G4LYH0_SCHMA Loading...

BHLH domain-containing protein

AlphaFold DB , UniProt , Accession G4LYH0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 243 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M43.4Very low43.3Very low250 Ų250159.6 Ų159.6100%1.23281%0.81SS**  094.80-78.7-160-108.400106.1
2E40.6Very low42.8Very low175 Ų175158.4 Ų158.482%0.81881%0.805SS**  trans-77.4132.7175.3-66170.615000108.1
3E41.8Very low42.5Very low193 Ų193160.2 Ų160.290%0.90281%0.805SS**  trans-122.6107.4154-99.4-174.9175.200108.4
4I44.1Very low42.3Very low122 Ų122156 Ų15663%0.62679%0.792SS**  trans-66.4135.8170-67.3153.4000108.5
5Y49.5Very low42.5Very low203 Ų203150.3 Ų150.380%0.79678%0.777SS**  trans-144.585.7150.7-104-79000109.1I7Y5-I7 HydrophobicContact CD1-CD1 4.25Å; Y5-I7 HydrophobicContact CD1-CG1 4.1Å
6D42.7Very low42.6Very low134 Ų134150.2 Ų150.272%0.71778%0.777SS**  trans-68.8131.3150.6-78.5-45.8000108.3
7I57Low42.8Very low152 Ų152148.4 Ų148.478%0.77977%0.774SS**  trans-127.884.7163-58176.6000106.2Y5Y5-I7 HydrophobicContact CD1-CD1 4.25Å; Y5-I7 HydrophobicContact CD1-CG1 4.1Å
8D41Very low43.3Very low134 Ų134147.2 Ų147.272%0.71777%0.774SS**  trans-71.6156.3159.1-84-30.5000110.6
9E43.2Very low43.2Very low172 Ų172145.5 Ų145.580%0.80477%0.771SS**  trans57.599.4144.8-73.8-74.9154.200117.3
10S40.5Very low43.4Very low100 Ų100144.1 Ų144.170%0.69977%0.773SS**  -176123.2112.939.80000112.6L12S10-L12 PolarHBondContact O-N 3.43Å; S10-L12 VanDerWaalsContact O-N 3.12Å
11C32.6Very low43.6Very low121 Ų121146.2 Ų146.282%0.81878%0.778SS**  trans-54.4102.8159.9-170.80000110.2
12L37.3Very low43.2Very low145 Ų145141.9 Ų141.976%0.75976%0.76SS**  trans-95.792.3164.7-126.288.9000109.7S10 T14S10-L12 PolarHBondContact O-N 3.43Å; S10-L12 VanDerWaalsContact O-N 3.12Å; L12-T14 PolarHBondContact O-N 3.12Å
13F39Very low43.3Very low182 Ų182140.9 Ų140.980%0.79876%0.759SS**  trans-74.795.8159.3-171.5-91.9000107.6A15F13-A15 HydrophobicContact CE1-CB 4.31Å
14T40.1Very low43.2Very low101 Ų101136.9 Ų136.962%0.6275%0.747SS**  trans-96.2101.2171-51.80000109.1L12L12-T14 PolarHBondContact O-N 3.12Å
15A44.4Very low43Very low70 Ų70140 Ų14058%0.57976%0.759SS**  trans-70.5124.1159.500000108.3F13 T17F13-A15 HydrophobicContact CE1-CB 4.31Å; A15-T17 PolarHBondContact O-N 3.1Å
16I44.6Very low42.4Very low149 Ų149135.6 Ų135.676%0.76476%0.758SS**  trans-87.4108.6170.8-61.2174.6000107.2T18I16-T18 HydrophobicContact CG2-CG2 4.1Å
17T46.4Very low42.4Very low119 Ų119138 Ų13873%0.7377%0.765SS**  trans-99.2115.5163.7-58.20000107.5A15 T19A15-T17 PolarHBondContact O-N 3.1Å; T17-T19 HydrophobicContact CG2-CG2 4.35Å
18T51.1Low41.8Very low127 Ų127139.5 Ų139.578%0.77977%0.766SS**  trans-95118.7169.543.70000109.5I16I16-T18 HydrophobicContact CG2-CG2 4.1Å
19T40.7Very low41.5Very low115 Ų115138.6 Ų138.671%0.70676%0.761SS**  trans-129.4130161.2570000107T17T17-T19 HydrophobicContact CG2-CG2 4.35Å
20S48.3Very low41.4Very low117 Ų117137 Ų13782%0.81876%0.758SS**  trans-160.2101169-69.40000105.4
21H46.6Very low41.6Very low190 Ų190138.9 Ų138.988%0.8876%0.76SS**  61.8111.183.7-95.8-74.1000115.4
22D35.8Very low42.3Very low158 Ų158140.4 Ų140.485%0.84576%0.76SS**  trans-67.1140169.5-80.8-53.3000113.3
23I42.6Very low42.7Very low155 Ų155140.8 Ų140.880%0.79576%0.762SS**  trans-142.5105.6159.5-65.3-173.9000110.8
24T40Very low43.1Very low109 Ų109138.3 Ų138.367%0.66976%0.756SS**  trans49.1121.5142.658.70000124.4
25Q38.8Very low42.9Very low187 Ų187141.3 Ų141.387%0.87477%0.767SS**  44.4118.9125.4-55-176.129.100120.1
26S37.3Very low42.7Very low110 Ų110146.4 Ų146.477%0.76978%0.777SS**  -177.7124.3117-164.70000112.8
27Q43.3Very low43Very low184 Ų184144.7 Ų144.786%0.8678%0.775SS**  trans47.9106.3146.1-62.5-160.3-32.800123.6
28K44.5Very low42.6Very low184 Ų184142.4 Ų142.480%0.878%0.775SS**  trans8.5131.2130.2-95.7-170161.71690121.3
29N33.7Very low42.2Very low115 Ų115143.9 Ų143.962%0.61578%0.777SS**  trans88.8105133.7-59-7.3000119
30N42.7Very low42.4Very low138 Ų138146.5 Ų146.574%0.73878%0.778SS**  158.3124102.3-77.8-38.1000109.8
31D44.8Very low41.7Very low141 Ų141146.3 Ų146.375%0.75478%0.776SS**  trans40138.5145-49.9-34.1000121.3
32D45.5Very low41.1Very low152 Ų152144.1 Ų144.181%0.81377%0.766SS**  trans84.6103.8177.4-53.1-28.6000115
33L46.9Very low41Very low153 Ų153143.2 Ų143.280%0.80177%0.766SS**  167.7109.3118-81.1164.2000110.9
34I46.1Very low40.6Very low131 Ų131140.5 Ų140.567%0.67276%0.761SS**  trans58.8102.3134.9-42.2178.5000117.5F36I34-F36 HydrophobicContact CG2-CD2 4.47Å; I34-F36 HydrophobicContact CG2-CE2 4.15Å; I34-F36 PolarHBondContact O-N 2.69Å
35L37.1Very low40.3Very low163 Ų163146.3 Ų146.385%0.85377%0.772SS**  trans-52.5112.4164-178.570.6000112.8
36F40.2Very low40.2Very low178 Ų178143.7 Ų143.778%0.78176%0.764SS**  trans-114.9133.8150.2-78.6-80.4000108.8I34 G38I34-F36 HydrophobicContact CG2-CD2 4.47Å; I34-F36 HydrophobicContact CG2-CE2 4.15Å; I34-F36 PolarHBondContact O-N 2.69Å; F36-G38 PolarHBondContact O-N 3.26Å; F36-G38 VanDerWaalsContact O-N 3.17Å
37P51.1Low40.4Very low113 Ų113150.2 Ų150.273%0.73477%0.772SS**  trans-69.2117.4-17227.4-31.2000110I39P37-I39 PolarHBondContact O-N 3.07Å
38G37.6Very low40.4Very low70 Ų70150.1 Ų150.172%0.72277%0.769SS**  trans-58.6122.9173.400000110.9F36 K40F36-G38 PolarHBondContact O-N 3.26Å; F36-G38 VanDerWaalsContact O-N 3.17Å; G38-K40 VanDerWaalsContact C-N 3.35Å; G38-K40 PolarHBondContact O-N 3.37Å
39I42.4Very low40.2Very low158 Ų158150.3 Ų150.381%0.8177%0.769SS**  trans-65.9100.2165.1-62.9172.7000106.4P37 C41P37-I39 PolarHBondContact O-N 3.07Å; I39-C41 PolarHBondContact O-N 2.9Å; I39-C41 VanDerWaalsContact O-N 3.17Å
40K46Very low40.6Very low171 Ų171151.4 Ų151.474%0.74378%0.775SS**  trans-74.1101.9173.9-148.5176.6-173.5-168.60107.5G38 E42G38-K40 VanDerWaalsContact C-N 3.35Å; G38-K40 PolarHBondContact O-N 3.37Å; K40-E42 HydrophobicContact CG-CG 4.49Å; K40-E42 IonicContact NZ-OE1 3.2Å; K40-E42 PolarHBondContact O-N 3.19Å
41C33.5Very low40.6Very low113 Ų113151.4 Ų151.476%0.76478%0.776SS**  trans-71.585.5166.6-66.20000108.2I39 T43I39-C41 PolarHBondContact O-N 2.9Å; I39-C41 VanDerWaalsContact O-N 3.17Å; C41-T43 PolarHBondContact O-N 2.93Å; C41-T43 VanDerWaalsContact O-N 3.1Å
42E33Very low40.9Very low144 Ų144151.2 Ų151.267%0.67377%0.774SS**  trans-72101.2168.6-86.2-178.7176.100109.4K40 S44K40-E42 HydrophobicContact CG-CG 4.49Å; K40-E42 IonicContact NZ-OE1 3.2Å; K40-E42 PolarHBondContact O-N 3.19Å; E42-S44 PolarHBondContact O-N 2.66Å; E42-S44 VanDerWaalsContact O-N 3.08Å
43T33.2Very low41Very low139 Ų139152 Ų15285%0.85378%0.777SS**  trans-62.298.3153.853.30000107.6C41C41-T43 PolarHBondContact O-N 2.93Å; C41-T43 VanDerWaalsContact O-N 3.1Å
44S33.9Very low40.6Very low98 Ų98153.1 Ų153.169%0.68577%0.771SS**  trans-129.1106.7172.7-165.30000111.1E42 D46E42-S44 PolarHBondContact O-N 2.66Å; E42-S44 VanDerWaalsContact O-N 3.08Å; S44-D46 PolarHBondContact O-N 3.07Å; S44-D46 VanDerWaalsContact O-N 3.14Å
45Y35Very low40.5Very low230 Ų230156.6 Ų156.690%0.90278%0.775SS**  trans-58.997.1160.2-85.9-104.4000109.4
46D35.8Very low40.7Very low132 Ų132157 Ų15771%0.70677%0.771SS**  trans161.3101.3140.9-109.6-50.5000107.8S44S44-D46 PolarHBondContact O-N 3.07Å; S44-D46 VanDerWaalsContact O-N 3.14Å
47R41.5Very low41Very low247 Ų247155.3 Ų155.393%0.93278%0.775SS**  trans-124.767.6164.1-150.3176.4-86.2-143.9-0.2108.7
48K43.1Very low41.2Very low182 Ų182155.5 Ų155.579%0.79177%0.774SS**  trans-75139156.8-87.3172.3-178.1153.90108.3
49K40.8Very low41.6Very low188 Ų188158.1 Ų158.182%0.81778%0.779SS**SBendtrans79.8129.3170.8-135.3170.6-177.3178.50112.6
50N42.2Very low41.8Very low138 Ų138158.8 Ų158.874%0.73878%0.783SS**  trans118.212.8165.9-47.7-12000116.9L52N50-L52 PolarHBondContact O-N 2.97Å; N50-L52 VanDerWaalsContact O-N 3.12Å
51D43.5Very low41.6Very low139 Ų139156.1 Ų156.174%0.74379%0.786SS**THydrogen-bonded Turntrans-86.137178.3-127.7-4.7000114.4
52L50.4Low42.2Very low136 Ų136156.2 Ų156.271%0.71279%0.787SS**THydrogen-bonded Turntrans-120.49.8177.7-79.6171.9000114.1N50N50-L52 PolarHBondContact O-N 2.97Å; N50-L52 VanDerWaalsContact O-N 3.12Å
53L47.6Very low42.5Very low169 Ų169154.7 Ų154.789%0.88579%0.793SS**THydrogen-bonded Turntrans-107.821-175.2-99.2165.5000115
54W39.5Very low43.2Very low177 Ų177154 Ų15467%0.6779%0.793SS**THydrogen-bonded Turntrans-107.511.8161.557.5-96.9000112.5F56W54-F56 HydrophobicContact CE3-CE2 4.34Å; W54-F56 HydrophobicContact CZ3-CE2 4.33Å; W54-F56 PolarHBondContact O-N 2.87Å
55R42.1Very low43.3Very low204 Ų204154.8 Ų154.877%0.7780%0.799SS**  trans-65.1102.3172.3-87.8-164.9172.7-172.1-0.7110.2T57R55-T57 PolarHBondContact O-N 3.28Å
56F41.2Very low43.6Very low172 Ų172149.3 Ų149.375%0.75479%0.794SS**  trans-12.9107.9155.4-66.8-84.9000114W54 T58W54-F56 HydrophobicContact CE3-CE2 4.34Å; W54-F56 HydrophobicContact CZ3-CE2 4.33Å; W54-F56 PolarHBondContact O-N 2.87Å; F56-T58 PolarHBondContact O-N 3.11Å; F56-T58 VanDerWaalsContact O-N 3.12Å
