A0A060YBM2_ONCMY Loading...

Distal-less homeobox 6a

AlphaFold DB , UniProt , Accession A0A060YBM2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 249 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
1M53.7Low52.8Low242 Ų242151.5 Ų151.5100%1.19286%0.862SS**  0105.90-56.3-177.7-165.900106.1
2M54.3Low52.1Low182 Ų182155.2 Ų155.290%0.89787%0.866SS**  trans-81.9134.6-174.4-7389168.800111.2
3T54.3Low52Low130 Ų130150.5 Ų150.580%0.79886%0.86SS**  trans-68.3135.7170.448.90000111.4
4M62.4Low51.6Low172 Ų172152.8 Ų152.885%0.84786%0.859SS**  trans-125.7106.7164-71.9-65.5-177.500109.6
5T49.4Very low51.3Low124 Ų124153.4 Ų153.476%0.76186%0.859SS**  trans-77.7129.8163.3-76.50000108.3
6T69.8Low51.2Low129 Ų129149.4 Ų149.479%0.79185%0.845SS**  trans-116.9139.3169.9103.50000109.5
7M45.4Very low50.8Low172 Ų172146.5 Ų146.585%0.84784%0.836SS**  trans-103.9177.2179.5-65.9-86.7-167.900110.8
8A48.8Very low50.9Low94 Ų94150.8 Ų150.878%0.77784%0.844SS**  trans100.3111.5166.600000114
9D44.2Very low51.1Low172 Ų172147.9 Ų147.992%0.9284%0.835SS**  65.3120.561.2-161.561.4000112.8
10G45.5Very low50.9Low67 Ų67145.8 Ų145.869%0.69184%0.836SS**  trans148.990.6175.300000115
11L52.4Low50.7Low183 Ų183147.4 Ų147.496%0.95883%0.834SS**  trans-36.4127.4167-61.9157.8000114.7
12E44.4Very low51.2Low195 Ų195144 Ų14491%0.91182%0.818SS**  trans-124.3128.1162.5-151.9178.6141.900110
13A50.8Low50.9Low95 Ų95141.7 Ų141.779%0.78580%0.804SS**  trans-73133.7-17600000111.6
14Q46.4Very low50.1Low182 Ų182144.6 Ų144.685%0.8581%0.806SS**  trans-123.4106.8157-90.9-160-74.800110.2
15D47.9Very low49.3Very low162 Ų162140.3 Ų140.387%0.86681%0.806SS**  trans-68.6117160.1-154.4-48.6000107.7
16S49.4Very low49.2Very low90 Ų90142.8 Ų142.863%0.62981%0.809SS**  trans-156.6136.1166.3-84.70000110.8
17S45.1Very low48Very low100 Ų100145.2 Ų145.270%0.69981%0.812SS**  trans98.371.1159.6-44.40000116.8S19S17-S19 PolarHBondContact O-N 3.1Å; S17-S19 VanDerWaalsContact O-N 3.1Å
18K52.4Low47.8Very low224 Ų224141.5 Ų141.597%0.97480%0.803SS**  trans-72.180.1140-78-178.2-179.8173.90108.7
19S53.5Low47.4Very low96 Ų96145.7 Ų145.767%0.67181%0.805SS**  trans-128.897.1168.5540000108.5S17S17-S19 PolarHBondContact O-N 3.1Å; S17-S19 VanDerWaalsContact O-N 3.1Å
20A48.4Very low47.1Very low104 Ų104142.2 Ų142.286%0.8680%0.795SS**  trans-151.969.4163.300000108.6
21F46.2Very low47.1Very low181 Ų181147.4 Ų147.479%0.79480%0.801SS**  trans-91.7114.1154.7170.3-90.3000106.5
22M64.2Low46.6Very low171 Ų171146.6 Ų146.684%0.84279%0.792SS**  trans-151.5108.8156.3-89.3-172.9-86.200104.8
23E47.3Very low46.3Very low133 Ų133142 Ų14262%0.62178%0.782SS**  64.895.871.8-163.2-174.6162.400111.3
24F38.6Very low45.9Very low190 Ų190143.1 Ų143.183%0.83378%0.784SS**  171.7134.1120.7-116.3-92.7000110.9
25G44.8Very low46.2Very low82 Ų82140.3 Ų140.385%0.84578%0.781SS**  trans165.755.917400000113.8
26Q48.7Very low45.8Very low176 Ų176137.5 Ų137.582%0.82277%0.774SS**  trans-101.6128.7171.3-174.3-176.384.200109.3
27Q43.8Very low45.8Very low181 Ų181141.9 Ų141.985%0.84679%0.787SS**  trans152.5140.6151.6-93.7172.3-14.700109
28S40.5Very low45.6Very low94 Ų94141.8 Ų141.866%0.65779%0.793SS**  cis179.9142.8-6.941.40000108
29H41.9Very low45.4Very low181 Ų181136 Ų13684%0.83879%0.786SS**  trans71.7138.5145.9-84.973.9000124.7
30S37.8Very low44.9Very low100 Ų100136.4 Ų136.470%0.69979%0.789SS**  trans81.6112.1143.455.10000122.8
31Q45.3Very low44.8Very low176 Ų176140.1 Ų140.182%0.82279%0.788SS**  36.4142.5124-74.9-174.16500121.4
32Q40.8Very low44.7Very low165 Ų165141.7 Ų141.777%0.77179%0.791SS**  trans111.3119.6141.4-103.4172.337.300119.4
33S39.3Very low44.2Very low100 Ų100139.2 Ų139.270%0.69979%0.787SS**  trans63.4113.4138.753.40000121.2
34S41.6Very low44.2Very low117 Ų117140.5 Ų140.582%0.81880%0.797SS**  trans-56.1149.1141.5-49.40000109.9
35P52.7Low44.8Very low123 Ų123139.9 Ų139.980%0.79980%0.797SS**  -152.717682.537.2-16.9000116.4
36S39Very low44.5Very low103 Ų103141 Ų14172%0.7279%0.79SS**  trans102.494.7143-155.90000119.5
37M50.4Low44.2Very low183 Ų183140.3 Ų140.390%0.90179%0.791SS**  30.8106.8125.7-48.3-56.2-179.600118.3
38A41.5Very low44.2Very low98 Ų98140.1 Ų140.181%0.8179%0.79SS**  trans-132.1110.2148.600000108.6S40A38-S40 PolarHBondContact O-N 3.35Å
39A46.3Very low44.1Very low101 Ų101141.2 Ų141.284%0.83580%0.798SS**  trans-70.7111.7178.100000110.1
40S43.9Very low44Very low105 Ų105136.3 Ų136.373%0.73480%0.796SS**  trans-99.4112.9163.3-71.50000108.9A38 Y42A38-S40 PolarHBondContact O-N 3.35Å; S40-Y42 PolarHBondContact O-N 2.99Å
41H45.6Very low44.1Very low183 Ų183136.3 Ų136.385%0.84780%0.796SS**  trans-36.7122.2172.1-93.366.3000113.8
42Y44.3Very low44.1Very low214 Ų214136.9 Ų136.984%0.83980%0.798SS**  trans-117124.7152.1-73.3-78.1000108S40 L44S40-Y42 PolarHBondContact O-N 2.99Å; Y42-L44 PolarHBondContact O-N 3.29Å
43P55Low44.6Very low118 Ų118134.9 Ų134.977%0.76680%0.8SS**  trans-67.9107.5173.3-14.528.7000109.5
44L47.2Very low44.8Very low161 Ų161134.7 Ų134.784%0.84380%0.804SS**  trans-78120.5168.1-153.176000107.3Y42 C46Y42-L44 PolarHBondContact O-N 3.29Å; L44-C46 PolarHBondContact O-N 3Å; L44-C46 VanDerWaalsContact O-N 3.14Å
45H49.8Very low44.8Very low177 Ų177137 Ų13782%0.81980%0.802SS**  trans-64.6114.3173.3-68.3-94.3000109.2L47H45-L47 PolarHBondContact O-N 3.44Å
46C39.6Very low44.4Very low105 Ų105138.2 Ų138.271%0.70980%0.796SS**  trans-62.6122.2178.7-61.10000111.4L44 H48L44-C46 PolarHBondContact O-N 3Å; L44-C46 VanDerWaalsContact O-N 3.14Å; C46-H48 PolarHBondContact O-N 3.05Å
47L42.9Very low44.6Very low161 Ų161142 Ų14284%0.84380%0.803SS**  trans-61.9118.9158.9-79.588.7000108.4H45H45-L47 PolarHBondContact O-N 3.44Å
48H42.4Very low44.1Very low178 Ų178142.3 Ų142.382%0.82480%0.801SS**  trans-89.399.8163.7-79.476000108.6C46 G50C46-H48 PolarHBondContact O-N 3.05Å; H48-G50 PolarHBondContact O-N 3.07Å
49S39.4Very low44.1Very low117 Ų117144.6 Ų144.682%0.81880%0.8SS**  trans-77.3101.4162.3-68.60000108.6
50G38.8Very low43.6Very low77 Ų77146 Ų14679%0.79479%0.794SS**  trans-79.6112.216800000110.5H48H48-G50 PolarHBondContact O-N 3.07Å
51S41.2Very low43.6Very low100 Ų100145.5 Ų145.570%0.69979%0.79SS**  trans-76.6129.3171.648.90000112
52H44.4Very low43.1Very low188 Ų188142.4 Ų142.487%0.8779%0.789SS**  trans-150.5153.7153.8-77.8-62.1000111.4
53P51.8Low43.3Very low124 Ų124142.4 Ų142.481%0.80579%0.789SS**  trans-106.5178.8-142.339.5-32.1000116
54A42.5Very low42.5Very low96 Ų96141.2 Ų141.279%0.79378%0.783SS**  trans-43.4144.9-17800000118.6
55H41.5Very low42.4Very low166 Ų166136.5 Ų136.577%0.76977%0.774SS**  trans-169.4141.8131-144.3-139.7000113.7
56H44Very low42Very low148 Ų148135.3 Ų135.369%0.68578%0.779SS**  trans88.8110.7152-85.826.4000122.7
57Q43.7Very low41.9Very low183 Ų183136.7 Ų136.786%0.85578%0.78SS**  trans-54.1143.5153.7-73.5169-3.300111.4
58H41.3Very low42.2Very low188 Ų188132.9 Ų132.987%0.8777%0.766SS**  trans-151.6132.3141.6-110.6-91.9000109.4
59D41.3Very low42.2Very low147 Ų147133.6 Ų133.679%0.78676%0.763SS**  trans-79.4159.7176.6-166.4-91.7000111.2
60N35.4Very low42.3Very low131 Ų131136 Ų13670%0.70177%0.767SS**  trans97.5111.4152.7-143.924.3000120.7
61S42.8Very low42.3Very low93 Ų93143.2 Ų143.265%0.6577%0.77SS**  trans41.4119.3135.4-56.80000121.7
62S35.2Very low42.6Very low118 Ų118143.8 Ų143.883%0.82577%0.774SS**  162.3149.6110-730000111.2
63Y49.1Very low42.8Very low215 Ų215141.9 Ų141.984%0.84377%0.77SS**  trans-51.9140.5179.8104.5-68.6000112.8
64S38.5Very low42.8Very low92 Ų92141.6 Ų141.664%0.64377%0.767SS**  trans173.9136.2136.8-83.30000110
65G44.6Very low42.7Very low63 Ų63147.8 Ų147.865%0.64977%0.772SS**  trans-83.8-161.3-17100000115.2
66T42.4Very low42.8Very low151 Ų151145.4 Ų145.493%0.92677%0.774SS**  trans90117.4173.772.70000115.9
