A0A5F8AV20_MACMU Loading...

Ventral anterior homeobox 1

Transcription factor that may function in dorsoventral specification of the forebrain. Required for axon guidance and major tract formation in the developing forebrain. May contribute to the differentiation of the neuroretina, pigmented epithelium and optic stalk.

AlphaFold DB , UniProt , Accession A0A5F8AV20, Species MACMU (Macaca mulatta, Rhesus macaque), Gene VAX1, Length 333 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
1M49.7Very low47.3Very low241 Ų241169.6 Ų169.6100%1.18786%0.861SS**  0125.90-66.4127.477.800107.6
2F44.1Very low46.7Very low217 Ų217164.8 Ų164.895%0.95285%0.852SS**  trans-84.6134.8-175.4-76.4-86.7000111.7
3G45.2Very low46.2Very low77 Ų77165.5 Ų165.579%0.79485%0.848SS**  trans-74.5151.1179.500000113.1
4K55.8Low45.5Very low205 Ų205160.1 Ų160.189%0.89183%0.833SS**  trans-111.1130.5167.9-63.9172.3-179.3172.30108.6
5P56.9Low44.6Very low124 Ų124158.9 Ų158.981%0.80583%0.828SS**  trans-138.3167.7130.638.3-27.8000111.1
6D43.9Very low44.4Very low148 Ų148153.9 Ų153.979%0.79182%0.817SS**  cis-150.2163.4-36.2-178-131.4000107.7
7K48.6Very low43.8Very low173 Ų173154.1 Ų154.175%0.75281%0.812SS**  trans-100.192-171.6-75.1175.5149.1-70.70113D9K7-D9 PolarHBondContact O-N 3.47Å
8M48.3Very low43.3Very low179 Ų179150.7 Ų150.788%0.88281%0.81SS**  trans-83.386.7165.157.2178.2177.300112.2V10M8-V10 PolarHBondContact O-N 3.22Å
9D43.7Very low43.1Very low140 Ų140146.9 Ų146.975%0.74980%0.802SS**  trans-77.5107.8164.4-94.7-88.2000109.8K7K7-D9 PolarHBondContact O-N 3.47Å
10V45.3Very low42.9Very low133 Ų133151.9 Ų151.981%0.80681%0.808SS**  trans-99.497.5171.8-178.10000109.3M8M8-V10 PolarHBondContact O-N 3.22Å
11R38.3Very low42.7Very low229 Ų229150.8 Ų150.886%0.86481%0.807SS**  trans-82.1127.7-178.8-175.9-177.8-177.693.9-0.4111.3
12C41.1Very low42.1Very low111 Ų111145.2 Ų145.275%0.7579%0.791SS**  trans-74.8140.9174.9-54.30000112.9
13H39.3Very low42.1Very low174 Ų174143.7 Ų143.781%0.80679%0.785SS**  trans170.4152.6151.7-103.2-81.1000105.9
14S37.1Very low41.3Very low91 Ų91148.3 Ų148.364%0.63679%0.791SS**  cis-157.8178.67.9-127.40000106.8
15D32.2Very low40.3Very low142 Ų142142.7 Ų142.776%0.75978%0.783SS**  cis-155.5-161.3-0.8-154.4-117.2000111.3
16A40.5Very low39.1Very low79 Ų79145.8 Ų145.865%0.65379%0.786SS**  trans-72.9-177.1175.500000113.2
17E34.8Very low38.7Very low157 Ų157146.8 Ų146.873%0.73478%0.784SS**  cis-135-147.612.4-130.3-59.266.500109.1A19E17-A19 PolarHBondContact OE2-N 3.29Å
18A34.8Very low37.8Very low93 Ų93145.6 Ų145.677%0.76978%0.781SS**  cis-141134.914.200000113
19A39.7Very low36.8Very low79 Ų79141.4 Ų141.465%0.65377%0.769SS**  trans-68.8154177.500000114.8E17E17-A19 PolarHBondContact OE2-N 3.29Å
20R38.6Very low36.4Very low245 Ų245144.8 Ų144.893%0.92577%0.771SS**  trans-151121.1144.455.9-179.2-179.2165.8-0.7112.9
21V38.8Very low35.7Very low129 Ų129145 Ų14578%0.78276%0.763SS**  trans-101.7133.1172.4169.70000108.8
22S36.3Very low35.6Very low124 Ų124139.8 Ų139.887%0.86776%0.762SS**  trans-129.1118.4158.8-74.90000109.8
23K43.9Very low35.3Very low186 Ų186143.8 Ų143.881%0.80977%0.767SS**  trans-75.2154.4161.7-65.6170.2177.8172.30108.5
24N29Very low34.8Very low173 Ų173139.2 Ų139.293%0.92577%0.766SS**  trans-154.8160.8130.8-111.5-6.7000110.2
25A34.9Very low34.9Very low88 Ų88140 Ų14073%0.72778%0.778SS**  trans-136.6156.3-174.800000110.6
26H32.1Very low35Very low189 Ų189143 Ų14388%0.87579%0.788SS**  trans56119.7149.1-129.779.6000118.7
27K34.8Very low34.8Very low169 Ų169143 Ų14374%0.73580%0.796SS**  173.8164.6112.8-166.7159.1-178.7-179.80111.2
28E29.4Very low34.8Very low148 Ų148142.6 Ų142.669%0.69280%0.798SS**  trans-28.5164.8170.2-53168.749.800117.3
29S28Very low35.2Very low90 Ų90145 Ų14563%0.62980%0.798SS**  cis-173.6163.438.4-152.70000114
30R35.1Very low35.8Very low211 Ų211147 Ų14780%0.79680%0.804SS**  trans56.5165.6157.1-74.7-175.8102.5165.98.4120.1
31E31.5Very low35.7Very low138 Ų138140.3 Ų140.365%0.64580%0.801SS**  cis171.8111.5-34172174.667.500107.9
32S35.2Very low35.6Very low120 Ų120138.6 Ų138.684%0.83980%0.801SS**  trans171.5152.4163.2-86.80000111.2
33K34.6Very low35.3Very low195 Ų195142 Ų14285%0.84880%0.8SS**  cis-167.3126.1-20.8174.4174.5178.9178.20109.1
34G29.1Very low35Very low77 Ų77139.9 Ų139.979%0.79480%0.797SS**  trans60115.4150.400000120.7
35A39.6Very low35.4Very low107 Ų107140.8 Ų140.888%0.88479%0.792SS**  trans-146.8129.214300000107.5
36E34.7Very low35.5Very low206 Ų206143.5 Ų143.596%0.96379%0.79SS**  trans-106.4145.4-169.9-55.5-158.8133.500112.6
37G34.8Very low36.1Very low80 Ų80140 Ų14083%0.82578%0.784SS**  trans-169.7101178.400000110.1
38N35Very low36.3Very low147 Ų147140.3 Ų140.379%0.78679%0.788SS**  trans-124.3176.8-171.4-168.78.8000110.6
39L45Very low36.4Very low144 Ų144137.1 Ų137.175%0.75480%0.795SS**  trans89.1143.4172.6-47.5-177000114.8
40P50.7Low36.9Very low122 Ų122137.8 Ų137.879%0.79281%0.806SS**  -134.8169.9-75.326.7-6000113.8
41A36.7Very low36.7Very low104 Ų104136.8 Ų136.886%0.8681%0.808SS**  trans-105.9131.6175.500000112.8
42A36.7Very low36.9Very low93 Ų93135.3 Ų135.377%0.76981%0.813SS**  trans-163.9153.2160.500000112.5
43F29.6Very low37Very low194 Ų194133.8 Ų133.885%0.85181%0.807SS**  trans58102.9158-103.2-117.6000117.8
44L39.1Very low37.1Very low142 Ų142129.8 Ų129.874%0.74380%0.804SS**  -167.3127.567.5-102.4156000113.8
45K37.3Very low37.3Very low192 Ų192129.8 Ų129.884%0.83580%0.804SS**  trans50112.2133.8-166.1161.8-177.5175.60120.8
46E36.9Very low37Very low146 Ų146127.4 Ų127.468%0.68279%0.79SS**  trans-53.8159.5160.8-138.2-164.585.900113.7Q48E46-Q48 PolarHBondContact OE1-N 2.7Å
47P44.2Very low37.6Very low116 Ų116122.7 Ų122.775%0.75379%0.786SS**  -141.6140.989.337.6-23.9000116.5
48Q38.2Very low37.9Very low175 Ų175127.4 Ų127.482%0.81879%0.786SS**  trans37.8115.7145.9-56.6-163.98.200120.3E46E46-Q48 PolarHBondContact OE1-N 2.7Å
49G32.7Very low38.2Very low81 Ų81127.5 Ų127.584%0.83579%0.787SS**  trans-154.552.1168.600000112.4F51G49-F51 PolarHBondContact O-N 2.98Å
50A39.2Very low37.9Very low104 Ų104126.7 Ų126.786%0.8679%0.792SS**  trans-74.2105.4-17400000112.5
51F30.4Very low37.3Very low190 Ų190127 Ų12783%0.83379%0.787SS**  trans-113.389.5164.4-166.2-89.2000110.5G49 A53G49-F51 PolarHBondContact O-N 2.98Å; F51-A53 HydrophobicContact CD1-CB 4.44Å; F51-A53 HydrophobicContact CE1-CB 4.39Å; F51-A53 PolarHBondContact O-N 2.95Å
52S35Very low37.8Very low107 Ų107131.3 Ų131.375%0.74879%0.786SS**  trans-7296.4174.7-62.80000110.3S54S52-S54 PolarHBondContact O-N 3.36Å
53A37.8Very low37.9Very low87 Ų87131.8 Ų131.872%0.71978%0.784SS**  trans-70.471.7170.900000110.9F51 G55F51-A53 HydrophobicContact CD1-CB 4.44Å; F51-A53 HydrophobicContact CE1-CB 4.39Å; F51-A53 PolarHBondContact O-N 2.95Å; A53-G55 PolarHBondContact O-N 3.33Å
54S37Very low38.8Very low112 Ų112131.6 Ų131.678%0.78378%0.783SS**  trans-70.790.3176-168.20000109.8S52 G56S52-S54 PolarHBondContact O-N 3.36Å; S54-G56 PolarHBondContact O-N 3.17Å
55G33.8Very low39Very low77 Ų77129.6 Ų129.679%0.79478%0.78SS**  trans-70.279.8170.200000110.3A53 A57A53-G55 PolarHBondContact O-N 3.33Å; G55-A57 PolarHBondContact O-N 3.22Å
56G32.5Very low39.6Very low56 Ų56127.9 Ų127.958%0.57778%0.78SS**  trans-57.3118.9177.800000111.2S54 E58S54-G56 PolarHBondContact O-N 3.17Å; G56-E58 PolarHBondContact O-N 3.08Å
57A47.8Very low40.1Very low107 Ų107124.2 Ų124.288%0.88477%0.771SS**  trans-77.173.6170.100000109.2G55 D59G55-A57 PolarHBondContact O-N 3.22Å; A57-D59 PolarHBondContact O-N 3.2Å
58E39.9Very low40.6Very low179 Ų179124 Ų12484%0.83678%0.779SS**  trans-70.8122.5175.5-66.9-161.310400110.4G56 C60G56-E58 PolarHBondContact O-N 3.08Å; E58-C60 PolarHBondContact O-N 3.42Å; E58-C60 VanDerWaalsContact O-N 3.12Å
59D41.7Very low41.6Very low149 Ų149120 Ų12080%0.79778%0.776SS**  trans-63.1112.7-178.5-166.2-80.3000109.7A57 N61A57-D59 PolarHBondContact O-N 3.2Å; D59-N61 PolarHBondContact O-N 3.14Å
60C38Very low42.7Very low127 Ų127119 Ų11986%0.85875%0.751SS**  trans-74.669.6177.5-78.10000110.5E58 K62E58-C60 PolarHBondContact O-N 3.42Å; E58-C60 VanDerWaalsContact O-N 3.12Å; C60-K62 PolarHBondContact O-N 3.4Å
61N38.1Very low44.1Very low128 Ų128117.1 Ų117.168%0.68473%0.73SS**  trans-44.7125.7177.8-172.7-7.4000110.3D59 S63D59-N61 PolarHBondContact O-N 3.14Å; N61-S63 PolarHBondContact O-N 3.1Å; N61-S63 PolarHBondContact O-OG 2.74Å
62K47.3Very low46Very low196 Ų196114.3 Ų114.385%0.85272%0.724SS**  trans-77.369.5-166.6-167.7170.5-179.1172.70111.5C60 K64C60-K62 PolarHBondContact O-N 3.4Å; K62-K64 PolarHBondContact O-N 3.42Å
63S38.8Very low47.8Very low102 Ų102117 Ų11771%0.71372%0.719SS**  trans-52.296.5177.8-68.60000111.1N61 S65N61-S63 PolarHBondContact O-N 3.1Å; N61-S63 PolarHBondContact O-OG 2.74Å; S63-S65 PolarHBondContact O-N 3.02Å
64K49.6Very low49.8Very low190 Ų190113.7 Ų113.783%0.82669%0.691SS**  trans-77.476.7177.5-171.7174.2179.51790109.1K62 N66K62-K64 PolarHBondContact O-N 3.42Å; K64-N66 PolarHBondContact O-N 3.22Å
65S42Very low52Low100 Ų100112.9 Ų112.970%0.69967%0.67SS**  trans-62.4117.6176.342.60000110.5S63 S67S63-S65 PolarHBondContact O-N 3.02Å; S65-S67 PolarHBondContact O-N 3.25Å
66N49.8Very low54.4Low156 Ų156114.8 Ų114.883%0.83465%0.654SS**  trans-69.691172.5-81.3-17.5000110K64K64-N66 PolarHBondContact O-N 3.22Å
67S48.2Very low57Low69 Ų69115.1 Ų115.148%0.48364%0.641SS.*  trans-9971.8168.860.50000110.5S65 A69 D70S65-S67 PolarHBondContact O-N 3.25Å; S67-A69 PolarHBondContact O-N 2.94Å; S67-D70 PolarHBondContact O-N 2.79Å
68A55.1Low59.1Low111 Ų111115.6 Ų115.692%0.91763%0.629SS**THydrogen-bonded Turntrans-72.958.5178.600000112.4
69A60.1Low61.5Low92 Ų92109.9 Ų109.976%0.7661%0.606SS**THydrogen-bonded Turntrans-167.4-20.9176.900000114S67 P71S67-A69 PolarHBondContact O-N 2.94Å; A69-P71 VanDerWaalsContact O-CD 3.29Å; A69-P71 WeakPolarHBondContact O-CD 3.34Å
70D54.9Low64Low59 Ų59111.4 Ų111.432%0.31660%0.601SS.*  trans-73.3117.5-169.2-153.8-8.3000111.3S67 D72 R76S67-D70 PolarHBondContact O-N 2.79Å; D70-D72 PolarHBondContact O-N 2.87Å; D70-R76 IonicContact OD1-NE 3.83Å; D70-R76 IonicContact OD2-CZ 2.78Å; D70-R76 VanDerWaalsContact OD2-CZ 3.28Å; D70-R76 IonicContact OD2-NE 3.25Å; D70-R76 PolarHBondContact OD2-NE 2.81Å; D70-R76 IonicContact OD2-NH2 2.81Å; D70-R76 PolarHBondContact OD2-NH2 3.07Å
71P67.6Low66.4Low65 Ų65107.6 Ų107.642%0.42257%0.572SS.*  trans-67121.3-176.6-21.534.4000111.8A69 Y73 C74A69-P71 VanDerWaalsContact O-CD 3.29Å; A69-P71 WeakPolarHBondContact O-CD 3.34Å; P71-Y73 HydrophobicContact CB-CD1 3.63Å; P71-Y73 HydrophobicContact CB-CE1 3.29Å; P71-Y73 HydrophobicContact CG-CE1 4.23Å; P71-Y73 PolarHBondContact O-N 2.88Å; P71-C74 PolarHBondContact O-N 3.46Å; P71-C74 VanDerWaalsContact O-N 3.09Å
72D71.6Confident68.7Low132 Ų132107.2 Ų107.271%0.70659%0.586SS**THydrogen-bonded Turntrans-65.2-4.5-167.5-159.928.3000114.6D70 K93D70-D72 PolarHBondContact O-N 2.87Å; D72-K93 WeakPolarHBondContact O-CD 3.31Å; D72-K93 WeakPolarHBondContact O-CE 3.44Å; D72-K93 PolarHBondContact O-NZ 3.41Å; D72-K93 IonicContact OD1-NZ 3.62Å; D72-K93 PolarHBondContact OD1-NZ 3.27Å
73Y72.6Confident70.6Confident162 Ų162107 Ų10764%0.63559%0.585SS**THydrogen-bonded Turntrans-80-7.8173.170.6-97.6000114.9P71 P92 K93P71-Y73 HydrophobicContact CB-CD1 3.63Å; P71-Y73 HydrophobicContact CB-CE1 3.29Å; P71-Y73 HydrophobicContact CG-CE1 4.23Å; P71-Y73 PolarHBondContact O-N 2.88Å; Y73-P92 CarbonylContact O-C 3.52Å; Y73-P92 WeakPolarHBondContact O-CA 3.46Å; Y73-K93 PolarHBondContact O-N 3.23Å
