A0A087XL69_POEFO Loading...

Sprouty homolog 4 (Drosophila)

AlphaFold DB , UniProt , Accession A0A087XL69, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 283 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.1Very low39.2Very low256 Ų256150.9 Ų150.9100%1.26181%0.807SS**  0134.10-81.2168.3164.400106.7
2E38.3Very low39.1Very low184 Ų184149.8 Ų149.886%0.8681%0.81SS**  trans-106.6163.9-161.8-175.459.192.900111.9
3S35.8Very low39Very low80 Ų80147.6 Ų147.656%0.55981%0.813SS**  trans77.9146.6165.9-119.20000116.3
4R40.6Very low39.2Very low216 Ų216145.1 Ų145.182%0.81581%0.81SS**  cis-156.5141.212.6-166.1170.1-73.8170.8-8.8112.2
5V43.4Very low39.2Very low121 Ų121142.6 Ų142.673%0.73381%0.807SS**  trans-101.1147.4163.6175.20000109.1
6P47.1Very low39.4Very low118 Ų118144.3 Ų144.377%0.76681%0.812SS**  -136.2166.9127.222.7-2.9000114.6
7H39.1Very low39.5Very low169 Ų169144.8 Ų144.878%0.78281%0.81SS**  trans-88.9169.4-165.4-72.6-108.7000117
8H33.1Very low39.6Very low173 Ų173143.1 Ų143.180%0.80181%0.809SS**  trans106.4149.1131.1-112.6-79.5000122
9I39.1Very low39.4Very low146 Ų146144.9 Ų144.975%0.74981%0.811SS**  trans-137.1141.5-163.6-57.4164.3000105.3
10P43.6Very low39.5Very low125 Ų125143.8 Ų143.881%0.81281%0.81SS**  -157.8176.365.343.9-22.4000120.6
11G32.1Very low39.7Very low72 Ų72144.3 Ų144.374%0.74281%0.81SS**  trans94.1143.3153.800000116.7
12V37.5Very low39.7Very low138 Ų138139.9 Ų139.984%0.83679%0.791SS**  cis-148.4143.91.7-82.50000109.8
13S38.5Very low39.7Very low121 Ų121136.8 Ų136.885%0.84678%0.78SS**  trans-96.8115.7176.4-63.80000111.5S15S13-S15 PolarHBondContact O-N 3.02Å
14S41.9Very low39.6Very low112 Ų112137.7 Ų137.778%0.78379%0.786SS**  trans-8995.2173.3-64.70000111.3L16S14-L16 PolarHBondContact O-N 2.81Å
15S39.2Very low39.6Very low108 Ų108138.1 Ų138.176%0.75579%0.788SS**  trans-80.398.2173.138.80000111.7S13 I17S13-S15 PolarHBondContact O-N 3.02Å; S15-I17 PolarHBondContact O-N 3.48Å
16L41.6Very low39.5Very low170 Ų170137.6 Ų137.689%0.8978%0.784SS**  trans-80.5101167-69.3174.7000109.9S14S14-L16 PolarHBondContact O-N 2.81Å
17I42.1Very low39.5Very low152 Ų152137.4 Ų137.478%0.77978%0.783SS**PPolyproline II helixtrans-98.9116.6166.3-86169.4000108.9S15S15-I17 PolarHBondContact O-N 3.48Å
18S40.9Very low39.5Very low114 Ų114139.5 Ų139.580%0.79779%0.786SS**PPolyproline II helixtrans-79.9120170.939.40000109.9
19Q36.3Very low39.8Very low178 Ų178134.6 Ų134.683%0.83278%0.783SS**PPolyproline II helixtrans-82136.6170.3-72.2-168.4-31.100110.8
20P41.4Very low40Very low123 Ų123138.4 Ų138.480%0.79979%0.787SS**PPolyproline II helixtrans-74.6137.1172.930.3-32.9000111.3L22P20-L22 PolarHBondContact O-N 3.1Å
21L42.7Very low39.8Very low154 Ų154140 Ų14081%0.80679%0.788SS**  trans-72.5113.1-178.2-160.2179.8000110.2D23L21-D23 HydrophobicContact CD2-CB 4.05Å
22L39.8Very low40.4Very low164 Ų164143.6 Ų143.686%0.85979%0.786SS**  trans-10298164.4-85.1170.6000109.9P20 S24P20-L22 PolarHBondContact O-N 3.1Å; L22-S24 PolarHBondContact O-N 3.26Å
23D38.4Very low40.7Very low118 Ų118144.6 Ų144.663%0.63178%0.781SS**  trans-69.8123.6167.6-176.941.5000109.2L21L21-D23 HydrophobicContact CD2-CB 4.05Å
24S32.9Very low41.1Very low99 Ų99144.7 Ų144.769%0.69278%0.779SS**  trans-151.884.3171.4-82.90000109.5L22 V26L22-S24 PolarHBondContact O-N 3.26Å; S24-V26 PolarHBondContact O-N 3.38Å; S24-V26 VanDerWaalsContact O-N 3.11Å
25R40.8Very low41.5Very low226 Ų226146.5 Ų146.585%0.85378%0.779SS**  trans-59.7110.7167.1-72.4-177.8-179.4158.11.3110.2
26V41Very low42.4Very low109 Ų109146.6 Ų146.666%0.66178%0.775SS**  trans-115.9115.3162.4-173.20000108.1S24 Y28S24-V26 PolarHBondContact O-N 3.38Å; S24-V26 VanDerWaalsContact O-N 3.11Å; V26-Y28 HydrophobicContact CG1-CD2 3.77Å; V26-Y28 HydrophobicContact CG1-CE2 3.96Å; V26-Y28 PolarHBondContact O-N 2.96Å
27P48.7Very low43.2Very low115 Ų115145.9 Ų145.975%0.74777%0.77SS**  trans-92.193.1-17234.4-32.8000111.8
28Y39Very low44.3Very low212 Ų212145.8 Ų145.883%0.83176%0.761SS**  trans-135.2128.3168.7-73.4-68.6000114.1V26V26-Y28 HydrophobicContact CG1-CD2 3.77Å; V26-Y28 HydrophobicContact CG1-CE2 3.96Å; V26-Y28 PolarHBondContact O-N 2.96Å
29G38.5Very low45.2Very low71 Ų71144.3 Ų144.373%0.73275%0.749SS**  trans67.678.513100000118L31G29-L31 PolarHBondContact O-N 2.04Å; G29-L31 VanDerWaalsContact O-N 3.12Å
30R43.9Very low46.3Very low225 Ų225142.4 Ų142.485%0.84974%0.743SS**  trans-30.7108.6157.9-171.1-167.6-159.1176.57.9113.9
31L39.4Very low47Very low158 Ų158143.5 Ų143.583%0.82774%0.742SS**  trans-133.194.6162.9-121.2159.4000108.9G29 H33G29-L31 PolarHBondContact O-N 2.04Å; G29-L31 VanDerWaalsContact O-N 3.12Å; L31-H33 PolarHBondContact O-N 3.4Å
32Q44.3Very low47.3Very low149 Ų149142.4 Ų142.470%0.69673%0.733SS**  trans-86.4100.8179.8-72.7179.6-49.600110.2
33H44.3Very low48.1Very low158 Ų158140 Ų14073%0.73172%0.72SS**  trans-144.9117.5153.7-81.196.5000108.1L31 L35L31-H33 PolarHBondContact O-N 3.4Å; H33-L35 PolarHBondContact O-N 2.92Å
34P45.8Very low48.9Very low124 Ų124143.8 Ų143.881%0.80573%0.731SS**  trans-74.497.5173.830-31.4000109T36P34-T36 PolarHBondContact O-N 3.37Å
35L50Low49.7Very low150 Ų150144.4 Ų144.479%0.78574%0.735SS**  trans-70.8110.2161.4-70.3172.9000107.5H33 I37H33-L35 PolarHBondContact O-N 2.92Å; L35-I37 VanDerWaalsContact C-N 3.28Å; L35-I37 PolarHBondContact O-N 2.93Å
36T58.5Low50.1Low110 Ų110137.8 Ų137.868%0.67572%0.723SS**  trans-69.987.1174.8-53.10000109.4P34 Y38P34-T36 PolarHBondContact O-N 3.37Å; T36-Y38 HydrophobicContact CG2-CD2 3.88Å; T36-Y38 HydrophobicContact CG2-CE2 3.51Å; T36-Y38 PolarHBondContact O-N 2.88Å
37I59.2Low50.9Low154 Ų154140 Ų14079%0.7973%0.726SS**  trans-75.1104.9172.8-61.3167.2000107.3L35L35-I37 VanDerWaalsContact C-N 3.28Å; L35-I37 PolarHBondContact O-N 2.93Å
38Y64.6Low51.2Low151 Ų151139.9 Ų139.959%0.59272%0.723SS**  trans-71.9145.5172.6-82.7-96.3000110.7T36T36-Y38 HydrophobicContact CG2-CD2 3.88Å; T36-Y38 HydrophobicContact CG2-CE2 3.51Å; T36-Y38 PolarHBondContact O-N 2.88Å
39P58.8Low51.9Low82 Ų82136.6 Ų136.653%0.53272%0.715SS.*  trans-63.814717626.3-33.7000111.8D41 Q42P39-D41 PolarHBondContact O-N 3.22Å; P39-Q42 PolarHBondContact O-N 3.49Å
40I61Low52.4Low138 Ų138139.7 Ų139.771%0.70872%0.715SS**G310 helixtrans-56.8-27.6-169.7-70.4175.5000113.2Q42 I43I40-Q42 PolarHBondContact O-N 3.16Å; I40-Q42 VanDerWaalsContact O-N 3.1Å; I40-I43 HydrophobicContact CB-CD1 4.29Å; I40-I43 HydrophobicContact CG1-CD1 4.23Å; I40-I43 HydrophobicContact CG2-CD1 4.24Å; I40-I43 WeakPolarHBondContact O-CB 3.17Å; I40-I43 WeakPolarHBondContact O-CG1 3.41Å; I40-I43 PolarHBondContact O-N 2.86Å
41D55.8Low53.5Low146 Ų146135.8 Ų135.878%0.78171%0.711SS**G310 helixtrans-63.1-17.1-178.3-56.4-58.3000114.5P39P39-D41 PolarHBondContact O-N 3.22Å
42Q49.5Very low54.1Low132 Ų132138.7 Ų138.762%0.61771%0.712SS**G310 helixtrans-88.5-6.4174.7-70.7-166.75.800114.8P39 I40 K44P39-Q42 PolarHBondContact O-N 3.49Å; I40-Q42 PolarHBondContact O-N 3.16Å; I40-Q42 VanDerWaalsContact O-N 3.1Å; Q42-K44 PolarHBondContact O-N 2.78Å
43I54.9Low55Low113 Ų113138.2 Ų138.258%0.57971%0.713SS**  trans-73.1-15-178-54.4172.4000111.3I40 S45I40-I43 HydrophobicContact CB-CD1 4.29Å; I40-I43 HydrophobicContact CG1-CD1 4.23Å; I40-I43 HydrophobicContact CG2-CD1 4.24Å; I40-I43 WeakPolarHBondContact O-CB 3.17Å; I40-I43 WeakPolarHBondContact O-CG1 3.41Å; I40-I43 PolarHBondContact O-N 2.86Å; I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.18Å
44K55.2Low55.2Low198 Ų198137.6 Ų137.686%0.86172%0.715SS**THydrogen-bonded Turntrans-84.954.1-171.7-158-172.6177.8-175.90114.6Q42Q42-K44 PolarHBondContact O-N 2.78Å
45S51Low55.3Low111 Ų111135.5 Ų135.578%0.77670%0.704SS**THydrogen-bonded Turntrans-163.7-5.4160.459.40000116.3I43 H47I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.18Å; S45-H47 VanDerWaalsContact C-N 3.27Å; S45-H47 PolarHBondContact O-N 2.81Å
46S48.3Very low55.1Low88 Ų88134.9 Ų134.962%0.61571%0.709SS**  trans-77.479.5170.361.10000110.6V48S46-V48 PolarHBondContact O-N 3.23Å
47H57.6Low54.5Low155 Ų155133.8 Ų133.872%0.71871%0.711SS**  trans-70.776.3165.8-169.4-87.8000109.2S45 E49S45-H47 VanDerWaalsContact C-N 3.27Å; S45-H47 PolarHBondContact O-N 2.81Å; H47-E49 VanDerWaalsContact C-N 3.35Å; H47-E49 IonicContact CE1-OE2 3.38Å; H47-E49 PolarHBondContact CE1-OE2 3.26Å; H47-E49 PolarHBondContact O-N 3.16Å; H47-E49 VanDerWaalsContact O-N 3.09Å
48V56.1Low53.9Low113 Ų113132.8 Ų132.869%0.68571%0.712SS**  trans-69.299.7162164.10000106.2S46 N50S46-V48 PolarHBondContact O-N 3.23Å; V48-N50 PolarHBondContact O-N 2.98Å
49E52.6Low52.8Low143 Ų143132.8 Ų132.867%0.66873%0.727SS**  trans-66.9123.7167.7-168.5144.279.500107.6H47 D51H47-E49 VanDerWaalsContact C-N 3.35Å; H47-E49 IonicContact CE1-OE2 3.38Å; H47-E49 PolarHBondContact CE1-OE2 3.26Å; H47-E49 PolarHBondContact O-N 3.16Å; H47-E49 VanDerWaalsContact O-N 3.09Å; E49-D51 PolarHBondContact O-N 3.48Å; E49-D51 VanDerWaalsContact O-N 3.12Å
50N50.6Low52.2Low135 Ų135133.1 Ų133.172%0.72274%0.737SS**  trans-78.195.2174.5-85.2-44.5000108.4V48 Y52V48-N50 PolarHBondContact O-N 2.98Å; N50-Y52 PolarHBondContact O-N 2.81Å
51D65.3Low51Low143 Ų143135.9 Ų135.977%0.76575%0.747SS**  trans-59.198.4164.1-95.1-52.1000109.3E49 I53E49-D51 PolarHBondContact O-N 3.48Å; E49-D51 VanDerWaalsContact O-N 3.12Å; D51-I53 PolarHBondContact O-N 3.31Å; D51-I53 VanDerWaalsContact O-N 3.1Å
52Y53.6Low49.9Very low219 Ų219138 Ų13886%0.85975%0.752SS**  trans-73.1101.6176.4-121.1-93.6000108.7N50 D54N50-Y52 PolarHBondContact O-N 2.81Å; Y52-D54 PolarHBondContact O-N 2.77Å
53I61.6Low49.5Very low139 Ų139137.2 Ų137.271%0.71376%0.758SS**  trans-70.499.6174.5-56.8-60.2000109D51 S55D51-I53 PolarHBondContact O-N 3.31Å; D51-I53 VanDerWaalsContact O-N 3.1Å; I53-S55 PolarHBondContact O-N 3Å