67N36.4Very low42.7Very low135 Ų135148.6 Ų148.672%0.72278%0.782SS**  trans-70.1126.4-173.2-154.319000109.5
68S49.4Very low42.8Very low80 Ų80144.9 Ų144.956%0.55977%0.771SS**  trans-47.6142.2160.751.90000111.7
69Y42Very low42.8Very low193 Ų193140.8 Ų140.876%0.75776%0.764SS**  179.870.8129-65.3-51.4000110.1
70N41.2Very low43.1Very low167 Ų167141.4 Ų141.489%0.89376%0.762SS**  trans-107.290.6156.4-103.6-16.4000107.4
71R39.4Very low43.9Very low229 Ų229139.9 Ų139.986%0.86476%0.759SS**  trans-107.785.8170.4-157.9-178.4-142.4-94.72.8107.3L73R71-L73 PolarHBondContact O-N 2.96Å
72S47.3Very low44.2Very low113 Ų113143.4 Ų143.479%0.7977%0.765SS**  trans-68118.3174.2-54.10000109.5
73L49.9Very low44.9Very low148 Ų148146.4 Ų146.478%0.77577%0.766SS**  trans-85137.8167.5-80.8158.1000109.3R71 Y75R71-L73 PolarHBondContact O-N 2.96Å; L73-Y75 PolarHBondContact O-N 3.16Å
74P51.4Low44.5Very low117 Ų117141.6 Ų141.676%0.7676%0.763SS**  trans-83.5114.6174.332.6-28.7000109.1
75Y40.8Very low45.3Very low226 Ų226142.9 Ų142.989%0.88677%0.77SS**  trans-122.7109.5161.1-119.2-84.3000108.2L73 Y77L73-Y75 PolarHBondContact O-N 3.16Å; Y75-Y77 PolarHBondContact O-N 2.98Å
76S42.1Very low45.1Very low117 Ų117150.9 Ų150.982%0.81878%0.782SS**  trans-66115.2172.9-55.40000109.1
77Y41.6Very low45.8Very low214 Ų214151.5 Ų151.584%0.83978%0.778SS**PPolyproline II helixtrans-80.6116.6171.5-168.6-96.2000108.9Y75 S79Y75-Y77 PolarHBondContact O-N 2.98Å; Y77-S79 PolarHBondContact O-N 3.41Å
78V46.8Very low46.3Very low106 Ų106149.2 Ų149.264%0.64277%0.771SS**PPolyproline II helixtrans-76.5120.2170.3115.30000108H80V78-H80 WeakPolarHBondContact CG1-CE1 3.46Å; V78-H80 VanDerWaalsContact CG1-ND1 3.34Å; V78-H80 WeakPolarHBondContact CG1-ND1 3.39Å
79S41.8Very low45.9Very low102 Ų102150 Ų15071%0.71378%0.776SS**PPolyproline II helixtrans-80122.4-179-162.10000110.2Y77Y77-S79 PolarHBondContact O-N 3.41Å
80H46.5Very low45.7Very low159 Ų159150.8 Ų150.874%0.73678%0.779SS**  trans-121.5122.2167.3-72.689.9000109V78V78-H80 WeakPolarHBondContact CG1-CE1 3.46Å; V78-H80 VanDerWaalsContact CG1-ND1 3.34Å; V78-H80 WeakPolarHBondContact CG1-ND1 3.39Å
81P51.9Low46Very low99 Ų99151 Ų15164%0.64378%0.775SS**  trans-91.7128.3179.631.8-26.7000111.7
82H50.5Low46Very low167 Ų167146.6 Ų146.677%0.77377%0.768SS**  trans48.8141.8150.4-56.7-89.9000116.8
83H49.5Very low45.7Very low182 Ų182148.8 Ų148.884%0.84377%0.771SS**  177.1130.475.6-66.969000105
84S40.3Very low45.2Very low114 Ų114147.1 Ų147.180%0.79777%0.767SS**  trans-147.6130.6162.1-1740000109.7
85P54.4Low44.9Very low119 Ų119147.4 Ų147.477%0.77377%0.772SS**PPolyproline II helixtrans-85.3125.6-171.133.5-31.2000110.6
86Y42.2Very low44.7Very low230 Ų230140 Ų14090%0.90276%0.764SS**PPolyproline II helixtrans-92.8116.3162.5-114-90.9000108
87L55.8Low44.6Very low164 Ų164137.9 Ų137.986%0.85976%0.761SS**PPolyproline II helixtrans-92.6128.6157.6-81.4171.7000108.4
88P48.3Very low44.4Very low88 Ų88136.9 Ų136.957%0.57176%0.764SS**  trans-89.3110.9167.827.7-18.3000109.8Y90P88-Y90 HydrophobicContact CB-CE2 4.31Å; P88-Y90 HydrophobicContact CG-CE2 4.23Å; P88-Y90 PolarHBondContact O-N 2.83Å
89S39.8Very low43.8Very low95 Ų95136.9 Ų136.966%0.66478%0.775SS**  trans-79.8105.3166-177.40000108.9H91S89-H91 PolarHBondContact O-N 3.14Å; S89-H91 PolarHBondContact OG-CE1 2.98Å; S89-H91 PolarHBondContact OG-ND1 3.03Å; S89-H91 VanDerWaalsContact OG-ND1 3.1Å
90Y39.3Very low43.4Very low210 Ų210142.1 Ų142.182%0.82478%0.779SS**  trans-74.2104.3168.4-66.4-85000109.1P88P88-Y90 HydrophobicContact CB-CE2 4.31Å; P88-Y90 HydrophobicContact CG-CE2 4.23Å; P88-Y90 PolarHBondContact O-N 2.83Å
91H46.8Very low43.1Very low173 Ų173141 Ų14180%0.80178%0.778SS**  trans-100.196.2161.7-85.575000108.3S89S89-H91 PolarHBondContact O-N 3.14Å; S89-H91 PolarHBondContact OG-CE1 2.98Å; S89-H91 PolarHBondContact OG-ND1 3.03Å; S89-H91 VanDerWaalsContact OG-ND1 3.1Å
92N40.1Very low42.1Very low136 Ų136144.3 Ų144.373%0.72779%0.79SS**  trans-73.1128.9168.8-172-1.8000108.4T94N92-T94 PolarHBondContact OD1-OG1 3.23Å
93N40.7Very low41.5Very low159 Ų159139 Ų13985%0.8578%0.78SS**  trans-138.685.4168.9-138-1.5000109.1S95N93-S95 PolarHBondContact O-N 3.12Å
94T39.4Very low40.9Very low113 Ų113135.8 Ų135.869%0.69377%0.774SS**  trans-70.7112.3168.1-63.20000108.9N92 G96N92-T94 PolarHBondContact OD1-OG1 3.23Å; T94-G96 PolarHBondContact O-N 3.38Å
95S45.4Very low41.2Very low123 Ų123139.5 Ų139.586%0.8678%0.779SS**  trans-76.497.1162.946.10000109.4N93N93-S95 PolarHBondContact O-N 3.12Å
96G36.4Very low40.5Very low69 Ų69141.5 Ų141.571%0.71178%0.778SS**  trans-101.3115.4160.800000109T94T94-G96 PolarHBondContact O-N 3.38Å
97G39Very low40.6Very low74 Ų74138.8 Ų138.876%0.76377%0.773SS**  trans-78.4143.817100000111.1
98Q37.8Very low40Very low192 Ų192138.3 Ų138.390%0.89776%0.764SS**  trans172104.4132.7-83.2-110.3-18.700109.1
99A34.4Very low39.8Very low106 Ų106139.4 Ų139.488%0.87677%0.77SS**  trans-143.2106.6146.300000106.2
100R33.5Very low40.1Very low213 Ų213140.1 Ų140.180%0.80477%0.77SS**  trans-74.6131.1171.3-167.9-157-178.8-150.30.2107.4
101L39.5Very low40.6Very low135 Ų135135.7 Ų135.771%0.70777%0.765SS**  150.2136.6127.4-78.5168.5000111.9
102D30.5Very low41.1Very low168 Ų168134.1 Ų134.190%0.89876%0.761SS**  trans91.4133.6151.8-143.319.2000119.5
103G39.1Very low41.4Very low55 Ų55134.8 Ų134.857%0.56776%0.759SS**  trans-77.1154.5-165.800000113.9
104T36.8Very low41.8Very low115 Ų115134.1 Ų134.171%0.70676%0.756SS**  -175.7130.2126.620.50000107.5Q106T104-Q106 PolarHBondContact O-N 2.97Å
105E46.1Very low42.5Very low193 Ų193132.2 Ų132.290%0.90276%0.759SS**  trans-53.4105.3167.1-65.9-177.8120.300109.2
106Q40.5Very low42.5Very low160 Ų160132.9 Ų132.975%0.74875%0.748SS**  trans-110.389.5168.4-71.6172.321.900106.9T104 K108T104-Q106 PolarHBondContact O-N 2.97Å; Q106-K108 PolarHBondContact O-N 3.38Å
107Q42.6Very low43.4Very low173 Ų173136.4 Ų136.481%0.80875%0.749SS**  trans-43.7106.1155.9-65.3178.615.200107.1T109Q107-T109 PolarHBondContact O-N 3.14Å; Q107-T109 PolarHBondContact O-OG1 2.88Å
108K43Very low44.1Very low154 Ų154142.7 Ų142.767%0.6775%0.75SS**  trans-69.991174.2-176.5179.6177179.70107.1Q106 T110Q106-K108 PolarHBondContact O-N 3.38Å; K108-T110 PolarHBondContact O-N 3.44Å
109T44.2Very low45Very low112 Ų112140.6 Ų140.669%0.68774%0.738SS**  trans-54.4106.5173.6-410000108.1Q107 V111Q107-T109 PolarHBondContact O-N 3.14Å; Q107-T109 PolarHBondContact O-OG1 2.88Å; T109-V111 HydrophobicContact CG2-CG2 4.02Å; T109-V111 PolarHBondContact O-N 3.11Å; T109-V111 VanDerWaalsContact O-N 3.16Å
110T47.5Very low46Very low110 Ų110143.1 Ų143.168%0.67574%0.737SS**  trans-75.597.6162.445.50000105.6K108 I112K108-T110 PolarHBondContact O-N 3.44Å; T110-I112 VanDerWaalsContact C-N 3.35Å; T110-I112 PolarHBondContact O-N 3.02Å
111V48.4Very low47.1Very low117 Ų117136 Ų13671%0.70973%0.73SS**  trans-71.499.1171.4-179.50000106.6T109 E113T109-V111 HydrophobicContact CG2-CG2 4.02Å; T109-V111 PolarHBondContact O-N 3.11Å; T109-V111 VanDerWaalsContact O-N 3.16Å; V111-E113 HydrophobicContact CG1-CB 4.44Å; V111-E113 PolarHBondContact O-N 2.91Å
112I57.2Low48.2Very low139 Ų139138.9 Ų138.971%0.71374%0.737SS**  trans-84.490.3171.1-56.9170.6000106.1T110T110-I112 VanDerWaalsContact C-N 3.35Å; T110-I112 PolarHBondContact O-N 3.02Å
113E47.8Very low49.7Very low150 Ų150134.9 Ų134.970%0.70174%0.735SS**SBendtrans-114.3117162-157.2177.9162.600107.4V111V111-E113 HydrophobicContact CG1-CB 4.44Å; V111-E113 PolarHBondContact O-N 2.91Å
114N48.8Very low51.2Low146 Ų146141.3 Ų141.378%0.78175%0.747SS**THydrogen-bonded Turntrans67.535.3175.1-53.5-39.8000118E116N114-E116 VanDerWaalsContact C-N 3.25Å; N114-E116 PolarHBondContact O-N 3.19Å
115G53.4Low53.2Low73 Ų73145.4 Ų145.475%0.75376%0.755SS**THydrogen-bonded Turntrans68.55.9157.400000117.9