57T47.4Very low43.7Very low141 Ų141150.7 Ų150.787%0.86580%0.801SS**  trans-66.198.7157.2-46.30000107.6R55R55-T57 PolarHBondContact O-N 3.28Å
58T54.7Low43.9Very low118 Ų118146.7 Ų146.772%0.72480%0.796SS**PPolyproline II helixtrans-87.7127.3163.347.70000108.3F56F56-T58 PolarHBondContact O-N 3.11Å; F56-T58 VanDerWaalsContact O-N 3.12Å
59P47.2Very low43.7Very low125 Ų125143.4 Ų143.481%0.81279%0.792SS**PPolyproline II helixtrans-71.7144.2176.97.35.9000110.9S61P59-S61 PolarHBondContact O-N 3.28Å
60L45.9Very low43.5Very low172 Ų172140 Ų14090%0.90179%0.787SS**PPolyproline II helixtrans-56.4122.4177-167.969.6000111.2S62L60-S62 PolarHBondContact O-N 3.02Å
61S41Very low44Very low115 Ų115140 Ų14080%0.80479%0.792SS**  trans-82112.5169.673.10000109.9P59P59-S61 PolarHBondContact O-N 3.28Å
62S48.1Very low43.7Very low114 Ų114139.2 Ų139.280%0.79780%0.798SS**  trans-79.7127.4160.746.90000109.6L60L60-S62 PolarHBondContact O-N 3.02Å
63S38.1Very low43.7Very low113 Ų113141.1 Ų141.179%0.7980%0.803SS**  trans-41138.4172.9-45.80000114.2
64S48.2Very low43.4Very low123 Ų123138.1 Ų138.186%0.8680%0.796SS**  trans-174.3126.1133.2-79.60000111.4
65S36.2Very low43.7Very low115 Ų115137.5 Ų137.580%0.80480%0.804SS**  trans-67.4138.8180-40.80000112.6
66S41Very low44Very low115 Ų115133.8 Ų133.880%0.80481%0.805SS**  trans176.4126.1131.934.10000112.5
67L39Very low43.8Very low161 Ų161131.5 Ų131.584%0.84381%0.809SS**  trans-14.9135.4154.2-55.7150.4000114.9
68I44.1Very low43.8Very low163 Ų163132.4 Ų132.484%0.83681%0.807SS**  171.8125.2108.827.9152.6000113.5
69T39.7Very low43.4Very low114 Ų114133.6 Ų133.670%0.69981%0.809SS**  trans70.298.6131.4-46.10000122.4
70T37.1Very low43.2Very low117 Ų117138.2 Ų138.272%0.71881%0.81SS**  trans41.1117.3135.964.30000121.1
71T51.5Low43.2Very low136 Ų136137 Ų13783%0.83480%0.8SS**  -170.9132.7126.122.50000109.5H73T71-H73 PolarHBondContact O-N 2.53Å
72S37.6Very low43.2Very low124 Ų124138.5 Ų138.587%0.86779%0.794SS**  trans-87.499.1-159.9-43.90000112.5
73H50.8Low43.2Very low176 Ų176142 Ų14282%0.81580%0.795SS**  trans-119.1119.4168.7-78.1-136.7000109.8T71 L75T71-H73 PolarHBondContact O-N 2.53Å; H73-L75 PolarHBondContact O-N 2.81Å
74S41.6Very low43.5Very low106 Ų106141.8 Ų141.874%0.74179%0.794SS**  trans-50.3107.4-174.3-172.90000113.5
75L45.5Very low43.5Very low163 Ų163143 Ų14385%0.85379%0.79SS**  trans-121.666166-66.4178.6000109.1H73H73-L75 PolarHBondContact O-N 2.81Å
76T47.6Very low43.9Very low127 Ų127141.3 Ų141.378%0.77978%0.784SS**  trans-112.280.6172.836.70000110
77C37Very low44.1Very low123 Ų123144.5 Ų144.583%0.83179%0.785SS**  trans-130.444.516262.80000111.6N79C77-N79 PolarHBondContact O-N 3.07Å
78L47.9Very low44.4Very low160 Ų160141 Ų14184%0.83878%0.775SS**  trans-85.880.3163.8-83.8157.7000109.2R80L78-R80 PolarHBondContact O-N 3.05Å
79N47.6Very low44.7Very low143 Ų143143.3 Ų143.377%0.76577%0.773SS**  trans-75.369.8166.9-117.5-29000109.5C77 H81C77-N79 PolarHBondContact O-N 3.07Å; N79-H81 PolarHBondContact O-N 2.85Å; N79-H81 PolarHBondContact OD1-CD2 3.5Å; N79-H81 VanDerWaalsContact OD1-CD2 3.3Å
80R41.6Very low45.1Very low222 Ų222146.2 Ų146.284%0.83878%0.784SS**  trans-88.365.8163.1-173.6-174.4-79.5-111.31.8107.7L78 Q82L78-R80 PolarHBondContact O-N 3.05Å; R80-Q82 PolarHBondContact O-N 3.23Å
81H45.6Very low46.2Very low148 Ų148144.3 Ų144.369%0.68577%0.772SS**  trans-81.5102.2159.5-91.1-73.7000107N79N79-H81 PolarHBondContact O-N 2.85Å; N79-H81 PolarHBondContact OD1-CD2 3.5Å; N79-H81 VanDerWaalsContact OD1-CD2 3.3Å
82Q41.6Very low46.7Very low145 Ų145142.9 Ų142.968%0.67876%0.763SS**  67.674.688.6-68.3-107.377.400111.7R80R80-Q82 PolarHBondContact O-N 3.23Å
83F47.8Very low47.8Very low188 Ų188145.7 Ų145.783%0.82576%0.76SS**  trans-156.767.3148.4-76.4-63.9000110N85F83-N85 PolarHBondContact O-N 2.96Å; F83-N85 VanDerWaalsContact O-N 3.1Å
84S45.5Very low48.4Very low108 Ų108144.2 Ų144.276%0.75575%0.753SS**  trans-7967.7158.757.50000109.3A86S84-A86 PolarHBondContact O-N 3.43Å; S84-A86 VanDerWaalsContact O-N 3.1Å
85N47.9Very low49.6Very low148 Ų148144.2 Ų144.279%0.79174%0.741SS**  trans-83.473.5166-93.61.2000108.8F83 H87F83-N85 PolarHBondContact O-N 2.96Å; F83-N85 VanDerWaalsContact O-N 3.1Å; N85-H87 VanDerWaalsContact C-N 3.28Å; N85-H87 PolarHBondContact O-N 2.92Å
86A44.2Very low50.8Low80 Ų80139.3 Ų139.366%0.66172%0.718SS**  trans-89.852.1172.700000110.7S84S84-A86 PolarHBondContact O-N 3.43Å; S84-A86 VanDerWaalsContact O-N 3.1Å
87H44.4Very low52.1Low182 Ų182139.6 Ų139.684%0.84371%0.71SS**  trans-148.3123.4172.3-78.987.6000111.8N85N85-H87 VanDerWaalsContact C-N 3.28Å; N85-H87 PolarHBondContact O-N 2.92Å
88S45.2Very low54.2Low88 Ų88139.5 Ų139.562%0.61570%0.697SS**  trans91.7116.6144.5-143.80000119.1
89R50.2Low56Low212 Ų212136.3 Ų136.380%0.868%0.678SS**  trans91.3118.9143.3-71.1169.9-83.9171-4.8118.5V91R89-V91 VanDerWaalsContact O-CG2 3.31Å; R89-V91 WeakPolarHBondContact O-CG2 3.25Å; R89-V91 PolarHBondContact O-N 2.84Å
90N49.6Very low57.8Low175 Ų175135.2 Ų135.294%0.93667%0.668SS**  trans-20.387.8159-65.5-42.1000114.7
91V60.4Low60.1Low77 Ų77129.6 Ų129.647%0.46765%0.651SS.*  trans-91.6117.8171.5175.70000107.7R89 K93 H95 V96R89-V91 VanDerWaalsContact O-CG2 3.31Å; R89-V91 WeakPolarHBondContact O-CG2 3.25Å; R89-V91 PolarHBondContact O-N 2.84Å; V91-K93 PolarHBondContact O-N 3.47Å; V91-H95 HydrophobicContact CG1-CB 3.44Å; V91-H95 VanDerWaalsContact CG1-CB 3.44Å; V91-H95 WeakPolarHBondContact CG1-ND1 3.45Å; V91-V96 HydrophobicContact CB-CG2 4.3Å; V91-V96 HydrophobicContact CG1-CG2 3.87Å
92T60.3Low62.3Low106 Ų106130.2 Ų130.265%0.6565%0.648SS**  trans-51.6137.5176.952.70000110.3H94 H95T92-H94 PolarHBondContact O-N 3.41Å; T92-H95 PolarHBondContact O-N 2.93Å
93K61.8Low64.7Low182 Ų182126.6 Ų126.679%0.79163%0.633SS**Hα-helixtrans-46.5-30.2-174.5-67.1176.5-179.5172.90113.7V91 V96 Q97V91-K93 PolarHBondContact O-N 3.47Å; K93-V96 PolarHBondContact O-N 2.84Å; K93-Q97 WeakPolarHBondContact O-CG 3.38Å; K93-Q97 PolarHBondContact O-N 3.36Å; K93-Q97 VanDerWaalsContact O-N 3.14Å
94H62.8Low67Low145 Ų145119.7 Ų119.767%0.67161%0.611SS**Hα-helixtrans-63.5-44176.6-167.8-92.2000113.9T92 V96 Q97 H98T92-H94 PolarHBondContact O-N 3.41Å; H94-V96 VanDerWaalsContact C-N 3.32Å; H94-V96 PolarHBondContact O-N 2.83Å; H94-Q97 PolarHBondContact O-N 3.22Å; H94-H98 PolarHBondContact O-N 2.76Å; H94-H98 VanDerWaalsContact O-N 3.09Å
95H66.7Low69.3Low107 Ų107122.2 Ų122.250%0.49560%0.604SS.*Hα-helixtrans-70.6-31.8178.6177.1-77.1000111.6V91 T92 H98 H99V91-H95 HydrophobicContact CG1-CB 3.44Å; V91-H95 VanDerWaalsContact CG1-CB 3.44Å; V91-H95 WeakPolarHBondContact CG1-ND1 3.45Å; T92-H95 PolarHBondContact O-N 2.93Å; H95-H98 PolarHBondContact O-N 3.29Å; H95-H99 WeakPolarHBondContact O-CB 3.37Å; H95-H99 PolarHBondContact O-N 2.91Å
96V71.2Confident71.7Confident60 Ų60119.6 Ų119.636%0.36459%0.589SS.*Hα-helixtrans-62.6-46.5172.4-178.70000110.6V91 K93 H94 H98 H99 H100V91-V96 HydrophobicContact CB-CG2 4.3Å; V91-V96 HydrophobicContact CG1-CG2 3.87Å; K93-V96 PolarHBondContact O-N 2.84Å; H94-V96 VanDerWaalsContact C-N 3.32Å; H94-V96 PolarHBondContact O-N 2.83Å; V96-H98 PolarHBondContact O-N 2.94Å; V96-H99 PolarHBondContact O-N 3.27Å; V96-H100 WeakPolarHBondContact CG1-CE1 3.49Å; V96-H100 WeakPolarHBondContact CG1-ND1 3.47Å; V96-H100 PolarHBondContact O-N 3.46Å; V96-H100 PolarHBondContact O-ND1 3.39Å
97Q75.5Confident74.1Confident133 Ų133119.1 Ų119.162%0.62158%0.581SS**Hα-helixtrans-60.9-43.6176.9-72176.4-2.700112.3K93 H94 H99 H100 Q101K93-Q97 WeakPolarHBondContact O-CG 3.38Å; K93-Q97 PolarHBondContact O-N 3.36Å; K93-Q97 VanDerWaalsContact O-N 3.14Å; H94-Q97 PolarHBondContact O-N 3.22Å; Q97-H99 VanDerWaalsContact C-N 3.32Å; Q97-H99 PolarHBondContact O-N 2.7Å; Q97-H100 PolarHBondContact O-N 3.49Å; Q97-Q101 PolarHBondContact O-N 3.27Å
98H80.5Confident76.6Confident120 Ų120114.4 Ų114.456%0.55656%0.561SS**Hα-helixtrans-62-39.7176.5-173.6-100.6000112.3H94 H95 V96 Q101 R102H94-H98 PolarHBondContact O-N 2.76Å; H94-H98 VanDerWaalsContact O-N 3.09Å; H95-H98 PolarHBondContact O-N 3.29Å; V96-H98 PolarHBondContact O-N 2.94Å; H98-Q101 PolarHBondContact O-N 2.89Å; H98-R102 WeakPolarHBondContact O-CB 3.45Å; H98-R102 PolarHBondContact O-N 2.97Å
99H84.5Confident79.2Confident94 Ų94114.1 Ų114.144%0.43555%0.553SS.*Hα-helixtrans-64.6-42174.9-173-95.6000112.2H95 V96 Q97 R102 N103H95-H99 WeakPolarHBondContact O-CB 3.37Å; H95-H99 PolarHBondContact O-N 2.91Å; V96-H99 PolarHBondContact O-N 3.27Å; Q97-H99 VanDerWaalsContact C-N 3.32Å; Q97-H99 PolarHBondContact O-N 2.7Å; H99-R102 PolarHBondContact O-N 3.28Å; H99-N103 PolarHBondContact CE1-ND2 3.45Å; H99-N103 PolarHBondContact ND1-ND2 3.33Å; H99-N103 WeakPolarHBondContact O-CB 3.25Å; H99-N103 PolarHBondContact O-N 3.46Å; H99-N103 PolarHBondContact O-OD1 3.43Å