54D50Low48.4Very low145 Ų145139 Ų13978%0.77577%0.774SS**  trans-70.8125.8170.1-156-52.7000109.6Y52Y52-D54 PolarHBondContact O-N 2.77Å
55S46.4Very low47.3Very low81 Ų81133.7 Ų133.757%0.56676%0.762SS**  trans73.795.8179.6-57.90000118I53 A57I53-S55 PolarHBondContact O-N 3Å; S55-A57 PolarHBondContact O-N 3.04Å
56P45.7Very low46.5Very low137 Ų137137 Ų13789%0.8977%0.765SS**  trans-80.243.2176.236.4-37.9000113.2
57A46.3Very low45.7Very low87 Ų87142.5 Ų142.572%0.71978%0.778SS**  trans-101-8.3-168.700000115.2S55S55-A57 PolarHBondContact O-N 3.04Å
58V47.1Very low44.4Very low133 Ų133140.2 Ų140.281%0.80678%0.78SS**  trans-136.264.5-174.8-1640000112.5
59V41.3Very low43.2Very low150 Ų150139.4 Ų139.491%0.90979%0.785SS**  trans-12868.1157.4-171.70000109.1
60A45.8Very low42.2Very low90 Ų90139.9 Ų139.974%0.74479%0.792SS**  trans-135.163171.300000110
61Q37.5Very low41.3Very low196 Ų196142.2 Ų142.292%0.91680%0.798SS**  trans-156.2117.9164-113156.345.300112.2
62Q32.1Very low39.5Very low189 Ų189139.3 Ų139.388%0.88380%0.802SS**  trans-80.8163.1159.7-99.9-178.3-29.500110
63P40.3Very low38.3Very low116 Ų116140.3 Ų140.375%0.75380%0.804SS**  trans-93.3150.5-156.435.6-36.5000114.6
64V31.2Very low36.7Very low151 Ų151139.3 Ų139.392%0.91581%0.808SS**  trans-145.3150.1145.8174.30000110.2
65S32.9Very low35.7Very low87 Ų87140.5 Ų140.561%0.60881%0.809SS**  trans-76.6157.1-175.5-163.30000115.5
66Q34.9Very low34.8Very low179 Ų179141 Ų14184%0.83681%0.813SS**  trans73.9116.8146.8-84.6169.629.400123
67K31Very low34.3Very low204 Ų204143.1 Ų143.189%0.88781%0.81SS**  113.6136.3120.8-158.6170.2-177.61790118.8
68S29.5Very low34Very low108 Ų108143.7 Ų143.776%0.75581%0.807SS**  trans-53.3148.3-168-46.50000119.8
69A31.3Very low33.4Very low96 Ų96146.3 Ų146.379%0.79381%0.81SS**  trans53.8123.2134.700000120.6
70N31.4Very low33.6Very low152 Ų152144 Ų14481%0.81380%0.798SS**  -166.5171.193.7-153.7-0.6000112.6
71H31.6Very low33Very low185 Ų185147.5 Ų147.586%0.85680%0.804SS**  trans-52.5151.9175.4-84.5-90.9000116.3
72G28.9Very low32.8Very low82 Ų82143.8 Ų143.885%0.84580%0.795SS**  trans-177.794.4160.100000113.5
73R28.3Very low32.9Very low240 Ų240140.2 Ų140.291%0.90679%0.786SS**  trans-107.8122.9173169.9-170.6173-144.3-3109.2
74C28.1Very low32.7Very low118 Ų118139.8 Ų139.880%0.79778%0.781SS**  trans-177.7160.5158-930000107.5
75E28.8Very low33Very low170 Ų170140.4 Ų140.479%0.79477%0.774SS**  cis-157.7156.4-37-170.9156.794.300106.2
76S27.8Very low33.4Very low91 Ų91142.2 Ų142.264%0.63678%0.784SS**  trans-77.6143.4-178.347.40000113.1
77H33.8Very low33.4Very low182 Ų182144.4 Ų144.484%0.84378%0.784SS**  -173.1155.3124.3-101.3-71.4000111.9
78P41Very low34.2Very low99 Ų99141.4 Ų141.464%0.64378%0.777SS**  trans-105.3164.4-170.440.1-33.5000113.6
79H33.2Very low34.2Very low187 Ų187141.6 Ų141.687%0.86678%0.778SS**  trans-165.6159.6135-106.1-75.2000109.7
80P46.8Very low34.4Very low103 Ų103147.7 Ų147.767%0.66979%0.787SS**  trans-94.2161.4-160.137.6-36.6000113.4
81D32.3Very low34.6Very low163 Ų163146.2 Ų146.287%0.87279%0.789SS**  trans-152.7160.5145.4-110.2-36.9000113.2
82T34.6Very low34.6Very low118 Ų118141.3 Ų141.372%0.72479%0.788SS**  trans-76.9157.2-16549.90000116.6
83T33.6Very low35.2Very low113 Ų113149 Ų14969%0.69379%0.792SS**  trans122.5126.4136.6-47.40000116.9
84T36.2Very low36.3Very low107 Ų107142.6 Ų142.666%0.65678%0.781SS**  trans78.5134.1154.226.20000123.1
85H36.9Very low36.4Very low165 Ų165143.1 Ų143.176%0.76479%0.786SS**  trans82.9113.3162.3-55.1-55.2000119.3W87H85-W87 PolarHBondContact O-N 2.78Å
86P42.5Very low36.6Very low124 Ų124140.3 Ų140.381%0.80579%0.785SS**  trans-89.8103.617634.3-30.4000111.4
87W34.9Very low37Very low226 Ų226144.3 Ų144.386%0.85680%0.797SS**  trans-129.1100.2158.5-102.179.6000110.4H85H85-W87 PolarHBondContact O-N 2.78Å
88I46.7Very low37Very low141 Ų141141.1 Ų141.172%0.72380%0.796SS**  trans23107154.5-17.1175.5000117.4
89S29.8Very low36.8Very low112 Ų112142.3 Ų142.378%0.78381%0.807SS**  trans-160.8112.8151.4-84.40000111.2
90F35.6Very low37Very low223 Ų223138.6 Ų138.698%0.97880%0.801SS**  trans-129.2112.7159.8-99.2-80.3000108
91S35.8Very low36.5Very low122 Ų122138.6 Ų138.685%0.85380%0.804SS**  trans-134.3118.2168.649.80000108.9
92G31.1Very low36.7Very low82 Ų82136.6 Ų136.685%0.84580%0.803SS**  trans-167.688.9-174.300000111
93R41.3Very low37.2Very low243 Ų243137.6 Ų137.692%0.91781%0.809SS**  trans-87.8179171.1-99.6-173.7-179.3-158.32.8109.9
94P51.1Low37.4Very low106 Ų106138.3 Ų138.369%0.68882%0.819SS**  cis-132170.7-8.133.8-15.9000114.9
95S31.1Very low37.7Very low128 Ų128138.3 Ų138.390%0.89582%0.823SS**  trans-160.8149.4130-830000110.9
96S33Very low38.6Very low111 Ų111136.6 Ų136.678%0.77682%0.82SS**  trans-99145.3-164.2-430000112.7
97I36.4Very low38.5Very low175 Ų175139.2 Ų139.290%0.89782%0.821SS**  -161.6144.7115.637171.5000109.8
98S33.2Very low38.9Very low115 Ų115139.3 Ų139.380%0.80482%0.821SS**  trans-92.1149.9-175.5-48.20000112.2
99S36.4Very low38.6Very low125 Ų125138.7 Ų138.787%0.87482%0.819SS**  trans-152.7120.1138.4-87.80000109.9
100S37.1Very low39.2Very low108 Ų108141.7 Ų141.776%0.75583%0.825SS**  trans-63.4164.1168.3-45.30000110.4
101S36.9Very low39.1Very low104 Ų104136.5 Ų136.573%0.72781%0.807SS**  cis-162.1156.433.6-49.10000113.9
102S37.4Very low39.3Very low121 Ų121138.6 Ų138.685%0.84680%0.804SS**  trans67.7106.4144.4-54.60000121.4
103T45.3Very low39.6Very low139 Ų139139.9 Ų139.985%0.85381%0.806SS**  trans-81.9149.715449.80000112
104S36.6Very low39.3Very low128 Ų128132.5 Ų132.590%0.89580%0.797SS**  trans-151.6143.2147.8-167.20000110
105S41.8Very low38.8Very low107 Ų107133.6 Ų133.675%0.74880%0.804SS**  trans-96.2160.6-152.7-520000115.9
106D57.1Low38.9Very low129 Ų129133.2 Ų133.269%0.6980%0.797SS**  trans-52.1136.1165.5-52.8-105.9000113.6
107Q39.8Very low39.1Very low179 Ų179133.4 Ų133.484%0.83680%0.795SS**  -178.2115.3119.1-123.795.294.800111.2
108R43.3Very low39Very low227 Ų227130.8 Ų130.886%0.85779%0.787SS**  178.9153129.3-100.8179.696142.15.4113
109L41Very low39.2Very low128 Ų128130.9 Ų130.967%0.6778%0.783SS**  trans58.978.7170.1-96.479.6000117.1
110L41.6Very low38.9Very low175 Ų175131.9 Ų131.992%0.91678%0.778SS**  -53125.8126.7-76.4156.1000108.6
111D33.8Very low38.8Very low114 Ų114135 Ų13561%0.6178%0.781SS**  trans-151.1130.5150.6-124.8-174.1000114.2
112H39.2Very low38.7Very low167 Ų167138.6 Ų138.677%0.77379%0.786SS**  trans58.384.3154.5-55.7-14.3000120.6
113A38.1Very low38.9Very low109 Ų109138.7 Ų138.790%0.90178%0.783SS**  trans-137.665.6153.200000112.5
114A35.1Very low38.2Very low87 Ų87138.5 Ų138.572%0.71978%0.777SS**  trans-140.1118.4168.500000110.2
115P40.1Very low37.9Very low129 Ų129137.9 Ų137.984%0.83877%0.773SS**  trans-66.3135.9174.6-19.432.2000111.4
116T34.3Very low37.3Very low121 Ų121138.5 Ų138.574%0.74277%0.768SS**  trans-71.5134.1172.643.10000110.9T118T116-T118 PolarHBondContact O-N 3.32Å
117P36.3Very low36.1Very low114 Ų114138.5 Ų138.574%0.7477%0.768SS**  trans-78.4107.4164.130.4-29.7000108.6V119P117-V119 PolarHBondContact O-N 3.41Å
118T34.5Very low35.7Very low120 Ų120137 Ų13774%0.73676%0.76SS**  trans-66.8104.1169.746.50000109.3T116 D120T116-T118 PolarHBondContact O-N 3.32Å; T118-D120 PolarHBondContact O-N 2.98Å
119V38.4Very low35.1Very low118 Ų118135 Ų13572%0.71576%0.761SS**  trans-87.397.2167.6178.10000107.3P117 H121P117-V119 PolarHBondContact O-N 3.41Å; V119-H121 PolarHBondContact O-N 3.26Å
120D29.3Very low34.6Very low145 Ų145132.4 Ų132.478%0.77577%0.765SS**  trans-67.5117.3169.3-75.3-66.7000109.9T118T118-D120 PolarHBondContact O-N 2.98Å
121H34.2Very low34.6Very low175 Ų175129.8 Ų129.881%0.8176%0.759SS**  trans-111.9127.3165.8-10524000109.7V119V119-H121 PolarHBondContact O-N 3.26Å
122H36.3Very low34.6Very low179 Ų179130.9 Ų130.983%0.82976%0.763SS**PPolyproline II helixtrans-55.1144.6179.8-86.648.1000112.7
123P41.6Very low34.3Very low122 Ų122130.2 Ų130.279%0.79277%0.765SS**PPolyproline II helixtrans-77.1126.3146.131.3-27.4000109.9
124N29.2Very low33.9Very low136 Ų136130.6 Ų130.673%0.72776%0.756SS**PPolyproline II helixtrans-69.1139.8172.9175.544.4000111.3N126N124-N126 PolarHBondContact ND2-OD1 2.73Å
125S30.7Very low33.8Very low115 Ų115132.6 Ų132.680%0.80476%0.759SS**  trans-140.3124.6163.2-166.30000110.5
126N30.2Very low33.4Very low119 Ų119131.4 Ų131.464%0.63675%0.75SS**  trans-74.7138.5-174-56-25.2000111.5N124N124-N126 PolarHBondContact ND2-OD1 2.73Å
127N30.5Very low33Very low130 Ų130131.6 Ų131.670%0.69575%0.751SS**  168.714197.8-104.8-15.9000115.6
128H31.1Very low32.7Very low147 Ų147137.5 Ų137.568%0.68176%0.759SS**  trans67.7122.1144.8-73.3-53.5000124.7
129Q32.7Very low32.5Very low185 Ų185137.7 Ų137.786%0.86476%0.76SS**  trans85.5127137.7-66.6172.546.900121.2
130G28.6Very low32.4Very low74 Ų74138.1 Ų138.176%0.76377%0.765SS**  trans145.3123.3166.900000114
131P41.9Very low32.4Very low120 Ų120140.5 Ų140.578%0.77977%0.768SS**  trans-127.3173.9-162.839.9-23.9000118.5
132I34.2Very low32.2Very low137 Ų137136.4 Ų136.470%0.70376%0.759SS**  trans72.2119.8160.1-18.2-179000119.7
133N33.8Very low32.4Very low152 Ų152135.6 Ų135.681%0.81376%0.76SS**  175.7111.5115.9-84-19.8000115.3
134T28.5Very low31.9Very low117 Ų117136.6 Ų136.672%0.71876%0.759SS**  trans-14.4142.3156.6-26.10000120.8
135V33.8Very low32.8Very low130 Ų130138 Ų13879%0.78877%0.766SS**  172.5100.8114.51630000113.6
136T30.4Very low32.8Very low104 Ų104141.6 Ų141.664%0.63877%0.767SS**  53.3115.5124.7-35.50000124.6
137T26.4Very low33.4Very low125 Ų125141.7 Ų141.777%0.76778%0.777SS**  trans64.1135.7148.2580000120.7
138R30Very low33.8Very low238 Ų238139.4 Ų139.490%0.89878%0.776SS**  cis-150.3148.442.1-74.2179.3169.3175.4-4.2113
