A0A060WSV1_ONCMY Loading...

Transcription factor JunD

AlphaFold DB , UniProt , Accession A0A060WSV1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110530134, Length 301 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
1M42.2Very low41.4Very low249 Ų249154.8 Ų154.8100%1.22785%0.848SS**  086.10-74.9179.4176.600107
2E40Very low40.7Very low193 Ų193154.6 Ų154.690%0.90285%0.845SS**  trans-86.1136.9166.5-72.4178.9131.200107.9
3I43Very low41.1Very low167 Ų167151.1 Ų151.186%0.85683%0.831SS**  trans-132.8135.8163-61.7179000108.9
4T40.7Very low40.9Very low111 Ų111157.9 Ų157.968%0.68184%0.839SS**  trans-96.6159.9-161.525.30000113.5
5L38.2Very low40.5Very low157 Ų157152.5 Ų152.582%0.82284%0.836SS**  trans68.8119.3141.3-89.179.5000121.7
6Y37Very low40.9Very low220 Ų220154.1 Ų154.186%0.86384%0.84SS**  trans-80.5152.8147-101.7-85.6000110.1
7P53.9Low40.9Very low123 Ų123150.7 Ų150.780%0.79984%0.838SS**  -156.4163.593.837.8-17.7000118.2
8G33.7Very low41.3Very low64 Ų64148.8 Ų148.866%0.6684%0.836SS**  trans78.8106.5145.700000118.6
9S36.7Very low41.9Very low115 Ų115148.9 Ų148.980%0.80483%0.834SS**  97.8106.875.164.50000114.1
10V43.2Very low41.8Very low147 Ų147153.2 Ų153.289%0.89184%0.838SS**  trans-143.1124.1143.2-82.80000109.5
11L46.5Very low42Very low157 Ų157151.2 Ų151.282%0.82284%0.835SS**  trans-62.1140.7171.5-82.183.7000110.7
12N33.6Very low42.3Very low152 Ų152148.5 Ų148.581%0.81381%0.813SS**  trans-142.9107.7139.3-161.2-0.7000110
13T45.2Very low42.4Very low109 Ų109147.4 Ų147.467%0.66981%0.813SS**  trans-69.3125.3172.431.90000110
14R38.6Very low42.9Very low247 Ų247144.9 Ų144.993%0.93281%0.81SS**  trans-171.6117.2142.4-105.2156.6-174.4-174.32.9112
15G35.7Very low43.5Very low77 Ų77146.6 Ų146.679%0.79481%0.812SS**  trans89.179.9134.600000116.9A17G15-A17 PolarHBondContact O-N 3.13Å
16I47Very low44.3Very low178 Ų178147.8 Ų147.891%0.91382%0.816SS**  trans-62118.2147.1-58.5178.6000107.5
17A41Very low44.9Very low96 Ų96146.8 Ų146.879%0.79382%0.816SS**  trans-176.671.5149.200000110.2G15G15-A17 PolarHBondContact O-N 3.13Å
18S47.8Very low44.9Very low116 Ų116150.7 Ų150.781%0.81182%0.82SS**  trans-93.3109.3153.4179.50000106.4
19L52.4Low45.7Very low152 Ų152154.8 Ų154.880%0.79683%0.827SS**  trans171.9143.1155.2-91.7154.5000107.6
20Y40.3Very low46.3Very low234 Ų234157.7 Ų157.792%0.91883%0.83SS**  trans89.957.7-172.2-49.7-69.5000116.2
21S45.2Very low46.6Very low111 Ų111155.2 Ų155.278%0.77682%0.819SS**  trans-94.8150.1145.5-173.40000108.7
22Y47.8Very low46.6Very low193 Ų193154.4 Ų154.476%0.75782%0.815SS**  trans79.391.9-176.1-92.4-95.7000117.9
23N44.1Very low46.9Very low170 Ų170154.2 Ų154.291%0.90981%0.814SS**  -176.663.7129.6-92.7-55.2000110.4