100H86.2Confident81.4Confident119 Ų119105.6 Ų105.655%0.55153%0.527SS*.Hα-helixtrans-62.2-44.3174.6-7578.9000111.6V96 Q97 R102 N103 A104V96-H100 WeakPolarHBondContact CG1-CE1 3.49Å; V96-H100 WeakPolarHBondContact CG1-ND1 3.47Å; V96-H100 PolarHBondContact O-N 3.46Å; V96-H100 PolarHBondContact O-ND1 3.39Å; Q97-H100 PolarHBondContact O-N 3.49Å; H100-R102 VanDerWaalsContact C-N 3.34Å; H100-R102 PolarHBondContact O-N 3.02Å; H100-N103 PolarHBondContact O-N 3.16Å; H100-A104 WeakPolarHBondContact O-CB 3.37Å; H100-A104 PolarHBondContact O-N 2.96Å
101Q90Very high83.8Confident105 Ų105103.5 Ų103.549%0.49151%0.507SS..Hα-helixtrans-62.9-41177.1-175.459.65100111.9Q97 H98 A104 R105Q97-Q101 PolarHBondContact O-N 3.27Å; H98-Q101 PolarHBondContact O-N 2.89Å; Q101-A104 PolarHBondContact O-N 3.32Å; Q101-R105 WeakPolarHBondContact O-CG 3.42Å; Q101-R105 PolarHBondContact O-N 2.96Å
102R91.8Very high85.6Confident160 Ų160103.5 Ų103.560%0.60450%0.501SS*.Hα-helixtrans-62-45.9174.6-176.4176-179.9156.30.3111H98 H99 H100 A104 R105 L106H98-R102 WeakPolarHBondContact O-CB 3.45Å; H98-R102 PolarHBondContact O-N 2.97Å; H99-R102 PolarHBondContact O-N 3.28Å; H100-R102 VanDerWaalsContact C-N 3.34Å; H100-R102 PolarHBondContact O-N 3.02Å; R102-A104 PolarHBondContact O-N 3.26Å; R102-R105 PolarHBondContact O-N 3.4Å; R102-L106 HydrophobicContact CG-CD1 4.16Å; R102-L106 VanDerWaalsContact O-CG 3.31Å; R102-L106 WeakPolarHBondContact O-CG 3.34Å; R102-L106 PolarHBondContact O-N 2.98Å
103N93Very high87.4Confident69 Ų69105.9 Ų105.937%0.36950%0.499SS..Hα-helixtrans-65.3-39178.8-70.4-5.9000112.3H99 H100 L106 S107H99-N103 PolarHBondContact CE1-ND2 3.45Å; H99-N103 PolarHBondContact ND1-ND2 3.33Å; H99-N103 WeakPolarHBondContact O-CB 3.25Å; H99-N103 PolarHBondContact O-N 3.46Å; H99-N103 PolarHBondContact O-OD1 3.43Å; H100-N103 PolarHBondContact O-N 3.16Å; N103-L106 PolarHBondContact O-N 3Å; N103-S107 VanDerWaalsContact O-CB 3.27Å; N103-S107 WeakPolarHBondContact O-CB 3.45Å; N103-S107 PolarHBondContact O-N 3.47Å
104A94.2Very high89.2Confident43 Ų43104 Ų10436%0.35549%0.486SS..Hα-helixtrans-60.9-46.7173.700000111.2H100 Q101 R102 L106 S107 I108H100-A104 WeakPolarHBondContact O-CB 3.37Å; H100-A104 PolarHBondContact O-N 2.96Å; Q101-A104 PolarHBondContact O-N 3.32Å; R102-A104 PolarHBondContact O-N 3.26Å; A104-L106 PolarHBondContact O-N 3.24Å; A104-S107 PolarHBondContact O-N 3.41Å; A104-I108 WeakPolarHBondContact O-CB 3.35Å; A104-I108 WeakPolarHBondContact O-CD1 3.27Å; A104-I108 VanDerWaalsContact O-CG1 3.23Å; A104-I108 WeakPolarHBondContact O-CG1 3.35Å; A104-I108 PolarHBondContact O-N 3.21Å
105R95.8Very high90.9Very high162 Ų162104.6 Ų104.661%0.61148%0.483SS*.Hα-helixtrans-58.4-47.6174.5-73.2177.2176.8-1670.8111.8Q101 R102 S107 I108 N109Q101-R105 WeakPolarHBondContact O-CG 3.42Å; Q101-R105 PolarHBondContact O-N 2.96Å; R102-R105 PolarHBondContact O-N 3.4Å; R105-S107 PolarHBondContact O-N 3.31Å; R105-I108 PolarHBondContact O-N 3.48Å; R105-N109 WeakPolarHBondContact O-CB 3.29Å; R105-N109 PolarHBondContact O-N 2.91Å; R105-N109 PolarHBondContact O-OD1 3.26Å
106L96.4Very high92.4Very high93 Ų93102.8 Ų102.849%0.48748%0.475SS..Hα-helixtrans-63.2-41.1178.7-69.2174.6000112.4R102 N103 A104 N109 A110R102-L106 HydrophobicContact CG-CD1 4.16Å; R102-L106 VanDerWaalsContact O-CG 3.31Å; R102-L106 WeakPolarHBondContact O-CG 3.34Å; R102-L106 PolarHBondContact O-N 2.98Å; N103-L106 PolarHBondContact O-N 3Å; A104-L106 PolarHBondContact O-N 3.24Å; L106-N109 PolarHBondContact O-N 3.09Å; L106-A110 WeakPolarHBondContact O-CB 3.44Å; L106-A110 PolarHBondContact O-N 3.45Å
107S96.3Very high93.7Very high70 Ų70105.2 Ų105.249%0.4948%0.483SS..Hα-helixtrans-63.9-43.1176.71780000112N103 A104 R105 A110 R111N103-S107 VanDerWaalsContact O-CB 3.27Å; N103-S107 WeakPolarHBondContact O-CB 3.45Å; N103-S107 PolarHBondContact O-N 3.47Å; A104-S107 PolarHBondContact O-N 3.41Å; R105-S107 PolarHBondContact O-N 3.31Å; S107-A110 PolarHBondContact O-N 2.94Å; S107-R111 WeakPolarHBondContact O-CB 3.31Å; S107-R111 PolarHBondContact O-N 3.42Å
108I97Very high94.8Very high82 Ų82103.9 Ų103.942%0.42148%0.48SS..Hα-helixtrans-62.3-47.3175-68.5163.8000110.6A104 R105 A110 R111 E112A104-I108 WeakPolarHBondContact O-CB 3.35Å; A104-I108 WeakPolarHBondContact O-CD1 3.27Å; A104-I108 VanDerWaalsContact O-CG1 3.23Å; A104-I108 WeakPolarHBondContact O-CG1 3.35Å; A104-I108 PolarHBondContact O-N 3.21Å; R105-I108 PolarHBondContact O-N 3.48Å; I108-A110 VanDerWaalsContact C-N 3.33Å; I108-A110 PolarHBondContact O-N 3.07Å; I108-R111 WeakPolarHBondContact O-CB 3.34Å; I108-R111 PolarHBondContact O-N 2.95Å; I108-R111 VanDerWaalsContact O-N 3.13Å; I108-E112 PolarHBondContact O-N 3.15Å
109N98.3Very high95.6Very high82 Ų82102.8 Ų102.844%0.43948%0.477SS..Hα-helixtrans-62.9-40.4178.4-68.1-5.2000111.9R105 L106 R111 E112 R113R105-N109 WeakPolarHBondContact O-CB 3.29Å; R105-N109 PolarHBondContact O-N 2.91Å; R105-N109 PolarHBondContact O-OD1 3.26Å; L106-N109 PolarHBondContact O-N 3.09Å; N109-R111 VanDerWaalsContact C-N 3.3Å; N109-R111 PolarHBondContact O-N 3.05Å; N109-E112 PolarHBondContact O-N 3.06Å; N109-R113 WeakPolarHBondContact O-CG 3.45Å; N109-R113 PolarHBondContact O-N 2.99Å
110A98.1Very high96.2Very high33 Ų33100.6 Ų100.627%0.27347%0.469SS..Hα-helixtrans-63.8-36.9175.300000111.9L106 S107 I108 R114L106-A110 WeakPolarHBondContact O-CB 3.44Å; L106-A110 PolarHBondContact O-N 3.45Å; S107-A110 PolarHBondContact O-N 2.94Å; I108-A110 VanDerWaalsContact C-N 3.33Å; I108-A110 PolarHBondContact O-N 3.07Å; A110-R114 PolarHBondContact O-N 3.11Å; A110-R114 PolarHBondContact O-NH1 2.9Å
111R98.4Very high96.8Very high132 Ų13299.3 Ų99.350%0.49847%0.466SS..Hα-helixtrans-65.8-46174.9-174.7178.467.9-108.82.8111.8S107 I108 N109 R113 R114 R115S107-R111 WeakPolarHBondContact O-CB 3.31Å; S107-R111 PolarHBondContact O-N 3.42Å; I108-R111 WeakPolarHBondContact O-CB 3.34Å; I108-R111 PolarHBondContact O-N 2.95Å; I108-R111 VanDerWaalsContact O-N 3.13Å; N109-R111 VanDerWaalsContact C-N 3.3Å; N109-R111 PolarHBondContact O-N 3.05Å; R111-R113 VanDerWaalsContact C-N 3.32Å; R111-R113 PolarHBondContact O-N 3.4Å; R111-R114 WeakPolarHBondContact O-CB 3.44Å; R111-R114 PolarHBondContact O-N 2.92Å; R111-R115 PolarHBondContact O-N 3.32Å
112E98.5Very high97.2Very high76 Ų7697 Ų9736%0.35547%0.465SS..Hα-helixtrans-65.8-36179.6-171.659.4-164.500112.1I108 N109 R114 R115 M116I108-E112 PolarHBondContact O-N 3.15Å; N109-E112 PolarHBondContact O-N 3.06Å; E112-R114 VanDerWaalsContact C-N 3.34Å; E112-R114 PolarHBondContact O-N 3.47Å; E112-R115 PolarHBondContact O-N 3.41Å; E112-R115 IonicContact OE1-NH1 3.59Å; E112-R115 PolarHBondContact OE1-NH1 2.94Å; E112-R115 WeakPolarHBondContact OE2-CD 3.28Å; E112-R115 IonicContact OE2-NH1 3.98Å; E112-M116 WeakPolarHBondContact O-CB 3.49Å; E112-M116 WeakPolarHBondContact O-CG 3.17Å; E112-M116 PolarHBondContact O-N 2.98Å
113R98.7Very high97.5Very high157 Ų15790.4 Ų90.459%0.59244%0.441SS*.Hα-helixtrans-58.1-46.1171.5-74.1-175.5-171.4111.9-2.2111.9N109 R111 M116 H117N109-R113 WeakPolarHBondContact O-CG 3.45Å; N109-R113 PolarHBondContact O-N 2.99Å; R111-R113 VanDerWaalsContact C-N 3.32Å; R111-R113 PolarHBondContact O-N 3.4Å; R113-M116 PolarHBondContact O-N 3.21Å; R113-H117 PolarHBondContact O-CD2 2.94Å; R113-H117 PolarHBondContact O-N 2.92Å
114R98.5Very high97.6Very high141 Ų14189.9 Ų89.953%0.53244%0.438SS..Hα-helixtrans-59.3-48.5175.8-73.1-171-65.4-88.12.7111.7A110 R111 E112 M116 H117 D118A110-R114 PolarHBondContact O-N 3.11Å; A110-R114 PolarHBondContact O-NH1 2.9Å; R111-R114 WeakPolarHBondContact O-CB 3.44Å; R111-R114 PolarHBondContact O-N 2.92Å; E112-R114 VanDerWaalsContact C-N 3.34Å; E112-R114 PolarHBondContact O-N 3.47Å; R114-M116 VanDerWaalsContact C-N 3.26Å; R114-M116 PolarHBondContact O-N 3.2Å; R114-H117 WeakPolarHBondContact O-CA 3.34Å; R114-H117 WeakPolarHBondContact O-CB 3.43Å; R114-H117 PolarHBondContact O-N 3.36Å; R114-D118 VanDerWaalsContact O-CG 3.31Å; R114-D118 PolarHBondContact O-N 3.38Å
115R98.6Very high97.7Very high159 Ų15993.2 Ų93.260%0.645%0.45SS*.Hα-helixtrans-55.3-41.7175.5-175.2-171.1177.1-142.32112.4R111 E112 D118 L119R111-R115 PolarHBondContact O-N 3.32Å; E112-R115 PolarHBondContact O-N 3.41Å; E112-R115 IonicContact OE1-NH1 3.59Å; E112-R115 PolarHBondContact OE1-NH1 2.94Å; E112-R115 WeakPolarHBondContact OE2-CD 3.28Å; E112-R115 IonicContact OE2-NH1 3.98Å; R115-D118 PolarHBondContact O-N 3.5Å; R115-L119 WeakPolarHBondContact O-CB 3.43Å; R115-L119 PolarHBondContact O-N 3.47Å
116M98.5Very high97.8Very high68 Ų6888 Ų8834%0.33544%0.435SS..Hα-helixtrans-69.8-30.6177.1-72.5-55.6-53.600113E112 R113 R114 L119 N120E112-M116 WeakPolarHBondContact O-CB 3.49Å; E112-M116 WeakPolarHBondContact O-CG 3.17Å; E112-M116 PolarHBondContact O-N 2.98Å; R113-M116 PolarHBondContact O-N 3.21Å; R114-M116 VanDerWaalsContact C-N 3.26Å; R114-M116 PolarHBondContact O-N 3.2Å; M116-L119 HydrophobicContact CE-CD2 4.03Å; M116-L119 HydrophobicContact SD-CD2 4.2Å; M116-N120 WeakPolarHBondContact O-CB 3.3Å; M116-N120 PolarHBondContact O-N 3.18Å; M116-N120 VanDerWaalsContact O-N 3.08Å; M116-N120 PolarHBondContact O-ND2 3.43Å