139T31.3Very low34.1Very low124 Ų124142.4 Ų142.476%0.76179%0.787SS**  trans-95.2163.8160.151.70000110.5
140P36.5Very low34.5Very low127 Ų127140.8 Ų140.883%0.82578%0.783SS**  -130.6169102.737.1-29.3000114.6
141K29.4Very low35Very low194 Ų194142.3 Ų142.384%0.84378%0.78SS**  trans-85.9173.3-178-33.9163.1179.3169.10108.9
142S29.1Very low34.8Very low89 Ų89142.4 Ų142.462%0.62279%0.79SS**  cis-170.1160.1663.80000110.2
143L40Very low35.3Very low162 Ų162139.1 Ų139.185%0.84879%0.79SS**  trans65.4155.8159.7-52.4166.8000115.1
144D31.9Very low35.8Very low143 Ų143138.7 Ų138.777%0.76578%0.783SS**  cis-143.7161.712.9-175.3-121.9000111.4
145L46.8Very low36.9Very low167 Ų167142.2 Ų142.287%0.87479%0.789SS**  trans-97.4102.8-176.8-170.678.8000112
146K32Very low37.8Very low190 Ų190142.3 Ų142.383%0.82678%0.778SS**  trans-134.2113.6167.1-162.6169.9-175.8177.90113.6A148K146-A148 PolarHBondContact O-N 3.48Å
147S42.8Very low39.4Very low121 Ų121142.8 Ų142.885%0.84677%0.773SS**  trans-69.3121.3174.1-179.20000111.6
148A37.6Very low41Very low82 Ų82143 Ų14368%0.67877%0.769SS**  trans-159.693.5164.100000112K146 I150K146-A148 PolarHBondContact O-N 3.48Å; A148-I150 PolarHBondContact O-N 3.05Å
149K38Very low42.9Very low209 Ų209139.3 Ų139.391%0.90976%0.759SS**  trans35.682149.7-163.8175.5180178.90117.5
150I40.8Very low45.1Very low151 Ų151137 Ų13777%0.77475%0.745SS**  trans-83.8128.9165.4-59.4176.8000109.2A148A148-I150 PolarHBondContact O-N 3.05Å
151P39.2Very low47Very low107 Ų107131 Ų13170%0.69571%0.706SS**  trans-69.1138.6170.329.3-33.2000110.5G153P151-G153 VanDerWaalsContact C-N 3.28Å; P151-G153 PolarHBondContact O-N 3.31Å
152A38.1Very low49.2Very low122 Ų122131.1 Ų131.1100%1.00871%0.71SS**SBendtrans-71.280-179.600000111.5
153G44.3Very low51.2Low67 Ų67134 Ų13469%0.69171%0.713SS**  trans-157.236.3-171.800000113.9P151P151-G153 VanDerWaalsContact C-N 3.28Å; P151-G153 PolarHBondContact O-N 3.31Å
154E45Very low52.9Low144 Ų144128.5 Ų128.567%0.67369%0.687SS**  trans-141.937-178.7-120.3-171.6-106.100114.7K156E154-K156 PolarHBondContact O-N 2.05Å; E154-K156 WeakPolarHBondContact OE2-CE 3.33Å
155K51.3Low54.7Low191 Ų191124.5 Ų124.583%0.8368%0.68SS**  trans-74.476158.4-74-176.9-177.9173.70108.7H157K155-H157 PolarHBondContact O-N 3.45Å
156K53.7Low56.2Low132 Ų132121.1 Ų121.157%0.57466%0.659SS**  trans-42.2134-173.8-60.6176.4179.8177.90111.5E154 L158E154-K156 PolarHBondContact O-N 2.05Å; E154-K156 WeakPolarHBondContact OE2-CE 3.33Å; K156-L158 HydrophobicContact CB-CD1 3.75Å; K156-L158 HydrophobicContact CB-CD2 4.19Å; K156-L158 HydrophobicContact CB-CG 3.58Å; K156-L158 HydrophobicContact CD-CD1 4.19Å; K156-L158 PolarHBondContact O-N 3.41Å
157H63.3Low58.5Low114 Ų114113 Ų11353%0.52863%0.625SS.*  trans-6835.9-177.5-67.7-72.5000114.8K155 F159 C167 C172K155-H157 PolarHBondContact O-N 3.45Å; H157-F159 PolarHBondContact O-N 2.74Å; H157-C167 HydrophobicContact CB-CB 4.35Å; H157-C167 VanDerWaalsContact CB-SG 3.58Å; H157-C167 PolarHBondContact O-SG 2.76Å; H157-C172 PolarHBondContact ND1-SG 2.72Å
158L60.1Low60.1Low130 Ų130113.1 Ų113.168%0.68161%0.607SS**  trans-71.6-23.3-164.1-64.3171.1000115K156 V160K156-L158 HydrophobicContact CB-CD1 3.75Å; K156-L158 HydrophobicContact CB-CD2 4.19Å; K156-L158 HydrophobicContact CB-CG 3.58Å; K156-L158 HydrophobicContact CD-CD1 4.19Å; K156-L158 PolarHBondContact O-N 3.41Å; L158-V160 PolarHBondContact O-N 3.21Å
159F69.5Low61.9Low159 Ų159110.3 Ų110.370%0.69758%0.582SS**  trans-79.966.7178.2-61.6-73.3000110.6H157 R168H157-F159 PolarHBondContact O-N 2.74Å; F159-R168 HydrophobicContact CB-CB 4.3Å; F159-R168 WeakPolarHBondContact O-CA 3.02Å; F159-R168 WeakPolarHBondContact O-CB 3.29Å; F159-R168 WeakPolarHBondContact O-CG 3.43Å; F159-R168 PolarHBondContact O-N 2.85Å
160V77.6Confident63.3Low76 Ų76105.8 Ų105.846%0.46157%0.572SS.*BIsolated β-bridgetrans-77.5143.1174.5-176.40000109.6L158 G165L158-V160 PolarHBondContact O-N 3.21Å; V160-G165 VanDerWaalsContact CG1-C 3.41Å; V160-G165 VanDerWaalsContact CG1-O 3.26Å; V160-G165 WeakPolarHBondContact CG1-O 3.26Å
161C77.1Confident64.6Low0 Ų0104.1 Ų104.10%056%0.561CS.*  trans-84.5122.2175.7-175.20000111.5H163 C164 G165 K166 R168 C276C161-H163 VanDerWaalsContact C-N 3.27Å; C161-H163 PolarHBondContact O-N 3.36Å; C161-C164 HydrophobicContact CB-CB 4.45Å; C161-C164 VanDerWaalsContact CB-SG 3.53Å; C161-C164 PolarHBondContact O-N 2.74Å; C161-C164 VanDerWaalsContact O-N 3.1Å; C161-G165 PolarHBondContact O-N 3.33Å; C161-K166 PolarHBondContact N-O 3.43Å; C161-R168 HydrophobicContact CB-CG 4.09Å; C161-R168 PolarHBondContact SG-NH2 2.88Å; C161-C276 HydrophobicContact CB-CB 3.72Å; C161-C276 WeakPolarHBondContact CB-SG 3.44Å; C161-C276 PolarHBondContact SG-SG 3.2Å
162E75.9Confident66Low198 Ų19899.4 Ų99.493%0.92553%0.531SS*.THydrogen-bonded Turntrans-59.8-33.1178.5-64.6-179.1121.600113.6C164E162-C164 PolarHBondContact O-N 3.12Å
163H69.8Low67.5Low149 Ų14996 Ų9669%0.6950%0.497SS*.THydrogen-bonded Turntrans-73.9-20.3177-74.3-61.7000115.1C161C161-H163 VanDerWaalsContact C-N 3.27Å; C161-H163 PolarHBondContact O-N 3.36Å
164C75.8Confident68.3Low46 Ų4697.6 Ų97.631%0.31149%0.49SS..THydrogen-bonded Turntrans-136.7-7.6-166.793.40000115C161 E162 K166 C276C161-C164 HydrophobicContact CB-CB 4.45Å; C161-C164 VanDerWaalsContact CB-SG 3.53Å; C161-C164 PolarHBondContact O-N 2.74Å; C161-C164 VanDerWaalsContact O-N 3.1Å; E162-C164 PolarHBondContact O-N 3.12Å; C164-K166 PolarHBondContact O-N 2.82Å; C164-K166 VanDerWaalsContact SG-CB 3.5Å; C164-K166 PolarHBondContact SG-N 3.31Å; C164-K166 VanDerWaalsContact SG-N 3.37Å; C164-C276 WeakPolarHBondContact CB-SG 3.26Å; C164-C276 WeakPolarHBondContact SG-CB 3.35Å; C164-C276 CovalentContact SG-SG 2.04Å; C164-C276 PolarHBondContact SG-SG 3.04Å
165G69.7Low68.9Low60 Ų6094.5 Ų94.562%0.61948%0.482SS*.SBendtrans66.5-1.9-178.200000115.8V160 C161V160-G165 VanDerWaalsContact CG1-C 3.41Å; V160-G165 VanDerWaalsContact CG1-O 3.26Å; V160-G165 WeakPolarHBondContact CG1-O 3.26Å; C161-G165 PolarHBondContact O-N 3.33Å
166K77.9Confident69.4Low96 Ų9691.4 Ų91.442%0.41747%0.465SS..  trans-95.1150.3-177.9-56.8-177.3178.5-165.20112.2C161 C164 P274 G275 C276C161-K166 PolarHBondContact N-O 3.43Å; C164-K166 PolarHBondContact O-N 2.82Å; C164-K166 VanDerWaalsContact SG-CB 3.5Å; C164-K166 PolarHBondContact SG-N 3.31Å; C164-K166 VanDerWaalsContact SG-N 3.37Å; K166-P274 WeakPolarHBondContact CB-O 3.4Å; K166-G275 WeakPolarHBondContact CD-O 3.49Å; K166-C276 HydrophobicContact CB-CB 3.96Å
167C81.3Confident69.8Low18 Ų1888.8 Ų88.812%0.12247%0.468CS..BIsolated β-bridgetrans-68.3140.4178.6-166.70000112.3H157 C169 C172 G275 C276H157-C167 HydrophobicContact CB-CB 4.35Å; H157-C167 VanDerWaalsContact CB-SG 3.58Å; H157-C167 PolarHBondContact O-SG 2.76Å; C167-C169 PolarHBondContact SG-N 3.3Å; C167-C169 VanDerWaalsContact SG-N 3.41Å; C167-C172 HydrophobicContact CB-CB 4.25Å; C167-G275 CarbonylContact O-C 3.48Å; C167-G275 WeakPolarHBondContact O-CA 3.32Å; C167-C276 PolarHBondContact O-N 3.1Å
168R75.6Confident69.4Low125 Ų12585.8 Ų85.847%0.47246%0.456SS..  trans-9610.8174.9-58.9177.9171.7-1730.7112.6F159 C161 C276F159-R168 HydrophobicContact CB-CB 4.3Å; F159-R168 WeakPolarHBondContact O-CA 3.02Å; F159-R168 WeakPolarHBondContact O-CB 3.29Å; F159-R168 WeakPolarHBondContact O-CG 3.43Å; F159-R168 PolarHBondContact O-N 2.85Å; C161-R168 HydrophobicContact CB-CG 4.09Å; C161-R168 PolarHBondContact SG-NH2 2.88Å; R168-C276 HydrophobicContact CG-CB 4.2Å
169C75.9Confident69.3Low23 Ų2382.4 Ų82.416%0.15544%0.442CS..  trans-61150.7179.993.70000111.9C167 E171 C172 T173C167-C169 PolarHBondContact SG-N 3.3Å; C167-C169 VanDerWaalsContact SG-N 3.41Å; C169-E171 VanDerWaalsContact C-N 3.34Å; C169-E171 PolarHBondContact O-N 3.49Å; C169-C172 HydrophobicContact CB-CB 4.11Å; C169-C172 WeakPolarHBondContact CB-SG 3.33Å; C169-C172 VanDerWaalsContact O-CB 3.28Å; C169-C172 WeakPolarHBondContact O-CB 3.16Å; C169-C172 PolarHBondContact O-N 3.48Å; C169-C172 VanDerWaalsContact O-N 3.09Å; C169-C172 WeakPolarHBondContact SG-CB 3.47Å; C169-C172 PolarHBondContact SG-N 3.24Å; C169-C172 CovalentContact SG-SG 2.05Å; C169-C172 PolarHBondContact SG-SG 3.1Å; C169-T173 WeakPolarHBondContact O-CB 3.46Å; C169-T173 WeakPolarHBondContact O-CG2 3.39Å; C169-T173 PolarHBondContact O-N 2.85Å; C169-T173 PolarHBondContact O-OG1 3.01Å
170T67.4Low68.6Low114 Ų11477.2 Ų77.270%0.69943%0.425SS*.Hα-helixtrans-60.1-43.4-179.545.70000111.6C172 T173 L174T170-C172 PolarHBondContact O-N 2.96Å; T170-T173 WeakPolarHBondContact CA-OG1 3.33Å; T170-T173 PolarHBondContact O-N 3.39Å; T170-T173 PolarHBondContact O-OG1 2.96Å; T170-L174 WeakPolarHBondContact O-CB 3.37Å; T170-L174 PolarHBondContact O-N 2.68Å
171E68.7Low67.3Low115 Ų11576.3 Ų76.354%0.53742%0.422SS..Hα-helixtrans-63.5-26.6175.9-60.3169.1-163.400113.9C169 R176C169-E171 VanDerWaalsContact C-N 3.34Å; C169-E171 PolarHBondContact O-N 3.49Å; E171-R176 PolarHBondContact O-NH2 3.03Å; E171-R176 VanDerWaalsContact O-NH2 3.1Å
172C68.7Low66.1Low9 Ų985 Ų856%0.06145%0.454CS..Hα-helixtrans-82.6-33.1180-51.50000111.7H157 C167 C169 T170 G275H157-C172 PolarHBondContact ND1-SG 2.72Å; C167-C172 HydrophobicContact CB-CB 4.25Å; C169-C172 HydrophobicContact CB-CB 4.11Å; C169-C172 WeakPolarHBondContact CB-SG 3.33Å; C169-C172 VanDerWaalsContact O-CB 3.28Å; C169-C172 WeakPolarHBondContact O-CB 3.16Å; C169-C172 PolarHBondContact O-N 3.48Å; C169-C172 VanDerWaalsContact O-N 3.09Å; C169-C172 WeakPolarHBondContact SG-CB 3.47Å; C169-C172 PolarHBondContact SG-N 3.24Å; C169-C172 CovalentContact SG-SG 2.05Å; C169-C172 PolarHBondContact SG-SG 3.1Å; T170-C172 PolarHBondContact O-N 2.96Å; C172-G275 VanDerWaalsContact O-CA 3.26Å; C172-G275 WeakPolarHBondContact O-CA 3.24Å; C172-G275 PolarHBondContact O-N 3.05Å