74C79.6Confident72.9Confident19 Ų19104.3 Ų104.313%0.12857%0.573CS.*EExtended strand (participates in β ladder)trans-119.3132.9-175.4-88.90000115.1P71 I90 K93P71-C74 PolarHBondContact O-N 3.46Å; P71-C74 VanDerWaalsContact O-N 3.09Å; C74-I90 HydrophobicContact CB-CG2 3.69Å; C74-I90 WeakPolarHBondContact SG-CG2 3.49Å; C74-K93 WeakPolarHBondContact O-CE 3.48Å
75R82.8Confident74.8Confident94 Ų9498.4 Ų98.436%0.35556%0.556SS.*EExtended strand (participates in β ladder)trans-96.9115.7165.8177.8177.4-72.9177.30.6108.3I77 L91 K93 D98R75-I77 HydrophobicContact CG-CD1 4.48Å; R75-I77 HydrophobicContact CG-CG1 4.04Å; R75-L91 PolarHBondContact N-O 3.27Å; R75-L91 PolarHBondContact O-N 3.08Å; R75-K93 HydrophobicContact CB-CG 4.06Å; R75-D98 IonicContact CZ-OD1 3.63Å; R75-D98 IonicContact CZ-OD2 3.28Å; R75-D98 IonicContact NH1-OD1 2.72Å; R75-D98 PolarHBondContact NH1-OD1 2.91Å; R75-D98 IonicContact NH1-OD2 2.81Å; R75-D98 PolarHBondContact NH1-OD2 3.47Å; R75-D98 IonicContact NH2-OD1 3.22Å; R75-D98 IonicContact NH2-OD2 3.7Å; R75-D98 PolarHBondContact NH2-OD2 3.11Å
76R84.3Confident77.1Confident118 Ų11898.2 Ų98.245%0.44555%0.546SS..EExtended strand (participates in β ladder)trans-87.5126174.2-56.2-171.5-68.1123-8.1109.2D70 E88 I90D70-R76 IonicContact OD1-NE 3.83Å; D70-R76 IonicContact OD2-CZ 2.78Å; D70-R76 VanDerWaalsContact OD2-CZ 3.28Å; D70-R76 IonicContact OD2-NE 3.25Å; D70-R76 PolarHBondContact OD2-NE 2.81Å; D70-R76 IonicContact OD2-NH2 2.81Å; D70-R76 PolarHBondContact OD2-NH2 3.07Å; R76-E88 HydrophobicContact CB-CG 4.3Å; R76-E88 WeakPolarHBondContact CB-OE1 3.47Å; R76-E88 WeakPolarHBondContact CD-OE1 3.37Å; R76-E88 IonicContact CZ-OE1 2.68Å; R76-E88 IonicContact NE-OE1 2.95Å; R76-E88 IonicContact NH1-OE1 2.74Å; R76-E88 PolarHBondContact NH1-OE1 2.97Å; R76-I90 HydrophobicContact CG-CG1 4.26Å; R76-I90 HydrophobicContact CG-CG2 4.49Å
77I87.9Confident79Confident62 Ų6298 Ų9832%0.31853%0.533SS..EExtended strand (participates in β ladder)trans-119.9120.1-179.4-55.3-174.1000108.3R75 V79 I89 L91R75-I77 HydrophobicContact CG-CD1 4.48Å; R75-I77 HydrophobicContact CG-CG1 4.04Å; I77-V79 HydrophobicContact CG2-CG2 4.18Å; I77-I89 PolarHBondContact N-O 3.43Å; I77-I89 PolarHBondContact O-N 3.48Å; I77-L91 HydrophobicContact CD1-CD1 3.94Å; I77-L91 HydrophobicContact CG1-CD1 4.21Å
78L90.9Very high80.9Confident118 Ų11899 Ų9962%0.61853%0.531SS*.EExtended strand (participates in β ladder)trans-87.2116.6175.2-59.9-176.9000109.8I86 R87 E88L78-I86 HydrophobicContact CB-CG2 3.87Å; L78-I86 HydrophobicContact CD1-CG2 4.5Å; L78-I86 HydrophobicContact CD2-CG2 4.28Å; L78-I86 HydrophobicContact CG-CG2 4.44Å; L78-R87 WeakPolarHBondContact CA-O 3.4Å; L78-E88 HydrophobicContact CD2-CB 3.86Å; L78-E88 HydrophobicContact CD2-CG 4.05Å
79V91.3Very high82.5Confident59 Ų5997.7 Ų97.736%0.35851%0.507SS..EExtended strand (participates in β ladder)trans-108.4129.2177.2177.70000109I77 I86 R87 I89I77-V79 HydrophobicContact CG2-CG2 4.18Å; V79-I86 WeakPolarHBondContact O-CA 3.46Å; V79-R87 PolarHBondContact N-O 2.95Å; V79-R87 PolarHBondContact O-N 3.44Å; V79-I89 HydrophobicContact CB-CD1 4.18Å; V79-I89 HydrophobicContact CG2-CD1 3.58Å; V79-I89 HydrophobicContact CG2-CG1 4.1Å
80R93.1Very high83.6Confident181 Ų18197.9 Ų97.968%0.68349%0.494SS*.EExtended strand (participates in β ladder)trans-94.5120176-174175.7-75.7166.4-1.2110.1G84 S85 I86R80-G84 WeakPolarHBondContact CG-O 3.49Å; R80-S85 CarbonylContact C-O 3.55Å; R80-S85 WeakPolarHBondContact CA-O 3.45Å; R80-I86 HydrophobicContact CG-CG1 4.44Å
81D88.3Confident84.9Confident47 Ų4796.9 Ų96.925%0.25149%0.489SS..  trans-65.6159.2172.5-75-13.3000110.8K83 G84 S85 R87D81-K83 PolarHBondContact O-N 3.26Å; D81-G84 PolarHBondContact O-N 3.38Å; D81-S85 PolarHBondContact N-O 3.13Å; D81-R87 IonicContact OD1-NE 2.71Å; D81-R87 PolarHBondContact OD1-NE 2.9Å; D81-R87 IonicContact OD2-CZ 3.8Å; D81-R87 VanDerWaalsContact OD2-CZ 3.24Å; D81-R87 IonicContact OD2-NE 2.72Å; D81-R87 PolarHBondContact OD2-NE 2.99Å; D81-R87 IonicContact OD2-NH2 3.14Å; D81-R87 PolarHBondContact OD2-NH2 3.2Å
82A86.3Confident85.5Confident119 Ų11997 Ų9798%0.98349%0.49SS*.THydrogen-bonded Turntrans-59.6-13.2173.600000114.5
83K87.7Confident85.3Confident193 Ų19395.4 Ų95.484%0.83948%0.476SS*.THydrogen-bonded Turntrans-91.48.9172.3-62.2-169.7178.3-173.60113.7D81 S85D81-K83 PolarHBondContact O-N 3.26Å; K83-S85 PolarHBondContact O-N 3.32Å
84G87.6Confident85Confident45 Ų4591.2 Ų91.246%0.46448%0.482SS..SBendtrans80.4-16.7-177.900000115.1R80 D81R80-G84 WeakPolarHBondContact CG-O 3.49Å; D81-G84 PolarHBondContact O-N 3.38Å
85S89.7Confident84.5Confident65 Ų6594.6 Ų94.646%0.45550%0.499SS..  trans-56.9138.4174.4-47.20000111.7R80 D81 K83R80-S85 CarbonylContact C-O 3.55Å; R80-S85 WeakPolarHBondContact CA-O 3.45Å; D81-S85 PolarHBondContact N-O 3.13Å; K83-S85 PolarHBondContact O-N 3.32Å
86I91Very high83.7Confident96 Ų9694.3 Ų94.349%0.49251%0.505SS..EExtended strand (participates in β ladder)trans-103.6130.4176.9-56.8175.7000108.7L78 V79 R80L78-I86 HydrophobicContact CB-CG2 3.87Å; L78-I86 HydrophobicContact CD1-CG2 4.5Å; L78-I86 HydrophobicContact CD2-CG2 4.28Å; L78-I86 HydrophobicContact CG-CG2 4.44Å; V79-I86 WeakPolarHBondContact O-CA 3.46Å; R80-I86 HydrophobicContact CG-CG1 4.44Å
87R88.1Confident82.9Confident151 Ų15192.2 Ų92.257%0.5750%0.502SS*.EExtended strand (participates in β ladder)trans-111.8141.6171.4-60.7-176.9-169.8-98.4-11.6109.7L78 V79 D81L78-R87 WeakPolarHBondContact CA-O 3.4Å; V79-R87 PolarHBondContact N-O 2.95Å; V79-R87 PolarHBondContact O-N 3.44Å; D81-R87 IonicContact OD1-NE 2.71Å; D81-R87 PolarHBondContact OD1-NE 2.9Å; D81-R87 IonicContact OD2-CZ 3.8Å; D81-R87 VanDerWaalsContact OD2-CZ 3.24Å; D81-R87 IonicContact OD2-NE 2.72Å; D81-R87 PolarHBondContact OD2-NE 2.99Å; D81-R87 IonicContact OD2-NH2 3.14Å; D81-R87 PolarHBondContact OD2-NH2 3.2Å
88E89.6Confident81.9Confident92 Ų9294.6 Ų94.643%0.4352%0.515SS..EExtended strand (participates in β ladder)trans-90.5130.3167.9-174.6164.7-118.800110R76 L78 I90R76-E88 HydrophobicContact CB-CG 4.3Å; R76-E88 WeakPolarHBondContact CB-OE1 3.47Å; R76-E88 WeakPolarHBondContact CD-OE1 3.37Å; R76-E88 IonicContact CZ-OE1 2.68Å; R76-E88 IonicContact NE-OE1 2.95Å; R76-E88 IonicContact NH1-OE1 2.74Å; R76-E88 PolarHBondContact NH1-OE1 2.97Å; L78-E88 HydrophobicContact CD2-CB 3.86Å; L78-E88 HydrophobicContact CD2-CG 4.05Å; E88-I90 HydrophobicContact CG-CG1 4.07Å
89I87.1Confident81Confident82 Ų8296.7 Ų96.742%0.42152%0.515SS..EExtended strand (participates in β ladder)trans-116.5120.7171.2-44.2-175.1000107.5I77 V79 L91I77-I89 PolarHBondContact N-O 3.43Å; I77-I89 PolarHBondContact O-N 3.48Å; V79-I89 HydrophobicContact CB-CD1 4.18Å; V79-I89 HydrophobicContact CG2-CD1 3.58Å; V79-I89 HydrophobicContact CG2-CG1 4.1Å; I89-L91 HydrophobicContact CB-CD1 4.07Å; I89-L91 HydrophobicContact CG2-CD1 3.59Å
90I83.9Confident80.1Confident96 Ų9699.3 Ų99.349%0.49253%0.533SS..EExtended strand (participates in β ladder)trans-100.5116.8-177.7-53.1-177.2000108.3C74 R76 E88C74-I90 HydrophobicContact CB-CG2 3.69Å; C74-I90 WeakPolarHBondContact SG-CG2 3.49Å; R76-I90 HydrophobicContact CG-CG1 4.26Å; R76-I90 HydrophobicContact CG-CG2 4.49Å; E88-I90 HydrophobicContact CG-CG1 4.07Å
91L81.9Confident79.4Confident39 Ų3999.6 Ų99.620%0.20454%0.539CS..EExtended strand (participates in β ladder)trans-116.8135.7178.6-6987.5000109.9R75 I77 I89 K93 L95 L97R75-L91 PolarHBondContact N-O 3.27Å; R75-L91 PolarHBondContact O-N 3.08Å; I77-L91 HydrophobicContact CD1-CD1 3.94Å; I77-L91 HydrophobicContact CG1-CD1 4.21Å; I89-L91 HydrophobicContact CB-CD1 4.07Å; I89-L91 HydrophobicContact CG2-CD1 3.59Å; L91-K93 PolarHBondContact O-N 3.39Å; L91-L95 HydrophobicContact CB-CD1 4.42Å; L91-L95 HydrophobicContact CD2-CD1 4.36Å; L91-L97 HydrophobicContact CB-CD1 4.43Å; L91-L97 HydrophobicContact CD2-CD1 3.92Å; L91-L97 HydrophobicContact CD2-CD2 4.35Å
92P79.6Confident78.7Confident68 Ų68108.7 Ų108.744%0.44257%0.57SS.*EExtended strand (participates in β ladder)trans-57.7133.6171.4-23.633.2000111.3Y73 G94 L95Y73-P92 CarbonylContact O-C 3.52Å; Y73-P92 WeakPolarHBondContact O-CA 3.46Å; P92-G94 PolarHBondContact O-N 2.99Å; P92-G94 VanDerWaalsContact O-N 3.16Å; P92-L95 HydrophobicContact CB-CG 4.38Å; P92-L95 WeakPolarHBondContact O-CB 3.37Å; P92-L95 PolarHBondContact O-N 3.35Å
93K67.8Low78.3Confident97 Ų97109.5 Ų109.542%0.42256%0.563SS.*THydrogen-bonded Turntrans-63.6-19.5179.1-61.8-170-160.5172.50113.2D72 Y73 C74 R75 L91 L95D72-K93 WeakPolarHBondContact O-CD 3.31Å; D72-K93 WeakPolarHBondContact O-CE 3.44Å; D72-K93 PolarHBondContact O-NZ 3.41Å; D72-K93 IonicContact OD1-NZ 3.62Å; D72-K93 PolarHBondContact OD1-NZ 3.27Å; Y73-K93 PolarHBondContact O-N 3.23Å; C74-K93 WeakPolarHBondContact O-CE 3.48Å; R75-K93 HydrophobicContact CB-CG 4.06Å; L91-K93 PolarHBondContact O-N 3.39Å; K93-L95 PolarHBondContact O-N 3.01Å
94G66.9Low78.2Confident74 Ų74111.6 Ų111.676%0.76357%0.566SS**THydrogen-bonded Turntrans-73.9-8.8170.700000114.5P92 D96P92-G94 PolarHBondContact O-N 2.99Å; P92-G94 VanDerWaalsContact O-N 3.16Å; G94-D96 PolarHBondContact O-N 3.46Å
95L68.9Low78Confident90 Ų90112.6 Ų112.647%0.47156%0.563SS.*SBendtrans-73.3113.5162-62.1-175.6000107.7L91 P92 K93 L97L91-L95 HydrophobicContact CB-CD1 4.42Å; L91-L95 HydrophobicContact CD2-CD1 4.36Å; P92-L95 HydrophobicContact CB-CG 4.38Å; P92-L95 WeakPolarHBondContact O-CB 3.37Å; P92-L95 PolarHBondContact O-N 3.35Å; K93-L95 PolarHBondContact O-N 3.01Å; L95-L97 HydrophobicContact CB-CG 4.38Å; L95-L97 WeakPolarHBondContact O-CG 3.41Å; L95-L97 PolarHBondContact O-N 2.77Å
96D65.6Low78.1Confident89 Ų89114.7 Ų114.748%0.47658%0.577SS.*  trans-74.659.8-170.3-160.3-1.1000112.2G94 D98 R99G94-D96 PolarHBondContact O-N 3.46Å; D96-D98 VanDerWaalsContact C-N 3.25Å; D96-D98 PolarHBondContact O-N 3.2Å; D96-R99 HydrophobicContact CB-CB 4.3Å; D96-R99 WeakPolarHBondContact O-CB 3.33Å; D96-R99 PolarHBondContact O-N 3.44Å; D96-R99 WeakPolarHBondContact OD1-CB 3.49Å; D96-R99 PolarHBondContact OD1-N 3.01Å; D96-R99 IonicContact OD2-CZ 2.77Å; D96-R99 IonicContact OD2-NE 2.71Å; D96-R99 PolarHBondContact OD2-NE 2.83Å; D96-R99 IonicContact OD2-NH2 3.58Å; D96-R99 PolarHBondContact OD2-NH2 3.42Å
97L68.2Low78.4Confident73 Ų73112.8 Ų112.838%0.38257%0.566SS.*THydrogen-bonded Turntrans-67.3-28-179.1-65.1169.2000112.3L91 L95 R99L91-L97 HydrophobicContact CB-CD1 4.43Å; L91-L97 HydrophobicContact CD2-CD1 3.92Å; L91-L97 HydrophobicContact CD2-CD2 4.35Å; L95-L97 HydrophobicContact CB-CG 4.38Å; L95-L97 WeakPolarHBondContact O-CG 3.41Å; L95-L97 PolarHBondContact O-N 2.77Å; L97-R99 VanDerWaalsContact C-N 3.33Å
98D67.1Low78.8Confident112 Ų112109.1 Ų109.160%0.59956%0.56SS**THydrogen-bonded Turntrans-87.9-3.4178.1-58.7-19.4000111.9R75 D96 P100R75-D98 IonicContact CZ-OD1 3.63Å; R75-D98 IonicContact CZ-OD2 3.28Å; R75-D98 IonicContact NH1-OD1 2.72Å; R75-D98 PolarHBondContact NH1-OD1 2.91Å; R75-D98 IonicContact NH1-OD2 2.81Å; R75-D98 PolarHBondContact NH1-OD2 3.47Å; R75-D98 IonicContact NH2-OD1 3.22Å; R75-D98 IonicContact NH2-OD2 3.7Å; R75-D98 PolarHBondContact NH2-OD2 3.11Å; D96-D98 VanDerWaalsContact C-N 3.25Å; D96-D98 PolarHBondContact O-N 3.2Å; D98-P100 WeakPolarHBondContact O-CD 3.22Å
99R71.4Confident79.2Confident162 Ų162108.7 Ų108.761%0.61157%0.573SS**SBendtrans-52.8128.8167.9-179.1161.6-70-97.3-9.2109.1D96 L97 K101D96-R99 HydrophobicContact CB-CB 4.3Å; D96-R99 WeakPolarHBondContact O-CB 3.33Å; D96-R99 PolarHBondContact O-N 3.44Å; D96-R99 WeakPolarHBondContact OD1-CB 3.49Å; D96-R99 PolarHBondContact OD1-N 3.01Å; D96-R99 IonicContact OD2-CZ 2.77Å; D96-R99 IonicContact OD2-NE 2.71Å; D96-R99 PolarHBondContact OD2-NE 2.83Å; D96-R99 IonicContact OD2-NH2 3.58Å; D96-R99 PolarHBondContact OD2-NH2 3.42Å; L97-R99 VanDerWaalsContact C-N 3.33Å; R99-K101 PolarHBondContact O-N 2.9Å