24S52.3Low47Very low113 Ų113156 Ų15679%0.7982%0.819SS**  trans-126.876170.5-179.70000109.6
25M53.4Low47.2Very low148 Ų148151.9 Ų151.973%0.72982%0.815SS**  trans-140.214.1177.6-83-168.17200116.3
26M55.3Low47.5Very low182 Ų182154.3 Ų154.390%0.89781%0.81SS**  trans-140.361.3171.8-62-65.6165.400112.4
27K50.2Low47.3Very low198 Ų198155.1 Ų155.186%0.86181%0.81SS**  trans-93.6102.4153.8-82.9-175.4174.6-179.70107.1
28K54Low47.7Very low205 Ų205155.1 Ų155.189%0.89180%0.804SS**  trans-94108.3166.9-121.8173.8-179.2162.80106.6M30K28-M30 PolarHBondContact O-N 3.46Å
29D49.4Very low47.9Very low150 Ų150153.8 Ų153.880%0.80280%0.795SS**  trans-66.4121.8171.3-65.6-54.2000109.1S31D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 3.1Å; D29-S31 VanDerWaalsContact O-N 3.08Å
30M49Very low47.5Very low177 Ų177153.7 Ų153.787%0.87280%0.795SS**  trans-77.784.7169.4-92.1-121.5-87.600108.7K28 L32K28-M30 PolarHBondContact O-N 3.46Å; M30-L32 PolarHBondContact O-N 2.99Å
31S49.6Very low47.7Very low95 Ų95150.7 Ų150.766%0.66479%0.794SS**  trans-76.9113162.7179.90000108.3D29 N33D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 3.1Å; D29-S31 VanDerWaalsContact O-N 3.08Å; S31-N33 PolarHBondContact O-N 2.95Å
32L46.3Very low47.6Very low140 Ų140154.9 Ų154.973%0.73380%0.798SS**  trans-8096.3171.8-59.5177.7000108M30 L34M30-L32 PolarHBondContact O-N 2.99Å; L32-L34 PolarHBondContact O-N 3.01Å
33N40.6Very low47.4Very low147 Ų147155.1 Ų155.179%0.78681%0.806SS**  trans-80.2107.5166-113-73.3000108.2S31S31-N33 PolarHBondContact O-N 2.95Å
34L48.1Very low46.9Very low148 Ų148153.7 Ų153.778%0.77580%0.799SS**  trans-87.297.5159.4-86.779.7000106.3L32L32-L34 PolarHBondContact O-N 3.01Å
35D42.1Very low46.6Very low159 Ų159156.9 Ų156.985%0.8581%0.806SS**  trans-171.5130.5139.9-96.3-34.2000111.6
36D41.8Very low46.3Very low128 Ų128160.2 Ų160.268%0.68481%0.811SS**  trans64.490.6158.3-136.610.1000121.2S38D36-S38 WeakPolarHBondContact OD1-CB 3.23Å; D36-S38 PolarHBondContact OD1-N 3.38Å; D36-S38 PolarHBondContact OD1-OG 3.48Å
37Q43.3Very low45.6Very low195 Ų195159.4 Ų159.491%0.91181%0.81SS**  trans-134.973138.3-104.9-170.26700109S39Q37-S39 PolarHBondContact O-N 3.23Å
38S48.3Very low45.3Very low97 Ų97154.5 Ų154.568%0.67881%0.806SS**  trans-83.672169.956.20000111.1D36D36-S38 WeakPolarHBondContact OD1-CB 3.23Å; D36-S38 PolarHBondContact OD1-N 3.38Å; D36-S38 PolarHBondContact OD1-OG 3.48Å
39S52.9Low44.9Very low87 Ų87152.9 Ų152.961%0.60881%0.807SS**  trans-163.6137.4158.751.60000111.4Q37Q37-S39 PolarHBondContact O-N 3.23Å
40N44Very low44.9Very low151 Ų151149.1 Ų149.181%0.80780%0.804SS**SBendtrans102.433173.7-54.3-72000119.2