116E46.8Very low54.9Low136 Ų136141.9 Ų141.964%0.63674%0.742SS**  trans-111.8103.6176.1-142.7-171.4-153.200110.6N114 R118N114-E116 VanDerWaalsContact C-N 3.25Å; N114-E116 PolarHBondContact O-N 3.19Å; E116-R118 PolarHBondContact O-N 3.14Å; E116-R118 IonicContact OE2-CZ 3.88Å; E116-R118 IonicContact OE2-NE 3.05Å; E116-R118 PolarHBondContact OE2-NE 3.25Å; E116-R118 IonicContact OE2-NH2 3.91Å
117I54Low57Low143 Ų143144.3 Ų144.373%0.73374%0.744SS**  trans-70.697.1173.8-59.6168.9000108.1
118R54.9Low59.1Low207 Ų207145.2 Ų145.278%0.78175%0.745SS**  trans-94.2108.7171.5-71.3179.3154.3-146.8-9.1109.2E116E116-R118 PolarHBondContact O-N 3.14Å; E116-R118 IonicContact OE2-CZ 3.88Å; E116-R118 IonicContact OE2-NE 3.05Å; E116-R118 PolarHBondContact OE2-NE 3.25Å; E116-R118 IonicContact OE2-NH2 3.91Å
119F56.9Low61.3Low147 Ų147143.4 Ų143.465%0.64575%0.749SS**  trans-85122.3169-153.2-91.4000108.9G121F119-G121 PolarHBondContact O-N 2.91Å; F119-G121 VanDerWaalsContact O-N 3.14Å
120N54.3Low63.5Low160 Ų160148.8 Ų148.886%0.85676%0.757SS**SBendtrans-57.2115.1173.8-10649.5000109.9
121G57.8Low65.6Low63 Ų63148.4 Ų148.465%0.64976%0.755SS**SBendtrans134.595.4173.100000113.2F119F119-G121 PolarHBondContact O-N 2.91Å; F119-G121 VanDerWaalsContact O-N 3.14Å
122K61Low67.9Low196 Ų196150.2 Ų150.285%0.85276%0.759SS**SBendtrans67.762.9163.5-41.9-179.5-171.6-179.90115.6K124K122-K124 PolarHBondContact O-N 2.97Å
123G62.3Low69.8Low84 Ų84146.2 Ų146.287%0.86674%0.735SS**  trans46.35.4141.800000122.1K125G123-K125 PolarHBondContact O-N 3.02Å
124K71.7Confident72.2Confident190 Ų190141.9 Ų141.983%0.82672%0.721SS**  trans-86.5109.6-178.8-71.4-178179-178.20108.4K122 I126K122-K124 PolarHBondContact O-N 2.97Å; K124-I126 PolarHBondContact O-N 3.37Å
125K77.8Confident74.5Confident200 Ų200139.6 Ų139.687%0.8772%0.717SS**  trans-51.2111172.5-38.3-175.4-176.6-168.10108.3G123 R127G123-K125 PolarHBondContact O-N 3.02Å; K125-R127 PolarHBondContact O-N 2.64Å
126I81.6Confident76.7Confident120 Ų120142.1 Ų142.162%0.61571%0.712SS**PPolyproline II helixtrans-65.2122.7177.7-67.8168.7000107.4K124K124-I126 PolarHBondContact O-N 3.37Å
127R85.4Confident79.1Confident210 Ų210137.4 Ų137.479%0.79269%0.69SS**PPolyproline II helixtrans-69.5140.7174.7-65.7179.272.7179.16.1108.3K125K125-R127 PolarHBondContact O-N 2.64Å
128K86.3Confident81.3Confident192 Ų192133.7 Ų133.784%0.83567%0.671SS**PPolyproline II helixtrans-53.4132.1174.8-74.390.5120.2172.20109.8
129P89Confident83.3Confident117 Ų117130 Ų13076%0.7666%0.663SS**PPolyproline II helixtrans-57.7145.3175.324.8-33000109.8
130R91.1Very high85.3Confident224 Ų224124.4 Ų124.485%0.84564%0.644SS**PPolyproline II helixtrans-76132.7177.4-67.3-173.9179.3110.4-5.5109.3
131T91.9Very high87.4Confident103 Ų103116.8 Ų116.863%0.63260%0.603SS**PPolyproline II helixtrans-80.7137.6171-46.80000110.1
132I95Very high89.3Confident155 Ų155116.1 Ų116.180%0.79559%0.585SS**  trans-105.6141.8169.759.8173.3000109.5
133Y97.9Very high91.1Very high55 Ų55112 Ų11222%0.21657%0.568CS.*  trans-85.9146.6175-57-56.7000110.1L138 L165 Q169 W173Y133-L138 HydrophobicContact CD2-CD2 4.15Å; Y133-L138 HydrophobicContact CG-CD2 4.49Å; Y133-L165 HydrophobicContact CD1-CD1 4.03Å; Y133-L165 HydrophobicContact CD1-CD2 3.8Å; Y133-L165 HydrophobicContact CE1-CD1 3.99Å; Y133-L165 HydrophobicContact CE1-CD2 3.77Å; Y133-Q169 HydrophobicContact CE1-CB 4.35Å; Y133-Q169 HydrophobicContact CE1-CG 4.48Å; Y133-Q169 WeakPolarHBondContact OH-CB 3.43Å; Y133-W173 AromaticContact CD2-CD1 3.76Å; Y133-W173 HydrophobicContact CE2-CB 4.47Å; Y133-W173 AromaticContact CE2-CD1 3.59Å; Y133-W173 HydrophobicContact CE2-CG 4.4Å
134S98.4Very high92.8Very high58 Ų58111.2 Ų111.241%0.40654%0.54SS..  trans-69.4162.9176.177.30000111.8L136 Q137 L138S134-L136 VanDerWaalsContact C-N 3.32Å; S134-L136 PolarHBondContact O-N 2.93Å; S134-Q137 PolarHBondContact O-N 2.78Å; S134-Q137 VanDerWaalsContact OG-CG 3.31Å; S134-Q137 WeakPolarHBondContact OG-CG 3.34Å; S134-Q137 PolarHBondContact OG-N 3.05Å; S134-L138 WeakPolarHBondContact O-CG 3.43Å; S134-L138 PolarHBondContact O-N 3.25Å
135S98Very high94.1Very high99 Ų99102.6 Ų102.669%0.69250%0.502SS*.Hα-helixtrans-56.6-46.2177.4-172.20000112Q137 L138 Q139S135-Q137 VanDerWaalsContact C-N 3.34Å; S135-Q137 PolarHBondContact O-N 3.47Å; S135-L138 PolarHBondContact O-N 3.03Å; S135-Q139 PolarHBondContact O-N 2.99Å
136L98.2Very high95.1Very high126 Ų126100.5 Ų100.566%0.6650%0.495SS*.Hα-helixtrans-59.8-43.6178.1-177.865.3000112S134 Q139 A140S134-L136 VanDerWaalsContact C-N 3.32Å; S134-L136 PolarHBondContact O-N 2.93Å; L136-Q139 PolarHBondContact O-N 2.94Å; L136-A140 PolarHBondContact O-N 3.1Å
137Q98.5Very high95.8Very high37 Ų3799.8 Ų99.817%0.17349%0.489CS..Hα-helixtrans-61.3-46.2176.6-72.3171.8-22.400111.2S134 S135 Q139 A140 L141 L163S134-Q137 PolarHBondContact O-N 2.78Å; S134-Q137 VanDerWaalsContact OG-CG 3.31Å; S134-Q137 WeakPolarHBondContact OG-CG 3.34Å; S134-Q137 PolarHBondContact OG-N 3.05Å; S135-Q137 VanDerWaalsContact C-N 3.34Å; S135-Q137 PolarHBondContact O-N 3.47Å; Q137-Q139 VanDerWaalsContact C-N 3.35Å; Q137-Q139 PolarHBondContact O-N 3.02Å; Q137-A140 PolarHBondContact O-N 2.93Å; Q137-L141 WeakPolarHBondContact O-CB 3.32Å; Q137-L141 WeakPolarHBondContact O-CD1 3.4Å; Q137-L141 WeakPolarHBondContact O-CG 3.14Å; Q137-L141 PolarHBondContact O-N 3.38Å; Q137-L163 HydrophobicContact CG-CB 4.36Å; Q137-L163 PolarHBondContact NE2-O 3.34Å
138L98.4Very high96.4Very high64 Ų6491.8 Ų91.834%0.33546%0.464SS..Hα-helixtrans-62.6-41.5178.2-68175.7000111.9Y133 S134 S135 L141 N142Y133-L138 HydrophobicContact CD2-CD2 4.15Å; Y133-L138 HydrophobicContact CG-CD2 4.49Å; S134-L138 WeakPolarHBondContact O-CG 3.43Å; S134-L138 PolarHBondContact O-N 3.25Å; S135-L138 PolarHBondContact O-N 3.03Å; L138-L141 PolarHBondContact O-N 3.35Å; L138-N142 WeakPolarHBondContact O-CB 3.27Å; L138-N142 VanDerWaalsContact O-CG 3.26Å; L138-N142 PolarHBondContact O-N 3.33Å; L138-N142 PolarHBondContact O-ND2 3.37Å
139Q98.5Very high96.9Very high129 Ų12986.2 Ų86.260%0.60344%0.441SS*.Hα-helixtrans-60.4-50.4177.8-177.3-179.8-14.800111.3S135 L136 Q137 L141 N142 H143S135-Q139 PolarHBondContact O-N 2.99Å; L136-Q139 PolarHBondContact O-N 2.94Å; Q137-Q139 VanDerWaalsContact C-N 3.35Å; Q137-Q139 PolarHBondContact O-N 3.02Å; Q139-L141 PolarHBondContact O-N 3.24Å; Q139-N142 PolarHBondContact O-N 2.92Å; Q139-H143 WeakPolarHBondContact O-CB 3.43Å; Q139-H143 PolarHBondContact O-N 3.5Å
140A98.3Very high97.4Very high30 Ų3087.9 Ų87.925%0.24843%0.433CS..Hα-helixtrans-62.3-42.9178.800000112.5L136 Q137 N142 H143 R144 L163L136-A140 PolarHBondContact O-N 3.1Å; Q137-A140 PolarHBondContact O-N 2.93Å; A140-N142 VanDerWaalsContact C-N 3.35Å; A140-N142 PolarHBondContact O-N 3.45Å; A140-H143 PolarHBondContact O-N 3.29Å; A140-R144 PolarHBondContact O-N 3.42Å; A140-L163 HydrophobicContact CB-CD1 4.13Å; A140-L163 HydrophobicContact CB-CD2 3.66Å; A140-L163 HydrophobicContact CB-CG 4.47Å
141L98.6Very high97.7Very high0 Ų078 Ų780%040%0.397CS..Hα-helixtrans-60.7-43175.2-72.3166000111.7Q137 L138 Q139 F145 L159 L163 L165 V170 W173 F174Q137-L141 WeakPolarHBondContact O-CB 3.32Å; Q137-L141 WeakPolarHBondContact O-CD1 3.4Å; Q137-L141 WeakPolarHBondContact O-CG 3.14Å; Q137-L141 PolarHBondContact O-N 3.38Å; L138-L141 PolarHBondContact O-N 3.35Å; Q139-L141 PolarHBondContact O-N 3.24Å; L141-F145 WeakPolarHBondContact O-CB 3.45Å; L141-F145 PolarHBondContact O-N 3.02Å; L141-L159 HydrophobicContact CD2-CD2 3.98Å; L141-L163 HydrophobicContact CD2-CD1 3.96Å; L141-L163 HydrophobicContact CG-CD1 3.78Å; L141-L165 HydrophobicContact CD1-CD1 4.27Å; L141-V170 HydrophobicContact CD2-CG1 4.34Å; L141-W173 HydrophobicContact CB-CD2 4.01Å; L141-W173 HydrophobicContact CB-CE3 3.97Å; L141-W173 HydrophobicContact CB-CH2 3.64Å; L141-W173 HydrophobicContact CB-CZ2 3.65Å; L141-W173 HydrophobicContact CB-CZ3 3.8Å; L141-W173 HydrophobicContact CD1-CD2 3.91Å; L141-W173 HydrophobicContact CD1-CG 3.93Å; L141-W173 HydrophobicContact CD1-CZ2 4.5Å; L141-W173 HydrophobicContact CD2-CD2 4.36Å; L141-W173 HydrophobicContact CD2-CE3 4.25Å; L141-W173 HydrophobicContact CG-CD2 4.33Å; L141-W173 HydrophobicContact CG-CE3 4.49Å; L141-F174 HydrophobicContact CD2-CE2 4.01Å