100P73.1Confident79.7Confident115 Ų115111.5 Ų111.575%0.74758%0.584SS**  trans-51.5109.2170.6-29.136.4000110.6D98 R102D98-P100 WeakPolarHBondContact O-CD 3.22Å; P100-R102 PolarHBondContact O-N 3.13Å
101K77Confident80.4Confident187 Ų187108.4 Ų108.481%0.81357%0.567SS**  trans-60.5108.4179-80165.2179.71560107.6R99 T103R99-K101 PolarHBondContact O-N 2.9Å; K101-T103 PolarHBondContact O-N 2.9Å; K101-T103 VanDerWaalsContact O-N 3.08Å
102R73.7Confident81.1Confident237 Ų237110 Ų11089%0.89458%0.575SS**  trans-47.8119.1-178.2-83.9-174170.9177-2.3109.8P100 R104P100-R102 PolarHBondContact O-N 3.13Å; R102-R104 PolarHBondContact O-N 3.36Å; R102-R104 VanDerWaalsContact O-N 3.11Å
103T78.8Confident82Confident137 Ų137114.1 Ų114.184%0.8458%0.584SS**  trans-51.1118.7178.3-49.40000109.7K101 T105K101-T103 PolarHBondContact O-N 2.9Å; K101-T103 VanDerWaalsContact O-N 3.08Å; T103-T105 PolarHBondContact O-N 2.78Å; T103-T105 VanDerWaalsContact O-N 3.15Å
104R84.4Confident83.5Confident237 Ų237113.7 Ų113.789%0.89458%0.579SS**  trans-74.9106.6-173.4-171-179.1-174.2-165.71.8109.2R102 S106R102-R104 PolarHBondContact O-N 3.36Å; R102-R104 VanDerWaalsContact O-N 3.11Å; R104-S106 PolarHBondContact O-N 2.88Å
105T83.6Confident85Confident66 Ų66110.1 Ų110.141%0.40554%0.543SS..  trans-58.8124.8175.4-48.80000110.6T103 F107 Q143T103-T105 PolarHBondContact O-N 2.78Å; T103-T105 VanDerWaalsContact O-N 3.15Å; T105-F107 HydrophobicContact CG2-CD1 4.31Å; T105-F107 HydrophobicContact CG2-CE1 4Å; T105-F107 HydrophobicContact CG2-CZ 4.37Å; T105-Q143 PolarHBondContact OG1-NE2 2.81Å; T105-Q143 VanDerWaalsContact OG1-NE2 3.07Å
106S92.3Very high86.4Confident108 Ų108108.1 Ų108.176%0.75553%0.531SS*.  trans-87.3142159.443.60000109.5R104R104-S106 PolarHBondContact O-N 2.88Å
107F96.4Very high87.9Confident56 Ų56106.6 Ų106.625%0.24652%0.521CS..  trans-104.8146.8173.5-58.7-70.2000109.3T105 Q111 L112 L139 Q143 W147T105-F107 HydrophobicContact CG2-CD1 4.31Å; T105-F107 HydrophobicContact CG2-CE1 4Å; T105-F107 HydrophobicContact CG2-CZ 4.37Å; F107-Q111 HydrophobicContact CB-CB 4.31Å; F107-L112 HydrophobicContact CB-CD2 3.82Å; F107-L112 HydrophobicContact CB-CG 3.86Å; F107-L112 HydrophobicContact CD2-CD2 4.17Å; F107-L112 HydrophobicContact CG-CD2 4.31Å; F107-L139 HydrophobicContact CD1-CD1 3.87Å; F107-L139 HydrophobicContact CD1-CD2 3.89Å; F107-L139 HydrophobicContact CE1-CD1 3.77Å; F107-L139 HydrophobicContact CE1-CD2 3.82Å; F107-L139 HydrophobicContact CE1-CG 4.45Å; F107-Q143 HydrophobicContact CE1-CB 4.26Å; F107-Q143 HydrophobicContact CZ-CB 4.33Å; F107-W147 AromaticContact CD2-CD1 3.94Å; F107-W147 AromaticContact CE2-CD1 3.75Å
108T97.8Very high89.3Confident74 Ų74105.4 Ų105.445%0.45451%0.514SS..  trans-71.216117472.80000111.1E110 Q111 L112T108-E110 PolarHBondContact O-N 3.24Å; T108-Q111 PolarHBondContact O-N 3.47Å; T108-Q111 WeakPolarHBondContact OG1-CG 2.94Å; T108-Q111 PolarHBondContact OG1-N 2.96Å; T108-Q111 VanDerWaalsContact OG1-N 3.12Å; T108-L112 WeakPolarHBondContact O-CG 3.38Å; T108-L112 PolarHBondContact O-N 2.92Å
109A97.4Very high90.8Very high84 Ų84100.4 Ų100.469%0.69449%0.487SS*.Hα-helixtrans-58.5-38.5175.800000112.2L112 Y113A109-L112 PolarHBondContact O-N 3.34Å; A109-Y113 WeakPolarHBondContact O-CB 3.25Å; A109-Y113 PolarHBondContact O-N 3Å
110E97.7Very high92.1Very high141 Ų14199.9 Ų99.966%0.65949%0.491SS*.Hα-helixtrans-65.1-46.5175.7-173-171.917400112.2T108 L112 Y113 R114T108-E110 PolarHBondContact O-N 3.24Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.12Å; E110-Y113 PolarHBondContact O-N 3.42Å; E110-R114 VanDerWaalsContact O-CG 3.28Å; E110-R114 WeakPolarHBondContact O-CG 3.35Å; E110-R114 PolarHBondContact O-N 3.37Å
111Q97.9Very high93.2Very high31 Ų31103.4 Ų103.415%0.14549%0.49CS..Hα-helixtrans-58-45.3174.9-74.8172.4-24.700110.8F107 T108 R114 L115 L137F107-Q111 HydrophobicContact CB-CB 4.31Å; T108-Q111 PolarHBondContact O-N 3.47Å; T108-Q111 WeakPolarHBondContact OG1-CG 2.94Å; T108-Q111 PolarHBondContact OG1-N 2.96Å; T108-Q111 VanDerWaalsContact OG1-N 3.12Å; Q111-R114 PolarHBondContact O-N 3.25Å; Q111-L115 WeakPolarHBondContact O-CB 3.38Å; Q111-L115 WeakPolarHBondContact O-CD1 3.38Å; Q111-L115 WeakPolarHBondContact O-CG 3.36Å; Q111-L115 PolarHBondContact O-N 3.12Å; Q111-L137 HydrophobicContact CG-CB 4.37Å; Q111-L137 PolarHBondContact NE2-O 3.45Å
112L98.1Very high94.1Very high71 Ų7196.7 Ų96.737%0.37247%0.466SS..Hα-helixtrans-63.4-42.1177.3-69.5174.7000112.4F107 T108 A109 E110 L115 E116 W147F107-L112 HydrophobicContact CB-CD2 3.82Å; F107-L112 HydrophobicContact CB-CG 3.86Å; F107-L112 HydrophobicContact CD2-CD2 4.17Å; F107-L112 HydrophobicContact CG-CD2 4.31Å; T108-L112 WeakPolarHBondContact O-CG 3.38Å; T108-L112 PolarHBondContact O-N 2.92Å; A109-L112 PolarHBondContact O-N 3.34Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.12Å; L112-L115 PolarHBondContact O-N 3.16Å; L112-E116 WeakPolarHBondContact O-CB 3.45Å; L112-E116 PolarHBondContact O-N 2.65Å; L112-W147 VanDerWaalsContact CD2-NE1 3.31Å
113Y98.1Very high95.2Very high156 Ų15689.2 Ų89.261%0.61244%0.441SS*.Hα-helixtrans-61-47.9176.1172.7-103.2000111.8A109 E110 E116 M117A109-Y113 WeakPolarHBondContact O-CB 3.25Å; A109-Y113 PolarHBondContact O-N 3Å; E110-Y113 PolarHBondContact O-N 3.42Å; Y113-E116 PolarHBondContact O-N 3.08Å; Y113-M117 WeakPolarHBondContact O-CB 3.39Å; Y113-M117 PolarHBondContact O-N 3.35Å
114R98.1Very high96.2Very high87 Ų8789.2 Ų89.233%0.32843%0.427SS..Hα-helixtrans-67-38.3180-62.8-79.7-85.6159.81.4112E110 Q111 E118 L137E110-R114 VanDerWaalsContact O-CG 3.28Å; E110-R114 WeakPolarHBondContact O-CG 3.35Å; E110-R114 PolarHBondContact O-N 3.37Å; Q111-R114 PolarHBondContact O-N 3.25Å; R114-E118 PolarHBondContact O-N 3.01Å; R114-E118 VanDerWaalsContact O-N 3.09Å; R114-L137 HydrophobicContact CB-CD1 4.29Å; R114-L137 HydrophobicContact CB-CD2 3.6Å; R114-L137 HydrophobicContact CG-CD2 3.99Å
115L98.3Very high96.8Very high0 Ų078.5 Ų78.50%039%0.388CS..Hα-helixtrans-64.1-41.8173.2-72.5164.9000112.2Q111 L112 F119 L133 L137 L139 V144 W147 F148Q111-L115 WeakPolarHBondContact O-CB 3.38Å; Q111-L115 WeakPolarHBondContact O-CD1 3.38Å; Q111-L115 WeakPolarHBondContact O-CG 3.36Å; Q111-L115 PolarHBondContact O-N 3.12Å; L112-L115 PolarHBondContact O-N 3.16Å; L115-F119 VanDerWaalsContact O-CB 3.28Å; L115-F119 WeakPolarHBondContact O-CB 3.33Å; L115-F119 PolarHBondContact O-N 2.93Å; L115-L133 HydrophobicContact CD2-CD2 4.12Å; L115-L133 HydrophobicContact CD2-CG 4.46Å; L115-L137 HydrophobicContact CD1-CD1 4.37Å; L115-L137 HydrophobicContact CD2-CD1 3.73Å; L115-L137 HydrophobicContact CG-CD1 3.63Å; L115-L139 HydrophobicContact CD1-CD1 4.25Å; L115-V144 HydrophobicContact CD2-CG1 4.35Å; L115-W147 HydrophobicContact CB-CD2 3.95Å; L115-W147 HydrophobicContact CB-CE3 3.94Å; L115-W147 HydrophobicContact CB-CH2 3.75Å; L115-W147 HydrophobicContact CB-CZ2 3.71Å; L115-W147 HydrophobicContact CB-CZ3 3.86Å; L115-W147 HydrophobicContact CD1-CD2 3.93Å; L115-W147 HydrophobicContact CD1-CG 3.87Å; L115-W147 HydrophobicContact CD2-CD2 4.42Å; L115-W147 HydrophobicContact CD2-CE3 4.34Å; L115-W147 HydrophobicContact CG-CD2 4.32Å; L115-F148 HydrophobicContact CD2-CD2 4.48Å; L115-F148 HydrophobicContact CD2-CE2 3.85Å
116E98.3Very high97.4Very high47 Ų4779.7 Ų79.722%0.2240%0.395CS..Hα-helixtrans-69.9-38.5177.5-168.370.7-149.100112.1L112 Y113 F119 Q120 W147 R151L112-E116 WeakPolarHBondContact O-CB 3.45Å; L112-E116 PolarHBondContact O-N 2.65Å; Y113-E116 PolarHBondContact O-N 3.08Å; E116-F119 WeakPolarHBondContact O-CB 3.31Å; E116-F119 PolarHBondContact O-N 2.9Å; E116-Q120 WeakPolarHBondContact O-CG 3.4Å; E116-Q120 PolarHBondContact O-N 2.99Å; E116-W147 HydrophobicContact CB-CH2 4.38Å; E116-R151 VanDerWaalsContact CD-NE 3.26Å; E116-R151 IonicContact OE1-CZ 3.74Å; E116-R151 VanDerWaalsContact OE1-CZ 3.22Å; E116-R151 IonicContact OE1-NE 3.36Å; E116-R151 PolarHBondContact OE1-NE 2.88Å; E116-R151 IonicContact OE1-NH2 3.66Å; E116-R151 PolarHBondContact OE1-NH2 3.31Å; E116-R151 WeakPolarHBondContact OE2-CD 3.36Å; E116-R151 IonicContact OE2-CZ 3.9Å; E116-R151 IonicContact OE2-NE 3.49Å; E116-R151 PolarHBondContact OE2-NE 2.93Å; E116-R151 IonicContact OE2-NH2 2.93Å
117M98.2Very high97.6Very high57 Ų5776.6 Ų76.628%0.28138%0.379SS..Hα-helixtrans-60.8-45.6174.5-174.8-160.575.200111.7Y113 Q120 R121Y113-M117 WeakPolarHBondContact O-CB 3.39Å; Y113-M117 PolarHBondContact O-N 3.35Å; M117-Q120 PolarHBondContact O-N 3.37Å; M117-R121 PolarHBondContact O-N 3.06Å
118E98.1Very high97.6Very high48 Ų4884.7 Ų84.722%0.22441%0.408CS..Hα-helixtrans-71.6-32.1175.4-156.367.4-108.400111.6R114 Q120 R121 C122 V125 L133 F148R114-E118 PolarHBondContact O-N 3.01Å; R114-E118 VanDerWaalsContact O-N 3.09Å; E118-Q120 VanDerWaalsContact C-N 3.29Å; E118-Q120 PolarHBondContact O-N 2.87Å; E118-R121 WeakPolarHBondContact O-CB 3.42Å; E118-R121 PolarHBondContact O-N 3.25Å; E118-R121 VanDerWaalsContact OE1-CD 3.31Å; E118-R121 WeakPolarHBondContact OE1-CD 3.41Å; E118-R121 IonicContact OE1-CZ 2.58Å; E118-R121 IonicContact OE1-NE 3.61Å; E118-R121 PolarHBondContact OE1-NE 3.45Å; E118-R121 IonicContact OE1-NH2 2.69Å; E118-C122 PolarHBondContact O-N 3.4Å; E118-V125 HydrophobicContact CG-CG1 4.41Å; E118-L133 HydrophobicContact CB-CD2 4.21Å; E118-L133 HydrophobicContact CG-CD2 4.22Å; E118-F148 HydrophobicContact CB-CZ 4.43Å
119F98.1Very high97.6Very high7 Ų786.1 Ų86.13%0.03141%0.41CS..Hα-helixtrans-61.8-35.2174.5-171-99.9000113.4L115 E116 R121 C122 Q123 W147 F148 R151 R152L115-F119 VanDerWaalsContact O-CB 3.28Å; L115-F119 WeakPolarHBondContact O-CB 3.33Å; L115-F119 PolarHBondContact O-N 2.93Å; E116-F119 WeakPolarHBondContact O-CB 3.31Å; E116-F119 PolarHBondContact O-N 2.9Å; F119-R121 VanDerWaalsContact C-N 3.31Å; F119-C122 CarbonylContact O-C 3.55Å; F119-Q123 HydrophobicContact CD2-CB 4.39Å; F119-Q123 HydrophobicContact CE1-CG 4.03Å; F119-Q123 HydrophobicContact CE2-CB 3.77Å; F119-Q123 HydrophobicContact CE2-CG 4.01Å; F119-Q123 HydrophobicContact CZ-CB 3.93Å; F119-Q123 HydrophobicContact CZ-CG 3.73Å; F119-W147 HydrophobicContact CB-CH2 4.28Å; F119-W147 HydrophobicContact CB-CZ3 4.03Å; F119-W147 HydrophobicContact CD2-CZ3 4.21Å; F119-W147 HydrophobicContact CG-CZ3 4.27Å; F119-F148 HydrophobicContact CB-CE1 4.25Å; F119-F148 AromaticContact CD2-CD1 3.69Å; F119-F148 HydrophobicContact CD2-CD1 3.69Å; F119-F148 AromaticContact CD2-CE1 3.77Å; F119-F148 HydrophobicContact CD2-CE1 3.77Å; F119-F148 HydrophobicContact CE2-CD1 4.27Å; F119-R151 HydrophobicContact CD1-CG 3.62Å; F119-R151 HydrophobicContact CD2-CB 4.17Å; F119-R151 HydrophobicContact CD2-CG 3.68Å; F119-R151 HydrophobicContact CE1-CG 3.6Å; F119-R151 HydrophobicContact CE2-CB 4.01Å; F119-R151 HydrophobicContact CE2-CG 3.67Å; F119-R151 HydrophobicContact CG-CG 3.66Å; F119-R151 HydrophobicContact CZ-CB 4.28Å; F119-R151 HydrophobicContact CZ-CG 3.63Å; F119-R152 HydrophobicContact CE2-CG 3.69Å; F119-R152 HydrophobicContact CZ-CG 3.76Å
120Q97.6Very high97.6Very high151 Ų15184.5 Ų84.571%0.70639%0.386SS*.Hα-helixtrans-67.8-30.8173.7-70.9170.615.200112.3E116 M117 E118E116-Q120 WeakPolarHBondContact O-CG 3.4Å; E116-Q120 PolarHBondContact O-N 2.99Å; M117-Q120 PolarHBondContact O-N 3.37Å; E118-Q120 VanDerWaalsContact C-N 3.29Å; E118-Q120 PolarHBondContact O-N 2.87Å