41L43.8Very low44.9Very low171 Ų171148.1 Ų148.190%0.89580%0.8SS**  trans-138.768162.1-72.1175000112.4
42K43Very low44.4Very low198 Ų198152 Ų15286%0.86181%0.813SS**  trans-148.3149.4156.1-76.8-166.3179.3172.10109.8
43Q43.7Very low44.6Very low198 Ų198153.1 Ų153.193%0.92582%0.819SS**  trans89.294.8-175.5-51.6174.4-8.900110.6
44N34.3Very low44.4Very low140 Ų140150.7 Ų150.775%0.74981%0.814SS**  -170.3107.766.7-171.2-23.8000109
45L45.6Very low44.4Very low181 Ų181149.8 Ų149.895%0.94882%0.82SS**  trans-142.241.7175-119.1151.5000109.1
46R46.9Very low44.4Very low218 Ų218149.2 Ų149.282%0.82382%0.817SS**  trans-138.898.8169.6-78.7-165.5167.7-167.8-5.1106.2
47D40.3Very low44.8Very low164 Ų164152.1 Ų152.188%0.87783%0.832SS**  trans168.877.1148.6-81.7-22.2000107.7
48A44.7Very low45.6Very low95 Ų95145.3 Ų145.379%0.78581%0.813SS**  trans-124.221167.800000111.8
49D45.4Very low46Very low172 Ų172148.7 Ų148.792%0.9282%0.823SS**SBendtrans-114.164.7179.2-69-42000110.5
50G50.2Low45.9Very low70 Ų70153 Ų15372%0.72284%0.838SS**SBendtrans-163.83.4-176.700000120.1
51I47.6Very low46.2Very low157 Ų157155.1 Ų155.181%0.80584%0.84SS**SBendtrans-117.90.2-173.9-46-179.3000114N53I51-N53 VanDerWaalsContact C-N 3.28Å; I51-N53 PolarHBondContact O-N 2.85Å
52L40.1Very low46.4Very low177 Ų177152.9 Ų152.993%0.92783%0.829SS**SBendtrans-89.325.5178.7-61.8-173.1000114.8
53N50.1Low46.5Very low162 Ų162146.4 Ų146.487%0.86681%0.812SS**  trans-135.976175.7-13716000112.8I51I51-N53 VanDerWaalsContact C-N 3.28Å; I51-N53 PolarHBondContact O-N 2.85Å
54S37Very low47.1Very low97 Ų97143.6 Ų143.668%0.67881%0.808SS**  trans-163.8101.415458.60000107.8
55S46.6Very low48.2Very low128 Ų128140.6 Ų140.690%0.89580%0.797SS**  58.476.998.9-55.90000113.6
56D42.9Very low48.8Very low148 Ų148137 Ų13779%0.79178%0.779SS**  -173101.4127.5-1604.7000110.8G58D56-G58 PolarHBondContact O-N 3.37Å
57L50.8Low49.5Very low189 Ų189131 Ų13199%0.9976%0.762SS**  trans-94.477.6173.2-71.5171.1000108.4
58G59.3Low50.4Low51 Ų51129.3 Ų129.353%0.52675%0.749SS.*  trans-123.8-15.3-16800000118.7D56D56-G58 PolarHBondContact O-N 3.37Å
59L56.5Low51.4Low169 Ų169133.7 Ų133.789%0.88575%0.745SS**SBendtrans-135.49.4-163.4-74.1173.6000118.1
60L50.7Low52.3Low176 Ų176130.7 Ų130.792%0.92173%0.729SS**  trans-131.348.7176.2-13378.3000112.4L62L60-L62 PolarHBondContact O-N 3.03Å
61K50.9Low53Low197 Ų197131.8 Ų131.886%0.85772%0.717SS**  trans-98.759.6173.3-148.3172.8-174.8174.60110A63K61-A63 PolarHBondContact O-N 3.22Å; K61-A63 VanDerWaalsContact O-N 3.13Å
62L47.4Very low53.7Low124 Ų124129.6 Ų129.665%0.64971%0.706SS**  trans-78.983.9152.6-65-176.9000105.8L60 T64 L67L60-L62 PolarHBondContact O-N 3.03Å; L62-T64 PolarHBondContact O-N 3.41Å; L62-L67 HydrophobicContact CD1-CD1 4.15Å
