1 3.87Å; L354-F377 HydrophobicContact CG-CE2 4.33Å; L354-F377 HydrophobicContact CG-CZ 3.82Å; F356-F377 HydrophobicContact CE2-CE2 4.46Å; L362-F377 HydrophobicContact CB-CE2 4.15Å; L362-F377 HydrophobicContact CB-CZ 4.42Å; D363-F377 WeakPolarHBondContact O-CZ 3.49Å; R364-F377 HydrophobicContact CB-CD1 4.28Å; R364-F377 HydrophobicContact CB-CE1 4.16Å; R364-F377 HydrophobicContact CG-CD1 4.4Å; I373-F377 PolarHBondContact O-N 3.09Å; L374-F377 PolarHBondContact O-N 3.32Å; F377-L380 PolarHBondContact O-N 3.49Å; F377-L381 HydrophobicContact CD1-CD1 3.73Å; F377-L381 HydrophobicContact CD1-CG 3.93Å; F377-L381 HydrophobicContact CE1-CD1 3.81Å; F377-L381 HydrophobicContact CE1-CD2 4.31Å; F377-L381 HydrophobicContact CE1-CG 4.01Å; F377-L381 WeakPolarHBondContact O-CG 3.35Å; F377-L381 PolarHBondContact O-N 2.99Å
378D96.5Very high95.4Very high59 Ų5944.2 Ų44.232%0.31624%0.236SC..Hα-helixtrans-68.5-39.5178.6-71.1-25000112.2R364 L374 E375 I376 L380 L381 A382R364-D378 WeakPolarHBondContact CD-OD1 3.43Å; R364-D378 IonicContact CZ-OD1 3.18Å; R364-D378 IonicContact CZ-OD2 2.74Å; R364-D378 IonicContact NE-OD1 3.5Å; R364-D378 PolarHBondContact NE-OD1 2.94Å; R364-D378 IonicContact NE-OD2 3.46Å; R364-D378 PolarHBondContact NE-OD2 3Å; R364-D378 IonicContact NH2-OD1 2.74Å; R364-D378 IonicContact NH2-OD2 2.75Å; R364-D378 PolarHBondContact NH2-OD2 3.17Å; L374-D378 WeakPolarHBondContact O-CB 3.43Å; L374-D378 PolarHBondContact O-N 3.32Å; E375-D378 PolarHBondContact O-N 3.28Å; I376-D378 PolarHBondContact O-N 3.44Å; D378-L380 PolarHBondContact O-N 3.28Å; D378-L381 PolarHBondContact O-N 3.01Å; D378-A382 VanDerWaalsContact O-CB 3.29Å; D378-A382 WeakPolarHBondContact O-CB 3.47Å; D378-A382 PolarHBondContact O-N 3.3Å
379M97.1Very high95.5Very high30 Ų3043.5 Ų43.515%0.14823%0.234CC..Hα-helixtrans-60.9-41.6172.1-77.6-174.2-69.700112.7E375 I376 T383 A468 K471E375-M379 HydrophobicContact CG-CE 4.02Å; E375-M379 WeakPolarHBondContact O-CE 3.43Å; E375-M379 WeakPolarHBondContact O-CG 3.21Å; E375-M379 PolarHBondContact O-N 3.3Å; I376-M379 HydrophobicContact CB-CE 4.41Å; I376-M379 HydrophobicContact CG1-CE 4.09Å; I376-M379 PolarHBondContact O-N 3.34Å; M379-T383 WeakPolarHBondContact O-CB 3.31Å; M379-T383 PolarHBondContact O-N 2.87Å; M379-T383 PolarHBondContact O-OG1 2.99Å; M379-A468 HydrophobicContact CB-CB 4.35Å; M379-K471 HydrophobicContact CE-CB 3.54Å; M379-K471 HydrophobicContact CE-CD 4.27Å; M379-K471 HydrophobicContact CE-CG 3.68Å; M379-K471 HydrophobicContact SD-CG 4.35Å
380L97.8Very high95.7Very high4 Ų442.9 Ų42.92%0.02123%0.228CC..Hα-helixtrans-67.3-44177-74168000111.5M340 L343 M344 L354 I376 F377 D378 T383 T384M340-L380 HydrophobicContact CB-CD2 4.1Å; M340-L380 HydrophobicContact CG-CD2 4.02Å; M340-L380 HydrophobicContact SD-CD2 3.84Å; L343-L380 HydrophobicContact CD2-CD1 3.86Å; L343-L380 HydrophobicContact CD2-CD2 4.46Å; M344-L380 HydrophobicContact CE-CD2 4.18Å; M344-L380 HydrophobicContact CG-CD2 3.74Å; M344-L380 HydrophobicContact SD-CD2 3.76Å; L354-L380 HydrophobicContact CD1-CB 3.87Å; L354-L380 HydrophobicContact CD1-CD1 3.91Å; L354-L380 HydrophobicContact CD2-CB 4.14Å; I376-L380 HydrophobicContact CG2-CD1 3.88Å; I376-L380 HydrophobicContact CG2-CG 4.38Å; I376-L380 WeakPolarHBondContact O-CB 3.32Å; I376-L380 VanDerWaalsContact O-CG 3.24Å; I376-L380 WeakPolarHBondContact O-CG 3.44Å; I376-L380 PolarHBondContact O-N 3.19Å; F377-L380 PolarHBondContact O-N 3.49Å; D378-L380 PolarHBondContact O-N 3.28Å; L380-T383 PolarHBondContact O-N 3.37Å; L380-T384 VanDerWaalsContact O-CB 3.27Å; L380-T384 WeakPolarHBondContact O-CB 3.27Å; L380-T384 PolarHBondContact O-N 3.36Å; L380-T384 PolarHBondContact O-OG1 2.9Å
381L97.3Very high95.9Very high30 Ų3050.7 Ų50.716%0.15726%0.262CS..Hα-helixtrans-62.9-44175.6-74.7-179.2000112.2L354 F377 D378 T384 S385L354-L381 HydrophobicContact CD2-CD2 3.96Å; L354-L381 HydrophobicContact CG-CD2 4.13Å; F377-L381 HydrophobicContact CD1-CD1 3.73Å; F377-L381 HydrophobicContact CD1-CG 3.93Å; F377-L381 HydrophobicContact CE1-CD1 3.81Å; F377-L381 HydrophobicContact CE1-CD2 4.31Å; F377-L381 HydrophobicContact CE1-CG 4.01Å; F377-L381 WeakPolarHBondContact O-CG 3.35Å; F377-L381 PolarHBondContact O-N 2.99Å; D378-L381 PolarHBondContact O-N 3.01Å; L381-T384 PolarHBondContact O-N 3.26Å; L381-S385 PolarHBondContact O-N 3.4Å
382A97.2Very high96.3Very high63 Ų6345 Ų4552%0.52124%0.235SC..Hα-helixtrans-63.2-46.3177.900000111.7D378 T384 S385 R386D378-A382 VanDerWaalsContact O-CB 3.29Å; D378-A382 WeakPolarHBondContact O-CB 3.47Å; D378-A382 PolarHBondContact O-N 3.3Å; A382-T384 VanDerWaalsContact C-N 3.34Å; A382-T384 PolarHBondContact O-N 3.47Å; A382-S385 VanDerWaalsContact O-CB 3.3Å; A382-S385 WeakPolarHBondContact O-CB 3.31Å; A382-S385 PolarHBondContact O-N 2.65Å; A382-S385 VanDerWaalsContact O-N 3.13Å; A382-R386 PolarHBondContact O-N 3.17Å
383T97.2Very high96.6Very high10 Ų1046.4 Ų46.46%0.06123%0.229CC..Hα-helixtrans-67-36.1178.2-53.80000111.5M344 M379 L380 S385 R386 F387 H464M344-T383 HydrophobicContact CE-CG2 4.04Å; M344-T383 WeakPolarHBondContact SD-CB 3.38Å; M344-T383 HydrophobicContact SD-CG2 3.47Å; M344-T383 WeakPolarHBondContact SD-CG2 3.36Å; M379-T383 WeakPolarHBondContact O-CB 3.31Å; M379-T383 PolarHBondContact O-N 2.87Å; M379-T383 PolarHBondContact O-OG1 2.99Å; L380-T383 PolarHBondContact O-N 3.37Å; T383-S385 VanDerWaalsContact C-N 3.34Å; T383-S385 PolarHBondContact O-N 3.2Å; T383-R386 WeakPolarHBondContact O-CB 3.12Å; T383-R386 PolarHBondContact O-N 3.04Å; T383-R386 VanDerWaalsContact O-N 3.13Å; T383-F387 HydrophobicContact CG2-CD1 4.42Å; T383-F387 HydrophobicContact CG2-CE1 3.78Å; T383-F387 HydrophobicContact CG2-CZ 4.36Å; T383-F387 WeakPolarHBondContact O-CD1 3.21Å; T383-F387 PolarHBondContact O-N 3.34Å; T383-F387 VanDerWaalsContact O-N 3.1Å; T383-H464 HydrophobicContact CG2-CB 3.92Å
384T98Very high96.8Very high2 Ų248.9 Ų48.91%0.01224%0.24CC..Hα-helixtrans-64.5-36171.3-55.60000112M344 S347 L380 L381 A382 R386 F387 R388M344-T384 WeakPolarHBondContact CB-OG1 3.46Å; M344-T384 WeakPolarHBondContact CG-OG1 3.34Å; S347-T384 WeakPolarHBondContact O-CG2 3.3Å; L380-T384 VanDerWaalsContact O-CB 3.27Å; L380-T384 WeakPolarHBondContact O-CB 3.27Å; L380-T384 PolarHBondContact O-N 3.36Å; L380-T384 PolarHBondContact O-OG1 2.9Å; L381-T384 PolarHBondContact O-N 3.26Å; A382-T384 VanDerWaalsContact C-N 3.34Å; A382-T384 PolarHBondContact O-N 3.47Å; T384-R386 VanDerWaalsContact C-N 3.31Å; T384-R386 PolarHBondContact O-N 3.07Å; T384-F387 WeakPolarHBondContact O-CB 3.28Å; T384-F387 PolarHBondContact O-N 3.47Å; T384-R388 PolarHBondContact O-N 3.29Å
385S97.7Very high97Very high39 Ų3950.3 Ų50.327%0.27324%0.244SC..Hα-helixtrans-60.6-42.3170.4-165.80000111.4L381 A382 T383 F387 R388 E389L381-S385 PolarHBondContact O-N 3.4Å; A382-S385 VanDerWaalsContact O-CB 3.3Å; A382-S385 WeakPolarHBondContact O-CB 3.31Å; A382-S385 PolarHBondContact O-N 2.65Å; A382-S385 VanDerWaalsContact O-N 3.13Å; T383-S385 VanDerWaalsContact C-N 3.34Å; T383-S385 PolarHBondContact O-N 3.2Å; S385-F387 VanDerWaalsContact C-N 3.26Å; S385-F387 PolarHBondContact O-N 3.46Å; S385-R388 WeakPolarHBondContact O-CB 3.2Å; S385-R388 PolarHBondContact O-N 2.92Å; S385-R388 VanDerWaalsContact O-N 3.08Å; S385-E389 WeakPolarHBondContact O-CG 3.36Å; S385-E389 PolarHBondContact O-N 3.5Å; S385-E389 PolarHBondContact OG-OE1 3.48Å
386R97.3Very high97.1Very high95 Ų9545.7 Ų45.736%0.35822%0.222SC..Hα-helixtrans-62.4-32.9177.1-166.255.8174.7175.81.1112.9A382 T383 T384 E389 L390 L461A382-R386 PolarHBondContact O-N 3.17Å; T383-R386 WeakPolarHBondContact O-CB 3.12Å; T383-R386 PolarHBondContact O-N 3.04Å; T383-R386 VanDerWaalsContact O-N 3.13Å; T384-R386 VanDerWaalsContact C-N 3.31Å; T384-R386 PolarHBondContact O-N 3.07Å; R386-E389 WeakPolarHBondContact CD-OE2 3.41Å; R386-E389 IonicContact CZ-OE2 3.67Å; R386-E389 IonicContact NE-OE2 3.63Å; R386-E389 IonicContact NH1-OE2 2.7Å; R386-E389 PolarHBondContact NH1-OE2 2.93Å; R386-L390 HydrophobicContact CG-CD1 4.23Å; R386-L390 WeakPolarHBondContact O-CB 3.43Å; R386-L390 VanDerWaalsContact O-CG 3.32Å; R386-L390 WeakPolarHBondContact O-CG 3.39Å; R386-L390 PolarHBondContact O-N 2.81Å; R386-L390 VanDerWaalsContact O-N 3.09Å; R386-L461 HydrophobicContact CB-CD2 4.47Å; R386-L461 HydrophobicContact CG-CD2 3.88Å
387F97.5Very high97.2Very high1 Ų145.3 Ų45.30%0.00422%0.22CC..Hα-helixtrans-65.9-41.5173.9-69.716.8000111.5V341 M344 I348 T383 T384 S385 K391 L392 L461 V465V341-F387 HydrophobicContact CG2-CE2 4.14Å; V341-F387 HydrophobicContact CG2-CZ 3.99Å; M344-F387 HydrophobicContact CB-CD2 4.21Å; M344-F387 HydrophobicContact CB-CE2 3.71Å; M344-F387 HydrophobicContact CB-CZ 4.23Å; M344-F387 HydrophobicContact CE-CZ 4.26Å; M344-F387 HydrophobicContact SD-CZ 4.49Å; I348-F387 HydrophobicContact CD1-CB 3.86Å; I348-F387 HydrophobicContact CG1-CB 4.19Å; T383-F387 HydrophobicContact CG2-CD1 4.42Å; T383-F387 HydrophobicContact CG2-CE1 3.78Å; T383-F387 HydrophobicContact CG2-CZ 4.36Å; T383-F387 WeakPolarHBondContact O-CD1 3.21Å; T383-F387 PolarHBondContact O-N 3.34Å; T383-F387 VanDerWaalsContact O-N 3.1Å; T384-F387 WeakPolarHBondContact O-CB 3.28Å; T384-F387 PolarHBondContact O-N 3.47Å; S385-F387 VanDerWaalsContact C-N 3.26Å; S385-F387 PolarHBondContact O-N 3.46Å; F387-K391 PolarHBondContact O-N 2.77Å; F387-L392 HydrophobicContact CB-CB 4.37Å; F387-L392 HydrophobicContact CB-CD2 4.17Å; F387-L392 HydrophobicContact CD1-CD2 4.37Å; F387-L392 HydrophobicContact CD2-CD2 3.63Å; F387-L392 HydrophobicContact CE2-CD2 4.07Å; F387-L392 HydrophobicContact CG-CD2 3.8Å; F387-L392 PolarHBondContact O-N 3.47Å; F387-L392 VanDerWaalsContact O-N 3.08Å; F387-L461 HydrophobicContact CD1-CD1 3.89Å; F387-L461 HydrophobicContact CD1-CD2 4.01Å; F387-L461 HydrophobicContact CD1-CG 4.5Å; F387-L461 HydrophobicContact CE1-CB 4.24Å; F387-L461 HydrophobicContact CE1-CD1 3.79Å; F387-L461 HydrophobicContact CE1-CD2 3.94Å; F387-L461 HydrophobicContact CE1-CG 4.2Å; F387-V465 HydrophobicContact CZ-CG2 4.49Å
388R97.3Very high97.3Very high74 Ų7445.1 Ų45.128%0.27922%0.22SC..Hα-helixtrans-62.4-49172.6-75.8-173-71.6-88-1.2112.2I348 T384 S385 L390 K391I348-R388 HydrophobicContact CG1-CG 3.79Å; I348-R388 WeakPolarHBondContact O-CD 3.29Å; I348-R388 WeakPolarHBondContact O-CG 3.46Å; I348-R388 PolarHBondContact O-NH1 2.94Å; T384-R388 PolarHBondContact O-N 3.29Å; S385-R388 WeakPolarHBondContact O-CB 3.2Å; S385-R388 PolarHBondContact O-N 2.92Å; S385-R388 VanDerWaalsContact O-N 3.08Å; R388-L390 VanDerWaalsContact C-N 3.33Å; R388-L390 PolarHBondContact O-N 3.4Å; R388-K391 WeakPolarHBondContact O-CA 3.23Å; R388-K391 PolarHBondContact O-N 3.36Å
389E96.8Very high97.3Very high105 Ų10542.3 Ų42.349%0.49121%0.205SC..Hα-helixtrans-57.6-44.3-178.8-72.4157.5-139.300112.3S385 R386 K391S385-E389 WeakPolarHBondContact O-CG 3.36Å; S385-E389 PolarHBondContact O-N 3.5Å; S385-E389 PolarHBondContact OG-OE1 3.48Å; R386-E389 WeakPolarHBondContact CD-OE2 3.41Å; R386-E389 IonicContact CZ-OE2 3.67Å; R386-E389 IonicContact NE-OE2 3.63Å; R386-E389 IonicContact NH1-OE2 2.7Å; R386-E389 PolarHBondContact NH1-OE2 2.93Å; E389-K391 PolarHBondContact O-N 2.99Å