142N98.4Very high98Very high50 Ų5075.5 Ų75.527%0.26739%0.386SS..Hα-helixtrans-66.7-43.8177.2-76.6-53.2000112L138 Q139 A140 F145 Q146 W173 K177L138-N142 WeakPolarHBondContact O-CB 3.27Å; L138-N142 VanDerWaalsContact O-CG 3.26Å; L138-N142 PolarHBondContact O-N 3.33Å; L138-N142 PolarHBondContact O-ND2 3.37Å; Q139-N142 PolarHBondContact O-N 2.92Å; A140-N142 VanDerWaalsContact C-N 3.35Å; A140-N142 PolarHBondContact O-N 3.45Å; N142-F145 WeakPolarHBondContact O-CB 3.34Å; N142-F145 PolarHBondContact O-N 3.36Å; N142-Q146 WeakPolarHBondContact O-CG 3.46Å; N142-Q146 PolarHBondContact O-N 2.89Å; N142-W173 WeakPolarHBondContact OD1-CH2 3.46Å; N142-K177 WeakPolarHBondContact OD1-CE 3.5Å; N142-K177 PolarHBondContact OD1-NZ 3.25Å
143H98.3Very high98.1Very high108 Ų10873.6 Ų73.650%0.538%0.377SS..Hα-helixtrans-59.1-48.5176.9176.8-104.6000110.8Q139 A140 F145 Q146 Q147Q139-H143 WeakPolarHBondContact O-CB 3.43Å; Q139-H143 PolarHBondContact O-N 3.5Å; A140-H143 PolarHBondContact O-N 3.29Å; H143-F145 VanDerWaalsContact C-N 3.29Å; H143-F145 PolarHBondContact O-N 2.96Å; H143-Q146 WeakPolarHBondContact O-CB 3.3Å; H143-Q146 PolarHBondContact O-N 3.27Å; H143-Q147 PolarHBondContact CE1-NE2 3.41Å; H143-Q147 PolarHBondContact O-N 3.36Å
144R98.1Very high98.1Very high69 Ų6974.9 Ų74.926%0.2639%0.392SS..Hα-helixtrans-63.1-36.1176.3-171.459.3173.8-160.4-3112.4A140 Q146 Q147 T148 L151 E155 L159 F174A140-R144 PolarHBondContact O-N 3.42Å; R144-Q146 VanDerWaalsContact C-N 3.32Å; R144-Q146 PolarHBondContact O-N 2.89Å; R144-Q147 VanDerWaalsContact CD-OE1 3.25Å; R144-Q147 VanDerWaalsContact NH1-OE1 3.14Å; R144-Q147 WeakPolarHBondContact O-CB 3.48Å; R144-Q147 PolarHBondContact O-N 3.3Å; R144-Q147 VanDerWaalsContact O-N 3.16Å; R144-T148 PolarHBondContact O-N 3.1Å; R144-L151 HydrophobicContact CG-CD2 3.88Å; R144-E155 IonicContact CZ-OE1 3.93Å; R144-E155 IonicContact NH2-OE1 2.78Å; R144-E155 PolarHBondContact NH2-OE1 3.25Å; R144-L159 HydrophobicContact CB-CD2 4.2Å; R144-L159 HydrophobicContact CG-CD2 4.07Å; R144-F174 HydrophobicContact CB-CZ 4.4Å; R144-F174 HydrophobicContact CG-CZ 4.26Å
145F98.4Very high98.1Very high9 Ų974.5 Ų74.54%0.03938%0.384CS..Hα-helixtrans-63.9-34.6177.2-175.2-95.1000113.5L141 N142 H143 Q147 T148 Q149 W173 F174 K177 R178 F181L141-F145 WeakPolarHBondContact O-CB 3.45Å; L141-F145 PolarHBondContact O-N 3.02Å; N142-F145 WeakPolarHBondContact O-CB 3.34Å; N142-F145 PolarHBondContact O-N 3.36Å; H143-F145 VanDerWaalsContact C-N 3.29Å; H143-F145 PolarHBondContact O-N 2.96Å; F145-Q147 VanDerWaalsContact C-N 3.28Å; F145-T148 WeakPolarHBondContact CA-O 3.35Å; F145-T148 CarbonylContact O-C 3.46Å; F145-Q149 HydrophobicContact CD2-CB 4.45Å; F145-Q149 HydrophobicContact CE1-CG 4.11Å; F145-Q149 HydrophobicContact CE2-CB 3.84Å; F145-Q149 HydrophobicContact CE2-CG 3.99Å; F145-Q149 HydrophobicContact CZ-CB 4.06Å; F145-Q149 HydrophobicContact CZ-CG 3.75Å; F145-W173 HydrophobicContact CB-CH2 4.4Å; F145-W173 HydrophobicContact CB-CZ3 4.15Å; F145-W173 HydrophobicContact CD2-CZ3 4.48Å; F145-F174 HydrophobicContact CB-CE1 4.29Å; F145-F174 HydrophobicContact CB-CZ 4.43Å; F145-F174 AromaticContact CD2-CD1 3.9Å; F145-F174 HydrophobicContact CD2-CD1 3.9Å; F145-F174 AromaticContact CD2-CE1 3.88Å; F145-F174 HydrophobicContact CD2-CE1 3.88Å; F145-K177 HydrophobicContact CD1-CD 4.45Å; F145-K177 HydrophobicContact CD1-CG 3.76Å; F145-K177 HydrophobicContact CD2-CB 4.19Å; F145-K177 HydrophobicContact CD2-CG 3.62Å; F145-K177 HydrophobicContact CE1-CG 3.75Å; F145-K177 HydrophobicContact CE2-CB 4.05Å; F145-K177 HydrophobicContact CE2-CG 3.61Å; F145-K177 HydrophobicContact CG-CG 3.7Å; F145-K177 HydrophobicContact CZ-CB 4.43Å; F145-K177 HydrophobicContact CZ-CG 3.68Å; F145-R178 HydrophobicContact CE2-CG 3.68Å; F145-R178 HydrophobicContact CZ-CG 4.07Å; F145-F181 HydrophobicContact CZ-CB 4.41Å
146Q98.1Very high98.2Very high155 Ų15572.3 Ų72.372%0.72436%0.361SS*.Hα-helixtrans-65.4-34.7174.4-70.4167.6-13.900111.4N142 H143 R144N142-Q146 WeakPolarHBondContact O-CG 3.46Å; N142-Q146 PolarHBondContact O-N 2.89Å; H143-Q146 WeakPolarHBondContact O-CB 3.3Å; H143-Q146 PolarHBondContact O-N 3.27Å; R144-Q146 VanDerWaalsContact C-N 3.32Å; R144-Q146 PolarHBondContact O-N 2.89Å
147Q97.7Very high98.2Very high106 Ų10668 Ų6850%0.49534%0.344SS..Hα-helixtrans-74-49.2175.5-59.8177.3-23.300111.8H143 R144 F145H143-Q147 PolarHBondContact CE1-NE2 3.41Å; H143-Q147 PolarHBondContact O-N 3.36Å; R144-Q147 VanDerWaalsContact CD-OE1 3.25Å; R144-Q147 VanDerWaalsContact NH1-OE1 3.14Å; R144-Q147 WeakPolarHBondContact O-CB 3.48Å; R144-Q147 PolarHBondContact O-N 3.3Å; R144-Q147 VanDerWaalsContact O-N 3.16Å; F145-Q147 VanDerWaalsContact C-N 3.28Å
148T97.3Very high98.2Very high42 Ų4272.7 Ų72.726%0.25837%0.365SS..  trans-143.2123.1-175.858.20000109.9R144 F145 Y150 L151 F174R144-T148 PolarHBondContact O-N 3.1Å; F145-T148 WeakPolarHBondContact CA-O 3.35Å; F145-T148 CarbonylContact O-C 3.46Å; T148-Y150 VanDerWaalsContact C-N 3.28Å; T148-Y150 PolarHBondContact O-N 3.48Å; T148-L151 WeakPolarHBondContact OG1-CD2 3.31Å; T148-F174 WeakPolarHBondContact O-CE1 3.34Å
149Q97.8Very high98.2Very high74 Ų7470.6 Ų70.635%0.34636%0.355SS..SBendtrans-80.7-13.3179.7-61.8-172.7-17.700113.1F145 R178F145-Q149 HydrophobicContact CD2-CB 4.45Å; F145-Q149 HydrophobicContact CE1-CG 4.11Å; F145-Q149 HydrophobicContact CE2-CB 3.84Å; F145-Q149 HydrophobicContact CE2-CG 3.99Å; F145-Q149 HydrophobicContact CZ-CB 4.06Å; F145-Q149 HydrophobicContact CZ-CG 3.75Å; Q149-R178 VanDerWaalsContact O-CD 3.28Å; Q149-R178 WeakPolarHBondContact O-CD 3.4Å
150Y98.2Very high98.2Very high152 Ų15264.7 Ų64.760%0.59633%0.327SS*.SBendtrans-133121.6-178.2-64.5-103.3000108T148 R178T148-Y150 VanDerWaalsContact C-N 3.28Å; T148-Y150 PolarHBondContact O-N 3.48Å; Y150-R178 VanDerWaalsContact CZ-NH1 3.27Å; Y150-R178 PolarHBondContact OH-NH1 2.98Å
151L97.8Very high98.2Very high17 Ų1767 Ų679%0.08935%0.347CS..  trans-96.8132.7176.5-68.8173.5000110.8R144 T148 E155 R156 L159 V170 F174R144-L151 HydrophobicContact CG-CD2 3.88Å; T148-L151 WeakPolarHBondContact OG1-CD2 3.31Å; L151-E155 HydrophobicContact CD2-CB 3.96Å; L151-R156 HydrophobicContact CB-CB 4.28Å; L151-R156 PolarHBondContact O-NH2 3.44Å; L151-L159 HydrophobicContact CD1-CD2 3.72Å; L151-V170 HydrophobicContact CD1-CG1 3.97Å; L151-F174 HydrophobicContact CD1-CD1 4.3Å; L151-F174 HydrophobicContact CD1-CD2 4.01Å; L151-F174 HydrophobicContact CD1-CE1 3.79Å; L151-F174 HydrophobicContact CD1-CE2 3.48Å; L151-F174 VanDerWaalsContact CD1-CE2 3.48Å; L151-F174 HydrophobicContact CD1-CG 4.41Å; L151-F174 HydrophobicContact CD1-CZ 3.36Å; L151-F174 HydrophobicContact CD2-CE1 4.49Å; L151-F174 HydrophobicContact CD2-CZ 4.45Å; L151-F174 HydrophobicContact CG-CD1 4.22Å; L151-F174 HydrophobicContact CG-CE1 3.71Å; L151-F174 HydrophobicContact CG-CE2 4.33Å; L151-F174 HydrophobicContact CG-CZ 3.79Å
152A97.9Very high98.2Very high50 Ų5071.3 Ų71.341%0.41338%0.377SS..  trans-66.1166.4165.800000110.7P154 E155 R156A152-P154 HydrophobicContact CB-CG 4.36Å; A152-E155 HydrophobicContact CB-CG 4.31Å; A152-E155 WeakPolarHBondContact CB-OE2 3.29Å; A152-E155 PolarHBondContact N-OE2 2.94Å; A152-R156 VanDerWaalsContact O-CB 3.3Å; A152-R156 WeakPolarHBondContact O-CB 3.5Å; A152-R156 PolarHBondContact O-N 3.04Å