121R97.1Very high97.6Very high189 Ų18981.1 Ų81.171%0.71338%0.375SS*.Hα-helixtrans-80.7-44176.6-68.1170.647.672.68.1112.5M117 E118 F119M117-R121 PolarHBondContact O-N 3.06Å; E118-R121 WeakPolarHBondContact O-CB 3.42Å; E118-R121 PolarHBondContact O-N 3.25Å; E118-R121 VanDerWaalsContact OE1-CD 3.31Å; E118-R121 WeakPolarHBondContact OE1-CD 3.41Å; E118-R121 IonicContact OE1-CZ 2.58Å; E118-R121 IonicContact OE1-NE 3.61Å; E118-R121 PolarHBondContact OE1-NE 3.45Å; E118-R121 IonicContact OE1-NH2 2.69Å; F119-R121 VanDerWaalsContact C-N 3.31Å
122C96.6Very high97.6Very high46 Ų4683 Ų8331%0.31138%0.384SS..  trans-148.6118.7178.1-178.50000110.8E118 F119 Y124 F148E118-C122 PolarHBondContact O-N 3.4Å; F119-C122 CarbonylContact O-C 3.55Å; C122-Y124 PolarHBondContact O-N 3.25Å; C122-Y124 VanDerWaalsContact O-N 3.14Å; C122-F148 WeakPolarHBondContact O-CE1 3.37Å
123Q97.3Very high97.6Very high81 Ų8180.1 Ų80.138%0.37937%0.369SS..SBendtrans-73.7-1.9179.9-61.4175.110.700113.9F119 R152F119-Q123 HydrophobicContact CD2-CB 4.39Å; F119-Q123 HydrophobicContact CE1-CG 4.03Å; F119-Q123 HydrophobicContact CE2-CB 3.77Å; F119-Q123 HydrophobicContact CE2-CG 4.01Å; F119-Q123 HydrophobicContact CZ-CB 3.93Å; F119-Q123 HydrophobicContact CZ-CG 3.73Å; Q123-R152 WeakPolarHBondContact O-CD 3Å; Q123-R152 PolarHBondContact O-NE 3.1Å
124Y97.9Very high97.6Very high137 Ų13773 Ų7354%0.53734%0.342SS..  trans-142.972.9-167.1-72.7-92.8000113.5C122 V126 R152C122-Y124 PolarHBondContact O-N 3.25Å; C122-Y124 VanDerWaalsContact O-N 3.14Å; Y124-V126 PolarHBondContact O-N 3.31Å; Y124-R152 WeakPolarHBondContact OH-CD 3.16Å; Y124-R152 PolarHBondContact OH-NH1 2.93Å
125V96.9Very high97.6Very high12 Ų1276.4 Ų76.47%0.07336%0.355CS..  trans-68.4126.3178-67.30000114E118 R130 L133 V144 F148E118-V125 HydrophobicContact CG-CG1 4.41Å; V125-R130 HydrophobicContact CB-CB 4.37Å; V125-R130 HydrophobicContact CG2-CB 4.28Å; V125-R130 HydrophobicContact CG2-CG 4.1Å; V125-R130 PolarHBondContact O-NE 2.94Å; V125-R130 PolarHBondContact O-NH2 3.36Å; V125-R130 VanDerWaalsContact O-NH2 3.13Å; V125-L133 HydrophobicContact CG1-CD2 4.28Å; V125-V144 HydrophobicContact CG2-CG1 3.92Å; V125-F148 HydrophobicContact CB-CE1 4.39Å; V125-F148 HydrophobicContact CB-CZ 4.41Å; V125-F148 HydrophobicContact CG1-CD1 4.42Å; V125-F148 HydrophobicContact CG1-CE1 3.71Å; V125-F148 HydrophobicContact CG1-CE2 4.29Å; V125-F148 HydrophobicContact CG1-CZ 3.63Å; V125-F148 HydrophobicContact CG2-CD1 3.92Å; V125-F148 HydrophobicContact CG2-CD2 3.72Å; V125-F148 HydrophobicContact CG2-CE1 3.95Å; V125-F148 HydrophobicContact CG2-CE2 3.75Å; V125-F148 HydrophobicContact CG2-CG 3.82Å; V125-F148 HydrophobicContact CG2-CZ 3.87Å
126V96.7Very high97.6Very high91 Ų9180.4 Ų80.455%0.55237%0.373SS*.  trans-126.9149.2-174.2-69.20000113Y124 R128 E129Y124-V126 PolarHBondContact O-N 3.31Å; V126-R128 PolarHBondContact O-N 2.93Å; V126-E129 WeakPolarHBondContact O-CB 3.44Å; V126-E129 PolarHBondContact O-N 3.37Å; V126-E129 VanDerWaalsContact O-N 3.08Å
127G95.9Very high97.5Very high42 Ų4278.7 Ų78.743%0.43337%0.365SS..Hα-helixtrans40.7-121176.800000113.6E129 R130 T131G127-E129 VanDerWaalsContact C-N 3.29Å; G127-E129 PolarHBondContact O-N 3.46Å; G127-R130 WeakPolarHBondContact O-CB 3.45Å; G127-R130 PolarHBondContact O-N 2.95Å; G127-T131 PolarHBondContact O-N 2.77Å; G127-T131 VanDerWaalsContact O-N 3.08Å; G127-T131 PolarHBondContact O-OG1 2.79Å
128R96.9Very high97.5Very high227 Ų22783 Ų8386%0.85739%0.39SS*.Hα-helixtrans-49.8-41.3-178.5-171.7-177.1-175.8-161.22114.3V126 R130 T131 E132V126-R128 PolarHBondContact O-N 2.93Å; R128-R130 VanDerWaalsContact C-N 3.3Å; R128-R130 PolarHBondContact O-N 3.01Å; R128-T131 PolarHBondContact O-N 2.71Å; R128-E132 WeakPolarHBondContact O-CB 3.42Å; R128-E132 PolarHBondContact O-N 2.8Å
129E97.3Very high97.4Very high104 Ų10481.8 Ų81.849%0.48639%0.385SS..Hα-helixtrans-63.3-40.9-179.9-57.9178.7143.400111V126 G127 L133V126-E129 WeakPolarHBondContact O-CB 3.44Å; V126-E129 PolarHBondContact O-N 3.37Å; V126-E129 VanDerWaalsContact O-N 3.08Å; G127-E129 VanDerWaalsContact C-N 3.29Å; G127-E129 PolarHBondContact O-N 3.46Å; E129-L133 VanDerWaalsContact O-CB 3.26Å; E129-L133 WeakPolarHBondContact O-CB 3.36Å; E129-L133 PolarHBondContact O-N 3.37Å
130R98.4Very high97.4Very high50 Ų5083.9 Ų83.919%0.18940%0.4CS..Hα-helixtrans-69.1-42.6177.9-163.7-168-48.8122.11.4111.4V125 G127 R128 E132 A134 E141 V144V125-R130 HydrophobicContact CB-CB 4.37Å; V125-R130 HydrophobicContact CG2-CB 4.28Å; V125-R130 HydrophobicContact CG2-CG 4.1Å; V125-R130 PolarHBondContact O-NE 2.94Å; V125-R130 PolarHBondContact O-NH2 3.36Å; V125-R130 VanDerWaalsContact O-NH2 3.13Å; G127-R130 WeakPolarHBondContact O-CB 3.45Å; G127-R130 PolarHBondContact O-N 2.95Å; R128-R130 VanDerWaalsContact C-N 3.3Å; R128-R130 PolarHBondContact O-N 3.01Å; R130-E132 VanDerWaalsContact C-N 3.35Å; R130-A134 WeakPolarHBondContact O-CB 3.4Å; R130-A134 PolarHBondContact O-N 3.24Å; R130-E141 WeakPolarHBondContact CD-O 3.49Å; R130-E141 WeakPolarHBondContact CD-OE2 3.42Å; R130-E141 HydrophobicContact CG-CB 4.39Å; R130-E141 HydrophobicContact CG-CG 4.1Å; R130-E141 IonicContact CZ-OE2 3.99Å; R130-E141 IonicContact NH1-OE2 3.82Å; R130-E141 PolarHBondContact NH1-OE2 3.09Å; R130-V144 HydrophobicContact CG-CB 4.11Å; R130-V144 HydrophobicContact CG-CG1 3.84Å
131T98.3Very high97.4Very high70 Ų7080 Ų8043%0.42938%0.382SS..Hα-helixtrans-60.8-44.4177.1-44.70000111G127 R128 R135 E141G127-T131 PolarHBondContact O-N 2.77Å; G127-T131 VanDerWaalsContact O-N 3.08Å; G127-T131 PolarHBondContact O-OG1 2.79Å; R128-T131 PolarHBondContact O-N 2.71Å; T131-R135 WeakPolarHBondContact O-CB 3.43Å; T131-R135 PolarHBondContact O-N 3.35Å; T131-E141 WeakPolarHBondContact CB-OE1 3.26Å; T131-E141 PolarHBondContact OG1-OE1 2.74Å
132E98Very high97.3Very high70 Ų7075.4 Ų75.433%0.32738%0.375SS..Hα-helixtrans-71.1-42.8179.5178.555.2-161.900112.4R128 R130 A134 R135 Q136R128-E132 WeakPolarHBondContact O-CB 3.42Å; R128-E132 PolarHBondContact O-N 2.8Å; R130-E132 VanDerWaalsContact C-N 3.35Å; E132-A134 VanDerWaalsContact C-N 3.32Å; E132-A134 PolarHBondContact O-N 3.06Å; E132-R135 WeakPolarHBondContact O-CB 3.24Å; E132-R135 PolarHBondContact O-N 2.93Å; E132-R135 IonicContact OE1-CZ 2.74Å; E132-R135 IonicContact OE1-NE 2.85Å; E132-R135 IonicContact OE1-NH2 3.5Å; E132-R135 PolarHBondContact OE1-NH2 3.46Å; E132-R135 IonicContact OE2-CZ 3.44Å; E132-R135 IonicContact OE2-NE 3.63Å; E132-R135 PolarHBondContact OE2-NE 3.04Å; E132-R135 IonicContact OE2-NH2 3.31Å; E132-R135 PolarHBondContact OE2-NH2 3.37Å; E132-Q136 WeakPolarHBondContact O-CG 3.28Å; E132-Q136 PolarHBondContact O-N 2.84Å; E132-Q136 WeakPolarHBondContact OE1-CG 3.36Å; E132-Q136 PolarHBondContact OE1-NE2 3.47Å
133L97.8Very high97.3Very high11 Ų1175.8 Ų75.86%0.05837%0.373CS..Hα-helixtrans-63.8-37.7174.7-17562.2000111.9L115 E118 V125 E129 L137 V144 F148L115-L133 HydrophobicContact CD2-CD2 4.12Å; L115-L133 HydrophobicContact CD2-CG 4.46Å; E118-L133 HydrophobicContact CB-CD2 4.21Å; E118-L133 HydrophobicContact CG-CD2 4.22Å; V125-L133 HydrophobicContact CG1-CD2 4.28Å; E129-L133 VanDerWaalsContact O-CB 3.26Å; E129-L133 WeakPolarHBondContact O-CB 3.36Å; E129-L133 PolarHBondContact O-N 3.37Å; L133-L137 HydrophobicContact CD1-CD1 3.79Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CG-CD1 4.13Å; L133-L137 WeakPolarHBondContact O-CB 3.36Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.41Å; L133-L137 PolarHBondContact O-N 2.92Å; L133-V144 HydrophobicContact CD2-CG1 4.05Å; L133-F148 HydrophobicContact CD2-CE2 3.75Å; L133-F148 HydrophobicContact CD2-CZ 3.94Å
134A98.1Very high97.4Very high5 Ų572 Ų724%0.04136%0.355CS..Hα-helixtrans-61.7-47.1172.700000111.3R130 E132 L137 N138 L139 E141 V144R130-A134 WeakPolarHBondContact O-CB 3.4Å; R130-A134 PolarHBondContact O-N 3.24Å; E132-A134 VanDerWaalsContact C-N 3.32Å; E132-A134 PolarHBondContact O-N 3.06Å; A134-L137 PolarHBondContact O-N 3.38Å; A134-N138 PolarHBondContact O-N 2.78Å; A134-N138 VanDerWaalsContact O-N 3.12Å; A134-L139 CarbonylContact C-O 3.5Å; A134-L139 WeakPolarHBondContact CB-O 3.42Å; A134-L139 PolarHBondContact O-N 2.9Å; A134-L139 VanDerWaalsContact O-O 3.13Å; A134-E141 HydrophobicContact CB-CG 4.09Å; A134-V144 HydrophobicContact CB-CG2 3.93Å
135R98.1Very high97.3Very high159 Ų15971.7 Ų71.760%0.636%0.356SS*.Hα-helixtrans-60.5-48.2176.5-168.7-166.970.477.92.5112.4T131 E132 L137 N138T131-R135 WeakPolarHBondContact O-CB 3.43Å; T131-R135 PolarHBondContact O-N 3.35Å; E132-R135 WeakPolarHBondContact O-CB 3.24Å; E132-R135 PolarHBondContact O-N 2.93Å; E132-R135 IonicContact OE1-CZ 2.74Å; E132-R135 IonicContact OE1-NE 2.85Å; E132-R135 IonicContact OE1-NH2 3.5Å; E132-R135 PolarHBondContact OE1-NH2 3.46Å; E132-R135 IonicContact OE2-CZ 3.44Å; E132-R135 IonicContact OE2-NE 3.63Å; E132-R135 PolarHBondContact OE2-NE 3.04Å; E132-R135 IonicContact OE2-NH2 3.31Å; E132-R135 PolarHBondContact OE2-NH2 3.37Å; R135-L137 VanDerWaalsContact C-N 3.26Å; R135-L137 PolarHBondContact O-N 3.13Å; R135-N138 PolarHBondContact O-N 3.18Å
136Q97.6Very high97.3Very high85 Ų8574.8 Ų74.840%0.39738%0.375SS..Hα-helixtrans-62.5-31.3-179.6-73.6-175.723.900113.3E132E132-Q136 WeakPolarHBondContact O-CG 3.28Å; E132-Q136 PolarHBondContact O-N 2.84Å; E132-Q136 WeakPolarHBondContact OE1-CG 3.36Å; E132-Q136 PolarHBondContact OE1-NE2 3.47Å
137L97.1Very high97.4Very high10 Ų1071.9 Ų71.95%0.05235%0.354CS..Hα-helixtrans-98.60.9-176.3-59.4-176.6000113.9Q111 R114 L115 L133 A134 R135 L139Q111-L137 HydrophobicContact CG-CB 4.37Å; Q111-L137 PolarHBondContact NE2-O 3.45Å; R114-L137 HydrophobicContact CB-CD1 4.29Å; R114-L137 HydrophobicContact CB-CD2 3.6Å; R114-L137 HydrophobicContact CG-CD2 3.99Å; L115-L137 HydrophobicContact CD1-CD1 4.37Å; L115-L137 HydrophobicContact CD2-CD1 3.73Å; L115-L137 HydrophobicContact CG-CD1 3.63Å; L133-L137 HydrophobicContact CD1-CD1 3.79Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CG-CD1 4.13Å; L133-L137 WeakPolarHBondContact O-CB 3.36Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.41Å; L133-L137 PolarHBondContact O-N 2.92Å; A134-L137 PolarHBondContact O-N 3.38Å; R135-L137 VanDerWaalsContact C-N 3.26Å; R135-L137 PolarHBondContact O-N 3.13Å; L137-L139 VanDerWaalsContact C-N 3.28Å; L137-L139 HydrophobicContact CB-CD1 4.04Å; L137-L139 HydrophobicContact CB-CG 4.05Å; L137-L139 HydrophobicContact CD1-CD1 4.46Å; L137-L139 PolarHBondContact O-N 3.14Å
138N97.6Very high97.5Very high147 Ų14770.1 Ų70.179%0.78633%0.334SS*.THydrogen-bonded Turntrans54.243.6-172.4-59.7-78.7000112.5A134 R135A134-N138 PolarHBondContact O-N 2.78Å; A134-N138 VanDerWaalsContact O-N 3.12Å; R135-N138 PolarHBondContact O-N 3.18Å
139L96.6Very high97.5Very high23 Ų2363.4 Ų63.412%0.1231%0.313CS..  trans-117.6161.4177.8-64.3179.7000110.5F107 L115 A134 L137 V144F107-L139 HydrophobicContact CD1-CD1 3.87Å; F107-L139 HydrophobicContact CD1-CD2 3.89Å; F107-L139 HydrophobicContact CE1-CD1 3.77Å; F107-L139 HydrophobicContact CE1-CD2 3.82Å; F107-L139 HydrophobicContact CE1-CG 4.45Å; L115-L139 HydrophobicContact CD1-CD1 4.25Å; A134-L139 CarbonylContact C-O 3.5Å; A134-L139 WeakPolarHBondContact CB-O 3.42Å; A134-L139 PolarHBondContact O-N 2.9Å; A134-L139 VanDerWaalsContact O-O 3.13Å; L137-L139 VanDerWaalsContact C-N 3.28Å; L137-L139 HydrophobicContact CB-CD1 4.04Å; L137-L139 HydrophobicContact CB-CG 4.05Å; L137-L139 HydrophobicContact CD1-CD1 4.46Å; L137-L139 PolarHBondContact O-N 3.14Å; L139-V144 HydrophobicContact CB-CG2 4.2Å; L139-V144 HydrophobicContact CD1-CG2 4.43Å