63A45.5Very low54.6Low62 Ų62128.9 Ų128.951%0.51270%0.697SS.*  trans-54.2140.6163.700000108K61 P65K61-A63 PolarHBondContact O-N 3.22Å; K61-A63 VanDerWaalsContact O-N 3.13Å; A63-P65 VanDerWaalsContact C-N 3.29Å; A63-P65 WeakPolarHBondContact O-CD 3.33Å
64T55.9Low54.8Low138 Ų138124.9 Ų124.985%0.84768%0.682SS**THydrogen-bonded Turntrans-6079.7173-34.60000109.9L62L62-T64 PolarHBondContact O-N 3.41Å
65P58.3Low55.8Low78 Ų78126.7 Ų126.751%0.50669%0.685SS.*THydrogen-bonded Turn-145.5-612123.4-2.1000115.1A63A63-P65 VanDerWaalsContact C-N 3.29Å; A63-P65 WeakPolarHBondContact O-CD 3.33Å
66D57.1Low56.3Low106 Ų106123.9 Ų123.957%0.56768%0.676SS**Hα-helixtrans-88.4-29.3-176.4-88.3-18.5000113.6E68 R69 L70D66-E68 VanDerWaalsContact C-N 3.32Å; D66-E68 PolarHBondContact O-N 2.89Å; D66-R69 PolarHBondContact O-N 3.41Å; D66-L70 PolarHBondContact O-N 3.13Å
67L62Low56.8Low91 Ų91125 Ų12548%0.47668%0.678SS.*Hα-helixtrans-66-35.7177.4-162.481000111.9L62 L70 I71L62-L67 HydrophobicContact CD1-CD1 4.15Å; L67-L70 PolarHBondContact O-N 3.41Å; L67-I71 HydrophobicContact CG-CD1 4.34Å; L67-I71 WeakPolarHBondContact O-CG1 3.43Å; L67-I71 PolarHBondContact O-N 2.99Å; L67-I71 VanDerWaalsContact O-N 3.11Å
68E60Low56.5Low129 Ų129122.9 Ų122.960%0.60367%0.673SS**Hα-helixtrans-64.8-39.4177.6-171.7178.2-178.400111.5D66 I71 I72D66-E68 VanDerWaalsContact C-N 3.32Å; D66-E68 PolarHBondContact O-N 2.89Å; E68-I71 PolarHBondContact O-N 3.41Å; E68-I72 HydrophobicContact CG-CD1 4.01Å; E68-I72 VanDerWaalsContact O-CG1 3.28Å; E68-I72 WeakPolarHBondContact O-CG1 3.47Å; E68-I72 PolarHBondContact O-N 3.3Å
69R64.6Low55.7Low186 Ų186126.1 Ų126.170%0.70268%0.682SS**Hα-helixtrans-66.5-37.3176.2-68.3-172.2178.7-169.81.5112.4D66 Q73D66-R69 PolarHBondContact O-N 3.41Å; R69-Q73 VanDerWaalsContact O-CB 3.31Å; R69-Q73 WeakPolarHBondContact O-CB 3.4Å; R69-Q73 PolarHBondContact O-N 3.26Å
70L65.3Low55.1Low110 Ų110124.1 Ų124.158%0.57668%0.677SS**Hα-helixtrans-65.5-41.3176.3-172.271.1000111.8D66 L67 Q73 S74D66-L70 PolarHBondContact O-N 3.13Å; L67-L70 PolarHBondContact O-N 3.41Å; L70-Q73 PolarHBondContact O-N 3.07Å; L70-S74 WeakPolarHBondContact O-CB 3.31Å; L70-S74 PolarHBondContact O-N 3.03Å
71I64.6Low54.7Low92 Ų92122.3 Ų122.347%0.47267%0.674SS.*Hα-helixtrans-67.1-43.7178.4-66.7168.8000110.6L67 E68 Q73 S74L67-I71 HydrophobicContact CG-CD1 4.34Å; L67-I71 WeakPolarHBondContact O-CG1 3.43Å; L67-I71 PolarHBondContact O-N 2.99Å; L67-I71 VanDerWaalsContact O-N 3.11Å; E68-I71 PolarHBondContact O-N 3.41Å; I71-Q73 VanDerWaalsContact C-N 3.35Å; I71-Q73 PolarHBondContact O-N 3.45Å; I71-S74 PolarHBondContact O-N 3.43Å; I71-S74 PolarHBondContact O-OG 3.16Å