390L95.8Very high97.4Very high24 Ų2441 Ų4113%0.12620%0.198CC..THydrogen-bonded Turntrans-72.9-11.1176.5-67.6175.4000113.1R386 R388 R454 N457 L458 L461R386-L390 HydrophobicContact CG-CD1 4.23Å; R386-L390 WeakPolarHBondContact O-CB 3.43Å; R386-L390 VanDerWaalsContact O-CG 3.32Å; R386-L390 WeakPolarHBondContact O-CG 3.39Å; R386-L390 PolarHBondContact O-N 2.81Å; R386-L390 VanDerWaalsContact O-N 3.09Å; R388-L390 VanDerWaalsContact C-N 3.33Å; R388-L390 PolarHBondContact O-N 3.4Å; L390-R454 PolarHBondContact O-NH1 3.44Å; L390-R454 PolarHBondContact O-NH2 2.99Å; L390-N457 HydrophobicContact CD1-CB 4.34Å; L390-N457 HydrophobicContact CD2-CB 3.86Å; L390-L458 HydrophobicContact CD1-CD2 4.45Å; L390-L461 HydrophobicContact CD1-CD1 4.1Å; L390-L461 HydrophobicContact CD1-CD2 3.86Å; L390-L461 HydrophobicContact CD1-CG 4.21Å
391K96.2Very high97.4Very high168 Ų16841.2 Ų41.273%0.7320%0.199SC*.THydrogen-bonded Turntrans48.560-169-59.1-178-178.9-177.80110.1F387 R388 E389 Q393 R454F387-K391 PolarHBondContact O-N 2.77Å; R388-K391 WeakPolarHBondContact O-CA 3.23Å; R388-K391 PolarHBondContact O-N 3.36Å; E389-K391 PolarHBondContact O-N 2.99Å; K391-Q393 PolarHBondContact O-N 3.14Å; K391-R454 PolarHBondContact O-NH2 3Å
392L97Very high97.4Very high10 Ų1039.8 Ų39.85%0.05219%0.192CC..  trans-59.6119.4-178.3-178.763.8000110.1W345 I348 F387 E396 L458W345-L392 HydrophobicContact CE3-CD2 3.98Å; W345-L392 HydrophobicContact CE3-CG 4.39Å; W345-L392 HydrophobicContact CZ3-CB 4.24Å; W345-L392 HydrophobicContact CZ3-CD2 3.98Å; W345-L392 HydrophobicContact CZ3-CG 3.9Å; W345-L392 WeakPolarHBondContact CZ3-O 3.3Å; I348-L392 HydrophobicContact CD1-CB 4.46Å; F387-L392 HydrophobicContact CB-CB 4.37Å; F387-L392 HydrophobicContact CB-CD2 4.17Å; F387-L392 HydrophobicContact CD1-CD2 4.37Å; F387-L392 HydrophobicContact CD2-CD2 3.63Å; F387-L392 HydrophobicContact CE2-CD2 4.07Å; F387-L392 HydrophobicContact CG-CD2 3.8Å; F387-L392 PolarHBondContact O-N 3.47Å; F387-L392 VanDerWaalsContact O-N 3.08Å; L392-E396 HydrophobicContact CD1-CB 3.81Å; L392-L458 HydrophobicContact CD1-CD2 3.44Å; L392-L458 VanDerWaalsContact CD1-CD2 3.44Å
393Q96.7Very high97.3Very high78 Ų7837.3 Ų37.336%0.36417%0.169SC..  trans-79.7149.4176.8-59.4177.711.600110.3K391 K395 E396 Y397 S444K391-Q393 PolarHBondContact O-N 3.14Å; Q393-K395 VanDerWaalsContact C-N 3.27Å; Q393-K395 PolarHBondContact O-N 3.49Å; Q393-E396 HydrophobicContact CB-CB 4.47Å; Q393-E396 HydrophobicContact CB-CG 4.04Å; Q393-E396 WeakPolarHBondContact CB-OE2 3.39Å; Q393-E396 WeakPolarHBondContact CG-OE2 3.35Å; Q393-E396 PolarHBondContact N-OE2 3.42Å; Q393-E396 WeakPolarHBondContact O-CB 3.34Å; Q393-E396 PolarHBondContact O-N 2.94Å; Q393-Y397 PolarHBondContact O-N 3.42Å; Q393-S444 PolarHBondContact NE2-OG 2.89Å
394H97.4Very high97.3Very high69 Ų6937 Ų3732%0.31917%0.167SC..Hα-helixtrans-56.4-40.7179.6-172.362.6000112.8L273 W345 E396 Y397 L398L273-H394 WeakPolarHBondContact CD1-NE2 3.35Å; W345-H394 AromaticContact CE2-ND1 3.37Å; W345-H394 HydrophobicContact CH2-CB 3.94Å; W345-H394 HydrophobicContact CZ2-CB 3.66Å; W345-H394 AromaticContact CZ2-CG 3.81Å; W345-H394 AromaticContact CZ2-ND1 3.23Å; W345-H394 WeakPolarHBondContact CZ2-ND1 3.31Å; W345-H394 AromaticContact NE1-CE1 3.86Å; W345-H394 AromaticContact NE1-ND1 3.39Å; W345-H394 PolarHBondContact NE1-ND1 3.4Å; H394-E396 VanDerWaalsContact C-N 3.31Å; H394-E396 PolarHBondContact O-N 2.87Å; H394-Y397 AromaticContact ND1-CD1 3.79Å; H394-Y397 WeakPolarHBondContact O-CB 3.27Å; H394-Y397 PolarHBondContact O-N 3.06Å; H394-L398 WeakPolarHBondContact O-CG 3.42Å; H394-L398 PolarHBondContact O-N 2.93Å
395K97.6Very high97.2Very high79 Ų7936.9 Ų36.934%0.34317%0.166SC..Hα-helixtrans-63.1-33.7175.7-70.4-174.1171-168.20113.3V269 Q393 C399 V440V269-K395 HydrophobicContact CG1-CB 3.98Å; V269-K395 HydrophobicContact CG1-CD 3.79Å; V269-K395 HydrophobicContact CG1-CG 3.74Å; Q393-K395 VanDerWaalsContact C-N 3.27Å; Q393-K395 PolarHBondContact O-N 3.49Å; K395-C399 PolarHBondContact O-N 2.98Å; K395-C399 PolarHBondContact O-SG 2.74Å; K395-V440 HydrophobicContact CB-CG1 3.72Å; K395-V440 HydrophobicContact CB-CG2 3.93Å
396E98.1Very high96.9Very high0 Ų035.1 Ų35.10%015%0.154CC..Hα-helixtrans-73.2-42.1175.4-61.6171.813600111L392 Q393 H394 L398 C399 V400 L437 V440 R454 L458L392-E396 HydrophobicContact CD1-CB 3.81Å; Q393-E396 HydrophobicContact CB-CB 4.47Å; Q393-E396 HydrophobicContact CB-CG 4.04Å; Q393-E396 WeakPolarHBondContact CB-OE2 3.39Å; Q393-E396 WeakPolarHBondContact CG-OE2 3.35Å; Q393-E396 PolarHBondContact N-OE2 3.42Å; Q393-E396 WeakPolarHBondContact O-CB 3.34Å; Q393-E396 PolarHBondContact O-N 2.94Å; H394-E396 VanDerWaalsContact C-N 3.31Å; H394-E396 PolarHBondContact O-N 2.87Å; E396-L398 PolarHBondContact O-N 2.74Å; E396-C399 PolarHBondContact O-N 3.34Å; E396-V400 WeakPolarHBondContact O-CG2 3.44Å; E396-V400 PolarHBondContact O-N 3.29Å; E396-L437 HydrophobicContact CB-CD1 4.04Å; E396-L437 HydrophobicContact CG-CD1 4.18Å; E396-V440 HydrophobicContact CG-CG1 3.57Å; E396-R454 IonicContact OE1-CZ 3.42Å; E396-R454 IonicContact OE1-NE 2.71Å; E396-R454 PolarHBondContact OE1-NE 2.65Å; E396-R454 IonicContact OE1-NH2 3.3Å; E396-R454 PolarHBondContact OE1-NH2 3.21Å; E396-R454 IonicContact OE2-CZ 3.59Å; E396-R454 IonicContact OE2-NE 3.67Å; E396-R454 IonicContact OE2-NH2 2.7Å; E396-R454 PolarHBondContact OE2-NH2 2.88Å; E396-L458 HydrophobicContact CB-CD1 4.11Å; E396-L458 HydrophobicContact CG-CD1 4.2Å
397Y98.2Very high96.3Very high5 Ų533.8 Ų33.82%0.0215%0.154CC..Hα-helixtrans-56.7-46172.8156.8-100.4000111.9V341 W345 Q393 H394 C399 V400 K401V341-Y397 HydrophobicContact CG1-CE2 4.27Å; V341-Y397 HydrophobicContact CG2-CD2 4.39Å; V341-Y397 HydrophobicContact CG2-CE2 4.2Å; W345-Y397 HydrophobicContact CB-CD2 3.73Å; W345-Y397 HydrophobicContact CB-CE1 4.27Å; W345-Y397 HydrophobicContact CB-CE2 3.37Å; W345-Y397 HydrophobicContact CB-CG 4.32Å; W345-Y397 AromaticContact CD1-CE1 3.68Å; W345-Y397 AromaticContact CD1-CZ 3.84Å; W345-Y397 AromaticContact CD2-CD1 3.7Å; W345-Y397 HydrophobicContact CD2-CD1 3.7Å; W345-Y397 AromaticContact CD2-CD2 3.87Å; W345-Y397 HydrophobicContact CD2-CD2 3.87Å; W345-Y397 HydrophobicContact CD2-CE1 4.1Å; W345-Y397 HydrophobicContact CD2-CE2 4.26Å; W345-Y397 AromaticContact CD2-CG 3.56Å; W345-Y397 HydrophobicContact CD2-CG 3.56Å; W345-Y397 AromaticContact CE2-CD1 3.95Å; W345-Y397 HydrophobicContact CE3-CD1 4.16Å; W345-Y397 AromaticContact CE3-CD2 3.88Å; W345-Y397 HydrophobicContact CE3-CD2 3.88Å; W345-Y397 AromaticContact CE3-CG 3.58Å; W345-Y397 HydrophobicContact CE3-CG 3.58Å; W345-Y397 AromaticContact CG-CD1 3.83Å; W345-Y397 HydrophobicContact CG-CD1 3.83Å; W345-Y397 AromaticContact CG-CD2 3.79Å; W345-Y397 HydrophobicContact CG-CD2 3.79Å; W345-Y397 AromaticContact CG-CE1 3.72Å; W345-Y397 HydrophobicContact CG-CE1 3.72Å; W345-Y397 AromaticContact CG-CE2 3.68Å; W345-Y397 HydrophobicContact CG-CE2 3.68Å; W345-Y397 AromaticContact CG-CG 3.86Å; W345-Y397 HydrophobicContact CG-CG 3.86Å; W345-Y397 AromaticContact CG-CZ 3.62Å; W345-Y397 HydrophobicContact CZ3-CG 4.27Å; Q393-Y397 PolarHBondContact O-N 3.42Å; H394-Y397 AromaticContact ND1-CD1 3.79Å; H394-Y397 WeakPolarHBondContact O-CB 3.27Å; H394-Y397 PolarHBondContact O-N 3.06Å; Y397-C399 VanDerWaalsContact C-N 3.33Å; Y397-C399 PolarHBondContact O-N 2.84Å; Y397-V400 PolarHBondContact O-N 3.25Å; Y397-K401 HydrophobicContact CE1-CD 4.32Å; Y397-K401 HydrophobicContact CE2-CB 4.41Å; Y397-K401 HydrophobicContact CE2-CD 4.41Å; Y397-K401 VanDerWaalsContact O-CB 3.27Å; Y397-K401 WeakPolarHBondContact O-CB 3.11Å; Y397-K401 PolarHBondContact O-N 2.97Å
398L98.2Very high95Very high3 Ų334.4 Ų34.42%0.01616%0.158CC..Hα-helixtrans-57.9-44.8177.4-69.8173.6000111.9L272 L273 E276 H394 E396 A402L272-L398 HydrophobicContact CB-CB 4.27Å; L273-L398 HydrophobicContact CB-CD1 3.88Å; L273-L398 HydrophobicContact CD1-CD1 3.91Å; E276-L398 VanDerWaalsContact CD-CD2 3.42Å; E276-L398 HydrophobicContact CG-CD2 3.4Å; E276-L398 VanDerWaalsContact CG-CD2 3.4Å; H394-L398 WeakPolarHBondContact O-CG 3.42Å; H394-L398 PolarHBondContact O-N 2.93Å; E396-L398 PolarHBondContact O-N 2.74Å; L398-A402 WeakPolarHBondContact O-CB 3.35Å; L398-A402 PolarHBondContact O-N 3.28Å
399C98.1Very high93.3Very high0 Ų036.2 Ų36.20%017%0.174CC..Hα-helixtrans-63.8-48174.2-68.70000111.8K395 E396 Y397 K401 A402 M403 V433 L437K395-C399 PolarHBondContact O-N 2.98Å; K395-C399 PolarHBondContact O-SG 2.74Å; E396-C399 PolarHBondContact O-N 3.34Å; Y397-C399 VanDerWaalsContact C-N 3.33Å; Y397-C399 PolarHBondContact O-N 2.84Å; C399-K401 VanDerWaalsContact C-N 3.31Å; C399-K401 PolarHBondContact O-N 3.23Å; C399-A402 CarbonylContact O-C 3.58Å; C399-A402 PolarHBondContact O-N 3.15Å; C399-M403 VanDerWaalsContact O-CG 3.32Å; C399-M403 WeakPolarHBondContact O-CG 3.25Å; C399-M403 PolarHBondContact O-N 3.21Å; C399-V433 HydrophobicContact CB-CG1 4.3Å; C399-V433 WeakPolarHBondContact O-CG1 3.42Å; C399-L437 HydrophobicContact CB-CB 3.85Å; C399-L437 HydrophobicContact CB-CD1 4.01Å; C399-L437 HydrophobicContact CB-CG 4.39Å
400V97.6Very high91.3Very high3 Ų333.7 Ų33.72%0.01816%0.162CC..Hα-helixtrans-59.3-40.6178.2169.30000111.6E396 Y397 M403 I404 L437 L458 L462E396-V400 WeakPolarHBondContact O-CG2 3.44Å; E396-V400 PolarHBondContact O-N 3.29Å; Y397-V400 PolarHBondContact O-N 3.25Å; V400-M403 WeakPolarHBondContact O-CB 3.14Å; V400-M403 PolarHBondContact O-N 3.36Å; V400-I404 HydrophobicContact CG1-CD1 4.37Å; V400-I404 WeakPolarHBondContact O-CG1 3.27Å; V400-I404 PolarHBondContact O-N 3.25Å; V400-L437 HydrophobicContact CG2-CD2 4.39Å; V400-L458 HydrophobicContact CG2-CB 4.44Å; V400-L462 HydrophobicContact CG1-CD2 3.94Å
401K97.7Very high89.1Confident8 Ų840.9 Ų40.94%0.03519%0.189CC..Hα-helixtrans-63.2-43.7175.2-169.3-167.7-172.5-174.80112E276 W312 V338 V341 Y397 C399 I404 L405E276-K401 IonicContact OE1-NZ 2.73Å; E276-K401 PolarHBondContact OE1-NZ 3.5Å; E276-K401 IonicContact OE2-NZ 3.33Å; E276-K401 PolarHBondContact OE2-NZ 3.33Å; W312-K401 HydrophobicContact CH2-CD 4.3Å; W312-K401 HydrophobicContact CH2-CG 3.9Å; W312-K401 HydrophobicContact CZ2-CB 4.37Å; W312-K401 HydrophobicContact CZ2-CD 3.6Å; W312-K401 HydrophobicContact CZ2-CG 3.62Å; V338-K401 HydrophobicContact CG1-CG 4.43Å; V341-K401 HydrophobicContact CG1-CB 4.34Å; V341-K401 HydrophobicContact CG1-CG 3.95Å; Y397-K401 HydrophobicContact CE1-CD 4.32Å; Y397-K401 HydrophobicContact CE2-CB 4.41Å; Y397-K401 HydrophobicContact CE2-CD 4.41Å; Y397-K401 VanDerWaalsContact O-CB 3.27Å; Y397-K401 WeakPolarHBondContact O-CB 3.11Å; Y397-K401 PolarHBondContact O-N 2.97Å; C399-K401 VanDerWaalsContact C-N 3.31Å; C399-K401 PolarHBondContact O-N 3.23Å; K401-I404 PolarHBondContact O-N 3.42Å; K401-L405 PolarHBondContact O-N 3.32Å