140S97.1Very high97.5Very high52 Ų5263.1 Ų63.136%0.36432%0.315SS..  trans-79.2149.8166.367.20000111.6T142 Q143 V144S140-T142 PolarHBondContact O-N 2.85Å; S140-T142 VanDerWaalsContact O-N 3.1Å; S140-Q143 PolarHBondContact O-N 3.18Å; S140-Q143 VanDerWaalsContact OG-CD 3.31Å; S140-Q143 WeakPolarHBondContact OG-CG 3.36Å; S140-Q143 PolarHBondContact OG-N 3.29Å; S140-Q143 PolarHBondContact OG-OE1 2.91Å; S140-V144 PolarHBondContact O-N 2.93Å; S140-V144 VanDerWaalsContact O-N 3.08Å
141E97.5Very high97.5Very high68 Ų6862.6 Ų62.632%0.31831%0.313SS..Hα-helixtrans-52.6-32.5170.9-84.7-160-134.900113.1R130 T131 A134 V144 K145R130-E141 WeakPolarHBondContact CD-O 3.49Å; R130-E141 WeakPolarHBondContact CD-OE2 3.42Å; R130-E141 HydrophobicContact CG-CB 4.39Å; R130-E141 HydrophobicContact CG-CG 4.1Å; R130-E141 IonicContact CZ-OE2 3.99Å; R130-E141 IonicContact NH1-OE2 3.82Å; R130-E141 PolarHBondContact NH1-OE2 3.09Å; T131-E141 WeakPolarHBondContact CB-OE1 3.26Å; T131-E141 PolarHBondContact OG1-OE1 2.74Å; A134-E141 HydrophobicContact CB-CG 4.09Å; E141-V144 PolarHBondContact O-N 3.42Å; E141-K145 VanDerWaalsContact O-CB 3.24Å; E141-K145 WeakPolarHBondContact O-CB 3.4Å; E141-K145 PolarHBondContact O-N 2.96Å
142T96.4Very high97.4Very high94 Ų9461.7 Ų61.758%0.57730%0.301SS*.Hα-helixtrans-68.5-40.5177.3-65.50000111.5S140 K145 V146S140-T142 PolarHBondContact O-N 2.85Å; S140-T142 VanDerWaalsContact O-N 3.1Å; T142-K145 PolarHBondContact O-N 3.33Å; T142-V146 HydrophobicContact CG2-CG2 4.46Å; T142-V146 WeakPolarHBondContact O-CB 3.34Å; T142-V146 VanDerWaalsContact O-CG2 3.26Å; T142-V146 WeakPolarHBondContact O-CG2 3.29Å; T142-V146 PolarHBondContact O-N 3.21Å
143Q96.5Very high97.4Very high54 Ų5462.2 Ų62.225%0.25231%0.309SS..Hα-helixtrans-64.6-43.3173.9-76.5154.7-43.800111.3T105 F107 S140 V146 W147T105-Q143 PolarHBondContact OG1-NE2 2.81Å; T105-Q143 VanDerWaalsContact OG1-NE2 3.07Å; F107-Q143 HydrophobicContact CE1-CB 4.26Å; F107-Q143 HydrophobicContact CZ-CB 4.33Å; S140-Q143 PolarHBondContact O-N 3.18Å; S140-Q143 VanDerWaalsContact OG-CD 3.31Å; S140-Q143 WeakPolarHBondContact OG-CG 3.36Å; S140-Q143 PolarHBondContact OG-N 3.29Å; S140-Q143 PolarHBondContact OG-OE1 2.91Å; Q143-V146 PolarHBondContact O-N 2.89Å; Q143-W147 WeakPolarHBondContact O-CB 3.27Å; Q143-W147 PolarHBondContact O-N 2.88Å
144V97.6Very high97.3Very high0 Ų066.6 Ų66.60%033%0.328CS..Hα-helixtrans-60.9-49.5174.6179.90000110.7L115 V125 R130 L133 A134 L139 S140 E141 V146 W147 F148L115-V144 HydrophobicContact CD2-CG1 4.35Å; V125-V144 HydrophobicContact CG2-CG1 3.92Å; R130-V144 HydrophobicContact CG-CB 4.11Å; R130-V144 HydrophobicContact CG-CG1 3.84Å; L133-V144 HydrophobicContact CD2-CG1 4.05Å; A134-V144 HydrophobicContact CB-CG2 3.93Å; L139-V144 HydrophobicContact CB-CG2 4.2Å; L139-V144 HydrophobicContact CD1-CG2 4.43Å; S140-V144 PolarHBondContact O-N 2.93Å; S140-V144 VanDerWaalsContact O-N 3.08Å; E141-V144 PolarHBondContact O-N 3.42Å; V144-V146 VanDerWaalsContact C-N 3.33Å; V144-V146 PolarHBondContact O-N 2.92Å; V144-W147 PolarHBondContact O-N 2.68Å; V144-F148 HydrophobicContact CG1-CD2 3.79Å; V144-F148 HydrophobicContact CG1-CE2 3.85Å; V144-F148 WeakPolarHBondContact O-CD2 3.31Å; V144-F148 PolarHBondContact O-N 2.74Å
145K97Very high97.2Very high132 Ų13268.5 Ų68.557%0.57434%0.336SS*.Hα-helixtrans-55.9-44.7176.9-178.2-179.8178.3-179.10112.3E141 T142 Q149E141-K145 VanDerWaalsContact O-CB 3.24Å; E141-K145 WeakPolarHBondContact O-CB 3.4Å; E141-K145 PolarHBondContact O-N 2.96Å; T142-K145 PolarHBondContact O-N 3.33Å; K145-Q149 WeakPolarHBondContact O-CB 3.1Å; K145-Q149 PolarHBondContact O-N 2.95Å
146V97Very high97Very high76 Ų7668.7 Ų68.746%0.46134%0.341SS..Hα-helixtrans-68.5-40.5177.9168.80000111.3T142 Q143 V144 Q149 N150T142-V146 HydrophobicContact CG2-CG2 4.46Å; T142-V146 WeakPolarHBondContact O-CB 3.34Å; T142-V146 VanDerWaalsContact O-CG2 3.26Å; T142-V146 WeakPolarHBondContact O-CG2 3.29Å; T142-V146 PolarHBondContact O-N 3.21Å; Q143-V146 PolarHBondContact O-N 2.89Å; V144-V146 VanDerWaalsContact C-N 3.33Å; V144-V146 PolarHBondContact O-N 2.92Å; V146-Q149 PolarHBondContact O-N 3.23Å; V146-N150 WeakPolarHBondContact O-CB 3.49Å; V146-N150 PolarHBondContact O-N 3.44Å; V146-N150 PolarHBondContact O-ND2 2.72Å
147W97.4Very high96.7Very high30 Ų3071.4 Ų71.411%0.11435%0.352CS..Hα-helixtrans-61.1-49.8175.9-171.1101.9000111.2F107 L112 L115 E116 F119 Q143 V144 Q149 N150 R151F107-W147 AromaticContact CD2-CD1 3.94Å; F107-W147 AromaticContact CE2-CD1 3.75Å; L112-W147 VanDerWaalsContact CD2-NE1 3.31Å; L115-W147 HydrophobicContact CB-CD2 3.95Å; L115-W147 HydrophobicContact CB-CE3 3.94Å; L115-W147 HydrophobicContact CB-CH2 3.75Å; L115-W147 HydrophobicContact CB-CZ2 3.71Å; L115-W147 HydrophobicContact CB-CZ3 3.86Å; L115-W147 HydrophobicContact CD1-CD2 3.93Å; L115-W147 HydrophobicContact CD1-CG 3.87Å; L115-W147 HydrophobicContact CD2-CD2 4.42Å; L115-W147 HydrophobicContact CD2-CE3 4.34Å; L115-W147 HydrophobicContact CG-CD2 4.32Å; E116-W147 HydrophobicContact CB-CH2 4.38Å; F119-W147 HydrophobicContact CB-CH2 4.28Å; F119-W147 HydrophobicContact CB-CZ3 4.03Å; F119-W147 HydrophobicContact CD2-CZ3 4.21Å; F119-W147 HydrophobicContact CG-CZ3 4.27Å; Q143-W147 WeakPolarHBondContact O-CB 3.27Å; Q143-W147 PolarHBondContact O-N 2.88Å; V144-W147 PolarHBondContact O-N 2.68Å; W147-Q149 VanDerWaalsContact C-N 3.32Å; W147-Q149 PolarHBondContact O-N 2.96Å; W147-N150 PolarHBondContact O-N 3.2Å; W147-R151 HydrophobicContact CD2-CB 4.5Å; W147-R151 HydrophobicContact CE3-CB 3.94Å; W147-R151 HydrophobicContact CE3-CG 4.47Å; W147-R151 HydrophobicContact CH2-CB 3.99Å; W147-R151 HydrophobicContact CH2-CG 3.66Å; W147-R151 HydrophobicContact CZ2-CG 4.44Å; W147-R151 HydrophobicContact CZ3-CB 3.66Å; W147-R151 HydrophobicContact CZ3-CG 3.69Å; W147-R151 WeakPolarHBondContact O-CB 3.39Å; W147-R151 PolarHBondContact O-N 2.94Å
148F98.3Very high96.3Very high5 Ų573.9 Ų73.92%0.02237%0.365CS..Hα-helixtrans-62.6-37.1177.9-88-103.1000112.6L115 E118 F119 C122 V125 L133 V144 R151 R152L115-F148 HydrophobicContact CD2-CD2 4.48Å; L115-F148 HydrophobicContact CD2-CE2 3.85Å; E118-F148 HydrophobicContact CB-CZ 4.43Å; F119-F148 HydrophobicContact CB-CE1 4.25Å; F119-F148 AromaticContact CD2-CD1 3.69Å; F119-F148 HydrophobicContact CD2-CD1 3.69Å; F119-F148 AromaticContact CD2-CE1 3.77Å; F119-F148 HydrophobicContact CD2-CE1 3.77Å; F119-F148 HydrophobicContact CE2-CD1 4.27Å; C122-F148 WeakPolarHBondContact O-CE1 3.37Å; V125-F148 HydrophobicContact CB-CE1 4.39Å; V125-F148 HydrophobicContact CB-CZ 4.41Å; V125-F148 HydrophobicContact CG1-CD1 4.42Å; V125-F148 HydrophobicContact CG1-CE1 3.71Å; V125-F148 HydrophobicContact CG1-CE2 4.29Å; V125-F148 HydrophobicContact CG1-CZ 3.63Å; V125-F148 HydrophobicContact CG2-CD1 3.92Å; V125-F148 HydrophobicContact CG2-CD2 3.72Å; V125-F148 HydrophobicContact CG2-CE1 3.95Å; V125-F148 HydrophobicContact CG2-CE2 3.75Å; V125-F148 HydrophobicContact CG2-CG 3.82Å; V125-F148 HydrophobicContact CG2-CZ 3.87Å; L133-F148 HydrophobicContact CD2-CE2 3.75Å; L133-F148 HydrophobicContact CD2-CZ 3.94Å; V144-F148 HydrophobicContact CG1-CD2 3.79Å; V144-F148 HydrophobicContact CG1-CE2 3.85Å; V144-F148 WeakPolarHBondContact O-CD2 3.31Å; V144-F148 PolarHBondContact O-N 2.74Å; F148-R151 PolarHBondContact O-N 3.49Å; F148-R152 PolarHBondContact O-N 2.95Å; F148-R152 VanDerWaalsContact O-N 3.13Å
149Q98Very high95.8Very high87 Ų8772.1 Ų72.141%0.40735%0.352SS..Hα-helixtrans-65.9-43.5174.1-174.955.17200112K145 V146 W147 R151 T153K145-Q149 WeakPolarHBondContact O-CB 3.1Å; K145-Q149 PolarHBondContact O-N 2.95Å; V146-Q149 PolarHBondContact O-N 3.23Å; W147-Q149 VanDerWaalsContact C-N 3.32Å; W147-Q149 PolarHBondContact O-N 2.96Å; Q149-R151 VanDerWaalsContact C-N 3.35Å; Q149-T153 PolarHBondContact O-N 2.86Å; Q149-T153 VanDerWaalsContact O-N 3.14Å; Q149-T153 PolarHBondContact O-OG1 3.34Å; Q149-T153 VanDerWaalsContact O-OG1 3.06Å
150N97.3Very high94.9Very high98 Ų9873 Ų7352%0.52437%0.367SS..Hα-helixtrans-65.6-37.9175.4-70.5-19.7000111.6V146 W147 T153 K154V146-N150 WeakPolarHBondContact O-CB 3.49Å; V146-N150 PolarHBondContact O-N 3.44Å; V146-N150 PolarHBondContact O-ND2 2.72Å; W147-N150 PolarHBondContact O-N 3.2Å; N150-T153 PolarHBondContact O-N 2.84Å; N150-K154 WeakPolarHBondContact O-CB 3.35Å; N150-K154 PolarHBondContact O-N 2.69Å
151R97.6Very high93.9Very high38 Ų3875.8 Ų75.814%0.14337%0.373CS..Hα-helixtrans-66.3-40.6-179-175.463.9-170.289.6-4.2112.6E116 F119 W147 F148 Q149 K154 Q155E116-R151 VanDerWaalsContact CD-NE 3.26Å; E116-R151 IonicContact OE1-CZ 3.74Å; E116-R151 VanDerWaalsContact OE1-CZ 3.22Å; E116-R151 IonicContact OE1-NE 3.36Å; E116-R151 PolarHBondContact OE1-NE 2.88Å; E116-R151 IonicContact OE1-NH2 3.66Å; E116-R151 PolarHBondContact OE1-NH2 3.31Å; E116-R151 WeakPolarHBondContact OE2-CD 3.36Å; E116-R151 IonicContact OE2-CZ 3.9Å; E116-R151 IonicContact OE2-NE 3.49Å; E116-R151 PolarHBondContact OE2-NE 2.93Å; E116-R151 IonicContact OE2-NH2 2.93Å; F119-R151 HydrophobicContact CD1-CG 3.62Å; F119-R151 HydrophobicContact CD2-CB 4.17Å; F119-R151 HydrophobicContact CD2-CG 3.68Å; F119-R151 HydrophobicContact CE1-CG 3.6Å; F119-R151 HydrophobicContact CE2-CB 4.01Å; F119-R151 HydrophobicContact CE2-CG 3.67Å; F119-R151 HydrophobicContact CG-CG 3.66Å; F119-R151 HydrophobicContact CZ-CB 4.28Å; F119-R151 HydrophobicContact CZ-CG 3.63Å; W147-R151 HydrophobicContact CD2-CB 4.5Å; W147-R151 HydrophobicContact CE3-CB 3.94Å; W147-R151 HydrophobicContact CE3-CG 4.47Å; W147-R151 HydrophobicContact CH2-CB 3.99Å; W147-R151 HydrophobicContact CH2-CG 3.66Å; W147-R151 HydrophobicContact CZ2-CG 4.44Å; W147-R151 HydrophobicContact CZ3-CB 3.66Å; W147-R151 HydrophobicContact CZ3-CG 3.69Å; W147-R151 WeakPolarHBondContact O-CB 3.39Å; W147-R151 PolarHBondContact O-N 2.94Å; F148-R151 PolarHBondContact O-N 3.49Å; Q149-R151 VanDerWaalsContact C-N 3.35Å; R151-K154 PolarHBondContact O-N 3.08Å; R151-Q155 WeakPolarHBondContact O-CB 3.39Å; R151-Q155 PolarHBondContact O-N 2.83Å
152R97.5Very high92.7Very high51 Ų5176.4 Ų76.419%0.19238%0.378CS..Hα-helixtrans-64.6-43.1170.8-73.6-174.7-76.1114.67.7112F119 Q123 Y124 F148 K154 Q155 K156F119-R152 HydrophobicContact CE2-CG 3.69Å; F119-R152 HydrophobicContact CZ-CG 3.76Å; Q123-R152 WeakPolarHBondContact O-CD 3Å; Q123-R152 PolarHBondContact O-NE 3.1Å; Y124-R152 WeakPolarHBondContact OH-CD 3.16Å; Y124-R152 PolarHBondContact OH-NH1 2.93Å; F148-R152 PolarHBondContact O-N 2.95Å; F148-R152 VanDerWaalsContact O-N 3.13Å; R152-K154 VanDerWaalsContact C-N 3.33Å; R152-K154 PolarHBondContact O-N 3.24Å; R152-Q155 PolarHBondContact O-N 2.98Å; R152-K156 PolarHBondContact O-N 3.19Å
153T97.1Very high91.5Very high81 Ų8175.8 Ų75.850%0.49738%0.378SS..Hα-helixtrans-60.8-41.9174.7-58.90000111.7Q149 N150 K156 K157Q149-T153 PolarHBondContact O-N 2.86Å; Q149-T153 VanDerWaalsContact O-N 3.14Å; Q149-T153 PolarHBondContact O-OG1 3.34Å; Q149-T153 VanDerWaalsContact O-OG1 3.06Å; N150-T153 PolarHBondContact O-N 2.84Å; T153-K156 PolarHBondContact O-N 3.44Å; T153-K157 PolarHBondContact O-N 3.17Å
154K95.4Very high90.4Very high104 Ų10480 Ų8045%0.45240%0.397SS..Hα-helixtrans-60.2-54.5173.6-155-161.279-175.90110.4N150 R151 R152 K156 K157 D158N150-K154 WeakPolarHBondContact O-CB 3.35Å; N150-K154 PolarHBondContact O-N 2.69Å; R151-K154 PolarHBondContact O-N 3.08Å; R152-K154 VanDerWaalsContact C-N 3.33Å; R152-K154 PolarHBondContact O-N 3.24Å; K154-K156 VanDerWaalsContact C-N 3.28Å; K154-K156 PolarHBondContact O-N 3.12Å; K154-K157 CarbonylContact O-C 3.46Å; K154-K157 WeakPolarHBondContact O-CA 3.29Å; K154-K157 WeakPolarHBondContact O-CB 3.44Å; K154-K157 PolarHBondContact O-N 3.38Å; K154-D158 VanDerWaalsContact C-OD2 3.29Å; K154-D158 WeakPolarHBondContact CE-OD2 3.4Å; K154-D158 WeakPolarHBondContact CG-OD2 3.48Å; K154-D158 PolarHBondContact O-N 2.84Å; K154-D158 VanDerWaalsContact O-OD2 3.1Å