153L98.3Very high98.1Very high115 Ų11570 Ų7060%0.60237%0.37SS*.Hα-helixtrans-56.7-49.1179.1-17164.2000113.6R156 A157L153-R156 PolarHBondContact O-N 3.47Å; L153-A157 PolarHBondContact O-N 3.19Å; L153-A157 VanDerWaalsContact O-N 3.12Å
154P98Very high98.1Very high82 Ų8268.1 Ų68.153%0.53238%0.38SS..Hα-helixtrans-63.1-48.2-179.722.6-33.3000112.3A152 R156 A157 E158A152-P154 HydrophobicContact CB-CG 4.36Å; P154-R156 PolarHBondContact O-N 3.44Å; P154-A157 WeakPolarHBondContact O-CB 3.38Å; P154-A157 PolarHBondContact O-N 3.41Å; P154-E158 PolarHBondContact O-N 3.26Å
155E98.3Very high98.1Very high50 Ų5065.9 Ų65.923%0.23437%0.372CS..Hα-helixtrans-60.9-35.1180-52.9177.7110.700112.4R144 L151 A152 L159R144-E155 IonicContact CZ-OE1 3.93Å; R144-E155 IonicContact NH2-OE1 2.78Å; R144-E155 PolarHBondContact NH2-OE1 3.25Å; L151-E155 HydrophobicContact CD2-CB 3.96Å; A152-E155 HydrophobicContact CB-CG 4.31Å; A152-E155 WeakPolarHBondContact CB-OE2 3.29Å; A152-E155 PolarHBondContact N-OE2 2.94Å; E155-L159 WeakPolarHBondContact O-CB 3.37Å; E155-L159 PolarHBondContact O-N 2.85Å
156R98.6Very high98.1Very high54 Ų5469.1 Ų69.120%0.20439%0.393CS..Hα-helixtrans-66.3-40.1174.8-175.5-170.7-56.8161.410.1111.5L151 A152 L153 P154 A160 Q167 V170L151-R156 HydrophobicContact CB-CB 4.28Å; L151-R156 PolarHBondContact O-NH2 3.44Å; A152-R156 VanDerWaalsContact O-CB 3.3Å; A152-R156 WeakPolarHBondContact O-CB 3.5Å; A152-R156 PolarHBondContact O-N 3.04Å; L153-R156 PolarHBondContact O-N 3.47Å; P154-R156 PolarHBondContact O-N 3.44Å; R156-A160 WeakPolarHBondContact O-CB 3.4Å; R156-A160 PolarHBondContact O-N 2.9Å; R156-Q167 WeakPolarHBondContact CD-O 3.46Å; R156-Q167 HydrophobicContact CG-CB 4.26Å; R156-V170 HydrophobicContact CG-CB 4.15Å; R156-V170 HydrophobicContact CG-CG1 3.98Å
157A98.5Very high98.2Very high36 Ų3665.9 Ų65.930%0.29838%0.378SS..Hα-helixtrans-64.8-43.9178.600000111L153 P154 A160 A161L153-A157 PolarHBondContact O-N 3.19Å; L153-A157 VanDerWaalsContact O-N 3.12Å; P154-A157 WeakPolarHBondContact O-CB 3.38Å; P154-A157 PolarHBondContact O-N 3.41Å; A157-A160 PolarHBondContact O-N 3.45Å; A157-A161 WeakPolarHBondContact O-CB 3.38Å; A157-A161 PolarHBondContact O-N 3.37Å
158E98.4Very high98.2Very high134 Ų13465 Ų6563%0.62638%0.38SS*.Hα-helixtrans-60.9-50.1176.6-69.2173.7-177.700112P154 A160 A161 S162P154-E158 PolarHBondContact O-N 3.26Å; E158-A160 VanDerWaalsContact C-N 3.3Å; E158-A160 PolarHBondContact O-N 2.98Å; E158-A161 PolarHBondContact O-N 3.45Å; E158-S162 PolarHBondContact O-N 2.87Å; E158-S162 PolarHBondContact O-OG 3.16Å
159L98.4Very high98.2Very high21 Ų2165.3 Ų65.311%0.1138%0.378CS..Hα-helixtrans-64.7-35.6179.6-174.563.3000112.6L141 R144 L151 E155 S162 L163 V170 F174L141-L159 HydrophobicContact CD2-CD2 3.98Å; R144-L159 HydrophobicContact CB-CD2 4.2Å; R144-L159 HydrophobicContact CG-CD2 4.07Å; L151-L159 HydrophobicContact CD1-CD2 3.72Å; E155-L159 WeakPolarHBondContact O-CB 3.37Å; E155-L159 PolarHBondContact O-N 2.85Å; L159-S162 PolarHBondContact O-OG 3.38Å; L159-L163 HydrophobicContact CD1-CD1 3.84Å; L159-L163 HydrophobicContact CD1-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 4.09Å; L159-L163 WeakPolarHBondContact O-CB 3.28Å; L159-L163 WeakPolarHBondContact O-CG 3.38Å; L159-L163 PolarHBondContact O-N 3.42Å; L159-V170 HydrophobicContact CD2-CG1 4.03Å; L159-F174 HydrophobicContact CD2-CE2 3.99Å; L159-F174 HydrophobicContact CD2-CZ 4.31Å
160A98.6Very high98.2Very high4 Ų461.8 Ų61.83%0.03336%0.362CS..Hα-helixtrans-63.9-47.8175.600000110.7R156 A157 E158 L163 G164 L165 Q167 V170R156-A160 WeakPolarHBondContact O-CB 3.4Å; R156-A160 PolarHBondContact O-N 2.9Å; A157-A160 PolarHBondContact O-N 3.45Å; E158-A160 VanDerWaalsContact C-N 3.3Å; E158-A160 PolarHBondContact O-N 2.98Å; A160-L163 PolarHBondContact O-N 3.36Å; A160-G164 PolarHBondContact O-N 3.25Å; A160-G164 VanDerWaalsContact O-N 3.1Å; A160-L165 CarbonylContact C-O 3.43Å; A160-L165 VanDerWaalsContact CB-O 3.32Å; A160-L165 WeakPolarHBondContact CB-O 3.18Å; A160-L165 PolarHBondContact O-N 3.28Å; A160-L165 VanDerWaalsContact O-O 3.12Å; A160-Q167 HydrophobicContact CB-CG 4.14Å; A160-V170 HydrophobicContact CB-CG2 3.96Å
161A98.4Very high98.3Very high80 Ų8059.1 Ų59.166%0.66135%0.353SS*.Hα-helixtrans-60.6-46.7177.100000111.8A157 E158 L163 G164A157-A161 WeakPolarHBondContact O-CB 3.38Å; A157-A161 PolarHBondContact O-N 3.37Å; E158-A161 PolarHBondContact O-N 3.45Å; A161-L163 PolarHBondContact O-N 3.21Å; A161-G164 PolarHBondContact O-N 3.44Å
162S98.1Very high98.3Very high89 Ų8961.9 Ų61.962%0.62237%0.368SS*.Hα-helixtrans-64.1-28.2-178.567.90000113.7E158 L159E158-S162 PolarHBondContact O-N 2.87Å; E158-S162 PolarHBondContact O-OG 3.16Å; L159-S162 PolarHBondContact O-OG 3.38Å
163L98Very high98.3Very high24 Ų2460.9 Ų60.913%0.12635%0.353CS..Hα-helixtrans-101-2.2-176.7-62.8-177.3000114.1Q137 A140 L141 L159 A160 A161 L165Q137-L163 HydrophobicContact CG-CB 4.36Å; Q137-L163 PolarHBondContact NE2-O 3.34Å; A140-L163 HydrophobicContact CB-CD1 4.13Å; A140-L163 HydrophobicContact CB-CD2 3.66Å; A140-L163 HydrophobicContact CB-CG 4.47Å; L141-L163 HydrophobicContact CD2-CD1 3.96Å; L141-L163 HydrophobicContact CG-CD1 3.78Å; L159-L163 HydrophobicContact CD1-CD1 3.84Å; L159-L163 HydrophobicContact CD1-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 4.09Å; L159-L163 WeakPolarHBondContact O-CB 3.28Å; L159-L163 WeakPolarHBondContact O-CG 3.38Å; L159-L163 PolarHBondContact O-N 3.42Å; A160-L163 PolarHBondContact O-N 3.36Å; A161-L163 PolarHBondContact O-N 3.21Å; L163-L165 VanDerWaalsContact C-N 3.26Å; L163-L165 HydrophobicContact CB-CD1 4.12Å; L163-L165 HydrophobicContact CB-CG 3.98Å; L163-L165 HydrophobicContact CD1-CD1 4.39Å; L163-L165 PolarHBondContact O-N 3.22Å
164G98.1Very high98.3Very high68 Ų6855.8 Ų55.870%0.70133%0.326SS*.THydrogen-bonded Turntrans63.332.6-173.100000112.9A160 A161A160-G164 PolarHBondContact O-N 3.25Å; A160-G164 VanDerWaalsContact O-N 3.1Å; A161-G164 PolarHBondContact O-N 3.44Å
165L98.1Very high98.3Very high21 Ų2155.8 Ų55.811%0.1132%0.319CS..  trans-110.6160.6179-61.5-177.8000110.4Y133 L141 A160 L163 Q169 V170Y133-L165 HydrophobicContact CD1-CD1 4.03Å; Y133-L165 HydrophobicContact CD1-CD2 3.8Å; Y133-L165 HydrophobicContact CE1-CD1 3.99Å; Y133-L165 HydrophobicContact CE1-CD2 3.77Å; L141-L165 HydrophobicContact CD1-CD1 4.27Å; A160-L165 CarbonylContact C-O 3.43Å; A160-L165 VanDerWaalsContact CB-O 3.32Å; A160-L165 WeakPolarHBondContact CB-O 3.18Å; A160-L165 PolarHBondContact O-N 3.28Å; A160-L165 VanDerWaalsContact O-O 3.12Å; L163-L165 VanDerWaalsContact C-N 3.26Å; L163-L165 HydrophobicContact CB-CD1 4.12Å; L163-L165 HydrophobicContact CB-CG 3.98Å; L163-L165 HydrophobicContact CD1-CD1 4.39Å; L163-L165 PolarHBondContact O-N 3.22Å; L165-Q169 HydrophobicContact CB-CB 4.45Å; L165-V170 HydrophobicContact CB-CG2 4.19Å; L165-V170 HydrophobicContact CD1-CG2 4.48Å
166T98.4Very high98.3Very high77 Ų7758.3 Ų58.347%0.47233%0.334SS..  trans-79.9151.1169.8630000110.9T168 Q169 V170T166-T168 PolarHBondContact O-N 3.47Å; T166-T168 VanDerWaalsContact O-N 3.14Å; T166-Q169 WeakPolarHBondContact O-CB 3.31Å; T166-Q169 PolarHBondContact O-N 3.05Å; T166-Q169 WeakPolarHBondContact OG1-CB 3.5Å; T166-Q169 VanDerWaalsContact OG1-CG 3.27Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.21Å; T166-Q169 PolarHBondContact OG1-N 2.99Å; T166-Q169 PolarHBondContact OG1-OE1 2.96Å; T166-V170 PolarHBondContact O-N 3.18Å; T166-V170 VanDerWaalsContact O-N 3.11Å
167Q98.4Very high98.3Very high87 Ų8758.8 Ų58.841%0.40734%0.338SS..Hα-helixtrans-54-35.8173.5-65.7-175.63300112R156 A160 V170 K171R156-Q167 WeakPolarHBondContact CD-O 3.46Å; R156-Q167 HydrophobicContact CG-CB 4.26Å; A160-Q167 HydrophobicContact CB-CG 4.14Å; Q167-V170 PolarHBondContact O-N 3.37Å; Q167-K171 WeakPolarHBondContact O-CB 3.34Å; Q167-K171 PolarHBondContact O-N 2.86Å