402A97.5Very high86.8Confident0 Ų038 Ų380%019%0.188CC..Hα-helixtrans-68.4-34.7173.900000112.4L272 I316 L398 C399 L405 L406 V433L272-A402 HydrophobicContact CD1-CB 4.07Å; L272-A402 HydrophobicContact CD2-CB 3.9Å; I316-A402 HydrophobicContact CD1-CB 4.46Å; L398-A402 WeakPolarHBondContact O-CB 3.35Å; L398-A402 PolarHBondContact O-N 3.28Å; C399-A402 CarbonylContact O-C 3.58Å; C399-A402 PolarHBondContact O-N 3.15Å; A402-L405 PolarHBondContact O-N 2.88Å; A402-L406 WeakPolarHBondContact O-CG 3.08Å; A402-L406 PolarHBondContact O-N 3.28Å; A402-V433 HydrophobicContact CB-CG1 3.83Å; A402-V433 HydrophobicContact CB-CG2 4.26Å
403M96.3Very high84.3Confident11 Ų1142.9 Ų42.95%0.05421%0.213CC..Hα-helixtrans-62.9-40.4171.8-69.8-172.778.300111.3C399 V400 L405 L406 N407 L430 V433 T434 L437 L459C399-M403 VanDerWaalsContact O-CG 3.32Å; C399-M403 WeakPolarHBondContact O-CG 3.25Å; C399-M403 PolarHBondContact O-N 3.21Å; V400-M403 WeakPolarHBondContact O-CB 3.14Å; V400-M403 PolarHBondContact O-N 3.36Å; M403-L405 VanDerWaalsContact C-N 3.3Å; M403-L405 PolarHBondContact O-N 3.34Å; M403-L406 PolarHBondContact O-N 2.65Å; M403-N407 WeakPolarHBondContact O-CA 3.34Å; M403-N407 WeakPolarHBondContact O-CB 3.34Å; M403-N407 PolarHBondContact O-N 2.82Å; M403-L430 HydrophobicContact CB-CD1 4.34Å; M403-L430 HydrophobicContact CE-CD1 3.98Å; M403-L430 HydrophobicContact CG-CD1 4.24Å; M403-V433 HydrophobicContact CG-CB 4.41Å; M403-V433 HydrophobicContact CG-CG1 3.6Å; M403-T434 WeakPolarHBondContact CE-OG1 3.35Å; M403-L437 HydrophobicContact SD-CD2 3.93Å; M403-L459 HydrophobicContact CE-CD2 3.6Å; M403-L459 HydrophobicContact SD-CD2 3.95Å
404I96.2Very high81.9Confident2 Ų244.9 Ų44.91%0.0123%0.231CC..Hα-helixtrans-57-42.9176.3-73.4163.1000111.7C334 E337 V338 V341 V400 K401 L462 V465C334-I404 HydrophobicContact CB-CG2 4.11Å; E337-I404 HydrophobicContact CB-CG2 3.41Å; E337-I404 VanDerWaalsContact CB-CG2 3.41Å; E337-I404 HydrophobicContact CG-CG2 4.37Å; V338-I404 HydrophobicContact CG2-CB 4.39Å; V338-I404 HydrophobicContact CG2-CG2 3.6Å; V341-I404 HydrophobicContact CB-CD1 3.94Å; V341-I404 HydrophobicContact CG1-CD1 3.89Å; V341-I404 HydrophobicContact CG2-CD1 4.03Å; V400-I404 HydrophobicContact CG1-CD1 4.37Å; V400-I404 WeakPolarHBondContact O-CG1 3.27Å; V400-I404 PolarHBondContact O-N 3.25Å; K401-I404 PolarHBondContact O-N 3.42Å; I404-L462 HydrophobicContact CD1-CD2 4.17Å; I404-L462 HydrophobicContact CG1-CD2 3.52Å; I404-V465 HydrophobicContact CD1-CG1 4.04Å
405L95.3Very high79.4Confident0 Ų045.7 Ų45.70%024%0.24CC..Hα-helixtrans-63.9-40.6177.2177.467000112.7M309 W312 A313 I316 F319 L330 L331 K401 A402 M403M309-L405 HydrophobicContact CE-CD1 4.32Å; W312-L405 HydrophobicContact CH2-CB 4.15Å; W312-L405 HydrophobicContact CH2-CD2 4.29Å; W312-L405 HydrophobicContact CZ3-CB 4.19Å; W312-L405 HydrophobicContact CZ3-CD2 3.91Å; W312-L405 HydrophobicContact CZ3-CG 4.48Å; A313-L405 HydrophobicContact CB-CD2 3.76Å; I316-L405 HydrophobicContact CD1-CD2 3.59Å; F319-L405 HydrophobicContact CD2-CD2 3.86Å; F319-L405 HydrophobicContact CD2-CG 4.43Å; F319-L405 HydrophobicContact CE2-CD1 4.04Å; F319-L405 HydrophobicContact CE2-CD2 3.81Å; F319-L405 HydrophobicContact CE2-CG 4.05Å; L330-L405 HydrophobicContact CB-CD1 4.35Å; L330-L405 WeakPolarHBondContact CD2-O 3.49Å; L331-L405 HydrophobicContact CD2-CD1 3.97Å; L331-L405 HydrophobicContact CG-CD1 4.44Å; K401-L405 PolarHBondContact O-N 3.32Å; A402-L405 PolarHBondContact O-N 2.88Å; M403-L405 VanDerWaalsContact C-N 3.3Å; M403-L405 PolarHBondContact O-N 3.34Å
406L93.1Very high77.2Confident2 Ų245.8 Ų45.81%0.0126%0.256CS..Hα-helixtrans-90.5-25.7-172.3-61.6171.2000113.3A402 M403 S408 L426 L429 L430 V433A402-L406 WeakPolarHBondContact O-CG 3.08Å; A402-L406 PolarHBondContact O-N 3.28Å; M403-L406 PolarHBondContact O-N 2.65Å; L406-S408 PolarHBondContact O-N 2.88Å; L406-S408 VanDerWaalsContact O-N 3.09Å; L406-L426 HydrophobicContact CB-CD1 4.21Å; L406-L426 HydrophobicContact CD2-CD1 3.83Å; L406-L429 HydrophobicContact CD1-CB 3.84Å; L406-L429 HydrophobicContact CD2-CB 3.99Å; L406-L429 HydrophobicContact CD2-CD1 3.83Å; L406-L429 HydrophobicContact CG-CB 4.5Å; L406-L430 HydrophobicContact CB-CB 4.33Å; L406-L430 HydrophobicContact CB-CD1 4.11Å; L406-V433 HydrophobicContact CD1-CB 4.44Å; L406-V433 HydrophobicContact CD1-CG2 3.73Å
407N83.6Confident75.1Confident67 Ų6751.3 Ų51.336%0.35829%0.29SS..  trans-85.842.9-179.2-169.745.7000111.9M403 L430M403-N407 WeakPolarHBondContact O-CA 3.34Å; M403-N407 WeakPolarHBondContact O-CB 3.34Å; M403-N407 PolarHBondContact O-N 2.82Å; N407-L430 HydrophobicContact CB-CD1 4.1Å; N407-L430 HydrophobicContact CB-CD2 4.37Å
408S70.2Confident72.9Confident14 Ų1458.4 Ų58.410%0.09832%0.323CS..  trans-81.2133169-172.30000110S333 L406 M410S333-S408 WeakPolarHBondContact CB-OG 3.49Å; S333-S408 WeakPolarHBondContact OG-CB 3.46Å; S333-S408 PolarHBondContact OG-OG 3.46Å; L406-S408 PolarHBondContact O-N 2.88Å; L406-S408 VanDerWaalsContact O-N 3.09Å; S408-M410 PolarHBondContact O-N 3Å; S408-M410 VanDerWaalsContact OG-CE 3.25Å; S408-M410 WeakPolarHBondContact OG-CE 3.39Å
409N61Low71.1Confident113 Ų11360.8 Ų60.860%0.60434%0.336SS*.  trans-66.988.5165.2-76.6-22.3000109Y411N409-Y411 HydrophobicContact CB-CD2 4.33Å; N409-Y411 HydrophobicContact CB-CE2 3.97Å; N409-Y411 VanDerWaalsContact O-CD2 3.23Å; N409-Y411 WeakPolarHBondContact O-CD2 3.25Å; N409-Y411 PolarHBondContact O-N 3.11Å
410M56.3Low69.7Low51 Ų5163.4 Ų63.425%0.25136%0.358SS..  trans-64.784169-79.4-60.5107.900109.9R329 L330 S408 P412 L426R329-M410 HydrophobicContact CB-CE 3.98Å; R329-M410 HydrophobicContact CB-SD 4.12Å; L330-M410 HydrophobicContact CD2-CE 4Å; L330-M410 HydrophobicContact CG-CE 4.39Å; S408-M410 PolarHBondContact O-N 3Å; S408-M410 VanDerWaalsContact OG-CE 3.25Å; S408-M410 WeakPolarHBondContact OG-CE 3.39Å; M410-P412 VanDerWaalsContact O-CD 3.3Å; M410-P412 WeakPolarHBondContact O-CD 3.32Å; M410-P412 VanDerWaalsContact O-N 3.15Å; M410-L426 HydrophobicContact CG-CD2 3.83Å
411Y49.3Very low68.6Low175 Ų17567.1 Ų67.169%0.68638%0.378SS*.  trans-57.7116.5167.6-73.7-87.2000108.4R329 N409 L413R329-Y411 PolarHBondContact NH1-O 2.83Å; N409-Y411 HydrophobicContact CB-CD2 4.33Å; N409-Y411 HydrophobicContact CB-CE2 3.97Å; N409-Y411 VanDerWaalsContact O-CD2 3.23Å; N409-Y411 WeakPolarHBondContact O-CD2 3.25Å; N409-Y411 PolarHBondContact O-N 3.11Å; Y411-L413 PolarHBondContact O-N 3.13Å; Y411-L413 VanDerWaalsContact O-N 3.1Å
412P46.7Very low67.6Low109 Ų10967.9 Ų67.971%0.70838%0.384SS*.  trans-74.2105.6-172.428.5-33.4000109.5M410 V414M410-P412 VanDerWaalsContact O-CD 3.3Å; M410-P412 WeakPolarHBondContact O-CD 3.32Å; M410-P412 VanDerWaalsContact O-N 3.15Å; P412-V414 VanDerWaalsContact C-N 3.35Å; P412-V414 PolarHBondContact O-N 2.65Å
413L45.2Very low66.9Low112 Ų11271.6 Ų71.659%0.58641%0.41SS*.  trans-98.463.1178.9-164.972.2000110.5Y411Y411-L413 PolarHBondContact O-N 3.13Å; Y411-L413 VanDerWaalsContact O-N 3.1Å
414V46.6Very low66.3Low120 Ų12076.8 Ų76.873%0.72743%0.429SS*.SBendtrans59.180.1160.6-165.70000115.9P412P412-V414 VanDerWaalsContact C-N 3.35Å; P412-V414 PolarHBondContact O-N 2.65Å
415T43.6Very low65.9Low85 Ų8580.3 Ų80.352%0.52144%0.444SS..  -162.696.412410.40000112.4T417 Q418 D419T415-T417 PolarHBondContact O-N 3.15Å; T415-Q418 PolarHBondContact O-N 2.82Å; T415-D419 PolarHBondContact N-OD2 3.16Å; T415-D419 PolarHBondContact O-N 3.34Å
416A53.3Low65.6Low81 Ų8181.3 Ų81.367%0.66945%0.449SS*.THydrogen-bonded Turntrans-62.46.1-163.600000118.3
417T53Low65.4Low117 Ų11783.3 Ų83.372%0.71847%0.466SS*.THydrogen-bonded Turntrans-108.5-33178.250.90000114.1T415T415-T417 PolarHBondContact O-N 3.15Å
418Q52.3Low65.7Low153 Ų15384.8 Ų84.872%0.71547%0.471SS*.THydrogen-bonded Turntrans-87.1-39.4169.5-76.5-174.8-22.700111T415 A420 D421 S422T415-Q418 PolarHBondContact O-N 2.82Å; Q418-A420 PolarHBondContact O-N 3.07Å; Q418-D421 PolarHBondContact O-N 3.15Å; Q418-D421 VanDerWaalsContact O-N 3.13Å; Q418-S422 PolarHBondContact O-N 2.93Å
419D59.9Low66.8Low53 Ų5384.4 Ų84.428%0.28347%0.467SS..Hα-helixtrans-48.8-38.6177.4-66.8-19.3000112.6T415 S423T415-D419 PolarHBondContact N-OD2 3.16Å; T415-D419 PolarHBondContact O-N 3.34Å; D419-S423 WeakPolarHBondContact O-CB 3.42Å; D419-S423 PolarHBondContact O-N 3.42Å
420A68.2Low68.4Low55 Ų5580.7 Ų80.746%0.45545%0.447SS..Hα-helixtrans-70.2-35.2-175.500000114Q418 R424Q418-A420 PolarHBondContact O-N 3.07Å; A420-R424 WeakPolarHBondContact O-CB 3.14Å; A420-R424 PolarHBondContact O-N 3.11Å; A420-R424 VanDerWaalsContact O-N 3.11Å
421D75.1Confident70.1Confident82 Ų8282.5 Ų82.544%0.43946%0.458SS..Hα-helixtrans-80.3-39177.8-79.1-27.6000111.1Q418 R424 K425Q418-D421 PolarHBondContact O-N 3.15Å; Q418-D421 VanDerWaalsContact O-N 3.13Å; D421-R424 PolarHBondContact O-N 2.97Å; D421-R424 IonicContact OD1-CZ 3.96Å; D421-R424 IonicContact OD1-NH1 2.71Å; D421-R424 PolarHBondContact OD1-NH1 3.07Å; D421-R424 IonicContact OD1-NH2 2.73Å; D421-R424 PolarHBondContact OD1-NH2 3.32Å; D421-K425 WeakPolarHBondContact O-CG 3.45Å; D421-K425 PolarHBondContact O-N 3.37Å
422S77.2Confident72.3Confident24 Ų2475.7 Ų75.717%0.16844%0.438CS..Hα-helixtrans-64-44.9171.6-840000112.3D326 Q418 R424 K425 L426D326-S422 VanDerWaalsContact OD2-CB 3.28Å; D326-S422 WeakPolarHBondContact OD2-CB 3.5Å; D326-S422 PolarHBondContact OD2-OG 3.26Å; Q418-S422 PolarHBondContact O-N 2.93Å; S422-R424 PolarHBondContact O-N 3.41Å; S422-K425 PolarHBondContact O-N 3.05Å; S422-L426 WeakPolarHBondContact O-CB 3.37Å; S422-L426 PolarHBondContact O-N 3.17Å
423S81.8Confident74.7Confident78 Ų7870.7 Ų70.755%0.54541%0.405SS..Hα-helixtrans-60.4-42.9175.4-178.30000111.7D419 L426 A427D419-S423 WeakPolarHBondContact O-CB 3.42Å; D419-S423 PolarHBondContact O-N 3.42Å; S423-L426 PolarHBondContact O-N 3.29Å; S423-A427 WeakPolarHBondContact O-CB 3.3Å; S423-A427 PolarHBondContact O-N 2.88Å
424R84.6Confident77.1Confident120 Ų12066.9 Ų66.945%0.45339%0.387SS..Hα-helixtrans-61.3-46.9173.8-176.9177.269.4-103.4-3.5111.5A420 D421 S422 A427 H428A420-R424 WeakPolarHBondContact O-CB 3.14Å; A420-R424 PolarHBondContact O-N 3.11Å; A420-R424 VanDerWaalsContact O-N 3.11Å; D421-R424 PolarHBondContact O-N 2.97Å; D421-R424 IonicContact OD1-CZ 3.96Å; D421-R424 IonicContact OD1-NH1 2.71Å; D421-R424 PolarHBondContact OD1-NH1 3.07Å; D421-R424 IonicContact OD1-NH2 2.73Å; D421-R424 PolarHBondContact OD1-NH2 3.32Å; S422-R424 PolarHBondContact O-N 3.41Å; R424-A427 PolarHBondContact O-N 2.78Å; R424-H428 WeakPolarHBondContact CG-NE2 3.32Å; R424-H428 PolarHBondContact O-CD2 3.32Å; R424-H428 PolarHBondContact O-N 2.74Å
425K87.3Confident79.4Confident75 Ų7565.8 Ų65.833%0.32638%0.377SS..Hα-helixtrans-57.3-51.6176.6-78.3178.4168.6-171.40111.6E321 L322 D421 S422 A427 H428 L429E321-K425 PolarHBondContact O-NZ 3.33Å; L322-K425 HydrophobicContact CD2-CB 3.78Å; D421-K425 WeakPolarHBondContact O-CG 3.45Å; D421-K425 PolarHBondContact O-N 3.37Å; S422-K425 PolarHBondContact O-N 3.05Å; K425-A427 VanDerWaalsContact C-N 3.29Å; K425-A427 PolarHBondContact O-N 2.88Å; K425-H428 WeakPolarHBondContact O-CA 3.23Å; K425-H428 WeakPolarHBondContact O-CB 3.3Å; K425-H428 PolarHBondContact O-N 2.75Å; K425-L429 WeakPolarHBondContact O-CG 3.35Å; K425-L429 PolarHBondContact O-N 2.73Å