155Q95.6Very high89.3Confident44 Ų4485.3 Ų85.321%0.20643%0.425CS..Hα-helixtrans-53.7-40.8178.9-167.9-169.1-4.800112.8R151 R152 D158 Q159R151-Q155 WeakPolarHBondContact O-CB 3.39Å; R151-Q155 PolarHBondContact O-N 2.83Å; R152-Q155 PolarHBondContact O-N 2.98Å; Q155-D158 PolarHBondContact O-N 2.94Å; Q155-Q159 WeakPolarHBondContact O-CB 3.15Å; Q155-Q159 WeakPolarHBondContact O-CG 3.33Å; Q155-Q159 PolarHBondContact O-N 3.45Å; Q155-Q159 PolarHBondContact O-NE2 3.32Å
156K94.3Very high88.1Confident164 Ų16487.3 Ų87.371%0.71343%0.429SS*.Hα-helixtrans-65.1-41175.7-163.3-17974.5162.40112.1R152 T153 K154 G160R152-K156 PolarHBondContact O-N 3.19Å; T153-K156 PolarHBondContact O-N 3.44Å; K154-K156 VanDerWaalsContact C-N 3.28Å; K154-K156 PolarHBondContact O-N 3.12Å; K156-G160 PolarHBondContact O-N 3.36Å
157K92.3Very high87.1Confident142 Ų14287.1 Ų87.162%0.61743%0.431SS*.Hα-helixtrans-68.3-37.2175.8-171.7172-174.4172.30112.2T153 K154 K161T153-K157 PolarHBondContact O-N 3.17Å; K154-K157 CarbonylContact O-C 3.46Å; K154-K157 WeakPolarHBondContact O-CA 3.29Å; K154-K157 WeakPolarHBondContact O-CB 3.44Å; K154-K157 PolarHBondContact O-N 3.38Å; K157-K161 WeakPolarHBondContact O-CG 3.34Å; K157-K161 PolarHBondContact O-N 3.26Å
158D88Confident86.2Confident62 Ų6289.5 Ų89.533%0.33245%0.449SS..Hα-helixtrans-69.2-43.2179.9-57.2-29.2000110.9K154 Q155 K161 D162K154-D158 VanDerWaalsContact C-OD2 3.29Å; K154-D158 WeakPolarHBondContact CE-OD2 3.4Å; K154-D158 WeakPolarHBondContact CG-OD2 3.48Å; K154-D158 PolarHBondContact O-N 2.84Å; K154-D158 VanDerWaalsContact O-OD2 3.1Å; Q155-D158 PolarHBondContact O-N 2.94Å; D158-K161 PolarHBondContact O-N 3.24Å; D158-D162 PolarHBondContact O-N 2.9Å
159Q86.6Confident85.4Confident109 Ų10994 Ų9451%0.50948%0.477SS..Hα-helixtrans-60.9-45.7174.8-75.1165.7109.900112.7Q155 K161 D162 S163Q155-Q159 WeakPolarHBondContact O-CB 3.15Å; Q155-Q159 WeakPolarHBondContact O-CG 3.33Å; Q155-Q159 PolarHBondContact O-N 3.45Å; Q155-Q159 PolarHBondContact O-NE2 3.32Å; Q159-K161 VanDerWaalsContact C-N 3.3Å; Q159-K161 PolarHBondContact O-N 2.96Å; Q159-D162 PolarHBondContact O-N 3.42Å; Q159-S163 PolarHBondContact O-N 3.41Å; Q159-S163 PolarHBondContact O-OG 3.32Å; Q159-S163 VanDerWaalsContact O-OG 3.08Å
160G78.1Confident84.6Confident43 Ų4393.8 Ų93.844%0.44348%0.484SS..Hα-helixtrans-61.7-37.6177.900000112.9K156 E164K156-G160 PolarHBondContact O-N 3.36Å; G160-E164 PolarHBondContact O-N 3.12Å; G160-E164 VanDerWaalsContact O-N 3.11Å
161K76.6Confident83.9Confident109 Ų10995.1 Ų95.147%0.47449%0.488SS..Hα-helixtrans-66.8-43.4173-74170.6163.6-165.40113.1K157 D158 Q159 S163 E164 L165K157-K161 WeakPolarHBondContact O-CG 3.34Å; K157-K161 PolarHBondContact O-N 3.26Å; D158-K161 PolarHBondContact O-N 3.24Å; Q159-K161 VanDerWaalsContact C-N 3.3Å; Q159-K161 PolarHBondContact O-N 2.96Å; K161-S163 VanDerWaalsContact C-N 3.28Å; K161-S163 PolarHBondContact O-N 3.28Å; K161-E164 PolarHBondContact O-N 3.34Å; K161-L165 WeakPolarHBondContact O-CB 3.38Å; K161-L165 VanDerWaalsContact O-CG 3.29Å; K161-L165 WeakPolarHBondContact O-CG 3.39Å; K161-L165 PolarHBondContact O-N 3.25Å
162D71.5Confident83.3Confident81 Ų8197 Ų9743%0.43350%0.503SS..Hα-helixtrans-61.7-42.1177.8-153.7-88.7000109.4D158 Q159 E164 L165 R166D158-D162 PolarHBondContact O-N 2.9Å; Q159-D162 PolarHBondContact O-N 3.42Å; D162-E164 PolarHBondContact O-N 3.07Å; D162-L165 PolarHBondContact O-N 3.34Å; D162-R166 WeakPolarHBondContact O-CB 3.44Å; D162-R166 WeakPolarHBondContact O-CG 3.28Å; D162-R166 PolarHBondContact O-N 2.86Å; D162-R166 WeakPolarHBondContact OD1-CG 3.37Å; D162-R166 IonicContact OD1-CZ 2.79Å; D162-R166 IonicContact OD1-NE 2.97Å; D162-R166 PolarHBondContact OD1-NE 2.68Å; D162-R166 IonicContact OD1-NH2 3.24Å
163S72.1Confident82.8Confident81 Ų8197 Ų9757%0.56652%0.515SS*.Hα-helixtrans-57.7-44.4174-56.20000113.5Q159 K161 S167Q159-S163 PolarHBondContact O-N 3.41Å; Q159-S163 PolarHBondContact O-OG 3.32Å; Q159-S163 VanDerWaalsContact O-OG 3.08Å; K161-S163 VanDerWaalsContact C-N 3.28Å; K161-S163 PolarHBondContact O-N 3.28Å; S163-S167 PolarHBondContact O-N 3.39Å
164E73.9Confident82.3Confident142 Ų14295.8 Ų95.866%0.66451%0.512SS*.Hα-helixtrans-66.6-46177.6-170.5169.380.600111.8G160 K161 D162 R166 S167 V168G160-E164 PolarHBondContact O-N 3.12Å; G160-E164 VanDerWaalsContact O-N 3.11Å; K161-E164 PolarHBondContact O-N 3.34Å; D162-E164 PolarHBondContact O-N 3.07Å; E164-R166 PolarHBondContact O-N 3.36Å; E164-S167 WeakPolarHBondContact O-CB 3.36Å; E164-S167 PolarHBondContact O-N 3.18Å; E164-V168 WeakPolarHBondContact O-CG2 3.34Å; E164-V168 PolarHBondContact O-N 2.78Å
165L72.8Confident81.9Confident112 Ų11294.5 Ų94.559%0.58651%0.513SS*.Hα-helixtrans-63.7-39.2175.9-69.2169.9000112.2K161 D162 S167 V168 V169K161-L165 WeakPolarHBondContact O-CB 3.38Å; K161-L165 VanDerWaalsContact O-CG 3.29Å; K161-L165 WeakPolarHBondContact O-CG 3.39Å; K161-L165 PolarHBondContact O-N 3.25Å; D162-L165 PolarHBondContact O-N 3.34Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-V168 PolarHBondContact O-N 3.09Å; L165-V169 WeakPolarHBondContact O-CB 3.26Å; L165-V169 VanDerWaalsContact O-CG2 3.27Å; L165-V169 WeakPolarHBondContact O-CG2 3.38Å; L165-V169 PolarHBondContact O-N 3.45Å
166R73.5Confident81.2Confident175 Ų17596 Ų9666%0.6653%0.528SS*.Hα-helixtrans-61.9-41.4173.6-69.8-87.5179.5171.4-4.4111.2D162 E164 S170D162-R166 WeakPolarHBondContact O-CB 3.44Å; D162-R166 WeakPolarHBondContact O-CG 3.28Å; D162-R166 PolarHBondContact O-N 2.86Å; D162-R166 WeakPolarHBondContact OD1-CG 3.37Å; D162-R166 IonicContact OD1-CZ 2.79Å; D162-R166 IonicContact OD1-NE 2.97Å; D162-R166 PolarHBondContact OD1-NE 2.68Å; D162-R166 IonicContact OD1-NH2 3.24Å; E164-R166 PolarHBondContact O-N 3.36Å; R166-S170 VanDerWaalsContact O-CB 3.25Å; R166-S170 WeakPolarHBondContact O-CB 3.42Å; R166-S170 PolarHBondContact O-N 3.32Å
167S74.6Confident80.9Confident71 Ų7191.5 Ų91.550%0.49752%0.517SS..Hα-helixtrans-61-53.6175.6-162.60000110.8S163 E164 L165 V169 S170 E171S163-S167 PolarHBondContact O-N 3.39Å; E164-S167 WeakPolarHBondContact O-CB 3.36Å; E164-S167 PolarHBondContact O-N 3.18Å; L165-S167 VanDerWaalsContact C-N 3.33Å; S167-V169 VanDerWaalsContact C-N 3.34Å; S167-V169 PolarHBondContact O-N 3.38Å; S167-S170 PolarHBondContact O-N 3.48Å; S167-S170 VanDerWaalsContact O-N 3.13Å; S167-E171 WeakPolarHBondContact O-CB 3.37Å; S167-E171 PolarHBondContact O-N 2.72Å
168V79.4Confident80.6Confident80 Ų8088.5 Ų88.549%0.48551%0.511SS..Hα-helixtrans-61.3-39.6-179.6175.20000112.1E164 L165 T172E164-V168 WeakPolarHBondContact O-CG2 3.34Å; E164-V168 PolarHBondContact O-N 2.78Å; L165-V168 PolarHBondContact O-N 3.09Å; V168-T172 VanDerWaalsContact O-CB 3.31Å; V168-T172 WeakPolarHBondContact O-CB 3.41Å; V168-T172 PolarHBondContact O-N 2.71Å; V168-T172 PolarHBondContact O-OG1 3.15Å
169V80.3Confident80.6Confident101 Ų10190.5 Ų90.561%0.61252%0.521SS*.Hα-helixtrans-67-40.8175.3169.40000111.4L165 S167 A173L165-V169 WeakPolarHBondContact O-CB 3.26Å; L165-V169 VanDerWaalsContact O-CG2 3.27Å; L165-V169 WeakPolarHBondContact O-CG2 3.38Å; L165-V169 PolarHBondContact O-N 3.45Å; S167-V169 VanDerWaalsContact C-N 3.34Å; S167-V169 PolarHBondContact O-N 3.38Å; V169-A173 VanDerWaalsContact O-CB 3.31Å; V169-A173 WeakPolarHBondContact O-CB 3.5Å; V169-A173 PolarHBondContact O-N 3.31Å
170S82.2Confident80.4Confident81 Ų8192.3 Ų92.357%0.56652%0.523SS*.Hα-helixtrans-66.9-39.8176.8-168.40000112.3R166 S167 A173 A174R166-S170 VanDerWaalsContact O-CB 3.25Å; R166-S170 WeakPolarHBondContact O-CB 3.42Å; R166-S170 PolarHBondContact O-N 3.32Å; S167-S170 PolarHBondContact O-N 3.48Å; S167-S170 VanDerWaalsContact O-N 3.13Å; S170-A173 PolarHBondContact O-N 3.28Å; S170-A174 WeakPolarHBondContact O-CB 3.32Å; S170-A174 PolarHBondContact O-N 3.46Å
171E81.6Confident80.8Confident126 Ų12693.7 Ų93.759%0.58952%0.52SS*.Hα-helixtrans-68.3-40.6176.9-172.3176.616900111.5S167 A174 T175S167-E171 WeakPolarHBondContact O-CB 3.37Å; S167-E171 PolarHBondContact O-N 2.72Å; E171-A174 PolarHBondContact O-N 2.79Å; E171-T175 WeakPolarHBondContact O-CB 3.48Å; E171-T175 PolarHBondContact O-N 2.75Å; E171-T175 PolarHBondContact O-OG1 2.88Å
172T86.1Confident81Confident78 Ų7892.6 Ų92.648%0.47952%0.519SS..Hα-helixtrans-62.4-46171.7-56.90000110.9V168 A174 T175 C176V168-T172 VanDerWaalsContact O-CB 3.31Å; V168-T172 WeakPolarHBondContact O-CB 3.41Å; V168-T172 PolarHBondContact O-N 2.71Å; V168-T172 PolarHBondContact O-OG1 3.15Å; T172-A174 PolarHBondContact O-N 3.4Å; T172-T175 PolarHBondContact O-N 2.91Å; T172-C176 PolarHBondContact O-N 2.97Å; T172-C176 PolarHBondContact O-SG 3.11Å; T172-C176 VanDerWaalsContact O-SG 3.37Å
173A86Confident81.3Confident52 Ų5296.5 Ų96.543%0.4353%0.534SS..Hα-helixtrans-64.3-38.2178.100000112.7V169 S170 S177V169-A173 VanDerWaalsContact O-CB 3.31Å; V169-A173 WeakPolarHBondContact O-CB 3.5Å; V169-A173 PolarHBondContact O-N 3.31Å; S170-A173 PolarHBondContact O-N 3.28Å; A173-S177 WeakPolarHBondContact O-CB 3.18Å; A173-S177 PolarHBondContact O-N 3.29Å; A173-S177 PolarHBondContact O-OG 3.23Å
174A87.1Confident81.6Confident54 Ų5497 Ų9745%0.44653%0.527SS..Hα-helixtrans-64-45.4172.200000111.3S170 E171 T172 S177 V178S170-A174 WeakPolarHBondContact O-CB 3.32Å; S170-A174 PolarHBondContact O-N 3.46Å; E171-A174 PolarHBondContact O-N 2.79Å; T172-A174 PolarHBondContact O-N 3.4Å; A174-S177 WeakPolarHBondContact O-CB 3.36Å; A174-S177 PolarHBondContact O-N 3.48Å; A174-S177 VanDerWaalsContact O-N 3.12Å; A174-V178 WeakPolarHBondContact O-CG2 3.13Å; A174-V178 PolarHBondContact O-N 2.87Å
175T86.5Confident81.1Confident77 Ų7792.3 Ų92.347%0.47252%0.517SS..Hα-helixtrans-60.2-48.1177.1-580000111.5E171 T172 S177 V178 L179E171-T175 WeakPolarHBondContact O-CB 3.48Å; E171-T175 PolarHBondContact O-N 2.75Å; E171-T175 PolarHBondContact O-OG1 2.88Å; T172-T175 PolarHBondContact O-N 2.91Å; T175-S177 VanDerWaalsContact C-N 3.27Å; T175-S177 PolarHBondContact O-N 3.16Å; T175-V178 PolarHBondContact O-N 2.95Å; T175-L179 HydrophobicContact CG2-CD1 4.18Å; T175-L179 WeakPolarHBondContact O-CG 3.34Å; T175-L179 PolarHBondContact O-N 3.09Å
176C82Confident80.5Confident75 Ų7596.9 Ų96.951%0.50753%0.527SS..Hα-helixtrans-60.4-36.5174.4-690000112.3T172 R180T172-C176 PolarHBondContact O-N 2.97Å; T172-C176 PolarHBondContact O-SG 3.11Å; T172-C176 VanDerWaalsContact O-SG 3.37Å; C176-R180 WeakPolarHBondContact O-CB 3.46Å; C176-R180 PolarHBondContact O-N 3.47Å
177S87.6Confident79.5Confident71 Ų7193.4 Ų93.450%0.49752%0.521SS..Hα-helixtrans-66.1-43.6176.4-59.90000112.1A173 A174 T175 R180 L181A173-S177 WeakPolarHBondContact O-CB 3.18Å; A173-S177 PolarHBondContact O-N 3.29Å; A173-S177 PolarHBondContact O-OG 3.23Å; A174-S177 WeakPolarHBondContact O-CB 3.36Å; A174-S177 PolarHBondContact O-N 3.48Å; A174-S177 VanDerWaalsContact O-N 3.12Å; T175-S177 VanDerWaalsContact C-N 3.27Å; T175-S177 PolarHBondContact O-N 3.16Å; S177-R180 PolarHBondContact O-N 3.27Å; S177-L181 WeakPolarHBondContact O-CD1 3.45Å; S177-L181 PolarHBondContact O-N 3.23Å; S177-L181 VanDerWaalsContact O-N 3.1Å
178V86.9Confident78.4Confident79 Ų7997.4 Ų97.448%0.47954%0.536SS..Hα-helixtrans-63.8-46.4176.4171.70000111.2A174 T175 R180 L181 L182A174-V178 WeakPolarHBondContact O-CG2 3.13Å; A174-V178 PolarHBondContact O-N 2.87Å; T175-V178 PolarHBondContact O-N 2.95Å; V178-R180 VanDerWaalsContact C-N 3.3Å; V178-R180 PolarHBondContact O-N 3.08Å; V178-L181 PolarHBondContact O-N 2.83Å; V178-L181 VanDerWaalsContact O-N 3.12Å; V178-L182 HydrophobicContact CG1-CD1 4.02Å; V178-L182 WeakPolarHBondContact O-CG 3.41Å; V178-L182 PolarHBondContact O-N 3.25Å