168T98.3Very high98.3Very high89 Ų8960.5 Ų60.555%0.54634%0.336SS..Hα-helixtrans-65.3-42.6176.9-59.10000112.1T166 K171 I172T166-T168 PolarHBondContact O-N 3.47Å; T166-T168 VanDerWaalsContact O-N 3.14Å; T168-K171 WeakPolarHBondContact O-CB 3.43Å; T168-K171 PolarHBondContact O-N 3.06Å; T168-I172 HydrophobicContact CG2-CD1 3.84Å; T168-I172 HydrophobicContact CG2-CG1 4.42Å; T168-I172 VanDerWaalsContact O-CG1 3.29Å; T168-I172 WeakPolarHBondContact O-CG1 3.35Å; T168-I172 PolarHBondContact O-N 3.4Å
169Q98.1Very high98.3Very high47 Ų4757.5 Ų57.522%0.2233%0.33CS..Hα-helixtrans-61-45.5175.3-80.2166.6-46.100111.6Y133 L165 T166 K171 I172 W173Y133-Q169 HydrophobicContact CE1-CB 4.35Å; Y133-Q169 HydrophobicContact CE1-CG 4.48Å; Y133-Q169 WeakPolarHBondContact OH-CB 3.43Å; L165-Q169 HydrophobicContact CB-CB 4.45Å; T166-Q169 WeakPolarHBondContact O-CB 3.31Å; T166-Q169 PolarHBondContact O-N 3.05Å; T166-Q169 WeakPolarHBondContact OG1-CB 3.5Å; T166-Q169 VanDerWaalsContact OG1-CG 3.27Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.21Å; T166-Q169 PolarHBondContact OG1-N 2.99Å; T166-Q169 PolarHBondContact OG1-OE1 2.96Å; Q169-K171 PolarHBondContact O-N 2.91Å; Q169-I172 PolarHBondContact O-N 3.22Å; Q169-W173 WeakPolarHBondContact O-CB 3.49Å; Q169-W173 PolarHBondContact O-N 2.9Å
170V98.4Very high98.2Very high0 Ų063 Ų630%035%0.354CS..Hα-helixtrans-60.9-46.3175.3178.90000110.5L141 L151 R156 L159 A160 L165 T166 Q167 I172 W173 F174L141-V170 HydrophobicContact CD2-CG1 4.34Å; L151-V170 HydrophobicContact CD1-CG1 3.97Å; R156-V170 HydrophobicContact CG-CB 4.15Å; R156-V170 HydrophobicContact CG-CG1 3.98Å; L159-V170 HydrophobicContact CD2-CG1 4.03Å; A160-V170 HydrophobicContact CB-CG2 3.96Å; L165-V170 HydrophobicContact CB-CG2 4.19Å; L165-V170 HydrophobicContact CD1-CG2 4.48Å; T166-V170 PolarHBondContact O-N 3.18Å; T166-V170 VanDerWaalsContact O-N 3.11Å; Q167-V170 PolarHBondContact O-N 3.37Å; V170-I172 PolarHBondContact O-N 3.24Å; V170-W173 PolarHBondContact O-N 3.47Å; V170-F174 HydrophobicContact CG1-CD2 3.87Å; V170-F174 HydrophobicContact CG1-CE2 3.97Å; V170-F174 WeakPolarHBondContact O-CD2 3.43Å; V170-F174 PolarHBondContact O-N 3.46Å
171K98.3Very high98Very high96 Ų9665.8 Ų65.842%0.41737%0.365SS..Hα-helixtrans-56.4-49.3176.7-179.2-174.9179.1-177.80111.9Q167 T168 Q169 F174 Q175Q167-K171 WeakPolarHBondContact O-CB 3.34Å; Q167-K171 PolarHBondContact O-N 2.86Å; T168-K171 WeakPolarHBondContact O-CB 3.43Å; T168-K171 PolarHBondContact O-N 3.06Å; Q169-K171 PolarHBondContact O-N 2.91Å; K171-F174 PolarHBondContact O-N 2.74Å; K171-Q175 VanDerWaalsContact O-CG 3.31Å; K171-Q175 WeakPolarHBondContact O-CG 3.37Å; K171-Q175 PolarHBondContact O-N 3.35Å
172I98.3Very high97.9Very high76 Ų7669.1 Ų69.139%0.3936%0.364SS..Hα-helixtrans-63.9-43.8179.9-69.7168.6000110.4T168 Q169 V170 F174 Q175 N176T168-I172 HydrophobicContact CG2-CD1 3.84Å; T168-I172 HydrophobicContact CG2-CG1 4.42Å; T168-I172 VanDerWaalsContact O-CG1 3.29Å; T168-I172 WeakPolarHBondContact O-CG1 3.35Å; T168-I172 PolarHBondContact O-N 3.4Å; Q169-I172 PolarHBondContact O-N 3.22Å; V170-I172 PolarHBondContact O-N 3.24Å; I172-F174 PolarHBondContact O-N 2.81Å; I172-Q175 PolarHBondContact O-N 3.46Å; I172-N176 VanDerWaalsContact O-CG 3.29Å; I172-N176 PolarHBondContact O-N 3.49Å; I172-N176 PolarHBondContact O-ND2 3.29Å
173W98.3Very high97.7Very high28 Ų2872.7 Ų72.711%0.10637%0.369CS..Hα-helixtrans-59.4-46.5178.2-171.499.7000111.4Y133 L141 N142 F145 Q169 V170 Q175 N176 K177Y133-W173 AromaticContact CD2-CD1 3.76Å; Y133-W173 HydrophobicContact CE2-CB 4.47Å; Y133-W173 AromaticContact CE2-CD1 3.59Å; Y133-W173 HydrophobicContact CE2-CG 4.4Å; L141-W173 HydrophobicContact CB-CD2 4.01Å; L141-W173 HydrophobicContact CB-CE3 3.97Å; L141-W173 HydrophobicContact CB-CH2 3.64Å; L141-W173 HydrophobicContact CB-CZ2 3.65Å; L141-W173 HydrophobicContact CB-CZ3 3.8Å; L141-W173 HydrophobicContact CD1-CD2 3.91Å; L141-W173 HydrophobicContact CD1-CG 3.93Å; L141-W173 HydrophobicContact CD1-CZ2 4.5Å; L141-W173 HydrophobicContact CD2-CD2 4.36Å; L141-W173 HydrophobicContact CD2-CE3 4.25Å; L141-W173 HydrophobicContact CG-CD2 4.33Å; L141-W173 HydrophobicContact CG-CE3 4.49Å; N142-W173 WeakPolarHBondContact OD1-CH2 3.46Å; F145-W173 HydrophobicContact CB-CH2 4.4Å; F145-W173 HydrophobicContact CB-CZ3 4.15Å; F145-W173 HydrophobicContact CD2-CZ3 4.48Å; Q169-W173 WeakPolarHBondContact O-CB 3.49Å; Q169-W173 PolarHBondContact O-N 2.9Å; V170-W173 PolarHBondContact O-N 3.47Å; W173-Q175 PolarHBondContact O-N 3.29Å; W173-N176 PolarHBondContact O-N 3.32Å; W173-K177 HydrophobicContact CE3-CB 4.09Å; W173-K177 HydrophobicContact CH2-CB 4.18Å; W173-K177 HydrophobicContact CH2-CD 3.82Å; W173-K177 HydrophobicContact CH2-CG 3.88Å; W173-K177 HydrophobicContact CZ2-CD 4.24Å; W173-K177 HydrophobicContact CZ3-CB 3.83Å; W173-K177 HydrophobicContact CZ3-CD 4.31Å; W173-K177 HydrophobicContact CZ3-CG 3.86Å; W173-K177 WeakPolarHBondContact O-CB 3.41Å; W173-K177 PolarHBondContact O-N 3.39Å
174F98.7Very high97.4Very high9 Ų975.3 Ų75.34%0.03938%0.383CS..Hα-helixtrans-63.7-38.5177.5-91.1-105000112.6L141 R144 F145 T148 L151 L159 V170 K171 I172 K177 R178L141-F174 HydrophobicContact CD2-CE2 4.01Å; R144-F174 HydrophobicContact CB-CZ 4.4Å; R144-F174 HydrophobicContact CG-CZ 4.26Å; F145-F174 HydrophobicContact CB-CE1 4.29Å; F145-F174 HydrophobicContact CB-CZ 4.43Å; F145-F174 AromaticContact CD2-CD1 3.9Å; F145-F174 HydrophobicContact CD2-CD1 3.9Å; F145-F174 AromaticContact CD2-CE1 3.88Å; F145-F174 HydrophobicContact CD2-CE1 3.88Å; T148-F174 WeakPolarHBondContact O-CE1 3.34Å; L151-F174 HydrophobicContact CD1-CD1 4.3Å; L151-F174 HydrophobicContact CD1-CD2 4.01Å; L151-F174 HydrophobicContact CD1-CE1 3.79Å; L151-F174 HydrophobicContact CD1-CE2 3.48Å; L151-F174 VanDerWaalsContact CD1-CE2 3.48Å; L151-F174 HydrophobicContact CD1-CG 4.41Å; L151-F174 HydrophobicContact CD1-CZ 3.36Å; L151-F174 HydrophobicContact CD2-CE1 4.49Å; L151-F174 HydrophobicContact CD2-CZ 4.45Å; L151-F174 HydrophobicContact CG-CD1 4.22Å; L151-F174 HydrophobicContact CG-CE1 3.71Å; L151-F174 HydrophobicContact CG-CE2 4.33Å; L151-F174 HydrophobicContact CG-CZ 3.79Å; L159-F174 HydrophobicContact CD2-CE2 3.99Å; L159-F174 HydrophobicContact CD2-CZ 4.31Å; V170-F174 HydrophobicContact CG1-CD2 3.87Å; V170-F174 HydrophobicContact CG1-CE2 3.97Å; V170-F174 WeakPolarHBondContact O-CD2 3.43Å; V170-F174 PolarHBondContact O-N 3.46Å; K171-F174 PolarHBondContact O-N 2.74Å; I172-F174 PolarHBondContact O-N 2.81Å; F174-K177 PolarHBondContact O-N 3.2Å; F174-R178 WeakPolarHBondContact O-CG 3.4Å; F174-R178 PolarHBondContact O-N 3Å
175Q98.5Very high97Very high82 Ų8276.9 Ų76.938%0.38337%0.374SS..Hα-helixtrans-63.1-44.4174.2-73.1176.27.900112.1K171 I172 W173 S179K171-Q175 VanDerWaalsContact O-CG 3.31Å; K171-Q175 WeakPolarHBondContact O-CG 3.37Å; K171-Q175 PolarHBondContact O-N 3.35Å; I172-Q175 PolarHBondContact O-N 3.46Å; W173-Q175 PolarHBondContact O-N 3.29Å; Q175-S179 WeakPolarHBondContact O-CB 3.4Å; Q175-S179 PolarHBondContact O-N 2.87Å; Q175-S179 PolarHBondContact O-OG 3.3Å
176N98Very high96.3Very high102 Ų10285.1 Ų85.155%0.54541%0.409SS..Hα-helixtrans-63.9-43.7176.9-70.2-19.9000111.1I172 W173 S179 K180I172-N176 VanDerWaalsContact O-CG 3.29Å; I172-N176 PolarHBondContact O-N 3.49Å; I172-N176 PolarHBondContact O-ND2 3.29Å; W173-N176 PolarHBondContact O-N 3.32Å; N176-S179 PolarHBondContact O-N 3.36Å; N176-K180 PolarHBondContact O-N 3.02Å