426L89.3Confident81.9Confident22 Ų2261.7 Ų61.712%0.11535%0.352CS..Hα-helixtrans-57.8-41.2178.9-177.560.3000112L322 L330 L406 M410 S422 S423 L429 L430L322-L426 HydrophobicContact CD1-CD1 4.36Å; L330-L426 HydrophobicContact CD1-CD1 3.96Å; L330-L426 HydrophobicContact CD2-CD1 4.01Å; L330-L426 HydrophobicContact CD2-CD2 3.97Å; L406-L426 HydrophobicContact CB-CD1 4.21Å; L406-L426 HydrophobicContact CD2-CD1 3.83Å; M410-L426 HydrophobicContact CG-CD2 3.83Å; S422-L426 WeakPolarHBondContact O-CB 3.37Å; S422-L426 PolarHBondContact O-N 3.17Å; S423-L426 PolarHBondContact O-N 3.29Å; L426-L429 PolarHBondContact O-N 2.89Å; L426-L430 WeakPolarHBondContact O-CB 3.26Å; L426-L430 PolarHBondContact O-N 2.7Å
427A89.3Confident84Confident43 Ų4357.9 Ų57.936%0.35532%0.32SS..Hα-helixtrans-63.7-38.2174.200000112.8S423 R424 K425 L430 N431S423-A427 WeakPolarHBondContact O-CB 3.3Å; S423-A427 PolarHBondContact O-N 2.88Å; R424-A427 PolarHBondContact O-N 2.78Å; K425-A427 VanDerWaalsContact C-N 3.29Å; K425-A427 PolarHBondContact O-N 2.88Å; A427-L430 PolarHBondContact O-N 2.75Å; A427-N431 VanDerWaalsContact O-CB 3.32Å; A427-N431 WeakPolarHBondContact O-CB 3.29Å; A427-N431 PolarHBondContact O-N 3.07Å; A427-N431 PolarHBondContact O-ND2 3.19Å
428H90.3Very high86.1Confident99 Ų9955.1 Ų55.146%0.45830%0.303SS..Hα-helixtrans-64-40.9172.4-72.4-69.1000112.3R424 K425 N431 A432R424-H428 WeakPolarHBondContact CG-NE2 3.32Å; R424-H428 PolarHBondContact O-CD2 3.32Å; R424-H428 PolarHBondContact O-N 2.74Å; K425-H428 WeakPolarHBondContact O-CA 3.23Å; K425-H428 WeakPolarHBondContact O-CB 3.3Å; K425-H428 PolarHBondContact O-N 2.75Å; H428-N431 PolarHBondContact O-N 2.82Å; H428-A432 WeakPolarHBondContact O-CB 3.46Å; H428-A432 PolarHBondContact O-N 3.43Å
429L92.6Very high88.2Confident6 Ų650.4 Ų50.43%0.03128%0.279CS..Hα-helixtrans-62-48175.1-56.1-175.4000111.5L260 L322 L406 K425 L426 N431 A432 V433L260-L429 HydrophobicContact CD1-CD2 3.52Å; L260-L429 HydrophobicContact CD2-CD2 3.57Å; L260-L429 HydrophobicContact CG-CD2 4.2Å; L322-L429 HydrophobicContact CD1-CD1 3.88Å; L322-L429 HydrophobicContact CD2-CD1 4.02Å; L322-L429 HydrophobicContact CG-CD1 4.01Å; L406-L429 HydrophobicContact CD1-CB 3.84Å; L406-L429 HydrophobicContact CD2-CB 3.99Å; L406-L429 HydrophobicContact CD2-CD1 3.83Å; L406-L429 HydrophobicContact CG-CB 4.5Å; K425-L429 WeakPolarHBondContact O-CG 3.35Å; K425-L429 PolarHBondContact O-N 2.73Å; L426-L429 PolarHBondContact O-N 2.89Å; L429-N431 VanDerWaalsContact C-N 3.33Å; L429-N431 PolarHBondContact O-N 3.07Å; L429-A432 PolarHBondContact O-N 3.34Å; L429-V433 WeakPolarHBondContact O-CG2 3.28Å; L429-V433 PolarHBondContact O-N 3.05Å
430L93.5Very high90Very high35 Ų3548 Ų4818%0.18327%0.266CS..Hα-helixtrans-64.1-38.7-179.8-176.960.5000111.7M403 L406 N407 L426 A427 T434M403-L430 HydrophobicContact CB-CD1 4.34Å; M403-L430 HydrophobicContact CE-CD1 3.98Å; M403-L430 HydrophobicContact CG-CD1 4.24Å; L406-L430 HydrophobicContact CB-CB 4.33Å; L406-L430 HydrophobicContact CB-CD1 4.11Å; N407-L430 HydrophobicContact CB-CD1 4.1Å; N407-L430 HydrophobicContact CB-CD2 4.37Å; L426-L430 WeakPolarHBondContact O-CB 3.26Å; L426-L430 PolarHBondContact O-N 2.7Å; A427-L430 PolarHBondContact O-N 2.75Å; L430-T434 WeakPolarHBondContact O-CB 3.17Å; L430-T434 PolarHBondContact O-N 2.93Å; L430-T434 PolarHBondContact O-OG1 3.33Å
431N93.3Very high91.4Very high89 Ų8945.5 Ų45.548%0.47625%0.245SC..Hα-helixtrans-63.1-47.9172.8-71.2-21000111.3A427 H428 L429 V433 T434 D435A427-N431 VanDerWaalsContact O-CB 3.32Å; A427-N431 WeakPolarHBondContact O-CB 3.29Å; A427-N431 PolarHBondContact O-N 3.07Å; A427-N431 PolarHBondContact O-ND2 3.19Å; H428-N431 PolarHBondContact O-N 2.82Å; L429-N431 VanDerWaalsContact C-N 3.33Å; L429-N431 PolarHBondContact O-N 3.07Å; N431-V433 VanDerWaalsContact C-N 3.33Å; N431-V433 PolarHBondContact O-N 3.08Å; N431-T434 CarbonylContact O-C 3.57Å; N431-T434 WeakPolarHBondContact O-CA 3.43Å; N431-T434 WeakPolarHBondContact O-CB 3.35Å; N431-T434 PolarHBondContact O-N 2.61Å; N431-D435 PolarHBondContact O-N 2.73Å
432A94.9Very high92.3Very high32 Ų3243.6 Ų43.626%0.26424%0.241SC..Hα-helixtrans-60.1-39.8179.300000112.8L268 H428 L429 A436L268-A432 HydrophobicContact CD2-CB 4.1Å; H428-A432 WeakPolarHBondContact O-CB 3.46Å; H428-A432 PolarHBondContact O-N 3.43Å; L429-A432 PolarHBondContact O-N 3.34Å; A432-A436 WeakPolarHBondContact O-CB 3.16Å; A432-A436 PolarHBondContact O-N 3.18Å
433V96.3Very high93.2Very high3 Ų349 Ų492%0.01826%0.261CS..Hα-helixtrans-69.9-32.4173.5178.40000111.9L268 C399 A402 M403 L406 L429 N431 A436 L437L268-V433 HydrophobicContact CD2-CG2 4.22Å; C399-V433 HydrophobicContact CB-CG1 4.3Å; C399-V433 WeakPolarHBondContact O-CG1 3.42Å; A402-V433 HydrophobicContact CB-CG1 3.83Å; A402-V433 HydrophobicContact CB-CG2 4.26Å; M403-V433 HydrophobicContact CG-CB 4.41Å; M403-V433 HydrophobicContact CG-CG1 3.6Å; L406-V433 HydrophobicContact CD1-CB 4.44Å; L406-V433 HydrophobicContact CD1-CG2 3.73Å; L429-V433 WeakPolarHBondContact O-CG2 3.28Å; L429-V433 PolarHBondContact O-N 3.05Å; N431-V433 VanDerWaalsContact C-N 3.33Å; N431-V433 PolarHBondContact O-N 3.08Å; V433-A436 WeakPolarHBondContact O-CB 3.45Å; V433-A436 PolarHBondContact O-N 3.19Å; V433-L437 PolarHBondContact O-N 3.5Å
434T95.8Very high93.5Very high33 Ų3347 Ų4720%0.20225%0.248CC..Hα-helixtrans-68.6-42.9174-56.30000111.5M403 L430 N431 A436 L437 V438M403-T434 WeakPolarHBondContact CE-OG1 3.35Å; L430-T434 WeakPolarHBondContact O-CB 3.17Å; L430-T434 PolarHBondContact O-N 2.93Å; L430-T434 PolarHBondContact O-OG1 3.33Å; N431-T434 CarbonylContact O-C 3.57Å; N431-T434 WeakPolarHBondContact O-CA 3.43Å; N431-T434 WeakPolarHBondContact O-CB 3.35Å; N431-T434 PolarHBondContact O-N 2.61Å; T434-A436 VanDerWaalsContact C-N 3.33Å; T434-A436 PolarHBondContact O-N 3.41Å; T434-L437 WeakPolarHBondContact O-CB 3.33Å; T434-L437 PolarHBondContact O-N 3.43Å; T434-L437 VanDerWaalsContact O-N 3.16Å; T434-V438 WeakPolarHBondContact O-CG2 3.32Å; T434-V438 PolarHBondContact O-N 3.32Å
435D95.4Very high93.7Very high96 Ų9644.8 Ų44.851%0.51326%0.261SS..Hα-helixtrans-65.5-36.3175.4-70.4-31.9000111.4N431 V438 W439N431-D435 PolarHBondContact O-N 2.73Å; D435-V438 PolarHBondContact O-N 2.7Å; D435-W439 VanDerWaalsContact O-CB 3.28Å; D435-W439 WeakPolarHBondContact O-CB 3.46Å; D435-W439 PolarHBondContact O-N 2.9Å
436A96.9Very high94Very high0 Ų043.5 Ų43.50%026%0.258CS..Hα-helixtrans-60.4-45.5168.400000112.6L268 V269 A432 V433 T434 W439 V440L268-A436 HydrophobicContact CD2-CB 4.1Å; L268-A436 HydrophobicContact CG-CB 4.46Å; V269-A436 HydrophobicContact CG2-CB 3.92Å; A432-A436 WeakPolarHBondContact O-CB 3.16Å; A432-A436 PolarHBondContact O-N 3.18Å; V433-A436 WeakPolarHBondContact O-CB 3.45Å; V433-A436 PolarHBondContact O-N 3.19Å; T434-A436 VanDerWaalsContact C-N 3.33Å; T434-A436 PolarHBondContact O-N 3.41Å; A436-W439 PolarHBondContact O-N 3.39Å; A436-V440 WeakPolarHBondContact O-CG2 3.24Å; A436-V440 PolarHBondContact O-N 2.98Å
437L97.6Very high94.3Very high0 Ų045.4 Ų45.40%027%0.273CS..Hα-helixtrans-62.1-45.8175.5-17956000111.7E396 C399 V400 M403 V433 T434 W439 V440 I441 L455 L458E396-L437 HydrophobicContact CB-CD1 4.04Å; E396-L437 HydrophobicContact CG-CD1 4.18Å; C399-L437 HydrophobicContact CB-CB 3.85Å; C399-L437 HydrophobicContact CB-CD1 4.01Å; C399-L437 HydrophobicContact CB-CG 4.39Å; V400-L437 HydrophobicContact CG2-CD2 4.39Å; M403-L437 HydrophobicContact SD-CD2 3.93Å; V433-L437 PolarHBondContact O-N 3.5Å; T434-L437 WeakPolarHBondContact O-CB 3.33Å; T434-L437 PolarHBondContact O-N 3.43Å; T434-L437 VanDerWaalsContact O-N 3.16Å; L437-W439 VanDerWaalsContact C-N 3.3Å; L437-W439 PolarHBondContact O-N 2.91Å; L437-V440 PolarHBondContact O-N 3.49Å; L437-I441 HydrophobicContact CD1-CD1 4.04Å; L437-I441 HydrophobicContact CD1-CG1 4.3Å; L437-I441 HydrophobicContact CG-CD1 3.89Å; L437-I441 VanDerWaalsContact O-CG1 3.25Å; L437-I441 WeakPolarHBondContact O-CG1 3.48Å; L437-I441 PolarHBondContact O-N 3.14Å; L437-L455 HydrophobicContact CD2-CD1 3.77Å; L437-L455 HydrophobicContact CG-CD1 4.05Å; L437-L458 HydrophobicContact CD1-CD1 3.99Å
438V96.8Very high94.4Very high59 Ų5948 Ų4836%0.35829%0.288SS..Hα-helixtrans-60-40.5175.8170.50000111.3T434 D435 I441 A442 L455T434-V438 WeakPolarHBondContact O-CG2 3.32Å; T434-V438 PolarHBondContact O-N 3.32Å; D435-V438 PolarHBondContact O-N 2.7Å; V438-I441 PolarHBondContact O-N 3.09Å; V438-A442 WeakPolarHBondContact O-CB 3.41Å; V438-A442 PolarHBondContact O-N 2.87Å; V438-L455 HydrophobicContact CG2-CD1 4.2Å; V438-L455 HydrophobicContact CG2-CD2 3.95Å
439W96.3Very high94.5Very high54 Ų5450.1 Ų50.121%0.20530%0.298CS..Hα-helixtrans-63.9-42.7175.7178.797.1000112.5P265 E266 D435 A436 L437 A442 K443P265-W439 HydrophobicContact CB-CB 3.69Å; P265-W439 HydrophobicContact CB-CD2 4.24Å; P265-W439 HydrophobicContact CB-CG 3.69Å; E266-W439 HydrophobicContact CB-CH2 3.65Å; E266-W439 HydrophobicContact CB-CZ2 3.41Å; E266-W439 VanDerWaalsContact CB-CZ2 3.41Å; E266-W439 HydrophobicContact CB-CZ3 4.36Å; E266-W439 VanDerWaalsContact CD-CH2 3.45Å; E266-W439 HydrophobicContact CG-CH2 3.49Å; E266-W439 VanDerWaalsContact CG-CH2 3.49Å; E266-W439 HydrophobicContact CG-CZ2 3.57Å; E266-W439 HydrophobicContact CG-CZ3 4.43Å; E266-W439 WeakPolarHBondContact OE1-CH2 3.45Å; E266-W439 WeakPolarHBondContact OE1-CZ2 3.08Å; E266-W439 WeakPolarHBondContact OE2-CZ2 3.44Å; D435-W439 VanDerWaalsContact O-CB 3.28Å; D435-W439 WeakPolarHBondContact O-CB 3.46Å; D435-W439 PolarHBondContact O-N 2.9Å; A436-W439 PolarHBondContact O-N 3.39Å; L437-W439 VanDerWaalsContact C-N 3.3Å; L437-W439 PolarHBondContact O-N 2.91Å; W439-A442 PolarHBondContact O-N 3.33Å; W439-K443 HydrophobicContact CD2-CG 4.08Å; W439-K443 HydrophobicContact CE3-CG 4.28Å; W439-K443 HydrophobicContact CH2-CG 4.11Å; W439-K443 HydrophobicContact CZ2-CD 4.18Å; W439-K443 HydrophobicContact CZ2-CG 3.93Å; W439-K443 HydrophobicContact CZ3-CG 4.29Å; W439-K443 WeakPolarHBondContact O-CB 3.33Å; W439-K443 VanDerWaalsContact O-CG 3.28Å; W439-K443 WeakPolarHBondContact O-CG 3.09Å; W439-K443 PolarHBondContact O-N 3.38Å
440V97.6Very high94.6Very high4 Ų454.8 Ų54.82%0.02432%0.32CS..Hα-helixtrans-62.4-44.3174.8174.30000111.2V269 K395 E396 A436 L437 A442 K443 S444V269-V440 HydrophobicContact CG1-CG2 4.29Å; V269-V440 HydrophobicContact CG2-CG2 3.79Å; K395-V440 HydrophobicContact CB-CG1 3.72Å; K395-V440 HydrophobicContact CB-CG2 3.93Å; E396-V440 HydrophobicContact CG-CG1 3.57Å; A436-V440 WeakPolarHBondContact O-CG2 3.24Å; A436-V440 PolarHBondContact O-N 2.98Å; L437-V440 PolarHBondContact O-N 3.49Å; V440-A442 PolarHBondContact O-N 3.24Å; V440-K443 PolarHBondContact O-N 3.49Å; V440-S444 PolarHBondContact O-N 3.18Å; V440-S444 PolarHBondContact O-OG 3.21Å