179L86.3Confident76.8Confident103 Ų10398.5 Ų98.554%0.53955%0.547SS..Hα-helixtrans-58.2-42.6176.8-70.2171.9000111.7T175 L181 L182 E183T175-L179 HydrophobicContact CG2-CD1 4.18Å; T175-L179 WeakPolarHBondContact O-CG 3.34Å; T175-L179 PolarHBondContact O-N 3.09Å; L179-L181 VanDerWaalsContact C-N 3.32Å; L179-L181 PolarHBondContact O-N 2.69Å; L179-L182 PolarHBondContact O-N 2.95Å; L179-E183 WeakPolarHBondContact O-CB 2.99Å; L179-E183 PolarHBondContact O-N 2.58Å
180R84.2Confident75.3Confident147 Ų14798.5 Ų98.556%0.55555%0.549SS*.Hα-helixtrans-68.4-27.8177.9-143.2-17776.199.65.7113.5C176 S177 V178 Q184C176-R180 WeakPolarHBondContact O-CB 3.46Å; C176-R180 PolarHBondContact O-N 3.47Å; S177-R180 PolarHBondContact O-N 3.27Å; V178-R180 VanDerWaalsContact C-N 3.3Å; V178-R180 PolarHBondContact O-N 3.08Å; R180-Q184 WeakPolarHBondContact O-CB 3.29Å; R180-Q184 WeakPolarHBondContact O-CG 2.88Å; R180-Q184 PolarHBondContact O-N 2.97Å; R180-Q184 PolarHBondContact O-NE2 2.77Å
181L84.7Confident73.9Confident73 Ų73101.1 Ų101.138%0.38256%0.564SS.*Hα-helixtrans-75-34.4173.1-102.463.9000112.5S177 V178 L179 R186 L187S177-L181 WeakPolarHBondContact O-CD1 3.45Å; S177-L181 PolarHBondContact O-N 3.23Å; S177-L181 VanDerWaalsContact O-N 3.1Å; V178-L181 PolarHBondContact O-N 2.83Å; V178-L181 VanDerWaalsContact O-N 3.12Å; L179-L181 VanDerWaalsContact C-N 3.32Å; L179-L181 PolarHBondContact O-N 2.69Å; L181-R186 PolarHBondContact O-N 2.74Å; L181-L187 HydrophobicContact CB-CD1 4.32Å
182L81.8Confident72.1Confident86 Ų8698.2 Ų98.245%0.4557%0.568SS.*Hα-helixtrans-68.6-45.5173.3-70.6165.4000111.4V178 L179 Q184 G185 L187V178-L182 HydrophobicContact CG1-CD1 4.02Å; V178-L182 WeakPolarHBondContact O-CG 3.41Å; V178-L182 PolarHBondContact O-N 3.25Å; L179-L182 PolarHBondContact O-N 2.95Å; L182-Q184 PolarHBondContact O-N 2.83Å; L182-G185 WeakPolarHBondContact O-CA 3.32Å; L182-G185 PolarHBondContact O-N 2.84Å; L182-L187 HydrophobicContact CD2-CB 4.13Å; L182-L187 HydrophobicContact CD2-CD1 3.95Å; L182-L187 HydrophobicContact CG-CD1 4.2Å
183E77.3Confident70.6Confident162 Ų162102.6 Ų102.676%0.75759%0.588SS**Hα-helixtrans-57.1-36174-177.3-179.2-142.800112.3L179 G185L179-E183 WeakPolarHBondContact O-CB 2.99Å; L179-E183 PolarHBondContact O-N 2.58Å; E183-G185 PolarHBondContact O-N 3.31Å
184Q78.9Confident68.8Low91 Ų91106.1 Ų106.143%0.42561%0.606SS.*THydrogen-bonded Turntrans-77.86.9175.2-71.5165.119.400114R180 L182 R186R180-Q184 WeakPolarHBondContact O-CB 3.29Å; R180-Q184 WeakPolarHBondContact O-CG 2.88Å; R180-Q184 PolarHBondContact O-N 2.97Å; R180-Q184 PolarHBondContact O-NE2 2.77Å; L182-Q184 PolarHBondContact O-N 2.83Å; Q184-R186 PolarHBondContact O-N 3.4Å
185G62.3Low67Low44 Ų44107.8 Ų107.845%0.45462%0.62SS.*THydrogen-bonded Turntrans65.73.2179.300000115L182 E183 L187 L188L182-G185 WeakPolarHBondContact O-CA 3.32Å; L182-G185 PolarHBondContact O-N 2.84Å; E183-G185 PolarHBondContact O-N 3.31Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 3.17Å; G185-L188 PolarHBondContact O-N 3.45Å
186R61Low64.8Low209 Ų209112 Ų11279%0.78964%0.639SS**THydrogen-bonded Turntrans-78.9-2.1-163.4-112.8-170.6177.6-115.8-2.5115.6L181 Q184L181-R186 PolarHBondContact O-N 2.74Å; Q184-R186 PolarHBondContact O-N 3.4Å
187L53.5Low63.2Low102 Ų102116 Ų11653%0.53466%0.655SS.*THydrogen-bonded Turntrans-112.23.5176.9-59.5-179.8000113.7L181 L182 G185L181-L187 HydrophobicContact CB-CD1 4.32Å; L182-L187 HydrophobicContact CD2-CB 4.13Å; L182-L187 HydrophobicContact CD2-CD1 3.95Å; L182-L187 HydrophobicContact CG-CD1 4.2Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 3.17Å
188L51Low61.7Low155 Ų155118 Ų11881%0.81267%0.666SS**SBendtrans-119.325.8178.5-73.7175.4000113.5G185 P190G185-L188 PolarHBondContact O-N 3.45Å; L188-P190 WeakPolarHBondContact O-CD 3.46Å
189S44.9Very low60.3Low102 Ų102119.6 Ų119.671%0.71368%0.678SS**  trans-99.9107.6162.6-170.10000109
190P50.1Low57.8Low102 Ų102120.9 Ų120.966%0.66269%0.694SS**  trans-58.5151.3161.6-16.930.4000109.2L188 G192L188-P190 WeakPolarHBondContact O-CD 3.46Å; P190-G192 PolarHBondContact O-N 2.85Å
191P51Low55.7Low135 Ų135117.8 Ų117.888%0.87770%0.7SS**  trans-64.377.5170.3-23.836000112.3L193P191-L193 PolarHBondContact O-N 3.37Å
192G45.2Very low53.8Low66 Ų66121.5 Ų121.568%0.6873%0.726SS**  trans-70.5113.8-179.100000111.2P190 P194P190-G192 PolarHBondContact O-N 2.85Å; G192-P194 WeakPolarHBondContact O-CD 3.43Å
193L53.5Low51.7Low169 Ų169121 Ų12189%0.88574%0.742SS**PPolyproline II helixtrans-66.2123177.1-63.7168.3000111.2P191P191-L193 PolarHBondContact O-N 3.37Å
194P48.1Very low49.9Very low126 Ų126117.8 Ų117.882%0.81874%0.743SS**PPolyproline II helixtrans-84.8123.3161.832.6-28.7000109.7G192G192-P194 WeakPolarHBondContact O-CD 3.43Å
195A49.6Very low48Very low90 Ų90122.1 Ų122.174%0.74477%0.768SS**PPolyproline II helixtrans-92149.6-177.800000113.1
196L41.8Very low46.7Very low166 Ų166123.6 Ų123.687%0.86978%0.783SS**  trans-140.171.4171.8-73.9-179.7000113.7
197L48.1Very low45.6Very low159 Ų159119.5 Ų119.583%0.83279%0.786SS**  trans62.3-170.3145.1-55172.9000117.1
198P55.7Low44.9Very low111 Ų111118.8 Ų118.872%0.72180%0.795SS**  -138.4-147.4-102.846.6-25.4000112.1
199P56.4Low44.4Very low113 Ų113119.4 Ų119.473%0.73480%0.798SS**  cis-124.6159.4-32.336.3-22.1000114
200C34.8Very low44.1Very low130 Ų130126.6 Ų126.688%0.87881%0.81SS**  trans-148.9115.8151.5-89.80000107.3
201A40Very low43.4Very low83 Ų83124.7 Ų124.769%0.68681%0.808SS**  88.886.66500000114
202T43.9Very low43.9Very low150 Ų150124.1 Ų124.192%0.9281%0.805SS**  trans53.6130145.153.30000122.3
203G39.1Very low43.5Very low76 Ų76127 Ų12778%0.78482%0.815SS**  trans123.289.9172.100000111.6
204A39.8Very low42.9Very low94 Ų94126.8 Ų126.878%0.77781%0.814SS**  cis79.5112.93600000115.5
205L39.2Very low43.2Very low183 Ų183126.7 Ų126.796%0.95881%0.813SS**  trans67.1154.7177.2-44.2-178.9000114.7
206G35Very low42.6Very low74 Ų74126.5 Ų126.576%0.76381%0.811SS**  cis-170.1171.5-2.900000110.9
207S37.5Very low42.5Very low124 Ų124126.9 Ų126.987%0.86781%0.813SS**  trans-85.4154.1-167.7-56.30000116.5
208A38.5Very low41.8Very low86 Ų86121.7 Ų121.771%0.71180%0.798SS**  trans84.5131.8139.400000122.6
209L41.1Very low41.1Very low168 Ų168123.7 Ų123.788%0.8881%0.809SS**  trans54.6100.8136-64.5169000120.7
210R38.6Very low40.2Very low253 Ų253121.8 Ų121.896%0.95581%0.809SS**  -168.5152.5123-115.3175.4175.2168.4-1.3114.1
211G35.5Very low40.2Very low62 Ų62120.5 Ų120.564%0.63981%0.808SS**  trans-136.6-158148.200000107.4
212P60.4Low40.1Very low124 Ų124121.1 Ų121.181%0.80581%0.813SS**  cis-128.1169-1740.5-27.1000112.8
213S36.5Very low40Very low126 Ų126119.2 Ų119.288%0.88181%0.813SS**  trans-169.1162.6150.714.90000113.5
214L42.3Very low39.8Very low165 Ų165119.2 Ų119.286%0.86481%0.813SS**  trans-102.2171.4-177.7-83.2173.3000110.1
215P53.1Low39.8Very low123 Ų123120.4 Ų120.480%0.79982%0.816SS**  cis-146.5-172.637.643-21.2000119.5
216A37.9Very low39.5Very low86 Ų86116.1 Ų116.171%0.71181%0.806SS**  trans-49.8170.9173.700000114.8
217L38.5Very low39.6Very low174 Ų174116.8 Ų116.891%0.91181%0.805SS**  cis-165.8153.734.8-177.571.6000108.6
218G34.9Very low39.5Very low51 Ų51115.8 Ų115.853%0.52680%0.804SS.*  cis171.5179-4.800000111.5
219T41Very low39.4Very low153 Ų153116.4 Ų116.494%0.93981%0.809SS**  trans65.7136.9167.559.60000121.1
220G36Very low39.2Very low72 Ų72112.7 Ų112.774%0.74280%0.803SS**  trans87103.5172.100000114.3
221A36.2Very low39.2Very low104 Ų104105.6 Ų105.686%0.8680%0.798SS**  cis65.1118.126.300000114.1
222A37.7Very low39.3Very low96 Ų96107 Ų10779%0.79380%0.804SS**  cis-155.5156.7-3.800000113.8
223A41Very low38.8Very low109 Ų109106.9 Ų106.990%0.90180%0.803SS**  trans33128.5152.700000121.9
224G35.7Very low38.7Very low77 Ų77104.5 Ų104.579%0.79480%0.798SS**  trans131.373.8146.100000117.4
225S38.4Very low39.3Very low119 Ų119102.4 Ų102.483%0.83280%0.795SS**  trans-59.1135.9154.3-59.20000108.6
226A34.5Very low38.4Very low92 Ų92101.8 Ų101.876%0.7680%0.8SS**  65.2138.951.200000111.7
227A35.9Very low38.2Very low89 Ų89101.4 Ų101.474%0.73680%0.804SS**  cis-155.1179.99.400000111.6
228A36Very low38.1Very low103 Ų10398.4 Ų98.485%0.85180%0.804SS**  trans67.4160153.700000116.4
229A36.9Very low38.1Very low98 Ų98100.8 Ų100.881%0.8182%0.819SS**  cis-178.1162.9-18.900000105.6
230A36Very low38Very low91 Ų9199 Ų9975%0.75281%0.813SS**  cis-164.9-176.4-21.100000107
231A38.2Very low38.9Very low104 Ų104100.9 Ų100.986%0.8681%0.812SS**  trans60.7109.7160.600000119.4
232A37.9Very low39Very low91 Ų91104.7 Ų104.775%0.75281%0.812SS**  trans-97.7-159.1151.100000108.6
233P49.7Very low40.4Very low121 Ų121105.4 Ų105.479%0.78681%0.808SS**  -132156.5-53.928.6-10.6000115.3
234G34.1Very low41.2Very low76 Ų76106.1 Ų106.178%0.78480%0.804SS**  trans66.7-164.2153.500000118.2
235P54.8Low41.3Very low122 Ų122106.5 Ų106.579%0.79280%0.799SS**  cis-139168.5-15.741.6-25.4000116.5
236A35.9Very low41.4Very low110 Ų110108.2 Ų108.291%0.90980%0.804SS**  trans53137.414800000123.8
237G32.3Very low41.4Very low78 Ų78107.7 Ų107.780%0.80481%0.808SS**  trans-169.2150.3167.700000112.4
238A36.3Very low41.2Very low110 Ų110107.6 Ų107.691%0.90982%0.816SS**  trans-161.3140.4-178.300000114.3
239A36.4Very low41.3Very low101 Ų101107.4 Ų107.484%0.83581%0.814SS**  trans-168.8168.6166.700000113.9
240S38.3Very low42.1Very low116 Ų116108.8 Ų108.881%0.81182%0.815SS**  trans-146.3-164.5168.1-590000106.9
241P55.1Low42.1Very low111 Ų111107.7 Ų107.772%0.72181%0.812SS**  cis-143.1162.2-5.540.7-20.9000118.7
242H38.4Very low42.8Very low184 Ų184109.4 Ų109.485%0.85282%0.815SS**  trans61.9-164.5147.5-66.8-129.4000120.1
243P66.7Low42.8Very low111 Ų111108.5 Ų108.572%0.72182%0.815SS**  -129.4171.6-105.141.5-21.8000117.4
244P58.7Low43.1Very low124 Ų124109.3 Ų109.381%0.80582%0.82SS**  -145.2178.9102.427.5-6000113.5
245A37.6Very low43.4Very low85 Ų85110.9 Ų110.970%0.70283%0.826SS**  cis114.8148-1.100000117.8
246V40.1Very low42.4Very low155 Ų155108.5 Ų108.594%0.93982%0.823SS**  trans64.1149.5180-440000119
247G33.6Very low43.2Very low81 Ų81110.1 Ų110.184%0.83582%0.824SS**  cis148.1132.6-14.500000114.9
248G33Very low43.4Very low88 Ų88110.3 Ų110.391%0.90783%0.827SS**  trans143.7131.4163.900000118.8
249A38.4Very low43.2Very low99 Ų99108.4 Ų108.482%0.81882%0.817SS**  trans-136.9177162.300000106.9
250P51.8Low43Very low126 Ų126112 Ų11282%0.81882%0.822SS**  cis-143.2-161.834.941.2-18000115.6
251G36.4Very low43Very low68 Ų68115.6 Ų115.670%0.70183%0.825SS**  trans-87.2-150.916800000113.4
252P54Low42Very low141 Ų141114.4 Ų114.492%0.91683%0.825SS**  cis-137.2-169.512.344.1-26.2000115.3
253G36.5Very low41.7Very low72 Ų72109.6 Ų109.674%0.74283%0.825SS**  trans154.5142161.800000116.5
254P57Low40.3Very low137 Ų137109 Ų10989%0.8983%0.829SS**  trans-125153.2-168.741.1-28.1000118.7
255A40.2Very low39.9Very low110 Ų110109 Ų10991%0.90983%0.829SS**  trans-161.3168.1163.100000108.9
256G34.1Very low39.6Very low72 Ų72109.4 Ų109.474%0.74283%0.833SS**  cis154.8103.6-5.400000111.2
257P51.6Low39.4Very low143 Ų143107.1 Ų107.193%0.92983%0.83SS**  trans-101.3143.5-164.736.6-34.5000117
258G37.3Very low39.6Very low83 Ų83106.9 Ų106.986%0.85683%0.827SS**  trans166.5158169.100000110.1
259G31.6Very low40.2Very low69 Ų69111.6 Ų111.671%0.71183%0.825SS**  cis162.2113.6-8.100000111.9