177K97.9Very high95.5Very high65 Ų6585.3 Ų85.328%0.28342%0.418SS..Hα-helixtrans-61.3-47.2178.8-172.770.8-178.3-164.80111.6N142 F145 W173 F174 S179 K180 F181N142-K177 WeakPolarHBondContact OD1-CE 3.5Å; N142-K177 PolarHBondContact OD1-NZ 3.25Å; F145-K177 HydrophobicContact CD1-CD 4.45Å; F145-K177 HydrophobicContact CD1-CG 3.76Å; F145-K177 HydrophobicContact CD2-CB 4.19Å; F145-K177 HydrophobicContact CD2-CG 3.62Å; F145-K177 HydrophobicContact CE1-CG 3.75Å; F145-K177 HydrophobicContact CE2-CB 4.05Å; F145-K177 HydrophobicContact CE2-CG 3.61Å; F145-K177 HydrophobicContact CG-CG 3.7Å; F145-K177 HydrophobicContact CZ-CB 4.43Å; F145-K177 HydrophobicContact CZ-CG 3.68Å; W173-K177 HydrophobicContact CE3-CB 4.09Å; W173-K177 HydrophobicContact CH2-CB 4.18Å; W173-K177 HydrophobicContact CH2-CD 3.82Å; W173-K177 HydrophobicContact CH2-CG 3.88Å; W173-K177 HydrophobicContact CZ2-CD 4.24Å; W173-K177 HydrophobicContact CZ3-CB 3.83Å; W173-K177 HydrophobicContact CZ3-CD 4.31Å; W173-K177 HydrophobicContact CZ3-CG 3.86Å; W173-K177 WeakPolarHBondContact O-CB 3.41Å; W173-K177 PolarHBondContact O-N 3.39Å; F174-K177 PolarHBondContact O-N 3.2Å; K177-S179 PolarHBondContact O-N 3.18Å; K177-K180 PolarHBondContact O-N 3.37Å; K177-F181 WeakPolarHBondContact O-CB 3.49Å; K177-F181 PolarHBondContact O-N 2.98Å
178R98Very high94Very high71 Ų7184.5 Ų84.527%0.26843%0.434SS..Hα-helixtrans-60.9-41.8175.2-74-170.6-76.3136-5.8112.6F145 Q149 Y150 F174 K180 F181 K182F145-R178 HydrophobicContact CE2-CG 3.68Å; F145-R178 HydrophobicContact CZ-CG 4.07Å; Q149-R178 VanDerWaalsContact O-CD 3.28Å; Q149-R178 WeakPolarHBondContact O-CD 3.4Å; Y150-R178 VanDerWaalsContact CZ-NH1 3.27Å; Y150-R178 PolarHBondContact OH-NH1 2.98Å; F174-R178 WeakPolarHBondContact O-CG 3.4Å; F174-R178 PolarHBondContact O-N 3Å; R178-K180 PolarHBondContact O-N 2.9Å; R178-F181 PolarHBondContact O-N 3.43Å; R178-K182 WeakPolarHBondContact O-CB 3.39Å; R178-K182 PolarHBondContact O-N 3.49Å
179S98.1Very high92.2Very high71 Ų7182 Ų8250%0.49743%0.426SS..Hα-helixtrans-62-44.5178-60.40000111.7Q175 N176 K177 K183Q175-S179 WeakPolarHBondContact O-CB 3.4Å; Q175-S179 PolarHBondContact O-N 2.87Å; Q175-S179 PolarHBondContact O-OG 3.3Å; N176-S179 PolarHBondContact O-N 3.36Å; K177-S179 PolarHBondContact O-N 3.18Å; S179-K183 WeakPolarHBondContact O-CB 3.38Å; S179-K183 PolarHBondContact O-N 3.49Å
180K96.4Very high89.9Confident138 Ų13887 Ų8760%0.645%0.454SS*.Hα-helixtrans-62.4-46.6174.5-174.5177.9179.3-1800111.3N176 K177 R178 K182 K183 L184N176-K180 PolarHBondContact O-N 3.02Å; K177-K180 PolarHBondContact O-N 3.37Å; R178-K180 PolarHBondContact O-N 2.9Å; K180-K182 PolarHBondContact O-N 3.19Å; K180-K183 WeakPolarHBondContact O-CB 3.5Å; K180-K183 PolarHBondContact O-N 3.05Å; K180-L184 HydrophobicContact CG-CD1 4.25Å; K180-L184 WeakPolarHBondContact O-CG 3.46Å; K180-L184 PolarHBondContact O-N 3.3Å
181F95.1Very high87.8Confident61 Ų6191 Ų9127%0.26848%0.48SS..Hα-helixtrans-59.7-47.5179.6-176.5-108.1000112.2F145 K177 R178 K183 L184 L185F145-F181 HydrophobicContact CZ-CB 4.41Å; K177-F181 WeakPolarHBondContact O-CB 3.49Å; K177-F181 PolarHBondContact O-N 2.98Å; R178-F181 PolarHBondContact O-N 3.43Å; F181-K183 VanDerWaalsContact C-N 3.3Å; F181-K183 PolarHBondContact O-N 3.49Å; F181-L184 PolarHBondContact O-N 3.36Å; F181-L185 HydrophobicContact CD1-CD1 3.64Å; F181-L185 HydrophobicContact CE1-CD1 3.31Å; F181-L185 HydrophobicContact CE1-CG 4.23Å; F181-L185 HydrophobicContact CG-CD1 4.37Å; F181-L185 HydrophobicContact CZ-CD1 3.8Å; F181-L185 HydrophobicContact CZ-CD2 4.43Å; F181-L185 HydrophobicContact CZ-CG 4.27Å; F181-L185 PolarHBondContact O-N 3.07Å
182K95.8Very high85.6Confident150 Ų15094.1 Ų94.165%0.65250%0.496SS*.Hα-helixtrans-58.8-41.1174.8-174.6-179.267.7173.10112.2R178 K180 L184 K186R178-K182 WeakPolarHBondContact O-CB 3.39Å; R178-K182 PolarHBondContact O-N 3.49Å; K180-K182 PolarHBondContact O-N 3.19Å; K182-L184 VanDerWaalsContact C-N 3.34Å; K182-K186 WeakPolarHBondContact O-CB 3.49Å; K182-K186 PolarHBondContact O-N 3.14Å; K182-K186 VanDerWaalsContact O-N 3.14Å
183K94.6Very high83Confident165 Ų16599.3 Ų99.372%0.71752%0.518SS*.Hα-helixtrans-63.7-40.2177.9-174178176.9-179.80111.6S179 K180 F181 A187S179-K183 WeakPolarHBondContact O-CB 3.38Å; S179-K183 PolarHBondContact O-N 3.49Å; K180-K183 WeakPolarHBondContact O-CB 3.5Å; K180-K183 PolarHBondContact O-N 3.05Å; F181-K183 VanDerWaalsContact C-N 3.3Å; F181-K183 PolarHBondContact O-N 3.49Å; K183-A187 WeakPolarHBondContact O-CB 3.38Å; K183-A187 PolarHBondContact O-N 3.36Å
184L91.6Very high80.4Confident79 Ų79104 Ų10441%0.41456%0.555SS.*Hα-helixtrans-66-45.9178.2-68.6169.8000111.8K180 F181 K182 K186 A187 G189K180-L184 HydrophobicContact CG-CD1 4.25Å; K180-L184 WeakPolarHBondContact O-CG 3.46Å; K180-L184 PolarHBondContact O-N 3.3Å; F181-L184 PolarHBondContact O-N 3.36Å; K182-L184 VanDerWaalsContact C-N 3.34Å; L184-K186 VanDerWaalsContact C-N 3.31Å; L184-K186 PolarHBondContact O-N 3.22Å; L184-A187 PolarHBondContact O-N 3.45Å; L184-A187 VanDerWaalsContact O-N 3.12Å; L184-G189 PolarHBondContact O-N 3.49Å
185L89.4Confident77.5Confident101 Ų101109 Ų10953%0.52958%0.583SS.*Hα-helixtrans-58.1-41.4176.4-74.2163.3000112.8F181 A187F181-L185 HydrophobicContact CD1-CD1 3.64Å; F181-L185 HydrophobicContact CE1-CD1 3.31Å; F181-L185 HydrophobicContact CE1-CG 4.23Å; F181-L185 HydrophobicContact CG-CD1 4.37Å; F181-L185 HydrophobicContact CZ-CD1 3.8Å; F181-L185 HydrophobicContact CZ-CD2 4.43Å; F181-L185 HydrophobicContact CZ-CG 4.27Å; F181-L185 PolarHBondContact O-N 3.07Å; L185-A187 VanDerWaalsContact C-N 3.28Å; L185-A187 PolarHBondContact O-N 3.12Å
186K84Confident75.3Confident194 Ų194110.9 Ų110.984%0.84360%0.602SS**Hα-helixtrans-70.8-24.5179.8-164.182.1156.9172.40112.7K182 L184 G188K182-K186 WeakPolarHBondContact O-CB 3.49Å; K182-K186 PolarHBondContact O-N 3.14Å; K182-K186 VanDerWaalsContact O-N 3.14Å; L184-K186 VanDerWaalsContact C-N 3.31Å; L184-K186 PolarHBondContact O-N 3.22Å; K186-G188 VanDerWaalsContact C-N 3.33Å
187A81.5Confident72.6Confident80 Ų80110.5 Ų110.566%0.66160%0.604SS**THydrogen-bonded Turntrans-89.98.7-176.900000113.6K183 L184 L185 G189K183-A187 WeakPolarHBondContact O-CB 3.38Å; K183-A187 PolarHBondContact O-N 3.36Å; L184-A187 PolarHBondContact O-N 3.45Å; L184-A187 VanDerWaalsContact O-N 3.12Å; L185-A187 VanDerWaalsContact C-N 3.28Å; L185-A187 PolarHBondContact O-N 3.12Å; A187-G189 PolarHBondContact O-N 3.27Å
188G67.6Low70Confident71 Ų71115.1 Ų115.173%0.73263%0.628SS**THydrogen-bonded Turntrans69.97.1179.600000114.6K186 N190K186-G188 VanDerWaalsContact C-N 3.33Å; G188-N190 PolarHBondContact O-N 3.3Å
189G59.3Low67.7Low37 Ų37118 Ų11838%0.38166%0.656SS.*  trans-83103.1179.100000110.6L184 A187 P191L184-G189 PolarHBondContact O-N 3.49Å; A187-G189 PolarHBondContact O-N 3.27Å; G189-P191 WeakPolarHBondContact O-CD 3.39Å
190N49.7Very low65Low150 Ų150119.4 Ų119.480%0.80267%0.666SS**  trans-53.3120166.8-117.6-27.5000108.9G188 H192G188-N190 PolarHBondContact O-N 3.3Å; N190-H192 PolarHBondContact O-N 3.18Å
191P55Low62.9Low86 Ų86117.9 Ų117.956%0.55867%0.673SS**SBendtrans-85.116.4-178.533.8-32.8000112.9G189G189-P191 WeakPolarHBondContact O-CD 3.39Å
192H52.6Low60.8Low160 Ų160122 Ų12274%0.74170%0.696SS**  trans-140.988.1-173.7-160.577000110N190N190-H192 PolarHBondContact O-N 3.18Å
193E42.2Very low58.7Low185 Ų185118.6 Ų118.686%0.86470%0.704SS**  trans-170.298.4144.9-107.3179.8166.500108.1
194S43.9Very low56.5Low126 Ų126117.7 Ų117.788%0.88171%0.706SS**  trans-108.778.2157.956.10000106.4
195D38.3Very low54.4Low115 Ų115118.1 Ų118.162%0.61572%0.715SS**  trans-102.8120.4159.5-171.717.6000107.1T197D195-T197 PolarHBondContact O-N 3.04Å; D195-T197 VanDerWaalsContact O-N 3.08Å
196P52.1Low52.5Low121 Ų121120 Ų12079%0.78673%0.733SS**  trans-87.257.2-175.936.4-33.8000110.6
197T42.4Very low50.9Low95 Ų95121.8 Ų121.858%0.58374%0.735SS**SBendtrans-141.8125160.858.90000110.4D195D195-T197 PolarHBondContact O-N 3.04Å; D195-T197 VanDerWaalsContact O-N 3.08Å