72I62.1Low54.2Low112 Ų112118.9 Ų118.957%0.57467%0.672SS**Hα-helixtrans-64.1-39.6176.9-66.2166.1000111.3E68 S74 N75E68-I72 HydrophobicContact CG-CD1 4.01Å; E68-I72 VanDerWaalsContact O-CG1 3.28Å; E68-I72 WeakPolarHBondContact O-CG1 3.47Å; E68-I72 PolarHBondContact O-N 3.3Å; I72-S74 VanDerWaalsContact C-N 3.31Å; I72-S74 PolarHBondContact O-N 3.33Å; I72-N75 PolarHBondContact O-N 3.46Å
73Q59.1Low54Low161 Ų161118.7 Ų118.775%0.75268%0.676SS**Hα-helixtrans-69.3-28.5177.3-167.3172.235.400112.7R69 L70 I71 N75R69-Q73 VanDerWaalsContact O-CB 3.31Å; R69-Q73 WeakPolarHBondContact O-CB 3.4Å; R69-Q73 PolarHBondContact O-N 3.26Å; L70-Q73 PolarHBondContact O-N 3.07Å; I71-Q73 VanDerWaalsContact C-N 3.35Å; I71-Q73 PolarHBondContact O-N 3.45Å; Q73-N75 VanDerWaalsContact C-N 3.33Å; Q73-N75 PolarHBondContact O-N 2.99Å
74S54.8Low53.7Low78 Ų78120.3 Ų120.355%0.54568%0.684SS.*Hα-helixtrans-76.4-14179.974.90000114.8L70 I71 I72 G76L70-S74 WeakPolarHBondContact O-CB 3.31Å; L70-S74 PolarHBondContact O-N 3.03Å; I71-S74 PolarHBondContact O-N 3.43Å; I71-S74 PolarHBondContact O-OG 3.16Å; I72-S74 VanDerWaalsContact C-N 3.31Å; I72-S74 PolarHBondContact O-N 3.33Å; S74-G76 PolarHBondContact O-N 2.87Å; S74-G76 VanDerWaalsContact O-N 3.12Å
75N57.7Low53.6Low136 Ų136121.6 Ų121.673%0.72768%0.68SS**THydrogen-bonded Turntrans-76.210.6178.4-75.5-12.1000114.5I72 Q73I72-N75 PolarHBondContact O-N 3.46Å; Q73-N75 VanDerWaalsContact C-N 3.33Å; Q73-N75 PolarHBondContact O-N 2.99Å
76G56.2Low52.7Low69 Ų69125.7 Ų125.771%0.71169%0.69SS**THydrogen-bonded Turntrans-93.5-7.2-176.700000116.6S74S74-G76 PolarHBondContact O-N 2.87Å; S74-G76 VanDerWaalsContact O-N 3.12Å
77M53.8Low52.2Low171 Ų171128.9 Ų128.984%0.84271%0.706SS**SBendtrans-16164.9-173.5-160.5172.66700114.7
78V45.4Very low51.3Low144 Ų144134.3 Ų134.387%0.87372%0.722SS**  trans-147.6127151.3-177.50000110.5
79T41.1Very low50.8Low119 Ų119133.7 Ų133.773%0.7373%0.729SS**  trans-52.5126.4178.5-620000115.8
80T45.1Very low50Low127 Ų127134.5 Ų134.578%0.77974%0.738SS**  trans12117.9147.665.50000119.9
81T41Very low49.3Very low138 Ų138133.7 Ų133.785%0.84774%0.741SS**  trans-121.5140.11499.30000108.9
82P40.3Very low48.8Very low125 Ų125132.7 Ų132.781%0.81275%0.747SS**  trans-75.4134.5-161.929.5-33.7000112.9S84P82-S84 PolarHBondContact O-N 3.49Å
83T44.9Very low48.6Very low121 Ų121131.4 Ų131.474%0.74275%0.747SS**  trans-38.3112.3166.6-56.90000113.3Q85T83-Q85 HydrophobicContact CG2-CG 3.71Å
84S38.6Very low48.6Very low96 Ų96129.2 Ų129.267%0.67174%0.741SS**  trans-97.5110.1154.2-173.90000107.7P82 F86P82-S84 PolarHBondContact O-N 3.49Å; S84-F86 PolarHBondContact O-N 3.32Å; S84-F86 VanDerWaalsContact O-N 3.12Å