441I97.1Very high94.7Very high2 Ų255.6 Ų55.61%0.0132%0.323CS..Hα-helixtrans-62.3-43.8177.3-67.4165.4000110.7L437 V438 S444 I446 Q451 R454 L455 L458L437-I441 HydrophobicContact CD1-CD1 4.04Å; L437-I441 HydrophobicContact CD1-CG1 4.3Å; L437-I441 HydrophobicContact CG-CD1 3.89Å; L437-I441 VanDerWaalsContact O-CG1 3.25Å; L437-I441 WeakPolarHBondContact O-CG1 3.48Å; L437-I441 PolarHBondContact O-N 3.14Å; V438-I441 PolarHBondContact O-N 3.09Å; I441-S444 WeakPolarHBondContact O-CB 3.29Å; I441-S444 PolarHBondContact O-N 2.73Å; I441-S444 VanDerWaalsContact O-N 3.17Å; I441-I446 HydrophobicContact CG2-CD1 4.12Å; I441-Q451 HydrophobicContact CG2-CB 3.79Å; I441-Q451 HydrophobicContact CG2-CG 3.99Å; I441-R454 HydrophobicContact CG1-CG 4.47Å; I441-R454 HydrophobicContact CG2-CB 4.16Å; I441-R454 HydrophobicContact CG2-CG 4.46Å; I441-L455 HydrophobicContact CD1-CB 3.91Å; I441-L455 HydrophobicContact CD1-CD1 3.99Å; I441-L458 HydrophobicContact CD1-CD1 4.05Å; I441-L458 HydrophobicContact CG1-CD1 4.33Å
442A95.4Very high94.7Very high42 Ų4254.8 Ų54.835%0.34732%0.324SS..Hα-helixtrans-65.2-37.4176.900000112.7V438 W439 V440 S444 G445V438-A442 WeakPolarHBondContact O-CB 3.41Å; V438-A442 PolarHBondContact O-N 2.87Å; W439-A442 PolarHBondContact O-N 3.33Å; V440-A442 PolarHBondContact O-N 3.24Å; A442-S444 PolarHBondContact O-N 3.47Å; A442-G445 PolarHBondContact O-N 2.97Å
443K94.1Very high94.8Very high136 Ų13658.3 Ų58.359%0.59134%0.336SS*.Hα-helixtrans-66.2-14.7174.1-73.7-73.2-170.6165.40113.9W439 V440 G445W439-K443 HydrophobicContact CD2-CG 4.08Å; W439-K443 HydrophobicContact CE3-CG 4.28Å; W439-K443 HydrophobicContact CH2-CG 4.11Å; W439-K443 HydrophobicContact CZ2-CD 4.18Å; W439-K443 HydrophobicContact CZ2-CG 3.93Å; W439-K443 HydrophobicContact CZ3-CG 4.29Å; W439-K443 WeakPolarHBondContact O-CB 3.33Å; W439-K443 VanDerWaalsContact O-CG 3.28Å; W439-K443 WeakPolarHBondContact O-CG 3.09Å; W439-K443 PolarHBondContact O-N 3.38Å; V440-K443 PolarHBondContact O-N 3.49Å; K443-G445 PolarHBondContact O-N 3.44Å
444S89.8Confident94.8Very high38 Ų3860.5 Ų60.527%0.26634%0.344SS..THydrogen-bonded Turntrans-76.71.3175.3-60.50000114.3Q393 V440 I441 A442 I446Q393-S444 PolarHBondContact NE2-OG 2.89Å; V440-S444 PolarHBondContact O-N 3.18Å; V440-S444 PolarHBondContact O-OG 3.21Å; I441-S444 WeakPolarHBondContact O-CB 3.29Å; I441-S444 PolarHBondContact O-N 2.73Å; I441-S444 VanDerWaalsContact O-N 3.17Å; A442-S444 PolarHBondContact O-N 3.47Å; S444-I446 PolarHBondContact O-N 3.26Å
445G89.1Confident94.9Very high72 Ų7260.7 Ų60.774%0.74234%0.344SS*.THydrogen-bonded Turntrans74.14.5171.900000116A442 K443A442-G445 PolarHBondContact O-N 2.97Å; K443-G445 PolarHBondContact O-N 3.44Å
446I93.3Very high95Very high49 Ų4958.5 Ų58.525%0.25134%0.339SS..  trans-78.8154.1178.363176.9000111.9I441 S444 Q450 Q451 R454I441-I446 HydrophobicContact CG2-CD1 4.12Å; S444-I446 PolarHBondContact O-N 3.26Å; I446-Q450 HydrophobicContact CB-CB 4.04Å; I446-Q450 HydrophobicContact CD1-CB 4.08Å; I446-Q450 HydrophobicContact CG1-CB 4.27Å; I446-Q451 HydrophobicContact CD1-CG 4.29Å; I446-Q451 HydrophobicContact CG1-CG 3.76Å; I446-Q451 PolarHBondContact O-NE2 2.96Å; I446-R454 HydrophobicContact CD1-CB 4.09Å
447S94.7Very high94.9Very high61 Ų6160.5 Ų60.543%0.42735%0.35SS..  trans-65.2154.4-177.868.20000112.8Q449 Q450 Q451S447-Q449 VanDerWaalsContact C-N 3.26Å; S447-Q449 PolarHBondContact O-N 3.38Å; S447-Q449 VanDerWaalsContact O-N 3.13Å; S447-Q450 CarbonylContact O-C 3.52Å; S447-Q450 WeakPolarHBondContact O-CA 3.39Å; S447-Q450 WeakPolarHBondContact O-CB 3.46Å; S447-Q450 PolarHBondContact O-N 3.39Å; S447-Q450 VanDerWaalsContact OG-CD 3.27Å; S447-Q450 WeakPolarHBondContact OG-CG 3.47Å; S447-Q450 PolarHBondContact OG-OE1 2.91Å; S447-Q451 WeakPolarHBondContact O-CG 3.45Å; S447-Q451 PolarHBondContact O-N 2.93Å
448S91.8Very high94.9Very high97 Ų9760.5 Ų60.568%0.67835%0.35SS*.Hα-helixtrans-52.1-38.6-176.9177.50000114.1Q451 S452S448-Q451 WeakPolarHBondContact O-CB 3.39Å; S448-Q451 PolarHBondContact O-N 3.12Å; S448-S452 PolarHBondContact O-N 3.44Å
449Q92Very high94.9Very high145 Ų14560.9 Ų60.968%0.67835%0.349SS*.Hα-helixtrans-66.3-37.6174.1-176177.5-4.400112.6S447 S452 M453S447-Q449 VanDerWaalsContact C-N 3.26Å; S447-Q449 PolarHBondContact O-N 3.38Å; S447-Q449 VanDerWaalsContact O-N 3.13Å; Q449-S452 PolarHBondContact O-OG 2.93Å; Q449-S452 VanDerWaalsContact O-OG 3.08Å; Q449-M453 HydrophobicContact CG-SD 4.47Å; Q449-M453 VanDerWaalsContact O-CG 3.32Å; Q449-M453 WeakPolarHBondContact O-CG 3.22Å; Q449-M453 PolarHBondContact O-N 3.01Å
450Q94.3Very high94.9Very high104 Ų10463 Ų6349%0.48636%0.363SS..Hα-helixtrans-72.2-29.4174.5-67165.4-4800111.9I446 S447 M453 R454I446-Q450 HydrophobicContact CB-CB 4.04Å; I446-Q450 HydrophobicContact CD1-CB 4.08Å; I446-Q450 HydrophobicContact CG1-CB 4.27Å; S447-Q450 CarbonylContact O-C 3.52Å; S447-Q450 WeakPolarHBondContact O-CA 3.39Å; S447-Q450 WeakPolarHBondContact O-CB 3.46Å; S447-Q450 PolarHBondContact O-N 3.39Å; S447-Q450 VanDerWaalsContact OG-CD 3.27Å; S447-Q450 WeakPolarHBondContact OG-CG 3.47Å; S447-Q450 PolarHBondContact OG-OE1 2.91Å; Q450-M453 PolarHBondContact O-N 2.77Å; Q450-R454 VanDerWaalsContact O-CB 3.28Å; Q450-R454 WeakPolarHBondContact O-CB 3.45Å; Q450-R454 PolarHBondContact O-N 3.25Å
451Q95.6Very high94.7Very high52 Ų5262.9 Ų62.924%0.24336%0.362CS..Hα-helixtrans-63-47.6175.2-63.7173.915.900111.3I441 I446 S447 S448 R454 L455I441-Q451 HydrophobicContact CG2-CB 3.79Å; I441-Q451 HydrophobicContact CG2-CG 3.99Å; I446-Q451 HydrophobicContact CD1-CG 4.29Å; I446-Q451 HydrophobicContact CG1-CG 3.76Å; I446-Q451 PolarHBondContact O-NE2 2.96Å; S447-Q451 WeakPolarHBondContact O-CG 3.45Å; S447-Q451 PolarHBondContact O-N 2.93Å; S448-Q451 WeakPolarHBondContact O-CB 3.39Å; S448-Q451 PolarHBondContact O-N 3.12Å; Q451-R454 PolarHBondContact O-N 2.99Å; Q451-L455 WeakPolarHBondContact O-CB 3.49Å; Q451-L455 PolarHBondContact O-N 3.39Å
452S94.8Very high94.6Very high71 Ų7163.9 Ų63.950%0.49737%0.367SS..Hα-helixtrans-67.8-37.7177.561.70000112.7S448 Q449 A456S448-S452 PolarHBondContact O-N 3.44Å; Q449-S452 PolarHBondContact O-OG 2.93Å; Q449-S452 VanDerWaalsContact O-OG 3.08Å; S452-A456 WeakPolarHBondContact O-CB 3.46Å; S452-A456 PolarHBondContact O-N 3.28Å
453M95.8Very high94.6Very high106 Ų10665.3 Ų65.352%0.52237%0.374SS..Hα-helixtrans-63.8-38.6171.4-70.3178.272.100112.5Q449 Q450 N457Q449-M453 HydrophobicContact CG-SD 4.47Å; Q449-M453 VanDerWaalsContact O-CG 3.32Å; Q449-M453 WeakPolarHBondContact O-CG 3.22Å; Q449-M453 PolarHBondContact O-N 3.01Å; Q450-M453 PolarHBondContact O-N 2.77Å; M453-N457 WeakPolarHBondContact O-CB 3.47Å; M453-N457 PolarHBondContact O-N 3.11Å; M453-N457 PolarHBondContact O-ND2 3.32Å
454R97.2Very high94.6Very high49 Ų4963.3 Ų63.319%0.18537%0.367CS..Hα-helixtrans-69.2-44.3177.4-171.1165-178.590.51111.1L390 K391 E396 I441 I446 Q450 Q451 A456 N457 L458L390-R454 PolarHBondContact O-NH1 3.44Å; L390-R454 PolarHBondContact O-NH2 2.99Å; K391-R454 PolarHBondContact O-NH2 3Å; E396-R454 IonicContact OE1-CZ 3.42Å; E396-R454 IonicContact OE1-NE 2.71Å; E396-R454 PolarHBondContact OE1-NE 2.65Å; E396-R454 IonicContact OE1-NH2 3.3Å; E396-R454 PolarHBondContact OE1-NH2 3.21Å; E396-R454 IonicContact OE2-CZ 3.59Å; E396-R454 IonicContact OE2-NE 3.67Å; E396-R454 IonicContact OE2-NH2 2.7Å; E396-R454 PolarHBondContact OE2-NH2 2.88Å; I441-R454 HydrophobicContact CG1-CG 4.47Å; I441-R454 HydrophobicContact CG2-CB 4.16Å; I441-R454 HydrophobicContact CG2-CG 4.46Å; I446-R454 HydrophobicContact CD1-CB 4.09Å; Q450-R454 VanDerWaalsContact O-CB 3.28Å; Q450-R454 WeakPolarHBondContact O-CB 3.45Å; Q450-R454 PolarHBondContact O-N 3.25Å; Q451-R454 PolarHBondContact O-N 2.99Å; R454-A456 PolarHBondContact O-N 2.88Å; R454-N457 PolarHBondContact O-N 3.22Å; R454-L458 HydrophobicContact CG-CD1 4.2Å; R454-L458 HydrophobicContact CG-CG 4.49Å; R454-L458 WeakPolarHBondContact O-CG 3.04Å; R454-L458 PolarHBondContact O-N 3Å
455L97.3Very high94.9Very high38 Ų3861.5 Ų61.520%0.19936%0.355CS..Hα-helixtrans-55.5-50.4173-178.767.1000111.1L437 V438 I441 Q451 N457 L458 L459L437-L455 HydrophobicContact CD2-CD1 3.77Å; L437-L455 HydrophobicContact CG-CD1 4.05Å; V438-L455 HydrophobicContact CG2-CD1 4.2Å; V438-L455 HydrophobicContact CG2-CD2 3.95Å; I441-L455 HydrophobicContact CD1-CB 3.91Å; I441-L455 HydrophobicContact CD1-CD1 3.99Å; Q451-L455 WeakPolarHBondContact O-CB 3.49Å; Q451-L455 PolarHBondContact O-N 3.39Å; L455-N457 VanDerWaalsContact C-N 3.35Å; L455-N457 PolarHBondContact O-N 3.35Å; L455-L458 PolarHBondContact O-N 3.42Å; L455-L458 VanDerWaalsContact O-N 3.15Å; L455-L459 HydrophobicContact CD1-CD1 4.31Å; L455-L459 HydrophobicContact CD1-CG 4.3Å; L455-L459 HydrophobicContact CG-CD1 4.09Å; L455-L459 HydrophobicContact CG-CG 4.42Å; L455-L459 WeakPolarHBondContact O-CG 3.35Å; L455-L459 PolarHBondContact O-N 3.45Å
456A96.8Very high95.2Very high49 Ų4961.6 Ų61.641%0.40533%0.332SS..Hα-helixtrans-59.1-43.4178.300000112.6S452 R454 L458 L459 M460S452-A456 WeakPolarHBondContact O-CB 3.46Å; S452-A456 PolarHBondContact O-N 3.28Å; R454-A456 PolarHBondContact O-N 2.88Å; A456-L458 VanDerWaalsContact C-N 3.33Å; A456-L458 PolarHBondContact O-N 3.24Å; A456-L459 PolarHBondContact O-N 3.1Å; A456-M460 WeakPolarHBondContact O-CG 3.48Å; A456-M460 PolarHBondContact O-N 2.89Å
457N96.6Very high95.2Very high43 Ų4364.3 Ų64.323%0.2334%0.344CS..Hα-helixtrans-62.2-37.6175.6-81-58.6000113.1L390 M453 R454 L455 M460L390-N457 HydrophobicContact CD1-CB 4.34Å; L390-N457 HydrophobicContact CD2-CB 3.86Å; M453-N457 WeakPolarHBondContact O-CB 3.47Å; M453-N457 PolarHBondContact O-N 3.11Å; M453-N457 PolarHBondContact O-ND2 3.32Å; R454-N457 PolarHBondContact O-N 3.22Å; L455-N457 VanDerWaalsContact C-N 3.35Å; L455-N457 PolarHBondContact O-N 3.35Å; N457-M460 WeakPolarHBondContact OD1-CE 3.49Å
458L97.3Very high95.3Very high0 Ų061.4 Ų61.40%032%0.323CS..Hα-helixtrans-73.5-39.5178-67177.2000112.2L390 L392 E396 V400 L437 I441 R454 L455 A456 M460 L461L390-L458 HydrophobicContact CD1-CD2 4.45Å; L392-L458 HydrophobicContact CD1-CD2 3.44Å; L392-L458 VanDerWaalsContact CD1-CD2 3.44Å; E396-L458 HydrophobicContact CB-CD1 4.11Å; E396-L458 HydrophobicContact CG-CD1 4.2Å; V400-L458 HydrophobicContact CG2-CB 4.44Å; L437-L458 HydrophobicContact CD1-CD1 3.99Å; I441-L458 HydrophobicContact CD1-CD1 4.05Å; I441-L458 HydrophobicContact CG1-CD1 4.33Å; R454-L458 HydrophobicContact CG-CD1 4.2Å; R454-L458 HydrophobicContact CG-CG 4.49Å; R454-L458 WeakPolarHBondContact O-CG 3.04Å; R454-L458 PolarHBondContact O-N 3Å; L455-L458 PolarHBondContact O-N 3.42Å; L455-L458 VanDerWaalsContact O-N 3.15Å; A456-L458 VanDerWaalsContact C-N 3.33Å; A456-L458 PolarHBondContact O-N 3.24Å; L458-M460 VanDerWaalsContact C-N 3.28Å; L458-M460 PolarHBondContact O-N 2.99Å; L458-L461 HydrophobicContact CD2-CD1 3.87Å; L458-L461 VanDerWaalsContact O-CB 3.29Å; L458-L461 WeakPolarHBondContact O-CB 3.42Å; L458-L461 PolarHBondContact O-N 2.96Å