117H98.4Very high97.7Very high112 Ų11284.7 Ų84.752%0.51942%0.416SS..Hα-helixtrans-66.7-51.4170.8-72.3-62000110.8R113 R114 L119 N120 D121R113-H117 PolarHBondContact O-CD2 2.94Å; R113-H117 PolarHBondContact O-N 2.92Å; R114-H117 WeakPolarHBondContact O-CA 3.34Å; R114-H117 WeakPolarHBondContact O-CB 3.43Å; R114-H117 PolarHBondContact O-N 3.36Å; H117-L119 PolarHBondContact O-N 3.04Å; H117-N120 PolarHBondContact O-N 2.84Å; H117-D121 VanDerWaalsContact O-CG 3.27Å; H117-D121 PolarHBondContact O-N 3.27Å
118D98.4Very high97.6Very high105 Ų10584.7 Ų84.756%0.56142%0.416SS*.Hα-helixtrans-55.7-41.2178.3-55.4-29.4000111.7R114 R115 D121 A122R114-D118 VanDerWaalsContact O-CG 3.31Å; R114-D118 PolarHBondContact O-N 3.38Å; R115-D118 PolarHBondContact O-N 3.5Å; D118-D121 PolarHBondContact O-N 2.9Å; D118-A122 PolarHBondContact O-N 3.38Å
119L98.3Very high97.6Very high96 Ų9685 Ų8550%0.50342%0.421SS..Hα-helixtrans-64.9-41.9175.3175.362.3000112.7R115 M116 H117 D121 L123R115-L119 WeakPolarHBondContact O-CB 3.43Å; R115-L119 PolarHBondContact O-N 3.47Å; M116-L119 HydrophobicContact CE-CD2 4.03Å; M116-L119 HydrophobicContact SD-CD2 4.2Å; H117-L119 PolarHBondContact O-N 3.04Å; L119-D121 VanDerWaalsContact C-N 3.35Å; L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 PolarHBondContact O-N 3.31Å; L119-L123 VanDerWaalsContact O-N 3.07Å
120N97.9Very high97.4Very high49 Ų4981.5 Ų81.526%0.26240%0.402SS..Hα-helixtrans-70.2-35.7179.5-72.7-31000111.2M116 H117 L123 D124 K143M116-N120 WeakPolarHBondContact O-CB 3.3Å; M116-N120 PolarHBondContact O-N 3.18Å; M116-N120 VanDerWaalsContact O-N 3.08Å; M116-N120 PolarHBondContact O-ND2 3.43Å; H117-N120 PolarHBondContact O-N 2.84Å; N120-L123 WeakPolarHBondContact O-CB 3.29Å; N120-L123 PolarHBondContact O-N 3.46Å; N120-D124 PolarHBondContact O-N 3.01Å; N120-K143 WeakPolarHBondContact OD1-CE 3.37Å; N120-K143 PolarHBondContact OD1-NZ 3.27Å
121D97.8Very high97.1Very high92 Ų9282.2 Ų82.249%0.49240%0.404SS..Hα-helixtrans-63.1-48.3175.3-66-11.1000109.9H117 D118 L119 L123 D124 D125H117-D121 VanDerWaalsContact O-CG 3.27Å; H117-D121 PolarHBondContact O-N 3.27Å; D118-D121 PolarHBondContact O-N 2.9Å; L119-D121 VanDerWaalsContact C-N 3.35Å; D121-L123 PolarHBondContact O-N 3.34Å; D121-D124 PolarHBondContact O-N 3.46Å; D121-D125 PolarHBondContact O-N 3.5Å
122A98Very high96.4Very high56 Ų5686.1 Ų86.146%0.46342%0.42SS..Hα-helixtrans-59.8-33.5173.800000113.3D118 L126D118-A122 PolarHBondContact O-N 3.38Å; A122-L126 PolarHBondContact O-N 2.94Å
123L97.7Very high95.5Very high21 Ų2183.1 Ų83.111%0.1141%0.409CS..Hα-helixtrans-72.3-34.3175.3-170.270.9000111.9L119 N120 D121 L126 R127 K143 T146 L147L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 PolarHBondContact O-N 3.31Å; L119-L123 VanDerWaalsContact O-N 3.07Å; N120-L123 WeakPolarHBondContact O-CB 3.29Å; N120-L123 PolarHBondContact O-N 3.46Å; D121-L123 PolarHBondContact O-N 3.34Å; L123-L126 HydrophobicContact CD1-CD2 4.35Å; L123-L126 PolarHBondContact O-N 3.32Å; L123-R127 WeakPolarHBondContact O-CG 3.42Å; L123-R127 PolarHBondContact O-N 2.94Å; L123-K143 HydrophobicContact CD2-CB 4.07Å; L123-K143 HydrophobicContact CD2-CD 4.09Å; L123-K143 HydrophobicContact CD2-CG 3.64Å; L123-T146 HydrophobicContact CD1-CG2 3.86Å; L123-T146 HydrophobicContact CG-CG2 4.37Å; L123-L147 HydrophobicContact CD1-CD2 4.43Å
124D95.4Very high94.8Very high58 Ų5881.1 Ų81.131%0.3141%0.406SS..Hα-helixtrans-70.6-38174-81.3-25.4000111.3N120 D121 L126 R127 S128 K140N120-D124 PolarHBondContact O-N 3.01Å; D121-D124 PolarHBondContact O-N 3.46Å; D124-L126 VanDerWaalsContact C-N 3.32Å; D124-L126 PolarHBondContact O-N 2.99Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 3.41Å; D124-R127 VanDerWaalsContact O-N 3.08Å; D124-R127 IonicContact OD1-CZ 3.5Å; D124-R127 IonicContact OD1-NE 2.92Å; D124-R127 IonicContact OD1-NH1 3.18Å; D124-R127 PolarHBondContact OD1-NH1 3.21Å; D124-S128 PolarHBondContact O-N 3.17Å; D124-K140 VanDerWaalsContact CG-NZ 3.3Å; D124-K140 WeakPolarHBondContact OD1-CE 3.5Å; D124-K140 IonicContact OD1-NZ 2.9Å; D124-K140 PolarHBondContact OD1-NZ 3.38Å; D124-K140 IonicContact OD2-NZ 2.64Å; D124-K140 PolarHBondContact OD2-NZ 2.95Å
125D96.5Very high93.9Very high113 Ų11376.9 Ų76.960%0.60440%0.398SS*.Hα-helixtrans-58.3-44.3169-71.5-15.8000111.1D121 R127 S128D121-D125 PolarHBondContact O-N 3.5Å; D125-R127 VanDerWaalsContact C-N 3.3Å; D125-R127 PolarHBondContact O-N 3.31Å; D125-S128 WeakPolarHBondContact O-CB 3.29Å; D125-S128 PolarHBondContact O-N 3.24Å; D125-S128 PolarHBondContact O-OG 3.15Å
126L97.4Very high92.9Very high54 Ų5476.1 Ų76.128%0.28341%0.413SS..Hα-helixtrans-61.2-37.6174.3178.561.2000112.1A122 L123 D124 S128 V129 I130 T146 L147 A150A122-L126 PolarHBondContact O-N 2.94Å; L123-L126 HydrophobicContact CD1-CD2 4.35Å; L123-L126 PolarHBondContact O-N 3.32Å; D124-L126 VanDerWaalsContact C-N 3.32Å; D124-L126 PolarHBondContact O-N 2.99Å; L126-S128 PolarHBondContact O-N 3.01Å; L126-V129 HydrophobicContact CD1-CG2 3.97Å; L126-V129 WeakPolarHBondContact O-CG2 3.42Å; L126-V129 PolarHBondContact O-N 3.5Å; L126-I130 HydrophobicContact CG-CD1 4.29Å; L126-I130 WeakPolarHBondContact O-CG1 3.35Å; L126-T146 HydrophobicContact CD2-CG2 4.02Å; L126-T146 HydrophobicContact CG-CG2 4.17Å; L126-L147 HydrophobicContact CD2-CD2 4.46Å; L126-A150 HydrophobicContact CD1-CB 4.09Å; L126-A150 HydrophobicContact CD2-CB 4.07Å; L126-A150 HydrophobicContact CG-CB 4.37Å
127R96Very high92Very high23 Ų2378.2 Ų78.29%0.08743%0.434CS..Hα-helixtrans-60.9-34175.7-69.8179.1179.490.49.3111.1L123 D124 D125 V129 I130 H134 L141 T146L123-R127 WeakPolarHBondContact O-CG 3.42Å; L123-R127 PolarHBondContact O-N 2.94Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 3.41Å; D124-R127 VanDerWaalsContact O-N 3.08Å; D124-R127 IonicContact OD1-CZ 3.5Å; D124-R127 IonicContact OD1-NE 2.92Å; D124-R127 IonicContact OD1-NH1 3.18Å; D124-R127 PolarHBondContact OD1-NH1 3.21Å; D125-R127 VanDerWaalsContact C-N 3.3Å; D125-R127 PolarHBondContact O-N 3.31Å; R127-V129 VanDerWaalsContact C-N 3.28Å; R127-V129 PolarHBondContact O-N 3.5Å; R127-I130 PolarHBondContact O-N 3.29Å; R127-H134 PolarHBondContact O-CE1 3.28Å; R127-H134 PolarHBondContact O-ND1 2.97Å; R127-L141 PolarHBondContact NE-O 2.9Å; R127-L141 PolarHBondContact NH2-O 3.35Å; R127-T146 HydrophobicContact CG-CG2 3.71Å; R127-T146 PolarHBondContact NE-OG1 3.02Å
128S93.9Very high91.1Very high70 Ų7076.4 Ų76.449%0.4943%0.431SS..Hα-helixtrans-63.9-28.2-178.481.80000115.4D124 D125 L126 H134D124-S128 PolarHBondContact O-N 3.17Å; D125-S128 WeakPolarHBondContact O-CB 3.29Å; D125-S128 PolarHBondContact O-N 3.24Å; D125-S128 PolarHBondContact O-OG 3.15Å; L126-S128 PolarHBondContact O-N 3.01Å; S128-H134 VanDerWaalsContact CA-CE1 3.46Å; S128-H134 WeakPolarHBondContact CA-CE1 3.5Å; S128-H134 WeakPolarHBondContact CA-NE2 3.29Å; S128-H134 PolarHBondContact N-CE1 3.13Å
129V95.7Very high90.6Very high88 Ų8882.1 Ų82.153%0.53345%0.445SS..Hα-helixtrans-94.4-8.2179.9-59.20000113.2L126 R127 P131L126-V129 HydrophobicContact CD1-CG2 3.97Å; L126-V129 WeakPolarHBondContact O-CG2 3.42Å; L126-V129 PolarHBondContact O-N 3.5Å; R127-V129 VanDerWaalsContact C-N 3.28Å; R127-V129 PolarHBondContact O-N 3.5Å; V129-P131 WeakPolarHBondContact O-CD 3.48Å
130I94.2Very high90.2Very high9 Ų984 Ų845%0.04645%0.449CS..SBendtrans-82.4122.4178.9-66.8169.6000109.3L126 R127 Y132 A133 T146 L149 A150L126-I130 HydrophobicContact CG-CD1 4.29Å; L126-I130 WeakPolarHBondContact O-CG1 3.35Å; R127-I130 PolarHBondContact O-N 3.29Å; I130-Y132 PolarHBondContact O-N 3.38Å; I130-A133 HydrophobicContact CB-CB 3.94Å; I130-A133 HydrophobicContact CG2-CB 3.88Å; I130-A133 WeakPolarHBondContact O-CB 3.3Å; I130-A133 PolarHBondContact O-N 2.98Å; I130-T146 HydrophobicContact CD1-CG2 3.77Å; I130-T146 WeakPolarHBondContact CD1-O 3.43Å; I130-L149 HydrophobicContact CD1-CB 4.36Å; I130-L149 HydrophobicContact CG2-CB 3.98Å; I130-L149 HydrophobicContact CG2-CD2 3.98Å; I130-A150 HydrophobicContact CD1-CB 4.05Å; I130-A150 HydrophobicContact CG1-CB 4.46Å
131P91.7Very high89.9Confident47 Ų4783.3 Ų83.331%0.30545%0.445SS..THydrogen-bonded Turntrans-55.8142175-24.534000112.1V129 A133 Y153V129-P131 WeakPolarHBondContact O-CD 3.48Å; P131-A133 PolarHBondContact O-N 3.38Å; P131-Y153 HydrophobicContact CG-CD2 3.78Å; P131-Y153 HydrophobicContact CG-CE1 4.32Å; P131-Y153 HydrophobicContact CG-CE2 3.4Å; P131-Y153 VanDerWaalsContact CG-CE2 3.4Å; P131-Y153 HydrophobicContact CG-CG 4.41Å
132Y83.6Confident89.8Confident214 Ų21482 Ų8284%0.83944%0.444SS*.THydrogen-bonded Turntrans65.1-5176.8-43.4-71.4000116.6I130 H134I130-Y132 PolarHBondContact O-N 3.38Å; Y132-H134 PolarHBondContact O-N 3.18Å; Y132-H134 VanDerWaalsContact O-N 3.15Å