85Q53Low49Very low165 Ų165132.9 Ų132.977%0.77175%0.749SS**  trans-72.995.1177.9-59.5-178.6-14.300109.3T83T83-Q85 HydrophobicContact CG2-CG 3.71Å
86F40.7Very low49.1Very low164 Ų164132.4 Ų132.472%0.71974%0.743SS**  trans-131.799.2157.7-79.6-80.7000108.5S84 Y88S84-F86 PolarHBondContact O-N 3.32Å; S84-F86 VanDerWaalsContact O-N 3.12Å; F86-Y88 HydrophobicContact CB-CD2 4.28Å; F86-Y88 HydrophobicContact CB-CE2 4.38Å; F86-Y88 PolarHBondContact O-N 2.88Å; F86-Y88 VanDerWaalsContact O-N 3.08Å
87L44.9Very low49.5Very low172 Ų172135.8 Ų135.890%0.90174%0.74SS**  trans-61102.6161.8-89.871.5000107.6
88Y43.3Very low50.3Low205 Ų205136 Ų13680%0.80474%0.737SS**  trans-91.9124.8161-94.8-89.8000108.7F86 K90F86-Y88 HydrophobicContact CB-CD2 4.28Å; F86-Y88 HydrophobicContact CB-CE2 4.38Å; F86-Y88 PolarHBondContact O-N 2.88Å; F86-Y88 VanDerWaalsContact O-N 3.08Å; Y88-K90 PolarHBondContact O-N 3.32Å
89P50Low51.9Low117 Ų117131.5 Ų131.576%0.7672%0.715SS**  trans-66.3126.5169-13.728.3000109.4S91P89-S91 PolarHBondContact O-N 2.88Å; P89-S91 VanDerWaalsContact O-N 3.16Å
90K49Very low53.7Low203 Ų203131.7 Ų131.788%0.88371%0.707SS**  trans-58.4111.3165.7-102.2-174.9172.5179.90109.4Y88Y88-K90 PolarHBondContact O-N 3.32Å
91S48.5Very low55.7Low92 Ų92127.7 Ų127.764%0.64369%0.692SS**  trans-114.978.5150.355.90000108.1P89 S93P89-S91 PolarHBondContact O-N 2.88Å; P89-S91 VanDerWaalsContact O-N 3.16Å; S91-S93 PolarHBondContact O-N 2.89Å
92A54.3Low57.8Low72 Ų72128 Ų12860%0.59568%0.682SS**THydrogen-bonded Turntrans-7336.7178.300000112.9
93S58.5Low60.1Low84 Ų84126.6 Ų126.659%0.58767%0.671SS**THydrogen-bonded Turntrans-102.5-43179.7-160.70000111.4S91 E95 Q96S91-S93 PolarHBondContact O-N 2.89Å; S93-E95 PolarHBondContact O-N 3.43Å; S93-Q96 PolarHBondContact O-N 3.26Å
94D59.9Low62.2Low115 Ų115127.3 Ų127.362%0.61566%0.664SS**Hα-helixtrans-73.8-28.2-172.7-65.4-1.9000113.2Q96 F98D94-Q96 VanDerWaalsContact C-N 3.32Å; D94-F98 PolarHBondContact O-N 3.45Å; D94-F98 VanDerWaalsContact O-N 3.16Å
95E61.7Low64.7Low155 Ų155125.6 Ų125.672%0.72466%0.655SS**Hα-helixtrans-73.2-27.8178.2-159.4174-167.900112S93 A99S93-E95 PolarHBondContact O-N 3.43Å; E95-A99 PolarHBondContact O-N 3.13Å; E95-A99 VanDerWaalsContact O-N 3.13Å
96Q61.1Low66.6Low126 Ų126122 Ų12259%0.58964%0.641SS**Hα-helixtrans-72-42.9177.6-1507722.400110.8S93 D94 F98 A99 E100S93-Q96 PolarHBondContact O-N 3.26Å; D94-Q96 VanDerWaalsContact C-N 3.32Å; Q96-F98 VanDerWaalsContact C-N 3.35Å; Q96-A99 PolarHBondContact O-N 3.05Å; Q96-E100 WeakPolarHBondContact O-CG 3.27Å; Q96-E100 PolarHBondContact O-N 2.88Å