173T68Low64.9Low49 Ų4981.5 Ų81.530%0.30145%0.446SS..Hα-helixtrans-100.2-13.3-174.1530000113.2C169 T170 R273C169-T173 WeakPolarHBondContact O-CB 3.46Å; C169-T173 WeakPolarHBondContact O-CG2 3.39Å; C169-T173 PolarHBondContact O-N 2.85Å; C169-T173 PolarHBondContact O-OG1 3.01Å; T170-T173 WeakPolarHBondContact CA-OG1 3.33Å; T170-T173 PolarHBondContact O-N 3.39Å; T170-T173 PolarHBondContact O-OG1 2.96Å; T173-R273 PolarHBondContact O-NH1 3.27Å
174L61Low63.8Low102 Ų10275.5 Ų75.553%0.53442%0.421SS..SBendtrans-59144178.3-162.870.8000112.4T170 R176 R273T170-L174 WeakPolarHBondContact O-CB 3.37Å; T170-L174 PolarHBondContact O-N 2.68Å; L174-R176 PolarHBondContact O-N 2.95Å; L174-R273 PolarHBondContact O-NE 3.01Å
175P58.6Low62.7Low79 Ų7980.2 Ų80.251%0.51344%0.443SS..  trans-53.1134.2164.7-23.833.5000113.4D269 R273P175-D269 VanDerWaalsContact CA-OD2 3.27Å; P175-D269 WeakPolarHBondContact CA-OD2 3.31Å; P175-R273 VanDerWaalsContact CA-NH2 3.31Å
176R62.8Low62Low125 Ų12585.2 Ų85.247%0.47245%0.451SS..  trans-109.288.1177.9-70.8-68.8178.2167-3107.9E171 L174 Q265 D269 R273E171-R176 PolarHBondContact O-NH2 3.03Å; E171-R176 VanDerWaalsContact O-NH2 3.1Å; L174-R176 PolarHBondContact O-N 2.95Å; R176-Q265 PolarHBondContact O-NE2 3.2Å; R176-D269 PolarHBondContact N-OD2 3.44Å; R176-R273 HydrophobicContact CG-CG 4.48Å
177A60.3Low60.8Low78 Ų7889 Ų8965%0.64547%0.47SS*.  trans-45.9141.7171.400000110.5
178L56.1Low59.6Low51 Ų5190.9 Ų90.927%0.26748%0.482SS..  trans-55.4127.3176.8-84163.3000107.8S180 A192 Q265 Y268L178-S180 PolarHBondContact O-N 3.41Å; L178-A192 HydrophobicContact CD1-CB 4.42Å; L178-Q265 VanDerWaalsContact CB-OE1 3.31Å; L178-Q265 HydrophobicContact CD1-CB 3.85Å; L178-Q265 HydrophobicContact CG-CB 4.31Å; L178-Q265 VanDerWaalsContact CG-OE1 3.27Å; L178-Q265 VanDerWaalsContact N-CD 3.34Å; L178-Y268 HydrophobicContact CD2-CD1 4.08Å; L178-Y268 HydrophobicContact CD2-CD2 4.49Å; L178-Y268 HydrophobicContact CD2-CG 3.98Å
179P57.4Low58.5Low59 Ų5991.8 Ų91.838%0.38350%0.496SS..  trans-54.6133.1173-23.231.5000109.9C181P179-C181 PolarHBondContact O-N 3.48Å
180S54.8Low57.6Low49 Ų4993.4 Ų93.434%0.34351%0.507SS..THydrogen-bonded Turntrans-70.312.4178.949.20000114.4L178 C190L178-S180 PolarHBondContact O-N 3.41Å; S180-C190 CarbonylContact O-C 3.59Å
181C50.9Low57.8Low58 Ų5890 Ų9039%0.39249%0.487SS..THydrogen-bonded Turntrans-131.525.7-159.6-45.10000113.4P179P179-C181 PolarHBondContact O-N 3.48Å
182W50.5Low58.1Low181 Ų18186.6 Ų86.669%0.68648%0.479SS*.SBendtrans-80.1-22.5-176-87.368.7000115.1Y268W182-Y268 AromaticContact CZ2-CE2 3.92Å; W182-Y268 HydrophobicContact CZ2-CE2 3.92Å
183V51.9Low58.5Low125 Ų12589.4 Ų89.476%0.75849%0.491SS*.SBendtrans-113.7-25.3-169.6178.80000112.9
184C47.3Very low58.9Low24 Ų2489.6 Ų89.616%0.16250%0.495CS..SBendtrans-130.9135.1-179.7-1770000107.9Q186 E187 C188C184-Q186 PolarHBondContact O-N 3.09Å; C184-E187 VanDerWaalsContact SG-C 3.56Å; C184-C188 HydrophobicContact CB-CB 3.39Å; C184-C188 WeakPolarHBondContact CB-SG 3.13Å; C184-C188 WeakPolarHBondContact SG-CB 3.49Å; C184-C188 PolarHBondContact SG-N 3.26Å; C184-C188 CovalentContact SG-SG 2.04Å; C184-C188 PolarHBondContact SG-SG 2.89Å
185N52.3Low59.8Low145 Ų14590 Ų9078%0.77550%0.497SS*.SBendtrans-77.163.7-163.3-165.18.8000112.1E187N185-E187 PolarHBondContact O-N 3.09Å
186Q53.5Low61.1Low165 Ų16587 Ų8777%0.77148%0.477SS*.SBendtrans65-2.8-167.1-60.5-176.889.200116.5C184C184-Q186 PolarHBondContact O-N 3.09Å
187E53.6Low62.1Low176 Ų17681.9 Ų81.982%0.82246%0.459SS*.SBendtrans-85-7.8-177.8-60.5-174.7145.700114.8C184 N185C184-E187 VanDerWaalsContact SG-C 3.56Å; N185-E187 PolarHBondContact O-N 3.09Å
188C55.8Low63.1Low56 Ų5682.9 Ų82.938%0.37846%0.457SS..SBendtrans-136.5130.2-179.7-36.10000110.7C184 C190C184-C188 HydrophobicContact CB-CB 3.39Å; C184-C188 WeakPolarHBondContact CB-SG 3.13Å; C184-C188 WeakPolarHBondContact SG-CB 3.49Å; C184-C188 PolarHBondContact SG-N 3.26Å; C184-C188 CovalentContact SG-SG 2.04Å; C184-C188 PolarHBondContact SG-SG 2.89Å; C188-C190 VanDerWaalsContact CB-SG 3.54Å; C188-C190 PolarHBondContact O-N 2.72Å
189L52.8Low64.3Low145 Ų14583.9 Ų83.976%0.75947%0.473SS*.  trans-74.254.5172.1-77.4164.5000112S191L189-S191 VanDerWaalsContact C-N 3.26Å; L189-S191 PolarHBondContact O-N 2.87Å
190C57.9Low65.7Low57 Ų5781.3 Ų81.339%0.38546%0.456SS..  trans-77.972.9179.3-690000111.2S180 C188S180-C190 CarbonylContact O-C 3.59Å; C188-C190 VanDerWaalsContact CB-SG 3.54Å; C188-C190 PolarHBondContact O-N 2.72Å
191S71.4Confident67.2Low41 Ų4180.1 Ų80.129%0.28745%0.448SS..  trans-60145.2166.694.10000110L189 Q193 S194 L195L189-S191 VanDerWaalsContact C-N 3.26Å; L189-S191 PolarHBondContact O-N 2.87Å; S191-Q193 PolarHBondContact O-N 3.3Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 PolarHBondContact OG-N 2.77Å; S191-S194 WeakPolarHBondContact O-CB 3.28Å; S191-S194 PolarHBondContact O-N 2.95Å; S191-S194 WeakPolarHBondContact OG-CB 3.26Å; S191-S194 PolarHBondContact OG-N 3.41Å; S191-S194 PolarHBondContact OG-OG 3.24Å; S191-L195 PolarHBondContact O-N 2.94Å; S191-L195 VanDerWaalsContact O-N 3.09Å
192A75.4Confident68.7Low45 Ų4577.8 Ų77.837%0.37243%0.431SS..Hα-helixtrans-58.3-30.3178.100000112.2L178 V196L178-A192 HydrophobicContact CD1-CB 4.42Å; A192-V196 VanDerWaalsContact O-CG2 3.31Å; A192-V196 WeakPolarHBondContact O-CG2 3.12Å; A192-V196 PolarHBondContact O-N 3.35Å
193Q76.3Confident70.2Confident67 Ų6771.9 Ų71.931%0.31342%0.417SS..Hα-helixtrans-71.2-42.7175.3-169.263.550.400111.7S191 L195 V196 D197S191-Q193 PolarHBondContact O-N 3.3Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 PolarHBondContact OG-N 2.77Å; Q193-L195 VanDerWaalsContact C-N 3.3Å; Q193-L195 PolarHBondContact O-N 3.33Å; Q193-V196 PolarHBondContact O-N 3.15Å; Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 WeakPolarHBondContact O-CB 3.28Å; Q193-D197 VanDerWaalsContact O-CG 3.23Å; Q193-D197 PolarHBondContact O-N 3.15Å
194S75.9Confident71.7Confident54 Ų5470.2 Ų70.238%0.37840%0.403SS..Hα-helixtrans-61.3-38.8177.1-51.70000111.9S191 T198S191-S194 WeakPolarHBondContact O-CB 3.28Å; S191-S194 PolarHBondContact O-N 2.95Å; S191-S194 WeakPolarHBondContact OG-CB 3.26Å; S191-S194 PolarHBondContact OG-N 3.41Å; S191-S194 PolarHBondContact OG-OG 3.24Å; S194-T198 WeakPolarHBondContact O-CB 3.14Å; S194-T198 PolarHBondContact O-N 3.47Å; S194-T198 VanDerWaalsContact O-N 3.08Å; S194-T198 PolarHBondContact O-OG1 3.48Å
195L81.2Confident73.5Confident110 Ų11069.1 Ų69.158%0.57640%0.396SS*.Hα-helixtrans-65.7-44.8174.618061.9000111.8S191 Q193 T198 A199S191-L195 PolarHBondContact O-N 2.94Å; S191-L195 VanDerWaalsContact O-N 3.09Å; Q193-L195 VanDerWaalsContact C-N 3.3Å; Q193-L195 PolarHBondContact O-N 3.33Å; L195-T198 PolarHBondContact O-N 2.95Å; L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 3.48Å
196V84.3Confident74.9Confident16 Ų1665.5 Ų65.510%0.09737%0.373CS..Hα-helixtrans-61.3-46.8175.8168.40000110.5A192 Q193 T198 A199 T200 Y254 A257 A261A192-V196 VanDerWaalsContact O-CG2 3.31Å; A192-V196 WeakPolarHBondContact O-CG2 3.12Å; A192-V196 PolarHBondContact O-N 3.35Å; Q193-V196 PolarHBondContact O-N 3.15Å; V196-T198 VanDerWaalsContact C-N 3.33Å; V196-T198 PolarHBondContact O-N 2.86Å; V196-A199 PolarHBondContact O-N 2.78Å; V196-T200 HydrophobicContact CG1-CG2 4.22Å; V196-T200 VanDerWaalsContact O-CB 3.27Å; V196-T200 WeakPolarHBondContact O-CB 3.2Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 2.79Å; V196-T200 PolarHBondContact O-OG1 3.35Å; V196-Y254 HydrophobicContact CG1-CD2 3.75Å; V196-Y254 HydrophobicContact CG1-CE2 3.87Å; V196-A257 HydrophobicContact CG1-CB 4.03Å; V196-A257 HydrophobicContact CG2-CB 4.28Å; V196-A261 HydrophobicContact CG2-CB 4.19Å
197D83.8Confident76.2Confident18 Ų1859.1 Ų59.110%0.09635%0.352CS..Hα-helixtrans-60.8-40.6-179-71.40.4000112.1Q193 C201 M202 C203 K206 Y254Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 WeakPolarHBondContact O-CB 3.28Å; Q193-D197 VanDerWaalsContact O-CG 3.23Å; Q193-D197 PolarHBondContact O-N 3.15Å; D197-C201 PolarHBondContact O-N 3.23Å; D197-M202 PolarHBondContact O-N 3.18Å; D197-C203 PolarHBondContact O-N 3.06Å; D197-K206 IonicContact OD1-NZ 3.86Å; D197-K206 IonicContact OD2-NZ 2.68Å; D197-K206 PolarHBondContact OD2-NZ 2.82Å; D197-Y254 WeakPolarHBondContact OD1-CE2 3.27Å
198T81.6Confident77.5Confident98 Ų9853.4 Ų53.460%0.60133%0.326SS*.Hα-helixtrans-72.1-48.1177.1-58.80000112.2S194 L195 V196 T200 C201S194-T198 WeakPolarHBondContact O-CB 3.14Å; S194-T198 PolarHBondContact O-N 3.47Å; S194-T198 VanDerWaalsContact O-N 3.08Å; S194-T198 PolarHBondContact O-OG1 3.48Å; L195-T198 PolarHBondContact O-N 2.95Å; V196-T198 VanDerWaalsContact C-N 3.33Å; V196-T198 PolarHBondContact O-N 2.86Å; T198-T200 PolarHBondContact O-N 2.97Å; T198-C201 PolarHBondContact O-N 2.77Å
199A82.4Confident78.5Confident73 Ų7351.5 Ų51.560%0.60331%0.312SS*.Hα-helixtrans-67.3-22.5-177.400000113.6L195 V196L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 3.48Å; V196-A199 PolarHBondContact O-N 2.78Å
200T85.8Confident79.6Confident4 Ų451 Ų513%0.02530%0.301CS..THydrogen-bonded Turntrans-104.73.7-176.8640000112.9V196 T198 M202 C250 L251 Y254 A257V196-T200 HydrophobicContact CG1-CG2 4.22Å; V196-T200 VanDerWaalsContact O-CB 3.27Å; V196-T200 WeakPolarHBondContact O-CB 3.2Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 2.79Å; V196-T200 PolarHBondContact O-OG1 3.35Å; T198-T200 PolarHBondContact O-N 2.97Å; T200-M202 PolarHBondContact O-N 2.04Å; T200-C250 WeakPolarHBondContact CA-O 3.2Å; T200-C250 WeakPolarHBondContact CB-O 3.49Å; T200-C250 CarbonylContact O-C 3.49Å; T200-L251 WeakPolarHBondContact O-CA 3.48Å; T200-L251 VanDerWaalsContact O-CD2 3.32Å; T200-L251 WeakPolarHBondContact O-CD2 3.38Å; T200-L251 PolarHBondContact O-N 3.17Å; T200-Y254 HydrophobicContact CG2-CD2 4.35Å; T200-Y254 WeakPolarHBondContact OG1-CD2 3.13Å; T200-A257 HydrophobicContact CG2-CB 4.07Å