133A81.5Confident89.8Confident14 Ų1484.1 Ų84.112%0.11644%0.442CS..THydrogen-bonded Turntrans-67.5-13.9178.600000113.5I130 P131 L141I130-A133 HydrophobicContact CB-CB 3.94Å; I130-A133 HydrophobicContact CG2-CB 3.88Å; I130-A133 WeakPolarHBondContact O-CB 3.3Å; I130-A133 PolarHBondContact O-N 2.98Å; P131-A133 PolarHBondContact O-N 3.38Å; A133-L141 HydrophobicContact CB-CD1 3.61Å
134H82.3Confident89.8Confident115 Ų11588.4 Ų88.453%0.53246%0.464SS..THydrogen-bonded Turntrans-113.711.3-168.6-70.521.3000113.7R127 S128 Y132R127-H134 PolarHBondContact O-CE1 3.28Å; R127-H134 PolarHBondContact O-ND1 2.97Å; S128-H134 VanDerWaalsContact CA-CE1 3.46Å; S128-H134 WeakPolarHBondContact CA-CE1 3.5Å; S128-H134 WeakPolarHBondContact CA-NE2 3.29Å; S128-H134 PolarHBondContact N-CE1 3.13Å; Y132-H134 PolarHBondContact O-N 3.18Å; Y132-H134 VanDerWaalsContact O-N 3.15Å
135S80.2Confident89.8Confident52 Ų5286.8 Ų86.836%0.36446%0.458SS..  trans-63.1132179.6177.20000109.8S137 V138S135-S137 PolarHBondContact O-N 3.18Å; S135-V138 PolarHBondContact O-N 3.47Å
136P77Confident89.8Confident143 Ų14381.4 Ų81.493%0.92943%0.43SS*.THydrogen-bonded Turntrans-61.6-16.8-177.624.7-34.5000113.2
137S79.5Confident89.8Confident111 Ų11183.4 Ų83.478%0.77644%0.44SS*.THydrogen-bonded Turntrans-86.5-9.3174.7-175.80000113.6S135S135-S137 PolarHBondContact O-N 3.18Å
138V81.2Confident89.9Confident75 Ų7586.7 Ų86.746%0.45546%0.459SS..SBendtrans-105.4127.9-168.6178.40000110.1S135S135-V138 PolarHBondContact O-N 3.47Å
139R87.6Confident90Very high224 Ų22486.6 Ų86.685%0.84545%0.453SS*.PPolyproline II helixtrans-59.5145.5174179.9-176.2-76.4158.8-5.6110.5L141R139-L141 PolarHBondContact O-N 3.5Å
140K89.5Confident90.1Very high137 Ų13782.9 Ų82.960%0.59643%0.432SS*.PPolyproline II helixtrans-51125.5174.4-173.3169.5-176.5165.30110.8D124D124-K140 VanDerWaalsContact CG-NZ 3.3Å; D124-K140 WeakPolarHBondContact OD1-CE 3.5Å; D124-K140 IonicContact OD1-NZ 2.9Å; D124-K140 PolarHBondContact OD1-NZ 3.38Å; D124-K140 IonicContact OD2-NZ 2.64Å; D124-K140 PolarHBondContact OD2-NZ 2.95Å
141L91.9Very high90.3Very high33 Ų3388.5 Ų88.517%0.17346%0.455CS..PPolyproline II helixtrans-63.8138.4-179.6-63.4175.6000111.9R127 A133 R139 A145 L149R127-L141 PolarHBondContact NE-O 2.9Å; R127-L141 PolarHBondContact NH2-O 3.35Å; A133-L141 HydrophobicContact CB-CD1 3.61Å; R139-L141 PolarHBondContact O-N 3.5Å; L141-A145 HydrophobicContact CB-CB 4.41Å; L141-L149 HydrophobicContact CD1-CD2 3.95Å
142S95.5Very high90.5Very high66 Ų6690.7 Ų90.746%0.46247%0.465SS..PPolyproline II helixtrans-64.1162.1171.873.80000111.5I144 A145 T146S142-I144 VanDerWaalsContact C-N 3.32Å; S142-I144 PolarHBondContact O-N 3.36Å; S142-I144 WeakPolarHBondContact OG-CG2 3.27Å; S142-A145 PolarHBondContact O-N 3.05Å; S142-A145 VanDerWaalsContact OG-CB 3.27Å; S142-A145 WeakPolarHBondContact OG-CB 3.34Å; S142-A145 PolarHBondContact OG-N 3.38Å; S142-T146 PolarHBondContact O-N 3.36Å; S142-T146 PolarHBondContact O-OG1 2.93Å; S142-T146 VanDerWaalsContact O-OG1 3.13Å
143K97.2Very high91.2Very high100 Ų10083.6 Ų83.644%0.43544%0.437SS..Hα-helixtrans-57.6-45.3-180-60.1-165.4170.1-1710111.9N120 L123 T146 L147N120-K143 WeakPolarHBondContact OD1-CE 3.37Å; N120-K143 PolarHBondContact OD1-NZ 3.27Å; L123-K143 HydrophobicContact CD2-CB 4.07Å; L123-K143 HydrophobicContact CD2-CD 4.09Å; L123-K143 HydrophobicContact CD2-CG 3.64Å; K143-T146 PolarHBondContact O-N 3.17Å; K143-L147 WeakPolarHBondContact O-CG 3.46Å; K143-L147 PolarHBondContact O-N 3.23Å
144I97.8Very high92Very high111 Ų11188.3 Ų88.357%0.56946%0.459SS*.Hα-helixtrans-66.7-40.3178.7-174.959.8000112S142 L147 L148S142-I144 VanDerWaalsContact C-N 3.32Å; S142-I144 PolarHBondContact O-N 3.36Å; S142-I144 WeakPolarHBondContact OG-CG2 3.27Å; I144-L147 PolarHBondContact O-N 3.08Å; I144-L148 HydrophobicContact CD1-CD1 4.44Å; I144-L148 HydrophobicContact CD1-CG 4.34Å; I144-L148 HydrophobicContact CG1-CD1 4.09Å; I144-L148 HydrophobicContact CG1-CG 4.45Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 2.64Å
145A95.7Very high92.7Very high23 Ų2387.1 Ų87.119%0.1946%0.456CS..Hα-helixtrans-63.5-44.5177.500000111.4L141 S142 L147 L148 L149L141-A145 HydrophobicContact CB-CB 4.41Å; S142-A145 PolarHBondContact O-N 3.05Å; S142-A145 VanDerWaalsContact OG-CB 3.27Å; S142-A145 WeakPolarHBondContact OG-CB 3.34Å; S142-A145 PolarHBondContact OG-N 3.38Å; A145-L147 VanDerWaalsContact C-N 3.33Å; A145-L147 PolarHBondContact O-N 3.3Å; A145-L148 PolarHBondContact O-N 2.85Å; A145-L149 WeakPolarHBondContact O-CB 3.38Å; A145-L149 VanDerWaalsContact O-CD1 3.29Å; A145-L149 WeakPolarHBondContact O-CD1 3.41Å; A145-L149 PolarHBondContact O-N 3.22Å
146T96.9Very high93.6Very high0 Ų089.9 Ų89.90%047%0.465CS..Hα-helixtrans-56.2-46.5175.1-61.70000111.6L123 L126 R127 I130 S142 K143 L149 A150L123-T146 HydrophobicContact CD1-CG2 3.86Å; L123-T146 HydrophobicContact CG-CG2 4.37Å; L126-T146 HydrophobicContact CD2-CG2 4.02Å; L126-T146 HydrophobicContact CG-CG2 4.17Å; R127-T146 HydrophobicContact CG-CG2 3.71Å; R127-T146 PolarHBondContact NE-OG1 3.02Å; I130-T146 HydrophobicContact CD1-CG2 3.77Å; I130-T146 WeakPolarHBondContact CD1-O 3.43Å; S142-T146 PolarHBondContact O-N 3.36Å; S142-T146 PolarHBondContact O-OG1 2.93Å; S142-T146 VanDerWaalsContact O-OG1 3.13Å; K143-T146 PolarHBondContact O-N 3.17Å; T146-L149 PolarHBondContact O-N 3.07Å; T146-A150 VanDerWaalsContact O-CB 3.3Å; T146-A150 WeakPolarHBondContact O-CB 3.19Å; T146-A150 PolarHBondContact O-N 2.85Å
147L98Very high94.6Very high97 Ų9786.9 Ų86.951%0.50844%0.438SS..Hα-helixtrans-66-40.6-179.9-65.8175.2000112.7L123 L126 K143 I144 A145 A150 K151L123-L147 HydrophobicContact CD1-CD2 4.43Å; L126-L147 HydrophobicContact CD2-CD2 4.46Å; K143-L147 WeakPolarHBondContact O-CG 3.46Å; K143-L147 PolarHBondContact O-N 3.23Å; I144-L147 PolarHBondContact O-N 3.08Å; A145-L147 VanDerWaalsContact C-N 3.33Å; A145-L147 PolarHBondContact O-N 3.3Å; L147-A150 PolarHBondContact O-N 3.24Å; L147-K151 PolarHBondContact O-N 3.5Å
148L97Very high95.4Very high91 Ų9183.8 Ų83.848%0.47642%0.419SS..Hα-helixtrans-64.7-46.8176.9-72.7171.7000111.9I144 A145 K151 N152I144-L148 HydrophobicContact CD1-CD1 4.44Å; I144-L148 HydrophobicContact CD1-CG 4.34Å; I144-L148 HydrophobicContact CG1-CD1 4.09Å; I144-L148 HydrophobicContact CG1-CG 4.45Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 2.64Å; A145-L148 PolarHBondContact O-N 2.85Å; L148-K151 PolarHBondContact O-N 3.43Å; L148-N152 PolarHBondContact O-N 2.83Å
149L95.7Very high96.2Very high68 Ų6884.8 Ų84.836%0.35642%0.422SS..Hα-helixtrans-62.7-43.1177.3-93.169.6000111.2I130 L141 A145 T146 K151 N152 Y153I130-L149 HydrophobicContact CD1-CB 4.36Å; I130-L149 HydrophobicContact CG2-CB 3.98Å; I130-L149 HydrophobicContact CG2-CD2 3.98Å; L141-L149 HydrophobicContact CD1-CD2 3.95Å; A145-L149 WeakPolarHBondContact O-CB 3.38Å; A145-L149 VanDerWaalsContact O-CD1 3.29Å; A145-L149 WeakPolarHBondContact O-CD1 3.41Å; A145-L149 PolarHBondContact O-N 3.22Å; T146-L149 PolarHBondContact O-N 3.07Å; L149-K151 PolarHBondContact O-N 3.24Å; L149-N152 PolarHBondContact O-N 3.44Å; L149-Y153 VanDerWaalsContact O-CB 3.29Å; L149-Y153 WeakPolarHBondContact O-CB 3.42Å; L149-Y153 PolarHBondContact O-N 3.19Å
150A97.9Very high96.7Very high11 Ų1176.6 Ų76.69%0.09140%0.402CS..Hα-helixtrans-59.4-46.9176.700000112.1L126 I130 T146 L147 N152 Y153 I154L126-A150 HydrophobicContact CD1-CB 4.09Å; L126-A150 HydrophobicContact CD2-CB 4.07Å; L126-A150 HydrophobicContact CG-CB 4.37Å; I130-A150 HydrophobicContact CD1-CB 4.05Å; I130-A150 HydrophobicContact CG1-CB 4.46Å; T146-A150 VanDerWaalsContact O-CB 3.3Å; T146-A150 WeakPolarHBondContact O-CB 3.19Å; T146-A150 PolarHBondContact O-N 2.85Å; L147-A150 PolarHBondContact O-N 3.24Å; A150-N152 PolarHBondContact O-N 3.43Å; A150-Y153 PolarHBondContact O-N 3.03Å; A150-I154 WeakPolarHBondContact O-CG1 3.21Å; A150-I154 PolarHBondContact O-N 2.63Å
151K98Very high97.1Very high126 Ų12674.2 Ų74.255%0.54840%0.395SS..Hα-helixtrans-56.5-50.3175.5178.3-171.1172.8-174.60111.2L147 L148 L149 Y153 I154 L155L147-K151 PolarHBondContact O-N 3.5Å; L148-K151 PolarHBondContact O-N 3.43Å; L149-K151 PolarHBondContact O-N 3.24Å; K151-Y153 VanDerWaalsContact C-N 3.3Å; K151-Y153 PolarHBondContact O-N 2.91Å; K151-I154 PolarHBondContact O-N 3.06Å; K151-L155 HydrophobicContact CG-CD1 4.32Å; K151-L155 WeakPolarHBondContact O-CG 3.46Å; K151-L155 PolarHBondContact O-N 3.1Å; K151-L155 VanDerWaalsContact O-N 3.11Å
152N97.1Very high97.4Very high94 Ų9476.7 Ų76.750%0.50341%0.408SS..Hα-helixtrans-64.6-37.2-178.7-70.4-10.6000111.8L148 L149 A150 L155 M156L148-N152 PolarHBondContact O-N 2.83Å; L149-N152 PolarHBondContact O-N 3.44Å; A150-N152 PolarHBondContact O-N 3.43Å; N152-L155 PolarHBondContact O-N 3.05Å; N152-M156 WeakPolarHBondContact O-CB 3.47Å; N152-M156 PolarHBondContact O-N 2.88Å