97E63.8Low68.9Low141 Ų141119.1 Ų119.166%0.65963%0.629SS**Hα-helixtrans-68.1-34.7176.9-161.8175.5-168.100111.8E100 G101E97-E100 PolarHBondContact O-N 3.15Å; E97-G101 PolarHBondContact O-N 3.43Å
98F71.3Confident71.1Confident174 Ų174115 Ų11576%0.76361%0.608SS**Hα-helixtrans-62.7-40.5171.9-177.9-99000112.4D94 Q96D94-F98 PolarHBondContact O-N 3.45Å; D94-F98 VanDerWaalsContact O-N 3.16Å; Q96-F98 VanDerWaalsContact C-N 3.35Å
99A78.5Confident73.2Confident51 Ų51109.5 Ų109.542%0.42159%0.592SS.*Hα-helixtrans-71.5-36.9176.500000112.5E95 Q96 G101 F102 V103E95-A99 PolarHBondContact O-N 3.13Å; E95-A99 VanDerWaalsContact O-N 3.13Å; Q96-A99 PolarHBondContact O-N 3.05Å; A99-G101 VanDerWaalsContact C-N 3.33Å; A99-G101 PolarHBondContact O-N 3.46Å; A99-F102 PolarHBondContact O-N 3.13Å; A99-V103 PolarHBondContact O-N 2.91Å
100E78.9Confident74.8Confident122 Ų122110 Ų11057%0.5758%0.584SS**Hα-helixtrans-63.1-36.1177.3-76.8178.4-165.500112.6Q96 E97 F102 V103 K104Q96-E100 WeakPolarHBondContact O-CG 3.27Å; Q96-E100 PolarHBondContact O-N 2.88Å; E97-E100 PolarHBondContact O-N 3.15Å; E100-F102 VanDerWaalsContact C-N 3.3Å; E100-F102 PolarHBondContact O-N 3.1Å; E100-V103 PolarHBondContact O-N 3.1Å; E100-K104 WeakPolarHBondContact O-CB 3.33Å; E100-K104 PolarHBondContact O-N 3.45Å
101G87.6Confident76.6Confident44 Ų44104.8 Ų104.845%0.45456%0.561SS.*Hα-helixtrans-59.6-38.417600000113.4E97 A99 A105E97-G101 PolarHBondContact O-N 3.43Å; A99-G101 VanDerWaalsContact C-N 3.33Å; A99-G101 PolarHBondContact O-N 3.46Å; G101-A105 WeakPolarHBondContact O-CB 3.49Å; G101-A105 PolarHBondContact O-N 2.9Å; G101-A105 VanDerWaalsContact O-N 3.09Å
102F84.6Confident78Confident144 Ų144106.9 Ų106.963%0.63256%0.561SS**Hα-helixtrans-71-41.7177.2-173.4-100.3000112.1A99 E100 A105 L106A99-F102 PolarHBondContact O-N 3.13Å; E100-F102 VanDerWaalsContact C-N 3.3Å; E100-F102 PolarHBondContact O-N 3.1Å; F102-A105 PolarHBondContact O-N 3.39Å; F102-L106 HydrophobicContact CD1-CD1 3.84Å; F102-L106 HydrophobicContact CE1-CD1 3.39Å; F102-L106 HydrophobicContact CE1-CG 4.29Å; F102-L106 HydrophobicContact CZ-CD1 3.96Å; F102-L106 HydrophobicContact CZ-CG 4.5Å; F102-L106 PolarHBondContact O-N 2.82Å; F102-L106 VanDerWaalsContact O-N 3.1Å
103V89.6Confident78.9Confident96 Ų96107.7 Ų107.758%0.58256%0.555SS**Hα-helixtrans-63.7-44.2177.3175.80000111A99 E100 L106 E107A99-V103 PolarHBondContact O-N 2.91Å; E100-V103 PolarHBondContact O-N 3.1Å; V103-L106 PolarHBondContact O-N 3.5Å; V103-E107 PolarHBondContact O-N 2.93Å