201C85.6Confident80.4Confident24 Ų2453.9 Ų53.916%0.16231%0.308CS..THydrogen-bonded Turntrans63.811.3-176.6-42.40000114.4D197 T198 C203 L204 L248 C250 L251D197-C201 PolarHBondContact O-N 3.23Å; T198-C201 PolarHBondContact O-N 2.77Å; C201-C203 PolarHBondContact O-N 2.84Å; C201-L204 HydrophobicContact CB-CD1 4.29Å; C201-L204 WeakPolarHBondContact O-CB 3.26Å; C201-L204 PolarHBondContact O-N 2.05Å; C201-L204 VanDerWaalsContact O-N 3.07Å; C201-L248 HydrophobicContact CB-CD1 4.2Å; C201-C250 HydrophobicContact CB-CB 4.18Å; C201-C250 WeakPolarHBondContact CB-SG 3.07Å; C201-C250 WeakPolarHBondContact SG-CB 3.07Å; C201-C250 CovalentContact SG-SG 2.05Å; C201-C250 PolarHBondContact SG-SG 2.92Å; C201-L251 HydrophobicContact CB-CD2 4.48Å; C201-L251 HydrophobicContact CB-CG 4.49Å
202M84.1Confident80.1Confident9 Ų955.6 Ų55.64%0.04432%0.319CS..Hα-helixtrans-66.9-22.4178.7-172.557.266.600112.4D197 T200 L204 V205 K206 P226 L251 Y254D197-M202 PolarHBondContact O-N 3.18Å; T200-M202 PolarHBondContact O-N 2.04Å; M202-L204 VanDerWaalsContact C-N 3.31Å; M202-L204 PolarHBondContact O-N 3.38Å; M202-V205 PolarHBondContact O-N 3.04Å; M202-V205 HydrophobicContact SD-CB 3.78Å; M202-V205 HydrophobicContact SD-CG1 3.76Å; M202-V205 HydrophobicContact SD-CG2 4.28Å; M202-K206 WeakPolarHBondContact O-CG 3.37Å; M202-K206 PolarHBondContact O-N 3.33Å; M202-P226 HydrophobicContact SD-CG 4.36Å; M202-L251 HydrophobicContact CB-CD2 4.4Å; M202-L251 HydrophobicContact CE-CD2 3.81Å; M202-L251 HydrophobicContact SD-CD2 4.41Å; M202-Y254 HydrophobicContact CB-CD2 3.87Å; M202-Y254 HydrophobicContact CB-CE2 4.02Å; M202-Y254 HydrophobicContact CB-CG 4.43Å; M202-Y254 HydrophobicContact CE-CD1 3.48Å; M202-Y254 VanDerWaalsContact CE-CD1 3.48Å; M202-Y254 HydrophobicContact CE-CD2 4.14Å; M202-Y254 HydrophobicContact CE-CE1 3.87Å; M202-Y254 HydrophobicContact CE-CE2 4.48Å; M202-Y254 HydrophobicContact CE-CG 3.61Å; M202-Y254 HydrophobicContact CG-CD2 4.01Å; M202-Y254 HydrophobicContact CG-CE1 4.46Å; M202-Y254 HydrophobicContact CG-CE2 3.78Å; M202-Y254 HydrophobicContact CG-CG 4.44Å
203C82Confident79.4Confident57 Ų5755 Ų5539%0.38531%0.311SS..Hα-helixtrans-58.8-39.2168.456.20000112.9D197 C201 K206 G207D197-C203 PolarHBondContact O-N 3.06Å; C201-C203 PolarHBondContact O-N 2.84Å; C203-K206 PolarHBondContact O-N 2.92Å; C203-G207 PolarHBondContact O-N 2.61Å
204L82.8Confident78.2Confident91 Ų9157.7 Ų57.748%0.47632%0.324SS..Hα-helixtrans-67-42.5176.9-59.6178.2000110.9C201 M202 K206 G207 I208 L248C201-L204 HydrophobicContact CB-CD1 4.29Å; C201-L204 WeakPolarHBondContact O-CB 3.26Å; C201-L204 PolarHBondContact O-N 2.05Å; C201-L204 VanDerWaalsContact O-N 3.07Å; M202-L204 VanDerWaalsContact C-N 3.31Å; M202-L204 PolarHBondContact O-N 3.38Å; L204-K206 PolarHBondContact O-N 3.38Å; L204-G207 PolarHBondContact O-N 3.18Å; L204-I208 WeakPolarHBondContact O-CD1 3.31Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.25Å; L204-L248 HydrophobicContact CD1-CD1 3.96Å
205V84.3Confident77.1Confident0 Ų062.1 Ų62.10%034%0.343CS..Hα-helixtrans-57.9-49.1174.6170.70000110.8M202 G207 I208 F209 P226 M241 L244 L251M202-V205 PolarHBondContact O-N 3.04Å; M202-V205 HydrophobicContact SD-CB 3.78Å; M202-V205 HydrophobicContact SD-CG1 3.76Å; M202-V205 HydrophobicContact SD-CG2 4.28Å; V205-G207 PolarHBondContact O-N 3.25Å; V205-I208 PolarHBondContact O-N 3.04Å; V205-F209 HydrophobicContact CG1-CD2 3.74Å; V205-F209 HydrophobicContact CG1-CE2 3.88Å; V205-F209 VanDerWaalsContact O-CD2 3.31Å; V205-F209 WeakPolarHBondContact O-CD2 3.34Å; V205-F209 PolarHBondContact O-N 3.42Å; V205-P226 HydrophobicContact CG1-CB 4.42Å; V205-M241 HydrophobicContact CG1-CE 3.52Å; V205-M241 HydrophobicContact CG1-SD 3.56Å; V205-M241 VanDerWaalsContact CG1-SD 3.56Å; V205-M241 HydrophobicContact CG2-SD 4.45Å; V205-L244 HydrophobicContact CG2-CD1 3.91Å; V205-L251 HydrophobicContact CG2-CD1 3.77Å; V205-L251 HydrophobicContact CG2-CD2 3.52Å; V205-L251 HydrophobicContact CG2-CG 4.32Å
206K82.1Confident75.8Confident69 Ų6963 Ų6330%0.334%0.344SS..Hα-helixtrans-59.3-43.5176.7-71.6175.9177.7-177.10112.2D197 M202 C203 L204 F209 Y210D197-K206 IonicContact OD1-NZ 3.86Å; D197-K206 IonicContact OD2-NZ 2.68Å; D197-K206 PolarHBondContact OD2-NZ 2.82Å; M202-K206 WeakPolarHBondContact O-CG 3.37Å; M202-K206 PolarHBondContact O-N 3.33Å; C203-K206 PolarHBondContact O-N 2.92Å; L204-K206 PolarHBondContact O-N 3.38Å; K206-F209 PolarHBondContact O-N 3.47Å; K206-Y210 WeakPolarHBondContact O-CB 3.34Å; K206-Y210 PolarHBondContact O-N 3.08Å
207G81.8Confident74.3Confident32 Ų3270.6 Ų70.633%0.3339%0.385SS..Hα-helixtrans-65.4-37.5177.200000113.8C203 L204 V205 Y210 H211C203-G207 PolarHBondContact O-N 2.61Å; L204-G207 PolarHBondContact O-N 3.18Å; V205-G207 PolarHBondContact O-N 3.25Å; G207-Y210 PolarHBondContact O-N 3.21Å; G207-H211 PolarHBondContact O-CD2 3.18Å; G207-H211 PolarHBondContact O-N 3.05Å
208I79.5Confident73Confident56 Ų5675.4 Ų75.429%0.28741%0.41SS..Hα-helixtrans-68.9-45.4174.6-62.9158.8000110.5L204 V205 Y210 H211 C212 F240 L244L204-I208 WeakPolarHBondContact O-CD1 3.31Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.25Å; V205-I208 PolarHBondContact O-N 3.04Å; I208-Y210 VanDerWaalsContact C-N 3.26Å; I208-Y210 PolarHBondContact O-N 2.99Å; I208-H211 PolarHBondContact O-N 3.01Å; I208-C212 VanDerWaalsContact O-CB 3.24Å; I208-C212 WeakPolarHBondContact O-CB 3.42Å; I208-C212 PolarHBondContact O-N 3.09Å; I208-C212 PolarHBondContact O-SG 2.74Å; I208-C212 VanDerWaalsContact O-SG 3.34Å; I208-F240 HydrophobicContact CG2-CE1 3.73Å; I208-F240 HydrophobicContact CG2-CZ 3.71Å; I208-L244 HydrophobicContact CD1-CD1 4.02Å; I208-L244 HydrophobicContact CD1-CD2 4.37Å
209F77.6Confident71.6Confident15 Ų1579.8 Ų79.87%0.06642%0.424CS..Hα-helixtrans-63.6-31.5176-86-72.5000112.9V205 K206 T213 C222 A223 R237 F240 M241V205-F209 HydrophobicContact CG1-CD2 3.74Å; V205-F209 HydrophobicContact CG1-CE2 3.88Å; V205-F209 VanDerWaalsContact O-CD2 3.31Å; V205-F209 WeakPolarHBondContact O-CD2 3.34Å; V205-F209 PolarHBondContact O-N 3.42Å; K206-F209 PolarHBondContact O-N 3.47Å; F209-T213 PolarHBondContact O-OG1 3.39Å; F209-T213 VanDerWaalsContact O-OG1 3.08Å; F209-C222 HydrophobicContact CD1-CB 4.37Å; F209-A223 HydrophobicContact CB-CB 4.47Å; F209-R237 HydrophobicContact CE1-CG 4.12Å; F209-R237 HydrophobicContact CZ-CB 4.42Å; F209-F240 HydrophobicContact CE2-CD1 4.08Å; F209-F240 HydrophobicContact CE2-CE1 4.42Å; F209-F240 AromaticContact CZ-CD1 3.9Å; F209-F240 HydrophobicContact CZ-CD1 3.9Å; F209-M241 HydrophobicContact CD2-CE 4.04Å; F209-M241 HydrophobicContact CE2-CE 3.27Å; F209-M241 HydrophobicContact CE2-SD 3.92Å; F209-M241 HydrophobicContact CZ-CE 3.9Å
210Y75.1Confident70.2Confident136 Ų13678.1 Ų78.153%0.53341%0.414SS..Hα-helixtrans-62.1-54.5173.8-178.5-105.8000111.4K206 G207 I208K206-Y210 WeakPolarHBondContact O-CB 3.34Å; K206-Y210 PolarHBondContact O-N 3.08Å; G207-Y210 PolarHBondContact O-N 3.21Å; I208-Y210 VanDerWaalsContact C-N 3.26Å; I208-Y210 PolarHBondContact O-N 2.99Å
211H74.6Confident68.9Low116 Ų11681 Ų8154%0.53743%0.434SS..Hα-helixtrans-73.6-33.4-179-71.9-52.5000114.2G207 I208 T213 E214G207-H211 PolarHBondContact O-CD2 3.18Å; G207-H211 PolarHBondContact O-N 3.05Å; I208-H211 PolarHBondContact O-N 3.01Å; H211-T213 PolarHBondContact O-N 3.45Å; H211-E214 IonicContact CE1-OE2 3.69Å; H211-E214 IonicContact CG-OE2 2.95Å; H211-E214 IonicContact ND1-OE2 3.21Å; H211-E214 PolarHBondContact ND1-OE2 3.16Å; H211-E214 PolarHBondContact O-N 2.9Å
212C65.6Low67.4Low78 Ų7880.1 Ų80.153%0.52743%0.428SS..THydrogen-bonded Turntrans-75.10.1179.5-68.60000114.4I208I208-C212 VanDerWaalsContact O-CB 3.24Å; I208-C212 WeakPolarHBondContact O-CB 3.42Å; I208-C212 PolarHBondContact O-N 3.09Å; I208-C212 PolarHBondContact O-SG 2.74Å; I208-C212 VanDerWaalsContact O-SG 3.34Å
213T60.5Low66Low32 Ų3280.5 Ų80.520%0.19643%0.432CS..THydrogen-bonded Turntrans-126.319.9172.367.40000112.9F209 H211 D215 C222F209-T213 PolarHBondContact O-OG1 3.39Å; F209-T213 VanDerWaalsContact O-OG1 3.08Å; H211-T213 PolarHBondContact O-N 3.45Å; T213-D215 VanDerWaalsContact C-N 3.28Å; T213-C222 HydrophobicContact CG2-CB 3.94Å; T213-C222 WeakPolarHBondContact CG2-SG 3.27Å; T213-C222 PolarHBondContact OG1-SG 2.82Å
214E50.8Low64.8Low123 Ų12384.5 Ų84.558%0.57545%0.45SS*.SBendtrans-78.8-19.2159.5-66.1-176100.600110.9H211H211-E214 IonicContact CE1-OE2 3.69Å; H211-E214 IonicContact CG-OE2 2.95Å; H211-E214 IonicContact ND1-OE2 3.21Å; H211-E214 PolarHBondContact ND1-OE2 3.16Å; H211-E214 PolarHBondContact O-N 2.9Å
215D54.1Low63.7Low148 Ų14886.3 Ų86.379%0.79145%0.454SS*.SBendtrans-93.7-12.3-177.5-65.8-40.2000114.9T213T213-D215 VanDerWaalsContact C-N 3.28Å
216E54Low62.5Low127 Ų12787 Ų8759%0.59346%0.459SS*.SBendtrans-127.8137.5176.3-62.4-160.3148.800109.8D218E216-D218 PolarHBondContact O-N 3.31Å
217D52.8Low61.3Low177 Ų17786.9 Ų86.995%0.94747%0.466SS*.SBendtrans-68.916.4-159.8-45.2-86.8000116.9E219D217-E219 PolarHBondContact O-N 3.2Å
218D56.1Low60.2Low119 Ų11986.7 Ų86.764%0.63646%0.459SS*.  trans-95.968179.6-89.7-49.5000111.8E216 G220E216-D218 PolarHBondContact O-N 3.31Å; D218-G220 PolarHBondContact O-N 3.21Å
219E51.3Low59.1Low190 Ų19088.1 Ų88.189%0.88847%0.473SS*.  trans-47115.1-174.9-164.9178.79800114.2D217 S221D217-E219 PolarHBondContact O-N 3.2Å; E219-S221 PolarHBondContact O-N 3.46Å