459L95.9Very high95.5Very high66 Ų6657 Ų5735%0.34629%0.292SS..Hα-helixtrans-65-32.3173.2-64.2178.5000112M403 L455 A456 L461 L462M403-L459 HydrophobicContact CE-CD2 3.6Å; M403-L459 HydrophobicContact SD-CD2 3.95Å; L455-L459 HydrophobicContact CD1-CD1 4.31Å; L455-L459 HydrophobicContact CD1-CG 4.3Å; L455-L459 HydrophobicContact CG-CD1 4.09Å; L455-L459 HydrophobicContact CG-CG 4.42Å; L455-L459 WeakPolarHBondContact O-CG 3.35Å; L455-L459 PolarHBondContact O-N 3.45Å; A456-L459 PolarHBondContact O-N 3.1Å; L459-L461 PolarHBondContact O-N 3.35Å; L459-L462 HydrophobicContact CD2-CD1 4.02Å; L459-L462 VanDerWaalsContact O-CB 3.3Å; L459-L462 WeakPolarHBondContact O-CB 3.45Å; L459-L462 WeakPolarHBondContact O-CG 3.11Å; L459-L462 PolarHBondContact O-N 3.24Å
460M95.6Very high95.5Very high99 Ų9953.1 Ų53.149%0.48828%0.277SS..Hα-helixtrans-66.6-15171.4-74.8-169.3-61.700113.9A456 N457 L458 L462 S463 H464A456-M460 WeakPolarHBondContact O-CG 3.48Å; A456-M460 PolarHBondContact O-N 2.89Å; N457-M460 WeakPolarHBondContact OD1-CE 3.49Å; L458-M460 VanDerWaalsContact C-N 3.28Å; L458-M460 PolarHBondContact O-N 2.99Å; M460-L462 VanDerWaalsContact C-N 3.28Å; M460-S463 PolarHBondContact O-OG 2.79Å; M460-H464 PolarHBondContact O-ND1 3.35Å
461L95.4Very high95.6Very high2 Ų250.7 Ų50.71%0.0126%0.264CS..Hα-helixtrans-68.7-31.1171.7-59178.5000111.5R386 F387 L390 L458 L459 S463 H464 V465R386-L461 HydrophobicContact CB-CD2 4.47Å; R386-L461 HydrophobicContact CG-CD2 3.88Å; F387-L461 HydrophobicContact CD1-CD1 3.89Å; F387-L461 HydrophobicContact CD1-CD2 4.01Å; F387-L461 HydrophobicContact CD1-CG 4.5Å; F387-L461 HydrophobicContact CE1-CB 4.24Å; F387-L461 HydrophobicContact CE1-CD1 3.79Å; F387-L461 HydrophobicContact CE1-CD2 3.94Å; F387-L461 HydrophobicContact CE1-CG 4.2Å; L390-L461 HydrophobicContact CD1-CD1 4.1Å; L390-L461 HydrophobicContact CD1-CD2 3.86Å; L390-L461 HydrophobicContact CD1-CG 4.21Å; L458-L461 HydrophobicContact CD2-CD1 3.87Å; L458-L461 VanDerWaalsContact O-CB 3.29Å; L458-L461 WeakPolarHBondContact O-CB 3.42Å; L458-L461 PolarHBondContact O-N 2.96Å; L459-L461 PolarHBondContact O-N 3.35Å; L461-S463 VanDerWaalsContact C-N 3.29Å; L461-S463 PolarHBondContact O-N 3.3Å; L461-H464 PolarHBondContact O-N 3.15Å; L461-H464 VanDerWaalsContact O-N 3.14Å; L461-V465 VanDerWaalsContact O-CG2 3.3Å; L461-V465 WeakPolarHBondContact O-CG2 3.34Å; L461-V465 PolarHBondContact O-N 3.37Å
462L94.9Very high95.5Very high22 Ų2248.3 Ų48.312%0.11525%0.254CS..Hα-helixtrans-58.8-38.1-178.4-58.8172.5000112.3V400 I404 L459 M460 R466V400-L462 HydrophobicContact CG1-CD2 3.94Å; I404-L462 HydrophobicContact CD1-CD2 4.17Å; I404-L462 HydrophobicContact CG1-CD2 3.52Å; L459-L462 HydrophobicContact CD2-CD1 4.02Å; L459-L462 VanDerWaalsContact O-CB 3.3Å; L459-L462 WeakPolarHBondContact O-CB 3.45Å; L459-L462 WeakPolarHBondContact O-CG 3.11Å; L459-L462 PolarHBondContact O-N 3.24Å; M460-L462 VanDerWaalsContact C-N 3.28Å; L462-R466 VanDerWaalsContact O-CB 3.27Å; L462-R466 WeakPolarHBondContact O-CB 3.07Å; L462-R466 PolarHBondContact O-N 3.45Å
463S94.4Very high95.4Very high72 Ų7245.4 Ų45.450%0.50323%0.233SC..Hα-helixtrans-71.5-34.817855.90000113.1M460 L461 H467M460-S463 PolarHBondContact O-OG 2.79Å; L461-S463 VanDerWaalsContact C-N 3.29Å; L461-S463 PolarHBondContact O-N 3.3Å; S463-H467 WeakPolarHBondContact O-CB 3.38Å; S463-H467 PolarHBondContact O-N 2.86Å
464H93.9Very high95.3Very high95 Ų9545.7 Ų45.744%0.4423%0.233SC..Hα-helixtrans-69.5-44.5175.7-64.382.3000110.8T383 M460 L461 R466 H467 A468T383-H464 HydrophobicContact CG2-CB 3.92Å; M460-H464 PolarHBondContact O-ND1 3.35Å; L461-H464 PolarHBondContact O-N 3.15Å; L461-H464 VanDerWaalsContact O-N 3.14Å; H464-R466 PolarHBondContact O-N 3.06Å; H464-H467 PolarHBondContact O-N 2.94Å; H464-A468 PolarHBondContact O-N 3.45Å
465V96.1Very high95Very high0 Ų044.5 Ų44.50%023%0.229CC..Hα-helixtrans-58.5-47.6173.3179.60000110.4E337 V341 M344 F387 I404 L461 H467 A468 S469E337-V465 HydrophobicContact CB-CG1 3.72Å; E337-V465 HydrophobicContact CG-CG1 4.07Å; V341-V465 HydrophobicContact CB-CG1 4.32Å; V341-V465 HydrophobicContact CG2-CG2 4.24Å; M344-V465 HydrophobicContact CE-CB 4.48Å; M344-V465 HydrophobicContact CE-CG1 4.43Å; M344-V465 HydrophobicContact CE-CG2 3.8Å; F387-V465 HydrophobicContact CZ-CG2 4.49Å; I404-V465 HydrophobicContact CD1-CG1 4.04Å; L461-V465 VanDerWaalsContact O-CG2 3.3Å; L461-V465 WeakPolarHBondContact O-CG2 3.34Å; L461-V465 PolarHBondContact O-N 3.37Å; V465-H467 VanDerWaalsContact C-N 3.33Å; V465-H467 PolarHBondContact O-N 2.9Å; V465-A468 PolarHBondContact O-N 2.81Å; V465-S469 WeakPolarHBondContact O-CB 3.29Å; V465-S469 PolarHBondContact O-N 2.9Å; V465-S469 PolarHBondContact O-OG 2.93Å
466R94.9Very high94.8Very high74 Ų7443.7 Ų43.728%0.27923%0.225SC..Hα-helixtrans-60-38.1176.7-179.963.160.7146.21.8113.3E337 L462 H464 S469 N470E337-R466 IonicContact OE1-CZ 3.56Å; E337-R466 IonicContact OE1-NE 3.63Å; E337-R466 PolarHBondContact OE1-NE 3.29Å; E337-R466 IonicContact OE1-NH1 3.26Å; E337-R466 IonicContact OE1-NH2 2.73Å; E337-R466 PolarHBondContact OE1-NH2 3.42Å; E337-R466 IonicContact OE2-CZ 2.74Å; E337-R466 IonicContact OE2-NE 3.88Å; E337-R466 PolarHBondContact OE2-NE 3.26Å; E337-R466 IonicContact OE2-NH2 2.76Å; E337-R466 PolarHBondContact OE2-NH2 2.73Å; L462-R466 VanDerWaalsContact O-CB 3.27Å; L462-R466 WeakPolarHBondContact O-CB 3.07Å; L462-R466 PolarHBondContact O-N 3.45Å; H464-R466 PolarHBondContact O-N 3.06Å; R466-S469 WeakPolarHBondContact CA-OG 3.48Å; R466-S469 PolarHBondContact O-OG 3.32Å; R466-N470 WeakPolarHBondContact O-CB 3.48Å; R466-N470 PolarHBondContact O-N 2.74Å; R466-N470 VanDerWaalsContact O-N 3.11Å; R466-N470 PolarHBondContact O-OD1 3.38Å
467H94.9Very high94.4Very high105 Ų10543.4 Ų43.449%0.48622%0.216SC..Hα-helixtrans-68.7-49.1179.3-17549.9000111.1S463 H464 V465 S469 N470 K471S463-H467 WeakPolarHBondContact O-CB 3.38Å; S463-H467 PolarHBondContact O-N 2.86Å; H464-H467 PolarHBondContact O-N 2.94Å; V465-H467 VanDerWaalsContact C-N 3.33Å; V465-H467 PolarHBondContact O-N 2.9Å; H467-S469 VanDerWaalsContact C-N 3.33Å; H467-S469 PolarHBondContact O-N 2.78Å; H467-N470 PolarHBondContact O-N 2.88Å; H467-K471 PolarHBondContact O-N 3.46Å
468A95.8Very high94.1Very high0 Ų044 Ų440%022%0.224CC..Hα-helixtrans-60.4-42.1175.400000111.7M340 M379 H464 V465 N470 K471 G472M340-A468 VanDerWaalsContact CE-O 3.22Å; M340-A468 WeakPolarHBondContact CE-O 3.43Å; M340-A468 HydrophobicContact SD-CB 3.65Å; M379-A468 HydrophobicContact CB-CB 4.35Å; H464-A468 PolarHBondContact O-N 3.45Å; V465-A468 PolarHBondContact O-N 2.81Å; A468-N470 PolarHBondContact O-N 3.22Å; A468-K471 PolarHBondContact O-N 3.35Å; A468-G472 PolarHBondContact O-N 3.38Å
469S95.3Very high93.6Very high4 Ų444.3 Ų44.33%0.02823%0.225CC..Hα-helixtrans-65.1-39.3-179.469.40000112.9E337 M340 V465 R466 H467 G472 M473E337-S469 WeakPolarHBondContact CG-OG 3.49Å; M340-S469 VanDerWaalsContact SD-CA 3.58Å; M340-S469 PolarHBondContact SD-N 3.31Å; M340-S469 VanDerWaalsContact SD-N 3.42Å; V465-S469 WeakPolarHBondContact O-CB 3.29Å; V465-S469 PolarHBondContact O-N 2.9Å; V465-S469 PolarHBondContact O-OG 2.93Å; R466-S469 WeakPolarHBondContact CA-OG 3.48Å; R466-S469 PolarHBondContact O-OG 3.32Å; H467-S469 VanDerWaalsContact C-N 3.33Å; H467-S469 PolarHBondContact O-N 2.78Å; S469-G472 PolarHBondContact O-N 3.13Å; S469-M473 WeakPolarHBondContact O-CB 3.3Å; S469-M473 PolarHBondContact O-N 2.98Å
470N93.6Very high93Very high65 Ų6544.2 Ų44.235%0.34822%0.222SC..Hα-helixtrans-64-46.2176.3-71.9-1000110.7R466 H467 A468 G472 M473 E474R466-N470 WeakPolarHBondContact O-CB 3.48Å; R466-N470 PolarHBondContact O-N 2.74Å; R466-N470 VanDerWaalsContact O-N 3.11Å; R466-N470 PolarHBondContact O-OD1 3.38Å; H467-N470 PolarHBondContact O-N 2.88Å; A468-N470 PolarHBondContact O-N 3.22Å; N470-G472 VanDerWaalsContact C-N 3.34Å; N470-G472 PolarHBondContact O-N 3.16Å; N470-M473 VanDerWaalsContact O-CB 3.28Å; N470-M473 WeakPolarHBondContact O-CB 3.2Å; N470-M473 PolarHBondContact O-N 3.37Å; N470-M473 VanDerWaalsContact O-N 3.12Å; N470-E474 WeakPolarHBondContact O-CG 3.18Å; N470-E474 PolarHBondContact O-N 2.75Å
471K95Very high92.5Very high52 Ų5244.4 Ų44.423%0.22623%0.232CC..Hα-helixtrans-61.6-39.6175.1-80.9-84-167.9166.60112.8E375 I376 M379 H467 A468 E474 H475E375-K471 WeakPolarHBondContact OE1-CE 3.48Å; E375-K471 IonicContact OE1-NZ 2.62Å; E375-K471 PolarHBondContact OE1-NZ 3.46Å; E375-K471 IonicContact OE2-NZ 3.17Å; E375-K471 PolarHBondContact OE2-NZ 3.42Å; I376-K471 HydrophobicContact CG1-CB 4.12Å; M379-K471 HydrophobicContact CE-CB 3.54Å; M379-K471 HydrophobicContact CE-CD 4.27Å; M379-K471 HydrophobicContact CE-CG 3.68Å; M379-K471 HydrophobicContact SD-CG 4.35Å; H467-K471 PolarHBondContact O-N 3.46Å; A468-K471 PolarHBondContact O-N 3.35Å; K471-E474 PolarHBondContact O-N 3.34Å; K471-H475 WeakPolarHBondContact O-CB 3.22Å; K471-H475 PolarHBondContact O-N 3.43Å
472G94.7Very high92Very high2 Ų248.8 Ų48.82%0.02125%0.251CS..Hα-helixtrans-62.4-39.3171.500000113.3A468 S469 N470 L476A468-G472 PolarHBondContact O-N 3.38Å; S469-G472 PolarHBondContact O-N 3.13Å; N470-G472 VanDerWaalsContact C-N 3.34Å; N470-G472 PolarHBondContact O-N 3.16Å; G472-L476 WeakPolarHBondContact O-CB 3.34Å; G472-L476 WeakPolarHBondContact O-CG 3.23Å; G472-L476 PolarHBondContact O-N 3.18Å
473M92.3Very high91.3Very high11 Ų1154.6 Ų54.65%0.05428%0.282CS..Hα-helixtrans-63.6-48.2174.5-164.575.66200111.4W335 M336 S469 N470 H475 L476 L477 L495 H498W335-M473 HydrophobicContact CH2-CE 4.48Å; W335-M473 HydrophobicContact CH2-SD 4.36Å; W335-M473 HydrophobicContact CZ2-CE 3.66Å; W335-M473 HydrophobicContact CZ2-SD 3.56Å; W335-M473 VanDerWaalsContact CZ2-SD 3.56Å; M336-M473 HydrophobicContact CB-CE 3.77Å; M336-M473 HydrophobicContact CG-CE 4.47Å; S469-M473 WeakPolarHBondContact O-CB 3.3Å; S469-M473 PolarHBondContact O-N 2.98Å; N470-M473 VanDerWaalsContact O-CB 3.28Å; N470-M473 WeakPolarHBondContact O-CB 3.2Å; N470-M473 PolarHBondContact O-N 3.37Å; N470-M473 VanDerWaalsContact O-N 3.12Å; M473-H475 VanDerWaalsContact C-N 3.34Å; M473-H475 PolarHBondContact O-N 3.01Å; M473-L476 PolarHBondContact O-N 3.44Å; M473-L477 HydrophobicContact CG-CD1 4.38Å; M473-L477 WeakPolarHBondContact O-CB 3.49Å; M473-L477 VanDerWaalsContact O-CG 3.31Å; M473-L477 WeakPolarHBondContact O-CG 3.38Å; M473-L477 PolarHBondContact O-N 3.43Å; M473-L495 HydrophobicContact CG-CD1 4.28Å; M473-L495 HydrophobicContact SD-CD1 3.53Å; M473-L495 VanDerWaalsContact SD-CD1 3.53Å; M473-H498 VanDerWaalsContact CE-CD2 3.49Å; M473-H498 WeakPolarHBondContact CE-CD2 3.12Å; M473-H498 WeakPolarHBondContact CE-NE2 3.32Å; M473-H498 HydrophobicContact CG-CB 4.4Å; M473-H498 HydrophobicContact SD-CB 4.29Å
474E92.4Very high90.4Very high112 Ų11253 Ų5352%0.52327%0.27SS..Hα-helixtrans-58.4-43.7177.5-71.9165.3-174.800111.7N470 K471 L477 S478N470-E474 WeakPolarHBondContact O-CG 3.18Å; N470-E474 PolarHBondContact O-N 2.75Å; K471-E474 PolarHBondContact O-N 3.34Å; E474-L477 PolarHBondContact O-N 2.91Å; E474-S478 WeakPolarHBondContact O-CB 3.21Å; E474-S478 PolarHBondContact O-N 3.38Å