198M42.6Very low49.5Very low161 Ų161122.4 Ų122.479%0.79374%0.735SS**  trans98.4121.3170.4-52.3-57.3-175.500118S200M198-S200 PolarHBondContact O-N 3.38Å; M198-S200 VanDerWaalsContact O-N 3.17Å
199P48.7Very low49.1Very low132 Ų132124.9 Ų124.986%0.85774%0.738SS**  trans-82.285.9168.534-30.3000109.6S201P199-S201 PolarHBondContact O-N 3.08Å; P199-S201 VanDerWaalsContact O-N 3.15Å
200S43Very low49.1Very low101 Ų101127.9 Ų127.971%0.70676%0.759SS**  trans-81.195.2171.5-74.70000110.5M198 I202M198-S200 PolarHBondContact O-N 3.38Å; M198-S200 VanDerWaalsContact O-N 3.17Å; S200-I202 PolarHBondContact O-N 3.01Å
201S50.6Low49.8Very low106 Ų106128.2 Ų128.274%0.74176%0.759SS**  trans25.492.4136.843.60000116.3P199 G203P199-S201 PolarHBondContact O-N 3.08Å; P199-S201 VanDerWaalsContact O-N 3.15Å; S201-G203 PolarHBondContact O-N 3.15Å; S201-G203 VanDerWaalsContact O-N 3.1Å
202I52.8Low50.2Low147 Ų147128.8 Ų128.875%0.75476%0.763SS**  trans-57.1115.5154-62.1172.9000106.5S200 L204S200-I202 PolarHBondContact O-N 3.01Å; I202-L204 VanDerWaalsContact C-N 3.34Å; I202-L204 HydrophobicContact CG2-CD2 4.26Å; I202-L204 PolarHBondContact O-N 3.17Å
203G50.9Low50.8Low79 Ų79125.1 Ų125.181%0.81475%0.753SS**  trans-58.695.417400000110.3S201S201-G203 PolarHBondContact O-N 3.15Å; S201-G203 VanDerWaalsContact O-N 3.1Å
204L47.7Very low51.7Low146 Ų146124.7 Ų124.776%0.76476%0.755SS**  trans-89.7125.3169.2-65.2175.3000108I202I202-L204 VanDerWaalsContact C-N 3.34Å; I202-L204 HydrophobicContact CG2-CD2 4.26Å; I202-L204 PolarHBondContact O-N 3.17Å
205S48.7Very low52.7Low87 Ų87128.1 Ų128.161%0.60875%0.749SS**  trans-35.1137163.1-178.80000111.7R207S205-R207 PolarHBondContact O-N 3.38Å
206P48.9Very low53.1Low141 Ų141128 Ų12892%0.91675%0.748SS**SBendtrans-71.315.2-168.528.4-33.6000114.8
207R51.4Low53.3Low231 Ų231129 Ų12987%0.87275%0.752SS**  trans-143.767.4-176-167.4173.8153177.5-6.1111.4S205S205-R207 PolarHBondContact O-N 3.38Å
208S50.7Low53.1Low94 Ų94129.2 Ų129.266%0.65776%0.757SS**SBendtrans-143.4134161.6-71.20000109.2A210S208-A210 PolarHBondContact O-N 3.1Å
209P60.7Low53.5Low122 Ų122126.5 Ų126.579%0.79276%0.76SS**PPolyproline II helixtrans-64.7135.6178.226.9-31.4000109.3I211P209-I211 PolarHBondContact O-N 2.84Å
210A58Low53Low101 Ų101124.9 Ų124.984%0.83575%0.752SS**PPolyproline II helixtrans-58.7123-179.600000110.3S208S208-A210 PolarHBondContact O-N 3.1Å
211I64.3Low53.1Low157 Ų157125.2 Ų125.281%0.80575%0.754SS**PPolyproline II helixtrans-86.7119.7171.1-54.8173000106.5P209P209-I211 PolarHBondContact O-N 2.84Å
212P64.5Low52.6Low98 Ų98130.2 Ų130.264%0.63676%0.763SS**PPolyproline II helixtrans-69.4150.4176.728.4-33.1000110.9I214P212-I214 PolarHBondContact O-N 3.41Å
213P65.3Low52.2Low83 Ų83127 Ų12754%0.53977%0.766SS.*PPolyproline II helixtrans-60.5133.117625.4-32.6000110.5W215P213-W215 PolarHBondContact O-N 2.87Å
214I60.1Low51.6Low175 Ų175128.8 Ų128.890%0.89776%0.76SS**THydrogen-bonded Turntrans-68.29.3-167.968160.1000115.9P212P212-I214 PolarHBondContact O-N 3.41Å
215W66.3Low51.7Low199 Ų199129.2 Ų129.275%0.75476%0.764SS**THydrogen-bonded Turntrans-109.3-6.1-175.364-97.2000114.2P213 V217P213-W215 PolarHBondContact O-N 2.87Å; W215-V217 PolarHBondContact O-N 3.22Å
216D45.9Very low51.4Low111 Ų111132.8 Ų132.859%0.59477%0.773SS**  trans-92.275.5177.1-141.2-49.3000110.6S218D216-S218 PolarHBondContact O-N 2.97Å
217V55.2Low51Low144 Ų144130.6 Ų130.687%0.87377%0.767SS**  trans-8991.4161.5125.80000106.8W215W215-V217 PolarHBondContact O-N 3.22Å
218S40.1Very low50.8Low99 Ų99124.2 Ų124.269%0.69276%0.763SS**  trans-109.294.9163.6-152.10000107.4D216 S220D216-S218 PolarHBondContact O-N 2.97Å; S218-S220 PolarHBondContact O-N 2.79Å; S218-S220 VanDerWaalsContact O-N 3.11Å
219A50.4Low50.5Low103 Ų103127.8 Ų127.885%0.85178%0.775SS**  trans-65.7104.7170.800000108.6
220S37Very low49.3Very low99 Ų99125.2 Ų125.269%0.69277%0.771SS**  trans-152.394.1161.2-160.80000111.1S218S218-S220 PolarHBondContact O-N 2.79Å; S218-S220 VanDerWaalsContact O-N 3.11Å
221S46.3Very low48.5Very low107 Ų107131.1 Ų131.175%0.74877%0.773SS**  41100.1129.5-450000118.3
222K39.5Very low47.7Very low212 Ų212131.6 Ų131.692%0.92277%0.774SS**  -177.8131.5124.3-99.5165.3-176.1179.20110.2
223G45.2Very low46.9Very low80 Ų80131.4 Ų131.483%0.82577%0.772SS**  trans-66.2146.5-165.800000114.8
224V38.4Very low45.8Very low115 Ų115129.9 Ų129.970%0.69777%0.772SS**  trans-140.9121.7151.9-160.80000107.5M226V224-M226 HydrophobicContact CB-CE 4.5Å; V224-M226 HydrophobicContact CG1-CE 3.68Å; V224-M226 PolarHBondContact O-N 3.48Å
225N48.7Very low45.3Very low156 Ų156131.8 Ų131.883%0.83477%0.769SS**  trans-61117.1173-174.1-58.5000108.8
226M43.2Very low44.4Very low162 Ų162127.5 Ų127.580%0.79877%0.769SS**  trans-134.4128.9171.5-65.7-67.5174.300109V224V224-M226 HydrophobicContact CB-CE 4.5Å; V224-M226 HydrophobicContact CG1-CE 3.68Å; V224-M226 PolarHBondContact O-N 3.48Å
227A39.3Very low44.5Very low95 Ų95130.4 Ų130.479%0.78578%0.779SS**  trans-63150.6-164.400000115.1N229A227-N229 PolarHBondContact O-N 3.27Å
228A47.1Very low44.4Very low96 Ų96134.3 Ų134.379%0.79378%0.779SS**SBendtrans-66106.2171.100000111.3
229N44.3Very low44.6Very low169 Ų169140 Ų14090%0.90479%0.786SS**  trans170.2105.1140.7-96.7-18.4000108.9A227A227-N229 PolarHBondContact O-N 3.27Å
230G37Very low44.2Very low69 Ų69141 Ų14171%0.71179%0.787SS**  trans177.390178.600000110.6M232G230-M232 PolarHBondContact O-N 3.48Å
231Y41.3Very low44.4Very low224 Ų224140.6 Ų140.688%0.87878%0.784SS**  trans-59.696.5178.5-155.1-96.7000110.2
232M46.5Very low44.6Very low167 Ų167141.2 Ų141.282%0.82379%0.786SS**  trans-87.1122.7164.5-80.6-92.792.700108.2G230 G234G230-M232 PolarHBondContact O-N 3.48Å; M232-G234 PolarHBondContact O-N 3.22Å
233P49Very low44.9Very low94 Ų94139.3 Ų139.361%0.6178%0.78SS**  trans-70.9101.1170.6-11.126.8000108.8Y235P233-Y235 PolarHBondContact O-N 3.11Å
234G42.1Very low44.9Very low51 Ų51144.1 Ų144.153%0.52678%0.781SS.*  trans-66.9119.517700000112M232 S236M232-G234 PolarHBondContact O-N 3.22Å; G234-S236 PolarHBondContact O-N 3.34Å
235Y49.5Very low45.1Very low216 Ų216148.4 Ų148.485%0.84779%0.793SS**  trans-78.662.6163.3-63.8-86.1000110P233P233-Y235 PolarHBondContact O-N 3.11Å
236S45.8Very low45.4Very low108 Ų108146.4 Ų146.476%0.75579%0.787SS**  trans-132.373.6173-74.40000109.8G234G234-S236 PolarHBondContact O-N 3.34Å
237H49.3Very low45.7Very low172 Ų172147.3 Ų147.380%0.79679%0.791SS**  trans-135.49.2171-67.6101.5000113.5
238W53.4Low46.3Very low227 Ų227151.9 Ų151.986%0.8680%0.796SS**SBendtrans-86.2-9.9-174.1-72.8100.7000115.5
239Y43.9Very low46.6Very low218 Ų218162.5 Ų162.586%0.85582%0.816SS**  trans-150.7114167.6-100.4-89.9000110.3
240S42.1Very low46.7Very low125 Ų125162.2 Ų162.287%0.87481%0.811SS**  trans-126.494.2160.3-142.90000106.6
241S40.1Very low47.2Very low89 Ų89167.1 Ų167.162%0.62282%0.817SS**  trans-73.4135.9169.6-74.30000109.5
242P51.1Low47.5Very low121 Ų121163.9 Ų163.979%0.78681%0.813SS**  trans-90.5108.3169.133.2-25.4000108.9
243H45.3Very low47.6Very low172 Ų172163.7 Ų163.780%0.79681%0.813SS**  trans-140.4105160.2-92.2-63.8000108.5
244Q45.6Very low47.5Very low181 Ų181168.1 Ų168.185%0.84683%0.825SS**  trans171.6112.6131-95.7168.57500109.4
245E42.1Very low47.9Very low204 Ų204175.9 Ų175.995%0.95385%0.845SS**  trans-125112142.8-148.4176.4139.100106.8
246T55.1Low47.8Very low114 Ų114173 Ų17370%0.69985%0.845SS**PPolyproline II helixtrans-86.7144.7-179.1-57.90000108.8
247M50.2Low47.9Very low182 Ų182178 Ų17890%0.89785%0.852SS**PPolyproline II helixtrans-52150.1-170.6-65.116112600116.7
248Q52.5Low47.8Very low190 Ų190178.5 Ų178.589%0.88886%0.857SS**PPolyproline II helixtrans-49.6146.7160.4-78.5163.4-13.600113.7
249R52.3Low47.3Very low319 Ų319174.1 Ų174.1100%1.20486%0.856SS**  trans-138.20131.4-97.7-165.3173.7170.6-0.6109.8

Retrieved 249 of 249 residues in 811.1 ms (Link to these results)