153Y97.8Very high97.5Very high65 Ų6578.2 Ų78.226%0.25541%0.408SS..Hα-helixtrans-64.1-43.4177.1-178.7-130000112.1P131 L149 A150 K151 M156 Q157P131-Y153 HydrophobicContact CG-CD2 3.78Å; P131-Y153 HydrophobicContact CG-CE1 4.32Å; P131-Y153 HydrophobicContact CG-CE2 3.4Å; P131-Y153 VanDerWaalsContact CG-CE2 3.4Å; P131-Y153 HydrophobicContact CG-CG 4.41Å; L149-Y153 VanDerWaalsContact O-CB 3.29Å; L149-Y153 WeakPolarHBondContact O-CB 3.42Å; L149-Y153 PolarHBondContact O-N 3.19Å; A150-Y153 PolarHBondContact O-N 3.03Å; K151-Y153 VanDerWaalsContact C-N 3.3Å; K151-Y153 PolarHBondContact O-N 2.91Å; Y153-M156 HydrophobicContact CD2-CE 3.64Å; Y153-M156 HydrophobicContact CE2-CE 3.75Å; Y153-M156 PolarHBondContact O-N 3.12Å; Y153-Q157 HydrophobicContact CD2-CG 4.13Å; Y153-Q157 HydrophobicContact CE2-CG 3.71Å; Y153-Q157 WeakPolarHBondContact O-CG 3.42Å; Y153-Q157 PolarHBondContact O-N 2.9Å; Y153-Q157 PolarHBondContact OH-OE1 3.08Å
154I98.3Very high97.5Very high113 Ų11378.5 Ų78.558%0.57941%0.414SS*.Hα-helixtrans-60.1-48174.8-67.4165.9000110.7A150 K151 M156 Q157 A158A150-I154 WeakPolarHBondContact O-CG1 3.21Å; A150-I154 PolarHBondContact O-N 2.63Å; K151-I154 PolarHBondContact O-N 3.06Å; I154-M156 PolarHBondContact O-N 3.28Å; I154-Q157 PolarHBondContact O-N 3.07Å; I154-A158 WeakPolarHBondContact O-CB 3.11Å; I154-A158 PolarHBondContact O-N 3.03Å
155L97.8Very high97.4Very high89 Ų8978.5 Ų78.547%0.46641%0.408SS..Hα-helixtrans-61.5-44179.2-69.5173.7000112.2K151 N152 A158 N159K151-L155 HydrophobicContact CG-CD1 4.32Å; K151-L155 WeakPolarHBondContact O-CG 3.46Å; K151-L155 PolarHBondContact O-N 3.1Å; K151-L155 VanDerWaalsContact O-N 3.11Å; N152-L155 PolarHBondContact O-N 3.05Å; L155-A158 PolarHBondContact O-N 3.08Å; L155-N159 WeakPolarHBondContact O-CB 3.38Å; L155-N159 PolarHBondContact O-N 2.96Å; L155-N159 PolarHBondContact O-ND2 2.89Å
156M97.6Very high97.4Very high111 Ų11182.7 Ų82.755%0.54742%0.421SS..Hα-helixtrans-61.4-45.2177.6-177.3-162.676.100111.4N152 Y153 I154 N159 A160N152-M156 WeakPolarHBondContact O-CB 3.47Å; N152-M156 PolarHBondContact O-N 2.88Å; Y153-M156 HydrophobicContact CD2-CE 3.64Å; Y153-M156 HydrophobicContact CE2-CE 3.75Å; Y153-M156 PolarHBondContact O-N 3.12Å; I154-M156 PolarHBondContact O-N 3.28Å; M156-N159 PolarHBondContact O-N 2.95Å; M156-A160 WeakPolarHBondContact O-CB 3.49Å; M156-A160 PolarHBondContact O-N 3.06Å
157Q97.8Very high97.4Very high80 Ų8086.4 Ų86.437%0.37444%0.441SS..Hα-helixtrans-65.6-42.1177.9-74.4-168.496.500112.2Y153 I154 N159 A160 I161Y153-Q157 HydrophobicContact CD2-CG 4.13Å; Y153-Q157 HydrophobicContact CE2-CG 3.71Å; Y153-Q157 WeakPolarHBondContact O-CG 3.42Å; Y153-Q157 PolarHBondContact O-N 2.9Å; Y153-Q157 PolarHBondContact OH-OE1 3.08Å; I154-Q157 PolarHBondContact O-N 3.07Å; Q157-N159 PolarHBondContact O-N 2.98Å; Q157-A160 PolarHBondContact O-N 3.5Å; Q157-I161 WeakPolarHBondContact O-CB 3.36Å; Q157-I161 VanDerWaalsContact O-CG1 3.29Å; Q157-I161 WeakPolarHBondContact O-CG1 3.46Å; Q157-I161 PolarHBondContact O-N 3.03Å
158A98Very high97.3Very high45 Ų4585.6 Ų85.637%0.37244%0.436SS..Hα-helixtrans-58.8-48.4175.800000111.4I154 L155 A160 I161 D162I154-A158 WeakPolarHBondContact O-CB 3.11Å; I154-A158 PolarHBondContact O-N 3.03Å; L155-A158 PolarHBondContact O-N 3.08Å; A158-A160 VanDerWaalsContact C-N 3.34Å; A158-A160 PolarHBondContact O-N 3.48Å; A158-I161 PolarHBondContact O-N 2.84Å; A158-D162 PolarHBondContact O-N 3.21Å
159N97.7Very high97.1Very high97 Ų9786.7 Ų86.752%0.51944%0.441SS..Hα-helixtrans-60.6-41.9176.4-68.1-20.4000112.1L155 M156 Q157 I161 D162 E163L155-N159 WeakPolarHBondContact O-CB 3.38Å; L155-N159 PolarHBondContact O-N 2.96Å; L155-N159 PolarHBondContact O-ND2 2.89Å; M156-N159 PolarHBondContact O-N 2.95Å; Q157-N159 PolarHBondContact O-N 2.98Å; N159-I161 VanDerWaalsContact C-N 3.33Å; N159-I161 PolarHBondContact O-N 2.93Å; N159-D162 PolarHBondContact O-N 3.26Å; N159-E163 WeakPolarHBondContact O-CG 3.34Å; N159-E163 PolarHBondContact O-N 3.23Å
160A98.1Very high97.1Very high51 Ų5190.2 Ų90.242%0.42145%0.45SS..Hα-helixtrans-62.9-41.1177.700000111.8M156 Q157 A158 E163 L164M156-A160 WeakPolarHBondContact O-CB 3.49Å; M156-A160 PolarHBondContact O-N 3.06Å; Q157-A160 PolarHBondContact O-N 3.5Å; A158-A160 VanDerWaalsContact C-N 3.34Å; A158-A160 PolarHBondContact O-N 3.48Å; A160-E163 PolarHBondContact O-N 3.14Å; A160-L164 VanDerWaalsContact O-CG 3.3Å; A160-L164 WeakPolarHBondContact O-CG 3.45Å; A160-L164 PolarHBondContact O-N 3.29Å
161I98.3Very high96.9Very high87 Ų8794.2 Ų94.245%0.44647%0.469SS..Hα-helixtrans-62.8-44.9175.1-71.4167.2000110.6Q157 A158 N159 E163 L164 Y165Q157-I161 WeakPolarHBondContact O-CB 3.36Å; Q157-I161 VanDerWaalsContact O-CG1 3.29Å; Q157-I161 WeakPolarHBondContact O-CG1 3.46Å; Q157-I161 PolarHBondContact O-N 3.03Å; A158-I161 PolarHBondContact O-N 2.84Å; N159-I161 VanDerWaalsContact C-N 3.33Å; N159-I161 PolarHBondContact O-N 2.93Å; I161-E163 PolarHBondContact O-N 3.35Å; I161-L164 PolarHBondContact O-N 3.44Å; I161-Y165 HydrophobicContact CG2-CD2 3.58Å; I161-Y165 HydrophobicContact CG2-CE2 3.31Å; I161-Y165 WeakPolarHBondContact O-CD2 3.46Å; I161-Y165 PolarHBondContact O-N 3.41Å
162D97Very high96.7Very high85 Ų8591 Ų9146%0.45546%0.458SS..Hα-helixtrans-61.6-42.3177.5-73.4-24.7000112.5A158 N159 Y165 K166A158-D162 PolarHBondContact O-N 3.21Å; N159-D162 PolarHBondContact O-N 3.26Å; D162-Y165 PolarHBondContact O-N 2.94Å; D162-K166 WeakPolarHBondContact O-CG 3.23Å; D162-K166 PolarHBondContact O-N 3.02Å
163E97.4Very high96.4Very high99 Ų9988.8 Ų88.846%0.46345%0.45SS..Hα-helixtrans-65.1-40.1175.4-68.9-50.713100112N159 A160 I161 Y165 K166 L167N159-E163 WeakPolarHBondContact O-CG 3.34Å; N159-E163 PolarHBondContact O-N 3.23Å; A160-E163 PolarHBondContact O-N 3.14Å; I161-E163 PolarHBondContact O-N 3.35Å; E163-Y165 PolarHBondContact O-N 3.35Å; E163-K166 PolarHBondContact O-N 3.02Å; E163-K166 IonicContact OE1-NZ 2.7Å; E163-K166 PolarHBondContact OE1-NZ 3.25Å; E163-L167 WeakPolarHBondContact O-CG 3.5Å; E163-L167 PolarHBondContact O-N 3.45Å
164L97.9Very high96.1Very high106 Ų10690.5 Ų90.556%0.55546%0.46SS*.Hα-helixtrans-62.3-41.9173.6-72.3173.6000111.7A160 I161 L167 I168A160-L164 VanDerWaalsContact O-CG 3.3Å; A160-L164 WeakPolarHBondContact O-CG 3.45Å; A160-L164 PolarHBondContact O-N 3.29Å; I161-L164 PolarHBondContact O-N 3.44Å; L164-L167 PolarHBondContact O-N 3.19Å; L164-I168 VanDerWaalsContact O-CG1 3.28Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.13Å
165Y95.9Very high95.7Very high111 Ų11188.7 Ų88.744%0.43545%0.451SS..Hα-helixtrans-61.3-44.1174.1-82.6-63.8000112.2I161 D162 E163 L167 I168 I169I161-Y165 HydrophobicContact CG2-CD2 3.58Å; I161-Y165 HydrophobicContact CG2-CE2 3.31Å; I161-Y165 WeakPolarHBondContact O-CD2 3.46Å; I161-Y165 PolarHBondContact O-N 3.41Å; D162-Y165 PolarHBondContact O-N 2.94Å; E163-Y165 PolarHBondContact O-N 3.35Å; Y165-L167 VanDerWaalsContact C-N 3.32Å; Y165-L167 PolarHBondContact O-N 2.95Å; Y165-I168 PolarHBondContact O-N 3.47Å; Y165-I169 VanDerWaalsContact O-CG1 3.27Å; Y165-I169 WeakPolarHBondContact O-CG1 3.4Å; Y165-I169 PolarHBondContact O-N 2.99Å
166K95.1Very high95.2Very high110 Ų11088.9 Ų88.948%0.47845%0.449SS..Hα-helixtrans-60.1-41.5175.4-70.2170.8-167.51690111.8D162 E163 I169 R170D162-K166 WeakPolarHBondContact O-CG 3.23Å; D162-K166 PolarHBondContact O-N 3.02Å; E163-K166 PolarHBondContact O-N 3.02Å; E163-K166 IonicContact OE1-NZ 2.7Å; E163-K166 PolarHBondContact OE1-NZ 3.25Å; K166-I169 PolarHBondContact O-N 2.92Å; K166-R170 WeakPolarHBondContact O-CB 3.48Å; K166-R170 PolarHBondContact O-N 2.95Å
167L96.3Very high94.6Very high79 Ų7989.2 Ų89.241%0.41445%0.45SS..Hα-helixtrans-64.4-45175.8-71.4174.7000111.7E163 L164 Y165 I169 R170 L171E163-L167 WeakPolarHBondContact O-CG 3.5Å; E163-L167 PolarHBondContact O-N 3.45Å; L164-L167 PolarHBondContact O-N 3.19Å; Y165-L167 VanDerWaalsContact C-N 3.32Å; Y165-L167 PolarHBondContact O-N 2.95Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.12Å; L167-R170 PolarHBondContact O-N 2.88Å; L167-L171 WeakPolarHBondContact O-CB 3.41Å; L167-L171 VanDerWaalsContact O-CG 3.31Å; L167-L171 WeakPolarHBondContact O-CG 3.49Å; L167-L171 PolarHBondContact O-N 3.48Å
168I95.9Very high94Very high79 Ų7987.9 Ų87.941%0.40545%0.453SS..Hα-helixtrans-60.1-44.3176.4-70.2164.9000110.8L164 Y165 R170 L171 N172L164-I168 VanDerWaalsContact O-CG1 3.28Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.13Å; Y165-I168 PolarHBondContact O-N 3.47Å; I168-R170 PolarHBondContact O-N 3.37Å; I168-L171 PolarHBondContact O-N 3.4Å; I168-N172 WeakPolarHBondContact CG2-ND2 3.48Å; I168-N172 VanDerWaalsContact O-CB 3.29Å; I168-N172 WeakPolarHBondContact O-CB 3.49Å; I168-N172 VanDerWaalsContact O-CG 3.26Å; I168-N172 PolarHBondContact O-N 3.28Å; I168-N172 PolarHBondContact O-ND2 2.96Å