475H92.9Very high89.3Confident24 Ų2449.1 Ų49.111%0.11125%0.253CS..Hα-helixtrans-65.5-46.2175.717772.6000112.3E371 I376 K471 M473 L477 S478 M479E371-H475 PolarHBondContact O-CE1 2.83Å; I376-H475 HydrophobicContact CD1-CB 3.53Å; K471-H475 WeakPolarHBondContact O-CB 3.22Å; K471-H475 PolarHBondContact O-N 3.43Å; M473-H475 VanDerWaalsContact C-N 3.34Å; M473-H475 PolarHBondContact O-N 3.01Å; H475-L477 VanDerWaalsContact C-N 3.32Å; H475-L477 PolarHBondContact O-N 3.44Å; H475-S478 WeakPolarHBondContact O-CB 3.43Å; H475-S478 PolarHBondContact O-N 3.18Å; H475-S478 VanDerWaalsContact O-N 3.17Å; H475-M479 WeakPolarHBondContact O-CG 3.28Å; H475-M479 PolarHBondContact O-N 2.97Å
476L91.6Very high88.1Confident21 Ų2153.1 Ų53.111%0.1128%0.278CS..Hα-helixtrans-61.4-38.3175.9-75.7174.4000112.5M295 T299 W335 M336 G472 M473 K480 L495M295-L476 HydrophobicContact CE-CD2 3.83Å; T299-L476 HydrophobicContact CG2-CD2 4.3Å; W335-L476 HydrophobicContact CH2-CD1 3.98Å; M336-L476 HydrophobicContact CE-CD1 3.64Å; M336-L476 HydrophobicContact CE-CG 4.48Å; M336-L476 HydrophobicContact SD-CD1 4.23Å; G472-L476 WeakPolarHBondContact O-CB 3.34Å; G472-L476 WeakPolarHBondContact O-CG 3.23Å; G472-L476 PolarHBondContact O-N 3.18Å; M473-L476 PolarHBondContact O-N 3.44Å; L476-K480 WeakPolarHBondContact O-CB 3.42Å; L476-K480 PolarHBondContact O-N 3.4Å; L476-L495 HydrophobicContact CB-CD1 4.2Å
477L89.3Confident87.3Confident43 Ų4350.9 Ų50.923%0.22527%0.273CS..Hα-helixtrans-62.4-45.5172.6-73.1171.6000111.7M473 E474 H475 K480 C481 L495 V499M473-L477 HydrophobicContact CG-CD1 4.38Å; M473-L477 WeakPolarHBondContact O-CB 3.49Å; M473-L477 VanDerWaalsContact O-CG 3.31Å; M473-L477 WeakPolarHBondContact O-CG 3.38Å; M473-L477 PolarHBondContact O-N 3.43Å; E474-L477 PolarHBondContact O-N 2.91Å; H475-L477 VanDerWaalsContact C-N 3.32Å; H475-L477 PolarHBondContact O-N 3.44Å; L477-K480 PolarHBondContact O-N 3.46Å; L477-C481 PolarHBondContact O-N 3.39Å; L477-C481 PolarHBondContact O-SG 2.97Å; L477-C481 VanDerWaalsContact O-SG 3.4Å; L477-L495 HydrophobicContact CD2-CD1 3.63Å; L477-L495 HydrophobicContact CD2-CD2 4.21Å; L477-L495 HydrophobicContact CD2-CG 3.65Å; L477-L495 HydrophobicContact CG-CD1 3.74Å; L477-L495 HydrophobicContact CG-CG 4.32Å; L477-V499 HydrophobicContact CD1-CG2 4.03Å; L477-V499 HydrophobicContact CD2-CG2 3.43Å; L477-V499 VanDerWaalsContact CD2-CG2 3.43Å; L477-V499 HydrophobicContact CG-CG2 4.4Å
478S89.1Confident86.5Confident56 Ų5650 Ų5039%0.39227%0.266SS..Hα-helixtrans-60.6-47.1177-171.60000111.9E474 H475 K480 C481 K482E474-S478 WeakPolarHBondContact O-CB 3.21Å; E474-S478 PolarHBondContact O-N 3.38Å; H475-S478 WeakPolarHBondContact O-CB 3.43Å; H475-S478 PolarHBondContact O-N 3.18Å; H475-S478 VanDerWaalsContact O-N 3.17Å; S478-K480 PolarHBondContact O-N 2.89Å; S478-C481 PolarHBondContact O-N 2.91Å; S478-K482 WeakPolarHBondContact O-CG 3.35Å; S478-K482 PolarHBondContact O-N 3.17Å
479M86.6Confident86Confident5 Ų556.2 Ų56.23%0.02530%0.299CS..Hα-helixtrans-68.7-31.5-179.7-62.5-55-77.900113E291 M295 V370 H475 K482 N483 V484E291-M479 HydrophobicContact CG-CE 3.76Å; E291-M479 WeakPolarHBondContact OE1-CE 3.42Å; M295-M479 HydrophobicContact CE-CB 4.41Å; M295-M479 HydrophobicContact CE-CG 4.19Å; M295-M479 HydrophobicContact CG-CE 4.27Å; V370-M479 HydrophobicContact CG1-CE 4.21Å; H475-M479 WeakPolarHBondContact O-CG 3.28Å; H475-M479 PolarHBondContact O-N 2.97Å; M479-K482 HydrophobicContact SD-CD 3.92Å; M479-N483 PolarHBondContact O-N 3.4Å; M479-V484 HydrophobicContact CE-CB 3.87Å; M479-V484 HydrophobicContact CE-CG1 3.8Å; M479-V484 HydrophobicContact CE-CG2 3.74Å; M479-V484 PolarHBondContact O-N 2.93Å; M479-V484 HydrophobicContact SD-CG2 4.45Å
480K84.8Confident85.7Confident64 Ų6458 Ų5828%0.27831%0.308SS..Hα-helixtrans-63-50.2167.2178.6-167.5169.3-164.90110.9L476 L477 S478 K482 N483 V487 L492 L495 N496L476-K480 WeakPolarHBondContact O-CB 3.42Å; L476-K480 PolarHBondContact O-N 3.4Å; L477-K480 PolarHBondContact O-N 3.46Å; S478-K480 PolarHBondContact O-N 2.89Å; K480-K482 VanDerWaalsContact C-N 3.28Å; K480-K482 PolarHBondContact O-N 2.86Å; K480-N483 WeakPolarHBondContact O-CA 3.35Å; K480-N483 PolarHBondContact O-N 3.36Å; K480-V487 HydrophobicContact CB-CG2 4.11Å; K480-V487 HydrophobicContact CD-CG2 4.48Å; K480-V487 HydrophobicContact CG-CG2 4.05Å; K480-L492 HydrophobicContact CD-CD1 4.04Å; K480-L492 VanDerWaalsContact CE-CD1 3.43Å; K480-L495 HydrophobicContact CD-CD2 3.97Å; K480-N496 PolarHBondContact NZ-OD1 3.29Å
481C85.2Confident85.5Confident104 Ų10455 Ų5570%0.70329%0.292SS*.Hα-helixtrans-64.8-29.7-179.8-72.50000113.4L477 S478 N483L477-C481 PolarHBondContact O-N 3.39Å; L477-C481 PolarHBondContact O-SG 2.97Å; L477-C481 VanDerWaalsContact O-SG 3.4Å; S478-C481 PolarHBondContact O-N 2.91Å; C481-N483 PolarHBondContact O-N 3.44Å
482K84.1Confident85.1Confident93 Ų9354.8 Ų54.840%0.40429%0.293SS..THydrogen-bonded Turntrans-74.1-5.3169.5-70.1177173.8179.10114E371 S478 M479 K480 V484E371-K482 IonicContact OE2-NZ 2.61Å; E371-K482 PolarHBondContact OE2-NZ 3.31Å; S478-K482 WeakPolarHBondContact O-CG 3.35Å; S478-K482 PolarHBondContact O-N 3.17Å; M479-K482 HydrophobicContact SD-CD 3.92Å; K480-K482 VanDerWaalsContact C-N 3.28Å; K480-K482 PolarHBondContact O-N 2.86Å; K482-V484 HydrophobicContact CB-CG2 3.53Å; K482-V484 HydrophobicContact CD-CG2 4.24Å; K482-V484 PolarHBondContact O-N 3.25Å
483N80.4Confident84.8Confident145 Ų14561 Ų6178%0.77532%0.322SS*.THydrogen-bonded Turntrans54.828-173.6-65.4-60.5000115M479 K480 C481 V485M479-N483 PolarHBondContact O-N 3.4Å; K480-N483 WeakPolarHBondContact O-CA 3.35Å; K480-N483 PolarHBondContact O-N 3.36Å; C481-N483 PolarHBondContact O-N 3.44Å; N483-V485 VanDerWaalsContact C-N 3.34Å; N483-V485 PolarHBondContact O-N 2.97Å
484V74.8Confident84.8Confident39 Ų3961.2 Ų61.224%0.23632%0.323CS..  trans-71.8-29.9-174.3-176.80000112E291 A292 M479 K482E291-V484 HydrophobicContact CG-CG1 4.2Å; A292-V484 HydrophobicContact CB-CG1 4.32Å; M479-V484 HydrophobicContact CE-CB 3.87Å; M479-V484 HydrophobicContact CE-CG1 3.8Å; M479-V484 HydrophobicContact CE-CG2 3.74Å; M479-V484 PolarHBondContact O-N 2.93Å; M479-V484 HydrophobicContact SD-CG2 4.45Å; K482-V484 HydrophobicContact CB-CG2 3.53Å; K482-V484 HydrophobicContact CD-CG2 4.24Å; K482-V484 PolarHBondContact O-N 3.25Å
485V70.9Confident84.6Confident13 Ų1356 Ų568%0.07930%0.298CS..SBendtrans-145.5137.2-176.11740000110.8M295 M296 T299 N483 V487M295-V485 HydrophobicContact CB-CB 4.47Å; M295-V485 HydrophobicContact CB-CG2 3.48Å; M295-V485 VanDerWaalsContact CB-CG2 3.48Å; M296-V485 HydrophobicContact CB-CG1 4.28Å; M296-V485 HydrophobicContact SD-CG1 4.23Å; T299-V485 HydrophobicContact CG2-CG1 3.91Å; T299-V485 WeakPolarHBondContact OG1-CG1 3.24Å; N483-V485 VanDerWaalsContact C-N 3.34Å; N483-V485 PolarHBondContact O-N 2.97Å; V485-V487 PolarHBondContact O-N 3.11Å
486P72.5Confident84.1Confident83 Ų8357.4 Ų57.454%0.53931%0.307SS..PPolyproline II helixtrans-65129169.928.3-35000110.9M296M296-P486 HydrophobicContact CE-CG 3.74Å; M296-P486 HydrophobicContact SD-CG 3.91Å
487V76.2Confident83.6Confident27 Ų2756.9 Ų56.916%0.16431%0.306CS..PPolyproline II helixtrans-93.6118.6173.2-168.90000107.9K480 V485 L491 L492 L495K480-V487 HydrophobicContact CB-CG2 4.11Å; K480-V487 HydrophobicContact CD-CG2 4.48Å; K480-V487 HydrophobicContact CG-CG2 4.05Å; V485-V487 PolarHBondContact O-N 3.11Å; V487-L491 HydrophobicContact CG1-CB 3.91Å; V487-L491 HydrophobicContact CG1-CD2 3.86Å; V487-L491 HydrophobicContact CG1-CG 3.64Å; V487-L492 HydrophobicContact CB-CB 4.18Å; V487-L492 HydrophobicContact CB-CD1 4.41Å; V487-L492 HydrophobicContact CG1-CB 3.81Å; V487-L495 HydrophobicContact CG1-CD2 4.34Å
488Y79.8Confident82.7Confident86 Ų8657 Ų5734%0.33731%0.305SS..PPolyproline II helixtrans-59.3149.2177-62.9-83.4000111.9K300 D303 L490 L491 L492K300-Y488 HydrophobicContact CB-CE2 3.69Å; K300-Y488 HydrophobicContact CG-CE2 4.29Å; D303-Y488 HydrophobicContact CB-CD2 3.98Å; D303-Y488 HydrophobicContact CB-CG 4.21Å; D303-Y488 VanDerWaalsContact OD1-CB 3.29Å; D303-Y488 WeakPolarHBondContact OD1-CB 3.48Å; Y488-L490 VanDerWaalsContact C-N 3.34Å; Y488-L490 PolarHBondContact O-N 2.92Å; Y488-L491 CarbonylContact O-C 3.53Å; Y488-L491 PolarHBondContact O-N 3.22Å; Y488-L492 VanDerWaalsContact O-CB 3.28Å; Y488-L492 WeakPolarHBondContact O-CB 3.31Å; Y488-L492 PolarHBondContact O-N 3.16Å
489D83.9Confident81.5Confident132 Ų13257 Ų5771%0.70630%0.303SS*.Hα-helixtrans-49.3-48-169.5-54.9-26.9000113.7L492 E493D489-L492 WeakPolarHBondContact O-CB 3.47Å; D489-L492 PolarHBondContact O-N 3.07Å; D489-E493 WeakPolarHBondContact O-CG 3.48Å; D489-E493 PolarHBondContact O-N 3.46Å
490L88.8Confident80.1Confident40 Ų4062.4 Ų62.421%0.20933%0.331CS..Hα-helixtrans-66.7-48.3179.217662.4000112L306 V307 I310 Y488 L492 E493 M494L306-L490 HydrophobicContact CB-CD2 3.87Å; L306-L490 HydrophobicContact CB-CG 4.37Å; L306-L490 HydrophobicContact CD1-CG 4.41Å; V307-L490 HydrophobicContact CG2-CD2 3.71Å; I310-L490 HydrophobicContact CD1-CD1 4.01Å; I310-L490 HydrophobicContact CD1-CD2 3.92Å; Y488-L490 VanDerWaalsContact C-N 3.34Å; Y488-L490 PolarHBondContact O-N 2.92Å; L490-L492 PolarHBondContact O-N 3.11Å; L490-E493 PolarHBondContact O-N 3.35Å; L490-M494 HydrophobicContact CD1-CG 4.12Å; L490-M494 WeakPolarHBondContact O-CB 3.47Å; L490-M494 WeakPolarHBondContact O-CG 3.12Å; L490-M494 PolarHBondContact O-N 2.77Å
491L89.4Confident78.7Confident2 Ų263.1 Ų63.11%0.0133%0.332CS..Hα-helixtrans-60.1-34.1175.1-178.562.7000111.5T299 A302 D303 L306 W335 V487 Y488 L495T299-L491 HydrophobicContact CG2-CD2 4.05Å; A302-L491 HydrophobicContact CB-CD1 4.02Å; A302-L491 HydrophobicContact CB-CD2 4.19Å; D303-L491 HydrophobicContact CB-CB 4.44Å; L306-L491 HydrophobicContact CD1-CB 4.05Å; L306-L491 HydrophobicContact CD1-CD1 3.65Å; L306-L491 HydrophobicContact CD1-CG 4.46Å; W335-L491 HydrophobicContact CE3-CD1 4.49Å; W335-L491 HydrophobicContact CH2-CD1 3.51Å; W335-L491 HydrophobicContact CZ2-CD1 4.3Å; W335-L491 HydrophobicContact CZ3-CD1 3.62Å; V487-L491 HydrophobicContact CG1-CB 3.91Å; V487-L491 HydrophobicContact CG1-CD2 3.86Å; V487-L491 HydrophobicContact CG1-CG 3.64Å; Y488-L491 CarbonylContact O-C 3.53Å; Y488-L491 PolarHBondContact O-N 3.22Å; L491-L495 WeakPolarHBondContact O-CB 3.49Å; L491-L495 PolarHBondContact O-N 3.47Å
492L88.1Confident76.8Confident48 Ų4859.9 Ų59.925%0.25132%0.316SS..Hα-helixtrans-71.2-44.1179177.158.6000111.9K480 V487 Y488 D489 L490 L495 N496K480-L492 HydrophobicContact CD-CD1 4.04Å; K480-L492 VanDerWaalsContact CE-CD1 3.43Å; V487-L492 HydrophobicContact CB-CB 4.18Å; V487-L492 HydrophobicContact CB-CD1 4.41Å; V487-L492 HydrophobicContact CG1-CB 3.81Å; Y488-L492 VanDerWaalsContact O-CB 3.28Å; Y488-L492 WeakPolarHBondContact O-CB 3.31Å; Y488-L492 PolarHBondContact O-N 3.16Å; D489-L492 WeakPolarHBondContact O-CB 3.47Å; D489-L492 PolarHBondContact O-N 3.07Å; L490-L492 PolarHBondContact O-N 3.11Å; L492-L495 PolarHBondContact O-N 3.1Å; L492-N496 VanDerWaalsContact O-CB 3.3Å; L492-N496 WeakPolarHBondContact O-CB 3.36Å; L492-N496 PolarHBondContact O-N 3.13Å; L492-N496 PolarHBondContact O-ND2 2.86Å; L492-N496 VanDerWaalsContact O-ND2 3.15Å; L492-N496 PolarHBondContact O-OD1 3.42Å