220G53.1Low58.1Low38 Ų3892 Ų9239%0.39250%0.502SS..SBendtrans71.8-26162.600000118.7D218 C222 A223D218-G220 PolarHBondContact O-N 3.21Å; G220-C222 PolarHBondContact O-N 2.95Å; G220-A223 PolarHBondContact O-N 3.47Å
221S58.1Low57.4Low65 Ų6588 Ų8846%0.45549%0.489SS..Hα-helixtrans-61.6-22.1-169.8-164.40000114.4E219 Q231E219-S221 PolarHBondContact O-N 3.46Å; S221-Q231 PolarHBondContact OG-NE2 2.77Å; S221-Q231 VanDerWaalsContact OG-NE2 3.09Å
222C54.6Low56.6Low5 Ų586.3 Ų86.33%0.03450%0.495CS..Hα-helixtrans-72.9-40.4-180590000114.4F209 T213 G220 K225 R237F209-C222 HydrophobicContact CD1-CB 4.37Å; T213-C222 HydrophobicContact CG2-CB 3.94Å; T213-C222 WeakPolarHBondContact CG2-SG 3.27Å; T213-C222 PolarHBondContact OG1-SG 2.82Å; G220-C222 PolarHBondContact O-N 2.95Å; C222-K225 CarbonylContact O-C 3.55Å; C222-R237 PolarHBondContact O-NH2 3.14Å
223A54.4Low56.5Low16 Ų1687.8 Ų87.813%0.13250%0.497CS..Hα-helixtrans-81-32.7-166.800000112F209 G220 P226F209-A223 HydrophobicContact CB-CB 4.47Å; G220-A223 PolarHBondContact O-N 3.47Å; A223-P226 WeakPolarHBondContact O-CD 3.48Å
224D58.4Low56.9Low141 Ų14187.7 Ų87.775%0.75450%0.498SS*.Hα-helixtrans-70.8-30176.5-74-32.5000113.2P226D224-P226 VanDerWaalsContact C-CD 3.44Å
225K59.4Low57.8Low129 Ų12986.6 Ų86.656%0.56150%0.502SS*.  trans-131.366.1-174.6-98.4163.664.4-175.20112.6C222 C227 S228C222-K225 CarbonylContact O-C 3.55Å; K225-C227 PolarHBondContact O-N 3.46Å; K225-S228 PolarHBondContact O-N 2.68Å
226P58.5Low58.8Low15 Ų1582.5 Ų82.510%0.09749%0.489CS..THydrogen-bonded Turntrans-53-28.2179.316.1-30.3000114.7M202 V205 A223 D224 M241M202-P226 HydrophobicContact SD-CG 4.36Å; V205-P226 HydrophobicContact CG1-CB 4.42Å; A223-P226 WeakPolarHBondContact O-CD 3.48Å; D224-P226 VanDerWaalsContact C-CD 3.44Å; P226-M241 HydrophobicContact CB-CE 3.24Å; P226-M241 VanDerWaalsContact O-CE 3.22Å; P226-M241 WeakPolarHBondContact O-CE 3.1Å
227C58.1Low59.9Low66 Ų6678 Ų7845%0.44647%0.467SS..THydrogen-bonded Turntrans-105.918-174.9-46.20000114.6K225 W238K225-C227 PolarHBondContact O-N 3.46Å; C227-W238 HydrophobicContact CB-CH2 4.39Å
228S58.3Low61.2Low28 Ų2875.4 Ų75.420%0.19644%0.444CS..  trans-85.2128.9-177.4-163.60000112.6K225 S230K225-S228 PolarHBondContact O-N 2.68Å; S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 3.47Å; S228-S230 PolarHBondContact OG-OG 3.34Å; S228-S230 VanDerWaalsContact OG-OG 3.08Å
229C54.9Low62.4Low86 Ų8673.4 Ų73.458%0.58144%0.439SS*.  trans-866.3178.8-59.80000114.8W238C229-W238 VanDerWaalsContact SG-CZ2 3.6Å; C229-W238 PolarHBondContact SG-NE1 3.45Å
230S57.3Low63.8Low97 Ų9768.2 Ų68.268%0.67841%0.414SS*.  trans-98.611.2-164.867.50000115.8S228S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 3.47Å; S228-S230 PolarHBondContact OG-OG 3.34Å; S228-S230 VanDerWaalsContact OG-OG 3.08Å
231Q61.4Low65.1Low53 Ų5367.7 Ų67.725%0.24840%0.401CS..SBendtrans-114.2155.6-178.4-93.5165-21.100111.4S221 C234S221-Q231 PolarHBondContact OG-NE2 2.77Å; S221-Q231 VanDerWaalsContact OG-NE2 3.09Å; Q231-C234 PolarHBondContact O-N 3.07Å
232A57.4Low66.2Low80 Ų8067 Ų6766%0.66140%0.399SS*.THydrogen-bonded Turntrans-52150159.800000109.2C234A232-C234 VanDerWaalsContact C-N 3.27Å; A232-C234 PolarHBondContact O-N 3.3Å
233N63.1Low67.7Low109 Ų10969.4 Ų69.458%0.58342%0.42SS*.THydrogen-bonded Turntrans6618.1-176.7-50.8-34000116.2C235 A236 R237N233-C235 VanDerWaalsContact C-N 3.35Å; N233-C235 PolarHBondContact O-N 3.17Å; N233-A236 HydrophobicContact CB-CB 4.44Å; N233-A236 PolarHBondContact O-N 2.96Å; N233-A236 VanDerWaalsContact O-N 3.08Å; N233-R237 PolarHBondContact O-N 3.39Å; N233-R237 VanDerWaalsContact O-N 3.15Å
234C68Low69Low30 Ų3069.9 Ų69.920%0.20342%0.42CS..Hα-helixtrans-42.1-54.5171.5-178.40000113.2Q231 A232 A236 R237 W238Q231-C234 PolarHBondContact O-N 3.07Å; A232-C234 VanDerWaalsContact C-N 3.27Å; A232-C234 PolarHBondContact O-N 3.3Å; C234-A236 VanDerWaalsContact C-N 3.34Å; C234-A236 PolarHBondContact O-N 3.19Å; C234-R237 PolarHBondContact O-N 3.38Å; C234-W238 PolarHBondContact O-N 2.86Å
235C71.3Confident70.2Confident100 Ų10064.7 Ų64.768%0.67640%0.395SS*.Hα-helixtrans-62-35.3-178.2-61.10000114.1N233 S239N233-C235 VanDerWaalsContact C-N 3.35Å; N233-C235 PolarHBondContact O-N 3.17Å; C235-S239 VanDerWaalsContact O-CB 3.32Å; C235-S239 WeakPolarHBondContact O-CB 3.48Å; C235-S239 PolarHBondContact O-N 2.89Å; C235-S239 PolarHBondContact O-OG 3.34Å
236A75.3Confident71.2Confident62 Ų6264.3 Ų64.351%0.51240%0.403SS..Hα-helixtrans-67.1-42.5177.300000110.4N233 C234 S239 F240N233-A236 HydrophobicContact CB-CB 4.44Å; N233-A236 PolarHBondContact O-N 2.96Å; N233-A236 VanDerWaalsContact O-N 3.08Å; C234-A236 VanDerWaalsContact C-N 3.34Å; C234-A236 PolarHBondContact O-N 3.19Å; A236-S239 PolarHBondContact O-N 3.43Å; A236-F240 WeakPolarHBondContact O-CB 3.24Å; A236-F240 PolarHBondContact O-N 2.66Å
237R76Confident72.4Confident33 Ų3369 Ų6913%0.12543%0.432CS..Hα-helixtrans-65.9-44.2177.9-62.9-176.962.8168.2-1.9112.5F209 C222 N233 C234 S239 F240 M241F209-R237 HydrophobicContact CE1-CG 4.12Å; F209-R237 HydrophobicContact CZ-CB 4.42Å; C222-R237 PolarHBondContact O-NH2 3.14Å; N233-R237 PolarHBondContact O-N 3.39Å; N233-R237 VanDerWaalsContact O-N 3.15Å; C234-R237 PolarHBondContact O-N 3.38Å; R237-S239 VanDerWaalsContact C-N 3.34Å; R237-S239 PolarHBondContact O-N 2.98Å; R237-F240 PolarHBondContact O-N 3.29Å; R237-M241 VanDerWaalsContact O-CG 3.25Å; R237-M241 WeakPolarHBondContact O-CG 3.32Å; R237-M241 PolarHBondContact O-N 2.9Å
238W80.8Confident73.5Confident121 Ų12168 Ų6846%0.45842%0.421SS..Hα-helixtrans-64.4-37.5173.9-76.2100.7000112.3C227 C229 C234 M241 A242C227-W238 HydrophobicContact CB-CH2 4.39Å; C229-W238 VanDerWaalsContact SG-CZ2 3.6Å; C229-W238 PolarHBondContact SG-NE1 3.45Å; C234-W238 PolarHBondContact O-N 2.86Å; W238-M241 PolarHBondContact O-N 3.44Å; W238-A242 WeakPolarHBondContact O-CB 3.33Å; W238-A242 PolarHBondContact O-N 3.32Å
239S80.2Confident74.6Confident78 Ų7870.7 Ų70.755%0.54544%0.438SS..Hα-helixtrans-64.6-41.2173.8-58.90000112.1C235 A236 R237 A242 A243C235-S239 VanDerWaalsContact O-CB 3.32Å; C235-S239 WeakPolarHBondContact O-CB 3.48Å; C235-S239 PolarHBondContact O-N 2.89Å; C235-S239 PolarHBondContact O-OG 3.34Å; A236-S239 PolarHBondContact O-N 3.43Å; R237-S239 VanDerWaalsContact C-N 3.34Å; R237-S239 PolarHBondContact O-N 2.98Å; S239-A242 PolarHBondContact O-N 2.9Å; S239-A243 WeakPolarHBondContact O-CB 3.41Å; S239-A243 PolarHBondContact O-N 3.49Å
240F82Confident75.9Confident80 Ų8068 Ų6835%0.35142%0.42SS..Hα-helixtrans-65.7-44.3176.4-173.2-110.8000111.9I208 F209 A236 R237 A242 A243 L244I208-F240 HydrophobicContact CG2-CE1 3.73Å; I208-F240 HydrophobicContact CG2-CZ 3.71Å; F209-F240 HydrophobicContact CE2-CD1 4.08Å; F209-F240 HydrophobicContact CE2-CE1 4.42Å; F209-F240 AromaticContact CZ-CD1 3.9Å; F209-F240 HydrophobicContact CZ-CD1 3.9Å; A236-F240 WeakPolarHBondContact O-CB 3.24Å; A236-F240 PolarHBondContact O-N 2.66Å; R237-F240 PolarHBondContact O-N 3.29Å; F240-A242 VanDerWaalsContact C-N 3.32Å; F240-A242 PolarHBondContact O-N 2.9Å; F240-A243 PolarHBondContact O-N 2.72Å; F240-L244 HydrophobicContact CD1-CD1 4.01Å; F240-L244 HydrophobicContact CD1-CG 4.46Å; F240-L244 HydrophobicContact CE1-CD1 3.47Å; F240-L244 VanDerWaalsContact CE1-CD1 3.47Å; F240-L244 HydrophobicContact CE1-CG 4.09Å; F240-L244 HydrophobicContact CE2-CG 4.48Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.25Å; F240-L244 HydrophobicContact CZ-CG 4.07Å; F240-L244 WeakPolarHBondContact O-CG 3.21Å; F240-L244 PolarHBondContact O-N 3.31Å
241M79.5Confident77Confident27 Ų2764.2 Ų64.213%0.13339%0.392CS..Hα-helixtrans-58.6-42.7171.6-70.5-65.8-165.900112.5V205 F209 P226 R237 W238 L244 S245V205-M241 HydrophobicContact CG1-CE 3.52Å; V205-M241 HydrophobicContact CG1-SD 3.56Å; V205-M241 VanDerWaalsContact CG1-SD 3.56Å; V205-M241 HydrophobicContact CG2-SD 4.45Å; F209-M241 HydrophobicContact CD2-CE 4.04Å; F209-M241 HydrophobicContact CE2-CE 3.27Å; F209-M241 HydrophobicContact CE2-SD 3.92Å; F209-M241 HydrophobicContact CZ-CE 3.9Å; P226-M241 HydrophobicContact CB-CE 3.24Å; P226-M241 VanDerWaalsContact O-CE 3.22Å; P226-M241 WeakPolarHBondContact O-CE 3.1Å; R237-M241 VanDerWaalsContact O-CG 3.25Å; R237-M241 WeakPolarHBondContact O-CG 3.32Å; R237-M241 PolarHBondContact O-N 2.9Å; W238-M241 PolarHBondContact O-N 3.44Å; M241-L244 PolarHBondContact O-N 2.98Å; M241-S245 WeakPolarHBondContact O-CB 3.39Å; M241-S245 PolarHBondContact O-N 3.49Å
242A82.3Confident77.9Confident50 Ų5066.9 Ų66.941%0.41341%0.407SS..Hα-helixtrans-63.3-45.7177.100000111W238 S239 F240 S245 V246W238-A242 WeakPolarHBondContact O-CB 3.33Å; W238-A242 PolarHBondContact O-N 3.32Å; S239-A242 PolarHBondContact O-N 2.9Å; F240-A242 VanDerWaalsContact C-N 3.32Å; F240-A242 PolarHBondContact O-N 2.9Å; A242-S245 PolarHBondContact O-N 2.99Å; A242-S245 VanDerWaalsContact O-N 3.14Å; A242-S245 PolarHBondContact O-OG 3.01Å; A242-V246 PolarHBondContact O-N 3.45Å
243A84.3Confident79.2Confident56 Ų5666.4 Ų66.446%0.46340%0.398SS..Hα-helixtrans-60-46.5175.300000112S239 F240 S245 V246 V247S239-A243 WeakPolarHBondContact O-CB 3.41Å; S239-A243 PolarHBondContact O-N 3.49Å; F240-A243 PolarHBondContact O-N 2.72Å; A243-S245 VanDerWaalsContact C-N 3.29Å; A243-S245 PolarHBondContact O-N 3.18Å; A243-V246 PolarHBondContact O-N 3.08Å; A243-V247 PolarHBondContact O-N 3.27Å