260L33.1Very low40.1Very low178 Ų178111.5 Ų111.593%0.93282%0.819SS**  trans53.3118.9161.8-46.3176.7000119.3
261H37.2Very low39.7Very low190 Ų190112.5 Ų112.588%0.8882%0.817SS**  -173169110.2-155.7-105.3000111.7
262A35.4Very low39.9Very low86 Ų86118.1 Ų118.171%0.71182%0.822SS**  trans-96.2157.8176.600000113
263G32.3Very low39.1Very low83 Ų83117.1 Ų117.186%0.85682%0.818SS**  trans173.5110.1171.500000114.7
264A36.3Very low39.4Very low98 Ų98120.5 Ų120.581%0.8182%0.819SS**  trans-148.4165.9164.500000107.6
265P49.6Very low38.8Very low125 Ų125119.7 Ų119.781%0.81281%0.814SS**  cis-126.3-179.6-2.642.1-28.6000113.3
266A33Very low38.9Very low94 Ų94120.4 Ų120.478%0.77781%0.806SS**  171.9148.2128.800000113.9
267A35.3Very low39.8Very low107 Ų107122.5 Ų122.588%0.88481%0.807SS**  trans40119.3153.300000121.2
268G36.7Very low39.2Very low75 Ų75121.2 Ų121.277%0.77380%0.801SS**  trans-178.3109167.400000114.3
269H45.7Very low39.7Very low187 Ų187125.4 Ų125.487%0.86680%0.803SS**  trans-64.5160.2170.8-45.7-93.1000110.8
270S37.8Very low40.1Very low98 Ų98131 Ų13169%0.68582%0.815SS**  cis-170.6177.66.2-134.40000111.9
271L43.3Very low40.2Very low147 Ų147126.1 Ų126.177%0.7781%0.809SS**  trans59.494.4150.5-66.4161.2000120.3
272F40.6Very low40.4Very low186 Ų186122.6 Ų122.682%0.81681%0.805SS**  177.4128.1100.1-120.7-91.6000110.7
273S36.3Very low40.6Very low120 Ų120125.4 Ų125.484%0.83981%0.813SS**  trans-153.4137.5166.9-168.60000109.8
274L43.9Very low40.9Very low143 Ų143126 Ų12675%0.74981%0.81SS**PPolyproline II helixtrans-91.9141.4-172.7-66.9169.9000111.3
275P44.2Very low41.3Very low120 Ų120127.2 Ų127.278%0.77981%0.813SS**PPolyproline II helixtrans-75134.4-176.929.9-34.6000112.4
276V42.3Very low41.3Very low125 Ų125132.9 Ų132.976%0.75882%0.818SS**PPolyproline II helixtrans-91.8125168.3177.50000109.1S278V276-S278 PolarHBondContact O-N 2.81Å
277P51.9Low41.8Very low116 Ų116136.4 Ų136.475%0.75382%0.823SS**  trans-81.5100.6177.631.3-32.9000111.6
278S40.3Very low42Very low115 Ų115136.8 Ų136.880%0.80482%0.819SS**  trans-82.1116.5163.5-69.40000110.1V276V276-S278 PolarHBondContact O-N 2.81Å
279L47.7Very low42.3Very low172 Ų172139.1 Ų139.190%0.90182%0.824SS**  trans-118.698.8170.2-86.1167.9000110.3
280L39.5Very low42.1Very low185 Ų185134.4 Ų134.497%0.96982%0.817SS**  trans-106.9104.1166.4-157.480.1000107.6
281G34.2Very low42.7Very low77 Ų77135.8 Ų135.879%0.79482%0.824SS**  trans-143.6106.6-176.200000110.5
282S41.3Very low42.7Very low115 Ų115137 Ų13780%0.80483%0.83SS**  trans-91.6140.5-174.5-1780000112.1
283V41.2Very low42.9Very low145 Ų145134.4 Ų134.488%0.87983%0.829SS**  trans-153.5145.9130.2-94.20000109.2
284A38.4Very low43.2Very low95 Ų95137.4 Ų137.479%0.78583%0.832SS**  trans-102.9137.8176.700000111.2
285S43.8Very low43.3Very low124 Ų124135.1 Ų135.187%0.86783%0.834SS**  trans-132.6121.8166.8-760000109.7
286R51Low43.1Very low244 Ų244132.8 Ų132.892%0.92183%0.832SS**  trans-94.6110.2178.3-69.7179.6179.4-1016.9110.7
287L41.7Very low43Very low168 Ų168132.3 Ų132.388%0.8883%0.834SS**  trans-136.197.8155.7-68.5175.3000106
288S40Very low42.8Very low116 Ų116134.8 Ų134.881%0.81184%0.84SS**  78.2108.685.7-164.70000111.6
289S42.7Very low43.3Very low124 Ų124134.5 Ų134.587%0.86785%0.845SS**  trans-80.2128.4-170.4-48.50000112.5
290A42Very low43.1Very low87 Ų87129.3 Ų129.372%0.71983%0.833SS**  trans-144.4107.7167.200000110.5L292A290-L292 PolarHBondContact O-N 2.72Å
291P50.7Low43.6Very low128 Ų128125.2 Ų125.283%0.83181%0.812SS**  trans-76.4118.9171.130.3-31000109.6T293P291-T293 PolarHBondContact O-N 2.85Å; P291-T293 VanDerWaalsContact O-N 3.17Å
292L43.9Very low44.2Very low173 Ų173128.7 Ų128.791%0.90681%0.812SS**  trans-70111.2173.7-71.5176.4000110.1A290 M294A290-L292 PolarHBondContact O-N 2.72Å; L292-M294 PolarHBondContact O-N 2.82Å
293T43.7Very low44.5Very low131 Ų131130.9 Ų130.980%0.80481%0.809SS**  trans-75.4114.1168.8177.10000109.8P291P291-T293 PolarHBondContact O-N 2.85Å; P291-T293 VanDerWaalsContact O-N 3.17Å
294M43.5Very low44.6Very low182 Ų182129.6 Ų129.690%0.89779%0.794SS**  trans-97.9101.5167.4-105.4-63.2-145.500108.8L292 G296L292-M294 PolarHBondContact O-N 2.82Å; M294-G296 VanDerWaalsContact C-N 3.32Å; M294-G296 PolarHBondContact O-N 2.81Å
295A45.5Very low44.8Very low96 Ų96131.2 Ų131.279%0.79379%0.788SS**  trans-75.979.2178.400000111.3
296G39.2Very low44.8Very low71 Ų71128.3 Ų128.373%0.73277%0.768SS**  trans-92.991.3174.400000112.3M294 L298M294-G296 VanDerWaalsContact C-N 3.32Å; M294-G296 PolarHBondContact O-N 2.81Å; G296-L298 PolarHBondContact O-N 2.78Å
297S41.7Very low44.5Very low115 Ų115119.8 Ų119.880%0.80475%0.75SS**  trans-79.1101.8176.4-169.80000111.5
298L46.2Very low44.7Very low168 Ų168121.6 Ų121.688%0.8875%0.745SS**  trans-119.490.2164.3-72.1178.5000109.3G296 G300G296-L298 PolarHBondContact O-N 2.78Å; L298-G300 VanDerWaalsContact C-N 3.25Å; L298-G300 PolarHBondContact O-N 3.25Å
299A50.6Low45Very low108 Ų108126.2 Ų126.289%0.89375%0.746SS**  trans-70.580.717200000110.2
300G43.8Very low45.3Very low64 Ų64127.4 Ų127.466%0.6674%0.742SS**  trans-130.781.4-171.900000113.7L298 L302L298-G300 VanDerWaalsContact C-N 3.25Å; L298-G300 PolarHBondContact O-N 3.25Å; G300-L302 PolarHBondContact O-N 2.95Å
301N50.9Low45.3Very low98 Ų98128.3 Ų128.352%0.52474%0.743SS.*  trans36.167.6156.9-165.25000118Q303 E304N301-Q303 PolarHBondContact O-N 2.8Å; N301-Q303 PolarHBondContact OD1-N 2.78Å; N301-E304 PolarHBondContact ND2-OE2 2.86Å; N301-E304 VanDerWaalsContact OD1-CB 3.32Å; N301-E304 WeakPolarHBondContact OD1-CB 3.48Å; N301-E304 PolarHBondContact OD1-N 3.24Å; N301-E304 VanDerWaalsContact OD1-N 3.09Å
302L45.6Very low44.8Very low151 Ų151127.5 Ų127.579%0.79174%0.74SS**SBendtrans-76.8-8.9167.5-16661.7000112.8G300G300-L302 PolarHBondContact O-N 2.95Å
303Q47.6Very low44.8Very low161 Ų161124.2 Ų124.275%0.75273%0.731SS**SBendtrans-83.8-35.5-169-162.7161.9-6.800112.7N301 L305 S306N301-Q303 PolarHBondContact O-N 2.8Å; N301-Q303 PolarHBondContact OD1-N 2.78Å; Q303-L305 VanDerWaalsContact C-N 3.33Å; Q303-L305 PolarHBondContact O-N 3.2Å; Q303-S306 WeakPolarHBondContact O-CB 3.39Å; Q303-S306 PolarHBondContact O-N 2.87Å; Q303-S306 PolarHBondContact O-OG 2.99Å
304E45.1Very low45Very low118 Ų118123 Ų12355%0.55174%0.735SS**Hα-helixtrans-66.8-29.4-177.9-167.7171.7140.300113.9N301 S306 A307N301-E304 PolarHBondContact ND2-OE2 2.86Å; N301-E304 VanDerWaalsContact OD1-CB 3.32Å; N301-E304 WeakPolarHBondContact OD1-CB 3.48Å; N301-E304 PolarHBondContact OD1-N 3.24Å; N301-E304 VanDerWaalsContact OD1-N 3.09Å; E304-S306 PolarHBondContact O-N 2.93Å; E304-A307 PolarHBondContact O-N 2.75Å
305L41.1Very low44.8Very low129 Ų129122.4 Ų122.468%0.67573%0.728SS**Hα-helixtrans-64.6-26.4174.9-74.4168.5000113Q303Q303-L305 VanDerWaalsContact C-N 3.33Å; Q303-L305 PolarHBondContact O-N 3.2Å
306S43.4Very low44.7Very low62 Ų62126 Ų12643%0.43473%0.728SS.*Hα-helixtrans-71.6-37.5178.472.20000112.9Q303 E304 R308 Y309 L310Q303-S306 WeakPolarHBondContact O-CB 3.39Å; Q303-S306 PolarHBondContact O-N 2.87Å; Q303-S306 PolarHBondContact O-OG 2.99Å; E304-S306 PolarHBondContact O-N 2.93Å; S306-R308 VanDerWaalsContact C-N 3.33Å; S306-R308 PolarHBondContact O-N 3.49Å; S306-Y309 PolarHBondContact O-N 2.77Å; S306-L310 PolarHBondContact O-N 3.12Å
307A45.2Very low44.7Very low65 Ų65127.1 Ų127.154%0.53772%0.722SS.*Hα-helixtrans-66.1-34.6-17600000112.6E304 Y309E304-A307 PolarHBondContact O-N 2.75Å; A307-Y309 VanDerWaalsContact C-N 3.27Å; A307-Y309 PolarHBondContact O-N 3.31Å
308R46.7Very low44.4Very low207 Ų207132.1 Ų132.178%0.78173%0.725SS**Hα-helixtrans-69.9-17.6-178.9-67.5-67.8-174.3156.41.7114.3S306S306-R308 VanDerWaalsContact C-N 3.33Å; S306-R308 PolarHBondContact O-N 3.49Å
309Y45.9Very low44.3Very low213 Ų213129.1 Ų129.184%0.83572%0.718SS**Hα-helixtrans-112.3-6.5-175.9-127.6-90.1000114.8S306 A307S306-Y309 PolarHBondContact O-N 2.77Å; A307-Y309 VanDerWaalsContact C-N 3.27Å; A307-Y309 PolarHBondContact O-N 3.31Å
310L48.7Very low44Very low149 Ų149134.9 Ų134.978%0.7872%0.717SS**Hα-helixtrans-102.6-6.9-179.4-75.8166.1000114.1S306S306-L310 PolarHBondContact O-N 3.12Å
311S41.4Very low44Very low106 Ų106138.1 Ų138.174%0.74172%0.724SS**  trans-95.212.9-176.9-1640000115.3
312S42.2Very low43.5Very low110 Ų110139.4 Ų139.477%0.76973%0.731SS**  trans-9982.4171.8-70.20000110.3A314S312-A314 PolarHBondContact O-N 3.39Å
313S42Very low43.1Very low104 Ų104139.2 Ų139.273%0.72773%0.731SS**  trans-59.3122.5170.3-177.30000109.8F315S313-F315 PolarHBondContact O-N 2.95Å
314A49Very low43Very low105 Ų105139.2 Ų139.287%0.86873%0.728SS**SBendtrans-78.341.7-17400000113.4S312S312-A314 PolarHBondContact O-N 3.39Å
315F40.1Very low43.3Very low171 Ų171142.2 Ų142.275%0.7574%0.742SS**  trans-150.561.4-176.7-146.9-90.6000112.8S313 P317S313-F315 PolarHBondContact O-N 2.95Å; F315-P317 WeakPolarHBondContact O-CD 3.49Å
316E43.3Very low43.7Very low170 Ų170140 Ų14079%0.79475%0.751SS**  trans-68.1121.6154.4-75.5-167.1111.100108.8Y318E316-Y318 PolarHBondContact O-N 3.21Å
317P38.7Very low44Very low96 Ų96140.4 Ų140.462%0.62376%0.758SS**  trans-69.5118168.229.2-31.3000107.9F315 S319F315-P317 WeakPolarHBondContact O-CD 3.49Å; P317-S319 VanDerWaalsContact C-N 3.3Å; P317-S319 PolarHBondContact O-N 2.94Å
318Y35.7Very low44.2Very low219 Ų219146.5 Ų146.586%0.85978%0.775SS**  trans-64.194.2170.4-93.7-96000109.4E316 R320E316-Y318 PolarHBondContact O-N 3.21Å; Y318-R320 PolarHBondContact O-N 2.9Å
319S43.3Very low44.6Very low106 Ų106146.4 Ų146.474%0.74178%0.781SS**  trans-63.176.5168.2-67.70000109.5P317 T321P317-S319 VanDerWaalsContact C-N 3.3Å; P317-S319 PolarHBondContact O-N 2.94Å; S319-T321 PolarHBondContact O-N 2.8Å
320R43.7Very low44.7Very low228 Ų228146.4 Ų146.486%0.8679%0.785SS**  trans-68.692-176.1-168.5-176.8-165.6-168.34.2108.8Y318 N322Y318-R320 PolarHBondContact O-N 2.9Å; R320-N322 PolarHBondContact O-N 3.04Å
321T45.3Very low44.3Very low133 Ų133144.1 Ų144.182%0.81679%0.788SS**  trans-56.7100.717541.80000109.1S319 N323S319-T321 PolarHBondContact O-N 2.8Å; T321-N323 PolarHBondContact O-N 3.19Å
322N39Very low45Very low125 Ų125147.6 Ų147.667%0.66880%0.797SS**  trans-78.688.9-173.9-177.288.6000109R320 K324R320-N322 PolarHBondContact O-N 3.04Å; N322-K324 PolarHBondContact O-N 2.9Å
323N37.4Very low44.9Very low147 Ų147153.7 Ų153.779%0.78682%0.821SS**  trans-61.2105.5-178.3-15220.2000109.9T321T321-N323 PolarHBondContact O-N 3.19Å
324K46.5Very low45.1Very low160 Ų160156.2 Ų156.270%0.69683%0.826SS**  trans-127.141.8-171.4-157.1-164.6170.6-171.70112.4N322N322-K324 PolarHBondContact O-N 2.9Å
325E50.2Low44.9Very low181 Ų181158.8 Ų158.885%0.84682%0.823SS**  trans-76.7128.4156.8-69.5-173.473.600108.8
326G49.6Very low45.1Very low83 Ų83158.2 Ų158.286%0.85683%0.827SS**SBendtrans12040.5177.100000116.8
327A49.2Very low45.3Very low71 Ų71157.5 Ų157.559%0.58783%0.829SS**  trans-139.715.3176.200000115.9
328E51Low45.7Very low192 Ų192161.3 Ų161.390%0.89784%0.842SS**  trans-124.354.4-172.9-62.4-162141.400114.2
329K53.6Low46.3Very low206 Ų206157.5 Ų157.590%0.89684%0.841SS**SBendtrans-144.666.4166-72.3-161.9177.1-176.80113.3
330K48.5Very low46.5Very low212 Ų212161.1 Ų161.192%0.92285%0.848SS**  trans176.899149.7-105.7-178.7178.4-168.70111.9
331A40.7Very low46.8Very low102 Ų102156 Ų15684%0.84385%0.847SS**  trans177.186.1154.500000108.7
332L56.6Low46.9Very low179 Ų179157.9 Ų157.994%0.93785%0.85SS**  trans-155.765.6164.9-144.5162.7000109.1
333D40.3Very low47.6Very low237 Ų237160.9 Ų160.9100%1.26787%0.867SS**  trans-143.60158.6-166.5-115.3000104.4

Retrieved 333 of 333 residues in 251.4 ms (Link to these results)