493E88.6Confident74.3Confident133 Ų13358.1 Ų58.162%0.62132%0.315SS*.Hα-helixtrans-57.7-51.1171.9-75.6179.2176.500111.2D489 L490 L495 N496 A497D489-E493 WeakPolarHBondContact O-CG 3.48Å; D489-E493 PolarHBondContact O-N 3.46Å; L490-E493 PolarHBondContact O-N 3.35Å; E493-L495 VanDerWaalsContact C-N 3.28Å; E493-L495 PolarHBondContact O-N 3.17Å; E493-N496 PolarHBondContact O-N 3.04Å; E493-A497 WeakPolarHBondContact O-CB 3.18Å; E493-A497 PolarHBondContact O-N 2.74Å
494M91.1Very high72.2Confident15 Ų1558.5 Ų58.57%0.07431%0.31CS..Hα-helixtrans-64.6-30.2-178.3-63.5-69.6-74.800112.9L306 L331 E332 W335 L490L306-M494 HydrophobicContact CD1-CB 4.48Å; L306-M494 HydrophobicContact CD1-CG 4.34Å; L306-M494 HydrophobicContact CD2-CE 3.99Å; L306-M494 HydrophobicContact CD2-CG 4.4Å; L331-M494 VanDerWaalsContact C-CE 3.47Å; L331-M494 HydrophobicContact CB-CE 4.11Å; L331-M494 WeakPolarHBondContact O-CE 3.36Å; E332-M494 HydrophobicContact CG-SD 4.4Å; W335-M494 HydrophobicContact CB-CE 3.66Å; W335-M494 HydrophobicContact CD2-CB 4.37Å; W335-M494 HydrophobicContact CG-CB 4.38Å; W335-M494 HydrophobicContact CG-CE 3.76Å; W335-M494 PolarHBondContact NE1-O 2.67Å; L490-M494 HydrophobicContact CD1-CG 4.12Å; L490-M494 WeakPolarHBondContact O-CB 3.47Å; L490-M494 WeakPolarHBondContact O-CG 3.12Å; L490-M494 PolarHBondContact O-N 2.77Å
495L87.5Confident70.2Confident2 Ų261.6 Ų61.61%0.0133%0.333CS..Hα-helixtrans-76-43.7173.6-175.762.2000111.8W335 M473 L476 L477 K480 V487 L491 L492 E493 A497 H498W335-L495 HydrophobicContact CZ2-CB 4.49Å; W335-L495 HydrophobicContact CZ2-CD1 4.47Å; M473-L495 HydrophobicContact CG-CD1 4.28Å; M473-L495 HydrophobicContact SD-CD1 3.53Å; M473-L495 VanDerWaalsContact SD-CD1 3.53Å; L476-L495 HydrophobicContact CB-CD1 4.2Å; L477-L495 HydrophobicContact CD2-CD1 3.63Å; L477-L495 HydrophobicContact CD2-CD2 4.21Å; L477-L495 HydrophobicContact CD2-CG 3.65Å; L477-L495 HydrophobicContact CG-CD1 3.74Å; L477-L495 HydrophobicContact CG-CG 4.32Å; K480-L495 HydrophobicContact CD-CD2 3.97Å; V487-L495 HydrophobicContact CG1-CD2 4.34Å; L491-L495 WeakPolarHBondContact O-CB 3.49Å; L491-L495 PolarHBondContact O-N 3.47Å; L492-L495 PolarHBondContact O-N 3.1Å; E493-L495 VanDerWaalsContact C-N 3.28Å; E493-L495 PolarHBondContact O-N 3.17Å; L495-A497 VanDerWaalsContact C-N 3.33Å; L495-A497 PolarHBondContact O-N 2.75Å; L495-H498 PolarHBondContact O-N 2.75Å
496N83.9Confident68.2Low54 Ų5464.3 Ų64.329%0.28935%0.353SS..Hα-helixtrans-65.8-33.9178.4-68.4-20.7000112.4K480 L492 E493 H498 V499 L500K480-N496 PolarHBondContact NZ-OD1 3.29Å; L492-N496 VanDerWaalsContact O-CB 3.3Å; L492-N496 WeakPolarHBondContact O-CB 3.36Å; L492-N496 PolarHBondContact O-N 3.13Å; L492-N496 PolarHBondContact O-ND2 2.86Å; L492-N496 VanDerWaalsContact O-ND2 3.15Å; L492-N496 PolarHBondContact O-OD1 3.42Å; E493-N496 PolarHBondContact O-N 3.04Å; N496-H498 PolarHBondContact O-N 3.33Å; N496-V499 PolarHBondContact O-N 3.35Å; N496-L500 PolarHBondContact O-N 3.36Å; N496-L500 VanDerWaalsContact O-N 3.13Å
497A81.4Confident66.3Low11 Ų1166.1 Ų66.19%0.09136%0.356CS..Hα-helixtrans-57.9-31.7177.300000113.2E332 E493 L495 R501E332-A497 HydrophobicContact CB-CB 4.05Å; E332-A497 HydrophobicContact CG-CB 3.68Å; E493-A497 WeakPolarHBondContact O-CB 3.18Å; E493-A497 PolarHBondContact O-N 2.74Å; L495-A497 VanDerWaalsContact C-N 3.33Å; L495-A497 PolarHBondContact O-N 2.75Å; A497-R501 WeakPolarHBondContact O-CD 3.41Å; A497-R501 VanDerWaalsContact O-CG 3.29Å; A497-R501 WeakPolarHBondContact O-CG 3.37Å
498H68.9Low64.1Low44 Ų4471.8 Ų71.820%0.20439%0.392CS..Hα-helixtrans-73.2-41.7172.8-89.8-96.2000112.5E332 W335 M473 L495 N496 L500 R501 G502E332-H498 PolarHBondContact O-CD2 2.89Å; E332-H498 PolarHBondContact O-NE2 2.68Å; W335-H498 AromaticContact NE1-CD2 3.92Å; M473-H498 VanDerWaalsContact CE-CD2 3.49Å; M473-H498 WeakPolarHBondContact CE-CD2 3.12Å; M473-H498 WeakPolarHBondContact CE-NE2 3.32Å; M473-H498 HydrophobicContact CG-CB 4.4Å; M473-H498 HydrophobicContact SD-CB 4.29Å; L495-H498 PolarHBondContact O-N 2.75Å; N496-H498 PolarHBondContact O-N 3.33Å; H498-L500 PolarHBondContact O-N 2.62Å; H498-R501 WeakPolarHBondContact O-CB 3.49Å; H498-R501 PolarHBondContact O-N 3.17Å; H498-R501 VanDerWaalsContact O-N 3.11Å; H498-G502 PolarHBondContact O-N 2.9Å
499V64.9Low61.9Low58 Ų5870.3 Ų70.335%0.35240%0.403SS..Hα-helixtrans-61.3-45.4-179.3-174.60000111.2L477 N496 R501 G502 C503L477-V499 HydrophobicContact CD1-CG2 4.03Å; L477-V499 HydrophobicContact CD2-CG2 3.43Å; L477-V499 VanDerWaalsContact CD2-CG2 3.43Å; L477-V499 HydrophobicContact CG-CG2 4.4Å; N496-V499 PolarHBondContact O-N 3.35Å; V499-R501 PolarHBondContact O-N 3.06Å; V499-R501 VanDerWaalsContact O-N 3.16Å; V499-G502 PolarHBondContact O-N 3.42Å; V499-G502 VanDerWaalsContact O-N 3.11Å; V499-C503 PolarHBondContact O-N 2.91Å
500L56.5Low59.2Low117 Ų11769.6 Ų69.661%0.61341%0.408SS*.Hα-helixtrans-62.4-20.2177.1-78.6161.5000114.1N496 H498 K504N496-L500 PolarHBondContact O-N 3.36Å; N496-L500 VanDerWaalsContact O-N 3.13Å; H498-L500 PolarHBondContact O-N 2.62Å; L500-K504 WeakPolarHBondContact O-CG 3.47Å
501R55.8Low56.4Low79 Ų7976.8 Ų76.830%0.29844%0.44SS..Hα-helixtrans-88.5-41.3172.7-64.5169.6-175.5-146.311.8111R329 E332 A497 H498 V499 K504R329-R501 PolarHBondContact O-NH2 3.07Å; R329-R501 VanDerWaalsContact O-NH2 3.13Å; E332-R501 IonicContact OE2-CZ 2.94Å; E332-R501 IonicContact OE2-NE 2.74Å; E332-R501 IonicContact OE2-NH2 3.72Å; E332-R501 PolarHBondContact OE2-NH2 3.47Å; A497-R501 WeakPolarHBondContact O-CD 3.41Å; A497-R501 VanDerWaalsContact O-CG 3.29Å; A497-R501 WeakPolarHBondContact O-CG 3.37Å; H498-R501 WeakPolarHBondContact O-CB 3.49Å; H498-R501 PolarHBondContact O-N 3.17Å; H498-R501 VanDerWaalsContact O-N 3.11Å; V499-R501 PolarHBondContact O-N 3.06Å; V499-R501 VanDerWaalsContact O-N 3.16Å; R501-K504 PolarHBondContact O-N 3.26Å
502G45.1Very low53.4Low37 Ų3782.8 Ų82.838%0.38148%0.481SS..Hα-helixtrans-57.2-54.2175.200000112.7H498 V499 K504 S505 S506H498-G502 PolarHBondContact O-N 2.9Å; V499-G502 PolarHBondContact O-N 3.42Å; V499-G502 VanDerWaalsContact O-N 3.11Å; G502-K504 PolarHBondContact O-N 2.9Å; G502-K504 VanDerWaalsContact O-N 3.16Å; G502-S505 WeakPolarHBondContact O-CB 3.44Å; G502-S505 PolarHBondContact O-N 3.16Å; G502-S505 PolarHBondContact O-OG 2.8Å; G502-S506 PolarHBondContact O-N 3.26Å
503C32.7Very low50.6Low56 Ų5686 Ų8638%0.37851%0.507SS..Hα-helixtrans-57.5-32.4179.6-65.80000113.4V499 S505 S506 I507V499-C503 PolarHBondContact O-N 2.91Å; C503-S505 PolarHBondContact O-N 2.88Å; C503-S506 PolarHBondContact O-N 2.97Å; C503-S506 VanDerWaalsContact O-N 3.07Å; C503-S506 PolarHBondContact O-OG 3.37Å; C503-I507 HydrophobicContact CB-CD1 3.92Å; C503-I507 WeakPolarHBondContact O-CB 3.19Å; C503-I507 WeakPolarHBondContact O-CD1 3.42Å; C503-I507 WeakPolarHBondContact O-CG1 3.5Å; C503-I507 PolarHBondContact O-N 3.21Å
504K35.3Very low47.9Very low153 Ų15387.9 Ų87.967%0.66552%0.521SS*.Hα-helixtrans-71-9176.4-70.8-179.7-177.81790114.2L500 R501 G502L500-K504 WeakPolarHBondContact O-CG 3.47Å; R501-K504 PolarHBondContact O-N 3.26Å; G502-K504 PolarHBondContact O-N 2.9Å; G502-K504 VanDerWaalsContact O-N 3.16Å
505S32.3Very low45Very low103 Ų10392 Ų9272%0.7256%0.557SS**Hα-helixtrans-95.5-17.7168.971.90000113.6G502 C503G502-S505 WeakPolarHBondContact O-CB 3.44Å; G502-S505 PolarHBondContact O-N 3.16Å; G502-S505 PolarHBondContact O-OG 2.8Å; C503-S505 PolarHBondContact O-N 2.88Å
506S29.3Very low42.2Very low70 Ų70100.5 Ų100.549%0.4960%0.597SS.*Hα-helixtrans-107.1-16.4-179.167.40000114.6G502 C503 T508 G509G502-S506 PolarHBondContact O-N 3.26Å; C503-S506 PolarHBondContact O-N 2.97Å; C503-S506 VanDerWaalsContact O-N 3.07Å; C503-S506 PolarHBondContact O-OG 3.37Å; S506-T508 PolarHBondContact O-N 3.35Å; S506-G509 PolarHBondContact O-N 2.79Å
507I32.7Very low39.7Very low121 Ų121105.3 Ų105.362%0.62162%0.622SS**  trans-76.561.5175.6-61.4160.5000110.6C503C503-I507 HydrophobicContact CB-CD1 3.92Å; C503-I507 WeakPolarHBondContact O-CB 3.19Å; C503-I507 WeakPolarHBondContact O-CD1 3.42Å; C503-I507 WeakPolarHBondContact O-CG1 3.5Å; C503-I507 PolarHBondContact O-N 3.21Å
508T30.6Very low37.1Very low147 Ų147110 Ų11090%0.90266%0.655SS**SBendtrans-126.334.9143.160.30000109.3S506S506-T508 PolarHBondContact O-N 3.35Å
509G33.6Very low35.3Very low55 Ų55116.4 Ų116.457%0.56768%0.682SS**SBendtrans179119.3178.700000113.1S506S506-G509 PolarHBondContact O-N 2.79Å
510S27.7Very low33.7Very low117 Ų117121.1 Ų121.182%0.81871%0.705SS**  trans62.4125.6177.4-153.80000117.4
511E29.5Very low32.5Very low191 Ų191125.6 Ų125.689%0.89372%0.72SS**  trans-78.4152.9164.2-61.2173.2130.700109.7
512C26.5Very low31.3Very low127 Ų127131.3 Ų131.386%0.85875%0.75SS**  trans-140.2112167-167.50000108
513S29.3Very low30.6Very low116 Ų116133.4 Ų133.481%0.81177%0.772SS**PPolyproline II helixtrans-85.7124.7-174.638.30000111.3
514L31.8Very low30.4Very low173 Ų173136.8 Ų136.891%0.90680%0.796SS**PPolyproline II helixtrans-86.5119.4164.7-69.3172.2000108.4
515A28.7Very low30.4Very low100 Ų100137.5 Ų137.583%0.82680%0.802SS**PPolyproline II helixtrans-91.4123.8170.500000109.4D517A515-D517 PolarHBondContact O-N 3.26Å
516E30.3Very low30.4Very low181 Ų181139.5 Ų139.585%0.84680%0.804SS**  trans-84102.2173.6-68.5-169.6134.400110.4S518E516-S518 PolarHBondContact O-N 3.2Å; E516-S518 PolarHBondContact O-OG 3.33Å
517D29.9Very low31.5Very low155 Ų155140.7 Ų140.783%0.82981%0.81SS**  trans-72.7108.9179.4-151.3-12.9000110.2A515A515-D517 PolarHBondContact O-N 3.26Å
518S28.6Very low31.4Very low111 Ų111143.8 Ų143.878%0.77682%0.822SS**  trans-121.768.2-168.139.20000112E516E516-S518 PolarHBondContact O-N 3.2Å; E516-S518 PolarHBondContact O-OG 3.33Å
519K31.1Very low31.6Very low177 Ų177141.9 Ų141.977%0.7781%0.814SS**  trans-111112.8168.7-81.2-178.4174.7175.80111.9
520N29.8Very low31.7Very low158 Ų158152 Ų15285%0.84585%0.847SS**  177.5111.7120.6-91.7-23000112.6
521K31.3Very low31.9Very low210 Ų210153.8 Ų153.891%0.91385%0.848SS**  trans-172.290139.3-108.3172.4-176.2179.10110.7
522E32Very low32.1Very low200 Ų200151.8 Ų151.894%0.93585%0.846SS**  trans-72.3158.4152.1-65.5-176.1116.200109.1
523G28.8Very low32.4Very low81 Ų81153.2 Ų153.284%0.83585%0.845SS**  trans145.247167.800000118.6
524S30.3Very low32.6Very low127 Ų127155.4 Ų155.489%0.88885%0.848SS**  trans-159.8153.2143.3-149.30000111.5
525Q33.9Very low32.6Very low168 Ų168154.3 Ų154.379%0.78584%0.844SS**  trans-113.3157.1-173.4-68.2179.5-3900112.6
526N33.2Very low32.9Very low144 Ų144157.9 Ų157.977%0.7785%0.845SS**  trans70.7159.2152.6-69.3-14.5000118.6
527P52.3Low33Very low95 Ų95156.2 Ų156.262%0.61785%0.845SS**  -142.1-178.2-52.241.4-25.3000112.9
528Q30.9Very low33.3Very low187 Ų187156.3 Ų156.387%0.87485%0.846SS**  trans68.4151.8168.3-56.9168.4-49.100114.1
529S33.9Very low33.7Very low106 Ų106160.1 Ų160.174%0.74185%0.852SS**  cis-152.616222.954.80000113.5
530Q36.8Very low33.9Very low268 Ų268158.5 Ų158.5100%1.25286%0.86SS**  trans70.60172.8-61.8-172.9-9.500116.6

Retrieved 530 of 530 residues in 938.9 ms (Link to these results)