169I94.6Very high93Very high115 Ų11587.6 Ų87.659%0.5945%0.445SS*.Hα-helixtrans-61.7-45.3176.6-67.6164.1000110.6Y165 K166 L167 N172 S173Y165-I169 VanDerWaalsContact O-CG1 3.27Å; Y165-I169 WeakPolarHBondContact O-CG1 3.4Å; Y165-I169 PolarHBondContact O-N 2.99Å; K166-I169 PolarHBondContact O-N 2.92Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.12Å; I169-N172 PolarHBondContact O-N 3.41Å; I169-S173 WeakPolarHBondContact O-CB 3.33Å; I169-S173 PolarHBondContact O-N 3.41Å
170R94.2Very high91.5Very high142 Ų14287.1 Ų87.154%0.53645%0.449SS..Hα-helixtrans-61.1-48.6177.4-173.2-177.8-67143.60.2111.3K166 L167 I168 S173 Q174K166-R170 WeakPolarHBondContact O-CB 3.48Å; K166-R170 PolarHBondContact O-N 2.95Å; L167-R170 PolarHBondContact O-N 2.88Å; I168-R170 PolarHBondContact O-N 3.37Å; R170-S173 PolarHBondContact O-N 3.48Å; R170-S173 PolarHBondContact O-OG 3.01Å; R170-Q174 WeakPolarHBondContact O-CG 3.27Å; R170-Q174 PolarHBondContact O-N 2.94Å
171L95Very high89.7Confident95 Ų9591.9 Ų91.950%0.49747%0.467SS..Hα-helixtrans-62.3-44.8178.1-70.8172.9000111.6L167 I168 S173 Q174 I175L167-L171 WeakPolarHBondContact O-CB 3.41Å; L167-L171 VanDerWaalsContact O-CG 3.31Å; L167-L171 WeakPolarHBondContact O-CG 3.49Å; L167-L171 PolarHBondContact O-N 3.48Å; I168-L171 PolarHBondContact O-N 3.4Å; L171-S173 VanDerWaalsContact C-N 3.29Å; L171-S173 PolarHBondContact O-N 3.42Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 3.33Å; L171-I175 WeakPolarHBondContact O-CG1 3.36Å; L171-I175 PolarHBondContact O-N 3.36Å
172N92.5Very high87.7Confident59 Ų5993.8 Ų93.832%0.31648%0.477SS..Hα-helixtrans-60.5-38.9175.3-77.1-27.3000111.9I168 I169 Q174 I175 Q176I168-N172 WeakPolarHBondContact CG2-ND2 3.48Å; I168-N172 VanDerWaalsContact O-CB 3.29Å; I168-N172 WeakPolarHBondContact O-CB 3.49Å; I168-N172 VanDerWaalsContact O-CG 3.26Å; I168-N172 PolarHBondContact O-N 3.28Å; I168-N172 PolarHBondContact O-ND2 2.96Å; I169-N172 PolarHBondContact O-N 3.41Å; N172-Q174 VanDerWaalsContact C-N 3.33Å; N172-I175 PolarHBondContact O-N 2.91Å; N172-Q176 VanDerWaalsContact O-CG 3.25Å; N172-Q176 WeakPolarHBondContact O-CG 3.4Å; N172-Q176 PolarHBondContact O-N 3.24Å
173S90.7Very high85.5Confident47 Ų4796.6 Ų96.633%0.32949%0.491SS..Hα-helixtrans-67-34.1174.677.60000112.6I169 R170 L171 Q177I169-S173 WeakPolarHBondContact O-CB 3.33Å; I169-S173 PolarHBondContact O-N 3.41Å; R170-S173 PolarHBondContact O-N 3.48Å; R170-S173 PolarHBondContact O-OG 3.01Å; L171-S173 VanDerWaalsContact C-N 3.29Å; L171-S173 PolarHBondContact O-N 3.42Å; S173-Q177 VanDerWaalsContact O-CG 3.25Å; S173-Q177 WeakPolarHBondContact O-CG 3.31Å; S173-Q177 PolarHBondContact O-N 3.12Å; S173-Q177 VanDerWaalsContact O-N 3.11Å; S173-Q177 PolarHBondContact O-NE2 3.48Å
174Q91.7Very high83.4Confident100 Ų10098.7 Ų98.747%0.46751%0.506SS..Hα-helixtrans-71.3-40175.9-72.9174.1-29.400111.7R170 L171 N172 Q177 A178R170-Q174 WeakPolarHBondContact O-CG 3.27Å; R170-Q174 PolarHBondContact O-N 2.94Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 3.33Å; N172-Q174 VanDerWaalsContact C-N 3.33Å; Q174-Q177 PolarHBondContact O-N 2.84Å; Q174-A178 WeakPolarHBondContact O-CB 3.44Å; Q174-A178 PolarHBondContact O-N 3.48Å
175I91Very high81.3Confident76 Ų76101 Ų10139%0.3952%0.518SS..Hα-helixtrans-61.4-47.7174-67.8165.5000109.8L171 N172 Q177 A178 D179 Y187L171-I175 WeakPolarHBondContact O-CG1 3.36Å; L171-I175 PolarHBondContact O-N 3.36Å; N172-I175 PolarHBondContact O-N 2.91Å; I175-Q177 VanDerWaalsContact C-N 3.26Å; I175-Q177 PolarHBondContact O-N 3.49Å; I175-A178 CarbonylContact O-C 3.04Å; I175-A178 PolarHBondContact O-N 3.49Å; I175-A178 VanDerWaalsContact O-N 3.07Å; I175-D179 PolarHBondContact O-N 3.39Å; I175-Y187 HydrophobicContact CG2-CE2 4.3Å; I175-Y187 WeakPolarHBondContact CG2-OH 3.31Å
176Q86.3Confident79.7Confident92 Ų92103.3 Ų103.343%0.4354%0.538SS..Hα-helixtrans-62.3-33.1177.7-69.3-179.649.600113.2N172 S180 K188N172-Q176 VanDerWaalsContact O-CG 3.25Å; N172-Q176 WeakPolarHBondContact O-CG 3.4Å; N172-Q176 PolarHBondContact O-N 3.24Å; Q176-S180 PolarHBondContact O-N 2.91Å; Q176-S180 PolarHBondContact O-OG 3.23Å; Q176-K188 VanDerWaalsContact CG-CE 3.48Å; Q176-K188 VanDerWaalsContact OE1-CE 3.31Å
177Q86Confident77.8Confident118 Ų118104.9 Ų104.955%0.55154%0.542SS*.Hα-helixtrans-70.7-40.2173.1-74.8167.769.300111.7S173 Q174 I175 S180 L181S173-Q177 VanDerWaalsContact O-CG 3.25Å; S173-Q177 WeakPolarHBondContact O-CG 3.31Å; S173-Q177 PolarHBondContact O-N 3.12Å; S173-Q177 VanDerWaalsContact O-N 3.11Å; S173-Q177 PolarHBondContact O-NE2 3.48Å; Q174-Q177 PolarHBondContact O-N 2.84Å; I175-Q177 VanDerWaalsContact C-N 3.26Å; I175-Q177 PolarHBondContact O-N 3.49Å; Q177-S180 WeakPolarHBondContact CA-OG 3.33Å; Q177-S180 PolarHBondContact O-N 3.42Å; Q177-S180 PolarHBondContact O-OG 3.49Å; Q177-L181 PolarHBondContact O-N 3.45Å
178A84.5Confident75.8Confident53 Ų53108.6 Ų108.644%0.43856%0.555SS.*Hα-helixtrans-66.9-39.7175.700000112.3Q174 I175 L181 L182Q174-A178 WeakPolarHBondContact O-CB 3.44Å; Q174-A178 PolarHBondContact O-N 3.48Å; I175-A178 CarbonylContact O-C 3.04Å; I175-A178 PolarHBondContact O-N 3.49Å; I175-A178 VanDerWaalsContact O-N 3.07Å; A178-L181 WeakPolarHBondContact O-CB 3.46Å; A178-L181 PolarHBondContact O-N 2.87Å; A178-L181 VanDerWaalsContact O-N 3.1Å; A178-L182 PolarHBondContact O-N 2.91Å
179D77.4Confident73.8Confident38 Ų38109.7 Ų109.720%0.20357%0.57CS.*Hα-helixtrans-65-37.3173-70.8-23.3000112.2I175 L181 L182 Y187I175-D179 PolarHBondContact O-N 3.39Å; D179-L181 PolarHBondContact O-N 3.27Å; D179-L181 VanDerWaalsContact O-N 3.12Å; D179-L182 CarbonylContact O-C 3.6Å; D179-L182 WeakPolarHBondContact O-CA 3.17Å; D179-L182 PolarHBondContact O-N 3.46Å; D179-Y187 VanDerWaalsContact CG-CZ 3.4Å; D179-Y187 WeakPolarHBondContact OD1-CE1 3.49Å; D179-Y187 VanDerWaalsContact OD1-CZ 3.24Å; D179-Y187 PolarHBondContact OD1-OH 2.92Å; D179-Y187 WeakPolarHBondContact OD2-CE1 3.43Å; D179-Y187 PolarHBondContact OD2-OH 3.19Å
180S65.9Low72Confident88 Ų88109 Ų10962%0.61557%0.571SS**Hα-helixtrans-64.3-16.4174.458.10000113.4Q176 Q177Q176-S180 PolarHBondContact O-N 2.91Å; Q176-S180 PolarHBondContact O-OG 3.23Å; Q177-S180 WeakPolarHBondContact CA-OG 3.33Å; Q177-S180 PolarHBondContact O-N 3.42Å; Q177-S180 PolarHBondContact O-OG 3.49Å
181L59.8Low69.9Low150 Ų150108.3 Ų108.379%0.78558%0.583SS**Hα-helixtrans-93.8-11.1169.9-63.6176.3000113.4Q177 A178 D179Q177-L181 PolarHBondContact O-N 3.45Å; A178-L181 WeakPolarHBondContact O-CB 3.46Å; A178-L181 PolarHBondContact O-N 2.87Å; A178-L181 VanDerWaalsContact O-N 3.1Å; D179-L181 PolarHBondContact O-N 3.27Å; D179-L181 VanDerWaalsContact O-N 3.12Å
182L57.1Low68.2Low128 Ų128111.5 Ų111.567%0.6759%0.593SS**SBendtrans-120.484.9172.9-69.7-176.3000108.5A178 D179 N184A178-L182 PolarHBondContact O-N 2.91Å; D179-L182 CarbonylContact O-C 3.6Å; D179-L182 WeakPolarHBondContact O-CA 3.17Å; D179-L182 PolarHBondContact O-N 3.46Å; L182-N184 PolarHBondContact O-N 3.35Å
183L49.7Very low66.8Low144 Ų144117.5 Ų117.575%0.75462%0.616SS**  trans-46.1108.9167.6-71.2-165.7000109.3
184N53.3Low64.9Low143 Ų143120.6 Ų120.677%0.76564%0.635SS**  trans-171.395.4154.5-79.5-37.3000107.4L182 D186L182-N184 PolarHBondContact O-N 3.35Å; N184-D186 PolarHBondContact O-N 2.98Å
185D54.2Low63Low153 Ų153122.7 Ų122.782%0.81865%0.648SS**  trans-75.263.5-171.5-72-61000114.8
186D61.9Low61.1Low160 Ų160128 Ų12886%0.85667%0.668SS**  trans-135.512.4-174.2-89.1-34.7000119N184N184-D186 PolarHBondContact O-N 2.98Å
187Y55.5Low59.3Low143 Ų143129 Ų12956%0.56169%0.686SS**  trans-140.813.6-178.277.2-86.4000119.2I175 D179 S189I175-Y187 HydrophobicContact CG2-CE2 4.3Å; I175-Y187 WeakPolarHBondContact CG2-OH 3.31Å; D179-Y187 VanDerWaalsContact CG-CZ 3.4Å; D179-Y187 WeakPolarHBondContact OD1-CE1 3.49Å; D179-Y187 VanDerWaalsContact OD1-CZ 3.24Å; D179-Y187 PolarHBondContact OD1-OH 2.92Å; D179-Y187 WeakPolarHBondContact OD2-CE1 3.43Å; D179-Y187 PolarHBondContact OD2-OH 3.19Å; Y187-S189 PolarHBondContact O-N 3.45Å
188K55.3Low57.3Low157 Ų157131.9 Ų131.968%0.68370%0.699SS**  trans-7779.9179.1-102.3-174.6172.3-173.90113.4Q176Q176-K188 VanDerWaalsContact CG-CE 3.48Å; Q176-K188 VanDerWaalsContact OE1-CE 3.31Å
189S52.3Low55.2Low103 Ų103134.6 Ų134.672%0.7272%0.715SS**  trans-153.369167.6166.70000111.9Y187Y187-S189 PolarHBondContact O-N 3.45Å
190V57.5Low53.8Low101 Ų101140.8 Ų140.861%0.61275%0.747SS**  trans-133.584.3161-176.60000107.8F192V190-F192 HydrophobicContact CG1-CD2 3.54Å; V190-F192 HydrophobicContact CG1-CE2 3.14Å; V190-F192 HydrophobicContact CG1-CZ 3.92Å
191T51.2Low52.7Low127 Ų127143.3 Ų143.378%0.77975%0.754SS**  trans-97.2102.1172.7-60.60000108
192F59.3Low51.7Low162 Ų162142 Ų14271%0.71175%0.754SS**PPolyproline II helixtrans-85.4116.5168.5-74.7-72.6000109.1V190V190-F192 HydrophobicContact CG1-CD2 3.54Å; V190-F192 HydrophobicContact CG1-CE2 3.14Å; V190-F192 HydrophobicContact CG1-CZ 3.92Å
193K62.5Low51.2Low185 Ų185141.6 Ų141.680%0.80476%0.757SS**PPolyproline II helixtrans-70.4133171.9-67-178.2-179.2178.40108.3I195K193-I195 PolarHBondContact O-N 3.4Å