244L81.8Confident80.2Confident26 Ų2662.9 Ų62.914%0.13638%0.377CS..Hα-helixtrans-61.1-36.9174-70.9-176.3000112V205 I208 F240 M241 V246 V247 L248 L251V205-L244 HydrophobicContact CG2-CD1 3.91Å; I208-L244 HydrophobicContact CD1-CD1 4.02Å; I208-L244 HydrophobicContact CD1-CD2 4.37Å; F240-L244 HydrophobicContact CD1-CD1 4.01Å; F240-L244 HydrophobicContact CD1-CG 4.46Å; F240-L244 HydrophobicContact CE1-CD1 3.47Å; F240-L244 VanDerWaalsContact CE1-CD1 3.47Å; F240-L244 HydrophobicContact CE1-CG 4.09Å; F240-L244 HydrophobicContact CE2-CG 4.48Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.25Å; F240-L244 HydrophobicContact CZ-CG 4.07Å; F240-L244 WeakPolarHBondContact O-CG 3.21Å; F240-L244 PolarHBondContact O-N 3.31Å; M241-L244 PolarHBondContact O-N 2.98Å; L244-V246 VanDerWaalsContact C-N 3.26Å; L244-V246 PolarHBondContact O-N 3.05Å; L244-V247 PolarHBondContact O-N 3.19Å; L244-L248 WeakPolarHBondContact O-CA 3.44Å; L244-L248 WeakPolarHBondContact O-CB 3.35Å; L244-L248 PolarHBondContact O-N 3.47Å; L244-L251 HydrophobicContact CB-CD1 3.83Å
245S83.8Confident80.9Confident32 Ų3267.3 Ų67.322%0.22440%0.398CS..Hα-helixtrans-66.8-23.217878.10000114.3M241 A242 A243 L248M241-S245 WeakPolarHBondContact O-CB 3.39Å; M241-S245 PolarHBondContact O-N 3.49Å; A242-S245 PolarHBondContact O-N 2.99Å; A242-S245 VanDerWaalsContact O-N 3.14Å; A242-S245 PolarHBondContact O-OG 3.01Å; A243-S245 VanDerWaalsContact C-N 3.29Å; A243-S245 PolarHBondContact O-N 3.18Å; S245-L248 CarbonylContact O-C 3.2Å
246V81.4Confident81.5Confident122 Ų12266.5 Ų66.574%0.73939%0.391SS*.Hα-helixtrans-75.1-38172.8175.30000111.2A242 A243 L244A242-V246 PolarHBondContact O-N 3.45Å; A243-V246 PolarHBondContact O-N 3.08Å; L244-V246 VanDerWaalsContact C-N 3.26Å; L244-V246 PolarHBondContact O-N 3.05Å
247V82.4Confident81.9Confident114 Ų11465 Ų6569%0.69138%0.379SS*.Hα-helixtrans-79.1-34.2177.9-177.50000111.6A243 L244 P249A243-V247 PolarHBondContact O-N 3.27Å; L244-V247 PolarHBondContact O-N 3.19Å; V247-P249 WeakPolarHBondContact O-CD 3.02Å
248L81.7Confident82.2Confident43 Ų4364.1 Ų64.123%0.22538%0.377CS..  trans-12579.1-175.1-67173.3000109.6C201 L204 L244 S245 C250 L251C201-L248 HydrophobicContact CB-CD1 4.2Å; L204-L248 HydrophobicContact CD1-CD1 3.96Å; L244-L248 WeakPolarHBondContact O-CA 3.44Å; L244-L248 WeakPolarHBondContact O-CB 3.35Å; L244-L248 PolarHBondContact O-N 3.47Å; S245-L248 CarbonylContact O-C 3.2Å; L248-C250 PolarHBondContact O-N 3.3Å; L248-L251 HydrophobicContact CB-CD1 3.87Å; L248-L251 HydrophobicContact CB-CG 4.15Å; L248-L251 HydrophobicContact CD1-CD1 4.33Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.45Å
249P80.9Confident82.3Confident86 Ų8660.2 Ų60.256%0.55838%0.375SS*.G310 helixtrans-61.4-18.3-179.324.2-34.4000113.4V247 L251 I252V247-P249 WeakPolarHBondContact O-CD 3.02Å; P249-L251 PolarHBondContact O-N 3.49Å; P249-I252 PolarHBondContact O-N 3.41Å; P249-I252 VanDerWaalsContact O-N 3.15Å
250C83.2Confident82.4Confident30 Ų3062.4 Ų62.420%0.20338%0.38CS..G310 helixtrans-52.2-29.4167.742.90000113.6T200 C201 L248 I252 C253 Y254T200-C250 WeakPolarHBondContact CA-O 3.2Å; T200-C250 WeakPolarHBondContact CB-O 3.49Å; T200-C250 CarbonylContact O-C 3.49Å; C201-C250 HydrophobicContact CB-CB 4.18Å; C201-C250 WeakPolarHBondContact CB-SG 3.07Å; C201-C250 WeakPolarHBondContact SG-CB 3.07Å; C201-C250 CovalentContact SG-SG 2.05Å; C201-C250 PolarHBondContact SG-SG 2.92Å; L248-C250 PolarHBondContact O-N 3.3Å; C250-I252 VanDerWaalsContact C-N 3.34Å; C250-I252 PolarHBondContact O-N 2.89Å; C250-C253 WeakPolarHBondContact O-CB 3.39Å; C250-C253 PolarHBondContact O-N 2.98Å; C250-C253 VanDerWaalsContact O-N 3.15Å; C250-Y254 PolarHBondContact O-N 3.31Å
251L80.5Confident82.4Confident17 Ų1759.8 Ų59.89%0.08937%0.373CS..G310 helixtrans-67.8-32179.1-71.8169.1000112.9T200 C201 M202 V205 L244 L248 P249 C253 Y254T200-L251 WeakPolarHBondContact O-CA 3.48Å; T200-L251 VanDerWaalsContact O-CD2 3.32Å; T200-L251 WeakPolarHBondContact O-CD2 3.38Å; T200-L251 PolarHBondContact O-N 3.17Å; C201-L251 HydrophobicContact CB-CD2 4.48Å; C201-L251 HydrophobicContact CB-CG 4.49Å; M202-L251 HydrophobicContact CB-CD2 4.4Å; M202-L251 HydrophobicContact CE-CD2 3.81Å; M202-L251 HydrophobicContact SD-CD2 4.41Å; V205-L251 HydrophobicContact CG2-CD1 3.77Å; V205-L251 HydrophobicContact CG2-CD2 3.52Å; V205-L251 HydrophobicContact CG2-CG 4.32Å; L244-L251 HydrophobicContact CB-CD1 3.83Å; L248-L251 HydrophobicContact CB-CD1 3.87Å; L248-L251 HydrophobicContact CB-CG 4.15Å; L248-L251 HydrophobicContact CD1-CD1 4.33Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.45Å; P249-L251 PolarHBondContact O-N 3.49Å; L251-C253 PolarHBondContact O-N 2.9Å; L251-Y254 WeakPolarHBondContact O-CB 3.24Å; L251-Y254 PolarHBondContact O-N 3.18Å
252I80.9Confident82.5Confident108 Ų10865 Ų6555%0.55440%0.395SS*.THydrogen-bonded Turntrans-64.2-33.8175.2-56.2177.5000109.7P249 C250 Y254 P256P249-I252 PolarHBondContact O-N 3.41Å; P249-I252 VanDerWaalsContact O-N 3.15Å; C250-I252 VanDerWaalsContact C-N 3.34Å; C250-I252 PolarHBondContact O-N 2.89Å; I252-Y254 VanDerWaalsContact C-N 3.25Å; I252-Y254 PolarHBondContact O-N 3.27Å; I252-P256 VanDerWaalsContact O-CD 3.24Å; I252-P256 WeakPolarHBondContact O-CD 3.32Å
253C84.3Confident82.6Confident71 Ų7168 Ų6848%0.4840%0.403SS..THydrogen-bonded Turntrans-72.1-11.5175.6-610000113.9C250 L251 L255 P256 A257C250-C253 WeakPolarHBondContact O-CB 3.39Å; C250-C253 PolarHBondContact O-N 2.98Å; C250-C253 VanDerWaalsContact O-N 3.15Å; L251-C253 PolarHBondContact O-N 2.9Å; C253-L255 PolarHBondContact O-N 3.42Å; C253-P256 WeakPolarHBondContact O-CD 3.5Å; C253-P256 WeakPolarHBondContact O-CG 3.31Å; C253-A257 WeakPolarHBondContact O-CB 3.45Å; C253-A257 PolarHBondContact O-N 2.85Å
254Y83.9Confident82.3Confident34 Ų3466.9 Ų66.913%0.13340%0.397CS..Hα-helixtrans-61.2-43.3177.2178-107.6000113.2V196 D197 T200 M202 C250 L251 I252 T258V196-Y254 HydrophobicContact CG1-CD2 3.75Å; V196-Y254 HydrophobicContact CG1-CE2 3.87Å; D197-Y254 WeakPolarHBondContact OD1-CE2 3.27Å; T200-Y254 HydrophobicContact CG2-CD2 4.35Å; T200-Y254 WeakPolarHBondContact OG1-CD2 3.13Å; M202-Y254 HydrophobicContact CB-CD2 3.87Å; M202-Y254 HydrophobicContact CB-CE2 4.02Å; M202-Y254 HydrophobicContact CB-CG 4.43Å; M202-Y254 HydrophobicContact CE-CD1 3.48Å; M202-Y254 VanDerWaalsContact CE-CD1 3.48Å; M202-Y254 HydrophobicContact CE-CD2 4.14Å; M202-Y254 HydrophobicContact CE-CE1 3.87Å; M202-Y254 HydrophobicContact CE-CE2 4.48Å; M202-Y254 HydrophobicContact CE-CG 3.61Å; M202-Y254 HydrophobicContact CG-CD2 4.01Å; M202-Y254 HydrophobicContact CG-CE1 4.46Å; M202-Y254 HydrophobicContact CG-CE2 3.78Å; M202-Y254 HydrophobicContact CG-CG 4.44Å; C250-Y254 PolarHBondContact O-N 3.31Å; L251-Y254 WeakPolarHBondContact O-CB 3.24Å; L251-Y254 PolarHBondContact O-N 3.18Å; I252-Y254 VanDerWaalsContact C-N 3.25Å; I252-Y254 PolarHBondContact O-N 3.27Å; Y254-T258 WeakPolarHBondContact CE2-OG1 3.46Å; Y254-T258 WeakPolarHBondContact O-CB 3.14Å; Y254-T258 PolarHBondContact O-N 3.33Å; Y254-T258 PolarHBondContact O-OG1 3.15Å
255L82.6Confident82.2Confident124 Ų12468 Ų6865%0.64940%0.402SS*.Hα-helixtrans-62.8-53.4-179.6-62.5175.9000112.3C253 G259C253-L255 PolarHBondContact O-N 3.42Å; L255-G259 PolarHBondContact O-N 3.08Å
256P84.9Confident81.9Confident82 Ų8273 Ų7353%0.53242%0.419SS..Hα-helixtrans-67.4-36.317626-33.9000112.8I252 C253 G259 L260I252-P256 VanDerWaalsContact O-CD 3.24Å; I252-P256 WeakPolarHBondContact O-CD 3.32Å; C253-P256 WeakPolarHBondContact O-CD 3.5Å; C253-P256 WeakPolarHBondContact O-CG 3.31Å; P256-G259 PolarHBondContact O-N 2.79Å; P256-L260 WeakPolarHBondContact O-CB 3.41Å; P256-L260 PolarHBondContact O-N 3.24Å
257A82.5Confident81.7Confident31 Ų3170.4 Ų70.426%0.25641%0.406SS..Hα-helixtrans-65.1-44.6177.500000112.1V196 T200 C253 G259 L260 A261V196-A257 HydrophobicContact CG1-CB 4.03Å; V196-A257 HydrophobicContact CG2-CB 4.28Å; T200-A257 HydrophobicContact CG2-CB 4.07Å; C253-A257 WeakPolarHBondContact O-CB 3.45Å; C253-A257 PolarHBondContact O-N 2.85Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 3.22Å; A257-L260 PolarHBondContact O-N 3.3Å; A257-A261 WeakPolarHBondContact O-CB 3.49Å; A257-A261 PolarHBondContact O-N 3.37Å
258T82.9Confident81.3Confident14 Ų1468.2 Ų68.29%0.08639%0.386CS..Hα-helixtrans-63.4-39.8173.7-58.30000111.4Y254 K262Y254-T258 WeakPolarHBondContact CE2-OG1 3.46Å; Y254-T258 WeakPolarHBondContact O-CB 3.14Å; Y254-T258 PolarHBondContact O-N 3.33Å; Y254-T258 PolarHBondContact O-OG1 3.15Å; T258-K262 HydrophobicContact CG2-CD 4.2Å; T258-K262 WeakPolarHBondContact O-CB 3.21Å; T258-K262 WeakPolarHBondContact O-CG 3.43Å; T258-K262 PolarHBondContact O-N 3.46Å
259G82.8Confident81.1Confident40 Ų4066.7 Ų66.741%0.41238%0.378SS..Hα-helixtrans-61.4-46.3174.400000112.4L255 P256 A257 K262 L263L255-G259 PolarHBondContact O-N 3.08Å; P256-G259 PolarHBondContact O-N 2.79Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 3.22Å; G259-K262 PolarHBondContact O-N 3.34Å; G259-L263 WeakPolarHBondContact O-CB 3.34Å; G259-L263 PolarHBondContact O-N 3.36Å
260L82.6Confident80.7Confident123 Ų12365.8 Ų65.864%0.64437%0.368SS*.Hα-helixtrans-65.9-42.1177.8-177.261000111.8P256 A257 K262 L263 G264P256-L260 WeakPolarHBondContact O-CB 3.41Å; P256-L260 PolarHBondContact O-N 3.24Å; A257-L260 PolarHBondContact O-N 3.3Å; L260-K262 PolarHBondContact O-N 3.36Å; L260-L263 PolarHBondContact O-N 3.19Å; L260-G264 PolarHBondContact O-N 2.86Å
261A81.7Confident80.2Confident25 Ų2569.8 Ų69.821%0.20739%0.392CS..Hα-helixtrans-60.9-44.5174.900000111.7V196 A257 G264 Q265V196-A261 HydrophobicContact CG2-CB 4.19Å; A257-A261 WeakPolarHBondContact O-CB 3.49Å; A257-A261 PolarHBondContact O-N 3.37Å; A261-G264 PolarHBondContact O-N 2.98Å; A261-Q265 WeakPolarHBondContact O-CB 3.38Å; A261-Q265 PolarHBondContact O-N 3.48Å