194P50.2Low51.1Low112 Ų112142 Ų14273%0.72776%0.755SS**PPolyproline II helixtrans-53137.4169.6-21.230.7000109.5K196P194-K196 VanDerWaalsContact C-N 3.34Å; P194-K196 PolarHBondContact O-N 2.87Å
195I52.6Low50.7Low143 Ų143142.5 Ų142.573%0.73376%0.756SS**  trans-60.9105.1165.2-61.1171.9000105.1K193 S197K193-I195 PolarHBondContact O-N 3.4Å; I195-S197 PolarHBondContact O-N 3.33Å; I195-S197 VanDerWaalsContact O-N 3.07Å
196K51Low50.1Low188 Ų188141.3 Ų141.382%0.81775%0.749SS**  trans-62.8113.3170.6-71.9179.8177.6-176.10105.7P194 E198P194-K196 VanDerWaalsContact C-N 3.34Å; P194-K196 PolarHBondContact O-N 2.87Å; K196-E198 VanDerWaalsContact C-N 3.29Å; K196-E198 PolarHBondContact O-N 3.47Å
197S48.6Very low49.4Very low114 Ų114138.3 Ų138.380%0.79774%0.741SS**  trans-53.8104.2154.9490000106.1I195 S199I195-S197 PolarHBondContact O-N 3.33Å; I195-S197 VanDerWaalsContact O-N 3.07Å; S197-S199 PolarHBondContact O-N 3.09Å
198E44.5Very low48.9Very low177 Ų177139.2 Ų139.283%0.82776%0.755SS**  trans-55.7126.6175.2-166.1154.9-171.600107.9K196 L200K196-E198 VanDerWaalsContact C-N 3.29Å; K196-E198 PolarHBondContact O-N 3.47Å; E198-L200 PolarHBondContact O-N 2.97Å
199S39.9Very low48.3Very low110 Ų110137.2 Ų137.277%0.76976%0.76SS**  trans-51.9105.6-179.446.20000110.7S197S197-S199 PolarHBondContact O-N 3.09Å
200L47.5Very low47.6Very low168 Ų168140.2 Ų140.288%0.8877%0.768SS**  trans-90.1118.4154.2-86.5153.2000107E198E198-L200 PolarHBondContact O-N 2.97Å
201D43.3Very low47.1Very low142 Ų142142.4 Ų142.476%0.75978%0.775SS**  trans-46.4124.5179.5-85.5-43.6000112.4T203D201-T203 VanDerWaalsContact C-N 3.32Å; D201-T203 PolarHBondContact O-N 3.25Å; D201-T203 VanDerWaalsContact O-N 3.09Å
202P38.9Very low46.7Very low121 Ų121140.9 Ų140.979%0.78677%0.769SS**  trans-8575.917232.9-29.7000109.6
203T47.1Very low45.9Very low120 Ų120138.4 Ų138.474%0.73677%0.772SS**  trans-139.256.2168.755.20000113.1D201D201-T203 VanDerWaalsContact C-N 3.32Å; D201-T203 PolarHBondContact O-N 3.25Å; D201-T203 VanDerWaalsContact O-N 3.09Å
204H45.5Very low45.1Very low153 Ų153136.6 Ų136.671%0.70877%0.771SS**  trans-156.492.7145.1-150.2-102.5000109.4D206H204-D206 VanDerWaalsContact CE1-CG 3.43Å; H204-D206 IonicContact CE1-OD1 3.91Å; H204-D206 PolarHBondContact CE1-OD1 3.47Å; H204-D206 IonicContact CE1-OD2 3.55Å; H204-D206 PolarHBondContact CE1-OD2 3.24Å; H204-D206 VanDerWaalsContact ND1-CG 3.31Å; H204-D206 IonicContact ND1-OD1 2.85Å; H204-D206 IonicContact ND1-OD2 3.07Å; H204-D206 PolarHBondContact ND1-OD2 3.07Å; H204-D206 PolarHBondContact O-N 3.44Å
205I45.6Very low44.7Very low153 Ų153136.7 Ų136.779%0.78577%0.769SS**  trans-79.692.6169.8-60164000105.7S207I205-S207 PolarHBondContact O-N 3.3Å
206D42.5Very low44.3Very low128 Ų128136.7 Ų136.768%0.68477%0.77SS**  trans-84.2102.4158.5-81.5-39000108.3H204 N208H204-D206 VanDerWaalsContact CE1-CG 3.43Å; H204-D206 IonicContact CE1-OD1 3.91Å; H204-D206 PolarHBondContact CE1-OD1 3.47Å; H204-D206 IonicContact CE1-OD2 3.55Å; H204-D206 PolarHBondContact CE1-OD2 3.24Å; H204-D206 VanDerWaalsContact ND1-CG 3.31Å; H204-D206 IonicContact ND1-OD1 2.85Å; H204-D206 IonicContact ND1-OD2 3.07Å; H204-D206 PolarHBondContact ND1-OD2 3.07Å; H204-D206 PolarHBondContact O-N 3.44Å; D206-N208 PolarHBondContact O-N 3.34Å
207S47.6Very low43.6Very low98 Ų98138.2 Ų138.269%0.68577%0.772SS**  trans-55.395168.6-55.50000110.5I205I205-S207 PolarHBondContact O-N 3.3Å
208N44.9Very low43.4Very low161 Ų161138.4 Ų138.486%0.86177%0.768SS**  trans165.683.7144.5-87.1-24.7000111.8D206D206-N208 PolarHBondContact O-N 3.34Å
209C41.4Very low43.5Very low116 Ų116135 Ų13578%0.78476%0.759SS**  trans-141.188.8140.276.40000110.1I211C209-I211 PolarHBondContact O-N 3.24Å; C209-I211 VanDerWaalsContact O-N 3.16Å
210N38.4Very low43.8Very low166 Ų166135.9 Ų135.989%0.88876%0.763SS**  trans-7197162.1-122.5-13.8000106.7
211I46.4Very low43.9Very low146 Ų146133.4 Ų133.475%0.74976%0.755SS**  trans-115.892.8161.9-62.1179.1000106.4C209 S213C209-I211 PolarHBondContact O-N 3.24Å; C209-I211 VanDerWaalsContact O-N 3.16Å; I211-S213 PolarHBondContact O-N 2.85Å
212S43.9Very low44Very low95 Ų95133.1 Ų133.166%0.66475%0.753SS**  trans-43.9127.9172.6-160.50000110.6N214S212-N214 PolarHBondContact O-N 3.14Å
213S42.3Very low44.4Very low110 Ų110133.7 Ų133.777%0.76976%0.757SS**  trans-52107.2165.9-49.60000109.5I211I211-S213 PolarHBondContact O-N 2.85Å
214N44.4Very low44.4Very low148 Ų148134.1 Ų134.179%0.79175%0.753SS**  trans-133.596.6158.4-89.4-30.1000108.2S212 I216S212-N214 PolarHBondContact O-N 3.14Å; N214-I216 PolarHBondContact O-N 3.45Å
215V43.4Very low44.3Very low113 Ų113132 Ų13269%0.68576%0.755SS**  trans-42.3121.6161.21760000110.5Y217V215-Y217 HydrophobicContact CG1-CD2 3.6Å; V215-Y217 HydrophobicContact CG1-CE2 3.95Å
216I42.2Very low44.3Very low144 Ų144134.1 Ų134.174%0.73876%0.759SS**  trans-135.396.5145.6-53.5-175.2000107.1N214 T218N214-I216 PolarHBondContact O-N 3.45Å; I216-T218 HydrophobicContact CG2-CG2 3.51Å; I216-T218 PolarHBondContact O-N 2.74Å; I216-T218 VanDerWaalsContact O-N 3.15Å
217Y36.8Very low44.6Very low219 Ų219133.7 Ų133.786%0.85976%0.764SS**  trans-68.499158.1-72.9-84.3000107.2V215V215-Y217 HydrophobicContact CG1-CD2 3.6Å; V215-Y217 HydrophobicContact CG1-CE2 3.95Å
218T44.8Very low44.5Very low118 Ų118134.3 Ų134.372%0.72477%0.768SS**  trans-90.1114.8162.655.40000108.4I216I216-T218 HydrophobicContact CG2-CG2 3.51Å; I216-T218 PolarHBondContact O-N 2.74Å; I216-T218 VanDerWaalsContact O-N 3.15Å
219T46.6Very low44.7Very low105 Ų105135.7 Ų135.764%0.64477%0.769SS**  trans-47.314617150.30000112.5V221T219-V221 PolarHBondContact O-N 2.89Å
220P46.6Very low45Very low130 Ų130138.2 Ų138.284%0.84477%0.774SS**  trans-71.1104.8168.629.8-28.9000108.1
221V49.3Very low46.3Very low116 Ų116135.3 Ų135.370%0.70376%0.764SS**  trans-83.7123.5174.2-1710000108.1T219T219-V221 PolarHBondContact O-N 2.89Å
222N45.5Very low47.2Very low136 Ų136134.3 Ų134.373%0.72777%0.767SS**  trans-47.8144.2173.6-69.1-45.6000112I224N222-I224 PolarHBondContact O-N 3.44Å
223P48.1Very low47.5Very low132 Ų132135.8 Ų135.886%0.85778%0.776SS**  trans-67.6102.9172.126.5-29.9000109.4S225P223-S225 PolarHBondContact O-N 3.47Å
224I45.6Very low48.4Very low130 Ų130135.7 Ų135.767%0.66778%0.775SS**  trans-67.2122.3169.4-66.4171.5000107.7N222 F226N222-I224 PolarHBondContact O-N 3.44Å; I224-F226 PolarHBondContact O-N 3.1Å
225S44.7Very low48.7Very low107 Ų107137.3 Ų137.375%0.74878%0.78SS**  trans-50.7114.4166.438.60000111.4P223P223-S225 PolarHBondContact O-N 3.47Å
226F45.6Very low49.2Very low198 Ų198137.1 Ų137.187%0.86878%0.784SS**PPolyproline II helixtrans-80.6130.5167.1-86.5-84000110.3I224I224-F226 PolarHBondContact O-N 3.1Å
227P48Very low49.6Very low120 Ų120136 Ų13678%0.77979%0.788SS**PPolyproline II helixtrans-75.6145.7170.931-30.9000111.1
228S45Very low50.6Low110 Ų110131.1 Ų131.177%0.76979%0.787SS**PPolyproline II helixtrans-57154.4-177.7-40.70000115
229Q50.6Low51.1Low190 Ų190130.8 Ų130.889%0.88879%0.789SS**  trans88.995.8143.8-141.1162.815.300117.3
230L47.4Very low51.7Low169 Ų169134.9 Ų134.989%0.88580%0.801SS**  trans-106.9139.9151.1-81.3166.2000108.9
231P64.1Low52.6Low105 Ų105134.8 Ų134.868%0.68280%0.798SS**PPolyproline II helixtrans-75.9159.2-171.731-34.3000112.7
232P66.4Low53.1Low126 Ų126136.4 Ų136.482%0.81880%0.803SS**PPolyproline II helixtrans-72.4131.3179.829-32.4000111.4S234P232-S234 PolarHBondContact O-N 2.9Å
233C49.5Very low53.5Low126 Ų126143.2 Ų143.285%0.85183%0.826SS**PPolyproline II helixtrans-67.2122.3168.9-70.90000109.9
234S62.2Low53.8Low107 Ų107143.8 Ų143.875%0.74882%0.824SS**PPolyproline II helixtrans-64.9134.417339.30000111.2P232 S236P232-S234 PolarHBondContact O-N 2.9Å; S234-S236 PolarHBondContact O-N 3.1Å
235M50.1Low54.2Low183 Ų183144.5 Ų144.590%0.90183%0.833SS**PPolyproline II helixtrans-63.3124.4165.7-67.5-8491.900109.1
236S54.4Low54.8Low109 Ų109146.6 Ų146.676%0.76284%0.837SS**  trans-116.1109.3161.247.10000108.2S234 S238S234-S236 PolarHBondContact O-N 3.1Å; S236-S238 PolarHBondContact O-N 3.35Å
237S51.2Low55.3Low119 Ų119143.5 Ų143.583%0.83284%0.836SS**  trans-63.1121.8166.748.70000109.5
238S57.4Low55.7Low117 Ų117145 Ų14582%0.81884%0.839SS**  trans-116.9107.9158.2-71.10000108.1S236S236-S238 PolarHBondContact O-N 3.35Å
239S54Low56.5Low111 Ų111147.3 Ų147.378%0.77684%0.844SS**  trans-66.7122.8164.247.10000109.6
240E60.8Low56.9Low192 Ų192144.3 Ų144.390%0.89784%0.841SS**  trans-121.5101.3158.8-98.9-178.2148.100109.2
241T64Low57.6Low128 Ų128142.4 Ų142.479%0.78584%0.837SS**  trans-78.5124.9156.9440000108.5
242N60.2Low57.1Low150 Ų150145.5 Ų145.580%0.80285%0.85SS**  trans-151.7119.6152.6-118.5-40.7000111
243K54.7Low56.2Low278 Ų278147.3 Ų147.3100%1.20985%0.853SS**  trans35.10158.3-94.3177.9171.2-174.90121.1

Retrieved 243 of 243 residues in 32.5 ms (Link to these results)