262K82.3Confident79.6Confident138 Ų13871.3 Ų71.360%0.640%0.404SS*.Hα-helixtrans-69.3-33176.2-72.7178-179.2174.60113.2T258 G259 L260 K266T258-K262 HydrophobicContact CG2-CD 4.2Å; T258-K262 WeakPolarHBondContact O-CB 3.21Å; T258-K262 WeakPolarHBondContact O-CG 3.43Å; T258-K262 PolarHBondContact O-N 3.46Å; G259-K262 PolarHBondContact O-N 3.34Å; L260-K262 PolarHBondContact O-N 3.36Å; K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.43Å; K262-K266 PolarHBondContact O-N 2.92Å
263L82.4Confident79Confident112 Ų11269.3 Ų69.359%0.58639%0.389SS*.Hα-helixtrans-72.2-40.5173.8-176.259.8000111.6G259 L260 K266 C267G259-L263 WeakPolarHBondContact O-CB 3.34Å; G259-L263 PolarHBondContact O-N 3.36Å; L260-L263 PolarHBondContact O-N 3.19Å; L263-K266 CarbonylContact O-C 3.58Å; L263-K266 PolarHBondContact O-N 3.08Å; L263-C267 VanDerWaalsContact O-CB 3.29Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.38Å
264G80Confident78.1Confident33 Ų3370 Ų7034%0.3439%0.393SS..Hα-helixtrans-60.7-47.2172.900000111.4L260 A261 K266 C267 Y268L260-G264 PolarHBondContact O-N 2.86Å; A261-G264 PolarHBondContact O-N 2.98Å; G264-K266 PolarHBondContact O-N 3.01Å; G264-C267 PolarHBondContact O-N 2.87Å; G264-Y268 WeakPolarHBondContact O-CB 3.47Å; G264-Y268 PolarHBondContact O-N 3.4Å
265Q78.6Confident77.6Confident49 Ų4968.4 Ų68.423%0.22939%0.387CS..Hα-helixtrans-53-53.8169.3178.767.776.800111.1R176 L178 A261 C267 Y268 D269R176-Q265 PolarHBondContact O-NE2 3.2Å; L178-Q265 VanDerWaalsContact CB-OE1 3.31Å; L178-Q265 HydrophobicContact CD1-CB 3.85Å; L178-Q265 HydrophobicContact CG-CB 4.31Å; L178-Q265 VanDerWaalsContact CG-OE1 3.27Å; L178-Q265 VanDerWaalsContact N-CD 3.34Å; A261-Q265 WeakPolarHBondContact O-CB 3.38Å; A261-Q265 PolarHBondContact O-N 3.48Å; Q265-C267 VanDerWaalsContact C-N 3.28Å; Q265-C267 PolarHBondContact O-N 3.21Å; Q265-Y268 PolarHBondContact O-N 3Å; Q265-D269 PolarHBondContact NE2-OD1 3.09Å; Q265-D269 WeakPolarHBondContact O-CB 3.33Å; Q265-D269 PolarHBondContact O-N 3.38Å; Q265-D269 VanDerWaalsContact O-OD1 3.04Å
266K76.7Confident77.3Confident136 Ų13663.4 Ų63.459%0.59136%0.362SS*.Hα-helixtrans-62.7-34.1-179.2-170.3174.6-176.71770112.6K262 L263 G264 N270K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.43Å; K262-K266 PolarHBondContact O-N 2.92Å; L263-K266 CarbonylContact O-C 3.58Å; L263-K266 PolarHBondContact O-N 3.08Å; G264-K266 PolarHBondContact O-N 3.01Å; K266-N270 WeakPolarHBondContact O-CB 3.35Å; K266-N270 PolarHBondContact O-N 3.48Å; K266-N270 PolarHBondContact O-ND2 3.11Å; K266-N270 PolarHBondContact O-OD1 2.83Å
267C77.3Confident76.7Confident68 Ų6866.8 Ų66.846%0.45937%0.365SS..Hα-helixtrans-70.7-45.3175.4-166.80000111.3L263 G264 Q265 D269 N270 V271L263-C267 VanDerWaalsContact O-CB 3.29Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.38Å; G264-C267 PolarHBondContact O-N 2.87Å; Q265-C267 VanDerWaalsContact C-N 3.28Å; Q265-C267 PolarHBondContact O-N 3.21Å; C267-D269 PolarHBondContact O-N 3.12Å; C267-N270 WeakPolarHBondContact O-CA 3.41Å; C267-N270 WeakPolarHBondContact O-CB 3.42Å; C267-N270 PolarHBondContact O-N 2.78Å; C267-V271 WeakPolarHBondContact O-CG2 3.24Å; C267-V271 PolarHBondContact O-N 3.09Å
268Y75.9Confident76.4Confident69 Ų6968.1 Ų68.127%0.27137%0.371SS..Hα-helixtrans-59.2-46173.1-175.2-101.5000111.2L178 W182 G264 Q265 N270 V271 S272L178-Y268 HydrophobicContact CD2-CD1 4.08Å; L178-Y268 HydrophobicContact CD2-CD2 4.49Å; L178-Y268 HydrophobicContact CD2-CG 3.98Å; W182-Y268 AromaticContact CZ2-CE2 3.92Å; W182-Y268 HydrophobicContact CZ2-CE2 3.92Å; G264-Y268 WeakPolarHBondContact O-CB 3.47Å; G264-Y268 PolarHBondContact O-N 3.4Å; Q265-Y268 PolarHBondContact O-N 3Å; Y268-N270 VanDerWaalsContact C-N 3.26Å; Y268-N270 PolarHBondContact O-N 3.1Å; Y268-V271 PolarHBondContact O-N 2.86Å; Y268-S272 VanDerWaalsContact CD2-OG 3.26Å; Y268-S272 WeakPolarHBondContact CD2-OG 3.25Å; Y268-S272 WeakPolarHBondContact CE2-OG 3.22Å; Y268-S272 WeakPolarHBondContact O-CA 3.49Å; Y268-S272 WeakPolarHBondContact O-CB 3.34Å; Y268-S272 PolarHBondContact O-N 2.91Å; Y268-S272 PolarHBondContact O-OG 2.93Å
269D77.1Confident75.8Confident11 Ų1176.7 Ų76.76%0.05941%0.407CS..Hα-helixtrans-57.5-35.6169.9-9082.1000113.5P175 R176 Q265 C267 R273P175-D269 VanDerWaalsContact CA-OD2 3.27Å; P175-D269 WeakPolarHBondContact CA-OD2 3.31Å; R176-D269 PolarHBondContact N-OD2 3.44Å; Q265-D269 PolarHBondContact NE2-OD1 3.09Å; Q265-D269 WeakPolarHBondContact O-CB 3.33Å; Q265-D269 PolarHBondContact O-N 3.38Å; Q265-D269 VanDerWaalsContact O-OD1 3.04Å; C267-D269 PolarHBondContact O-N 3.12Å; D269-R273 VanDerWaalsContact O-CB 3.28Å; D269-R273 WeakPolarHBondContact O-CB 3.49Å; D269-R273 WeakPolarHBondContact O-CD 3.46Å; D269-R273 WeakPolarHBondContact O-CG 3.47Å; D269-R273 IonicContact OD2-CZ 2.66Å; D269-R273 IonicContact OD2-NE 2.83Å; D269-R273 PolarHBondContact OD2-NE 3.12Å; D269-R273 IonicContact OD2-NH2 3.91Å; D269-R273 PolarHBondContact OD2-NH2 3.35Å
270N72.1Confident74.4Confident66 Ų6680.2 Ų80.235%0.35342%0.417SS..Hα-helixtrans-72.2-34-179.9-74-31000112.7K266 C267 Y268 R277K266-N270 WeakPolarHBondContact O-CB 3.35Å; K266-N270 PolarHBondContact O-N 3.48Å; K266-N270 PolarHBondContact O-ND2 3.11Å; K266-N270 PolarHBondContact O-OD1 2.83Å; C267-N270 WeakPolarHBondContact O-CA 3.41Å; C267-N270 WeakPolarHBondContact O-CB 3.42Å; C267-N270 PolarHBondContact O-N 2.78Å; Y268-N270 VanDerWaalsContact C-N 3.26Å; Y268-N270 PolarHBondContact O-N 3.1Å; N270-R277 VanDerWaalsContact CB-NH1 3.34Å; N270-R277 PolarHBondContact O-NH1 3.22Å; N270-R277 PolarHBondContact OD1-NH1 2.87Å; N270-R277 PolarHBondContact OD1-NH2 3.47Å
271V72.5Confident72.7Confident114 Ų11478.8 Ų78.869%0.69142%0.417SS*.Hα-helixtrans-94.8-46-173.8175.70000111.4C267 Y268C267-V271 WeakPolarHBondContact O-CG2 3.24Å; C267-V271 PolarHBondContact O-N 3.09Å; Y268-V271 PolarHBondContact O-N 2.86Å
272S66.8Low70.7Confident50 Ų5085.4 Ų85.435%0.3544%0.443SS..Hα-helixtrans-85.5-7.1-172.8-50.70000114.2Y268 P274Y268-S272 VanDerWaalsContact CD2-OG 3.26Å; Y268-S272 WeakPolarHBondContact CD2-OG 3.25Å; Y268-S272 WeakPolarHBondContact CE2-OG 3.22Å; Y268-S272 WeakPolarHBondContact O-CA 3.49Å; Y268-S272 WeakPolarHBondContact O-CB 3.34Å; Y268-S272 PolarHBondContact O-N 2.91Å; Y268-S272 PolarHBondContact O-OG 2.93Å; S272-P274 WeakPolarHBondContact O-CD 3.36Å
273R68.5Low68.4Low66 Ų6687 Ų8725%0.24948%0.482CS..  trans-78.5121.4173.3-79.5-171.5-151.4-170.616.9111.3T173 L174 P175 R176 D269 G275T173-R273 PolarHBondContact O-NH1 3.27Å; L174-R273 PolarHBondContact O-NE 3.01Å; P175-R273 VanDerWaalsContact CA-NH2 3.31Å; R176-R273 HydrophobicContact CG-CG 4.48Å; D269-R273 VanDerWaalsContact O-CB 3.28Å; D269-R273 WeakPolarHBondContact O-CB 3.49Å; D269-R273 WeakPolarHBondContact O-CD 3.46Å; D269-R273 WeakPolarHBondContact O-CG 3.47Å; D269-R273 IonicContact OD2-CZ 2.66Å; D269-R273 IonicContact OD2-NE 2.83Å; D269-R273 PolarHBondContact OD2-NE 3.12Å; D269-R273 IonicContact OD2-NH2 3.91Å; D269-R273 PolarHBondContact OD2-NH2 3.35Å; R273-G275 VanDerWaalsContact C-N 3.31Å; R273-G275 PolarHBondContact O-N 3.37Å
274P65.9Low67.7Low84 Ų8485.7 Ų85.755%0.54548%0.477SS..  trans-77.9-14.3177.132.5-35.7000113.2K166 S272K166-P274 WeakPolarHBondContact CB-O 3.4Å; S272-P274 WeakPolarHBondContact O-CD 3.36Å
275G73.7Confident67Low2 Ų288.5 Ų88.52%0.02148%0.484CS..SBendtrans-77.3167.3-175.400000115.8K166 C167 C172 R273K166-G275 WeakPolarHBondContact CD-O 3.49Å; C167-G275 CarbonylContact O-C 3.48Å; C167-G275 WeakPolarHBondContact O-CA 3.32Å; C172-G275 VanDerWaalsContact O-CA 3.26Å; C172-G275 WeakPolarHBondContact O-CA 3.24Å; C172-G275 PolarHBondContact O-N 3.05Å; R273-G275 VanDerWaalsContact C-N 3.31Å; R273-G275 PolarHBondContact O-N 3.37Å
276C76.6Confident66.4Low19 Ų1990.7 Ų90.713%0.12850%0.498CS..  trans-74.7153.1178.1-1580000113.3C161 C164 K166 C167 R168C161-C276 HydrophobicContact CB-CB 3.72Å; C161-C276 WeakPolarHBondContact CB-SG 3.44Å; C161-C276 PolarHBondContact SG-SG 3.2Å; C164-C276 WeakPolarHBondContact CB-SG 3.26Å; C164-C276 WeakPolarHBondContact SG-CB 3.35Å; C164-C276 CovalentContact SG-SG 2.04Å; C164-C276 PolarHBondContact SG-SG 3.04Å; K166-C276 HydrophobicContact CB-CB 3.96Å; C167-C276 PolarHBondContact O-N 3.1Å; R168-C276 HydrophobicContact CG-CB 4.2Å
277R73Confident65.8Low153 Ų15388 Ų8858%0.57749%0.493SS*.  trans-129.88.5-175.6-60.1-175.162.51794.8114.4N270 K279N270-R277 VanDerWaalsContact CB-NH1 3.34Å; N270-R277 PolarHBondContact O-NH1 3.22Å; N270-R277 PolarHBondContact OD1-NH1 2.87Å; N270-R277 PolarHBondContact OD1-NH2 3.47Å; R277-K279 PolarHBondContact O-N 3.05Å
278C75.4Confident65Low59 Ų5989.3 Ų89.340%0.39950%0.495SS..  trans-56.3126.1174-63.50000108.9N280C278-N280 PolarHBondContact O-N 3.26Å
279K69.5Low64.3Low194 Ų19490.6 Ų90.684%0.84351%0.51SS*.  trans-55.1142.1160.7-73.4-177176.7-1790107.1R277 S281R277-K279 PolarHBondContact O-N 3.05Å; K279-S281 VanDerWaalsContact C-N 3.28Å; K279-S281 PolarHBondContact O-N 3.42Å
280N53.2Low63.4Low113 Ų11396.3 Ų96.360%0.60454%0.542SS*.  trans-70.186.2-172.2-158.713000109.6C278 Q282C278-N280 PolarHBondContact O-N 3.26Å; N280-Q282 PolarHBondContact ND2-NE2 3.33Å; N280-Q282 VanDerWaalsContact ND2-NE2 3.12Å; N280-Q282 PolarHBondContact O-N 3.43Å
281S46.8Very low62.7Low93 Ų9398.6 Ų98.665%0.6556%0.557SS**  trans-67.880162.8-59.80000107.1K279 A283K279-S281 VanDerWaalsContact C-N 3.28Å; K279-S281 PolarHBondContact O-N 3.42Å; S281-A283 PolarHBondContact O-N 3.3Å
282Q40.7Very low61.9Low164 Ų16497.3 Ų97.377%0.76655%0.546SS*.  trans-66.5108.4162.7-64.9-179.911.100106.1N280N280-Q282 PolarHBondContact ND2-NE2 3.33Å; N280-Q282 VanDerWaalsContact ND2-NE2 3.12Å; N280-Q282 PolarHBondContact O-N 3.43Å
283A33.1Very low61.5Low171 Ų171101.6 Ų101.6100%1.41356%0.563SS**  trans-111.80162.100000106.7S281S281-A283 PolarHBondContact O-N 3.3Å

Retrieved 283 of 283 residues in 88.5 ms (Link to these results)