104K88.8Confident79.3Confident136 Ų136109.9 Ų109.959%0.59156%0.557SS**Hα-helixtrans-64.8-41.3178.3-170.5-178.1178.6-163.70112.3E100 L106 E107 D108E100-K104 WeakPolarHBondContact O-CB 3.33Å; E100-K104 PolarHBondContact O-N 3.45Å; K104-L106 VanDerWaalsContact C-N 3.34Å; K104-L106 PolarHBondContact O-N 3.42Å; K104-E107 PolarHBondContact O-N 2.89Å; K104-D108 PolarHBondContact O-N 3.33Å
105A90.7Very high79.3Confident59 Ų59112 Ų11249%0.48857%0.567SS.*Hα-helixtrans-64.3-37.3176.700000112.5G101 F102 L109G101-A105 WeakPolarHBondContact O-CB 3.49Å; G101-A105 PolarHBondContact O-N 2.9Å; G101-A105 VanDerWaalsContact O-N 3.09Å; F102-A105 PolarHBondContact O-N 3.39Å; A105-L109 WeakPolarHBondContact O-CB 3.38Å; A105-L109 PolarHBondContact O-N 3.33Å
106L92.5Very high78.8Confident91 Ų91108.6 Ų108.648%0.47656%0.56SS.*Hα-helixtrans-65.7-40172.9-83.1169.5000112.1F102 V103 K104 L109 H110F102-L106 HydrophobicContact CD1-CD1 3.84Å; F102-L106 HydrophobicContact CE1-CD1 3.39Å; F102-L106 HydrophobicContact CE1-CG 4.29Å; F102-L106 HydrophobicContact CZ-CD1 3.96Å; F102-L106 HydrophobicContact CZ-CG 4.5Å; F102-L106 PolarHBondContact O-N 2.82Å; F102-L106 VanDerWaalsContact O-N 3.1Å; V103-L106 PolarHBondContact O-N 3.5Å; K104-L106 VanDerWaalsContact C-N 3.34Å; K104-L106 PolarHBondContact O-N 3.42Å; L106-L109 PolarHBondContact O-N 3.25Å; L106-H110 WeakPolarHBondContact O-CB 3.3Å; L106-H110 PolarHBondContact O-N 3.46Å
107E88.3Confident78.1Confident102 Ų102111.3 Ų111.348%0.47757%0.573SS.*Hα-helixtrans-64.5-44176.3-162.4-168.7171.600111.9V103 K104 L109 H110 K111V103-E107 PolarHBondContact O-N 2.93Å; K104-E107 PolarHBondContact O-N 2.89Å; E107-L109 PolarHBondContact O-N 3.24Å; E107-H110 PolarHBondContact O-N 3.44Å; E107-K111 VanDerWaalsContact CD-NZ 3.26Å; E107-K111 WeakPolarHBondContact O-CG 3.43Å; E107-K111 PolarHBondContact O-N 3.48Å; E107-K111 VanDerWaalsContact OE1-CE 3.29Å; E107-K111 WeakPolarHBondContact OE1-CE 3.44Å; E107-K111 IonicContact OE1-NZ 2.83Å; E107-K111 PolarHBondContact OE1-NZ 3.17Å; E107-K111 IonicContact OE2-NZ 3.73Å
108D91.4Very high77.5Confident86 Ų86107.6 Ų107.646%0.4657%0.573SS.*Hα-helixtrans-63.9-39.4176.9-81.1-8.4000111.9K104 H110 K111 Q112K104-D108 PolarHBondContact O-N 3.33Å; D108-H110 VanDerWaalsContact C-N 3.33Å; D108-H110 PolarHBondContact O-N 2.98Å; D108-K111 PolarHBondContact O-N 3.46Å; D108-Q112 WeakPolarHBondContact O-CB 3.47Å; D108-Q112 PolarHBondContact O-N 3.07Å
109L89.2Confident75.8Confident90 Ų90105.8 Ų105.847%0.47158%0.576SS.*Hα-helixtrans-62.5-41.1173.2-175.669000111.7A105 L106 E107 K111 Q112 N113A105-L109 WeakPolarHBondContact O-CB 3.38Å; A105-L109 PolarHBondContact O-N 3.33Å; L106-L109 PolarHBondContact O-N 3.25Å; E107-L109 PolarHBondContact O-N 3.24Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 3.17Å; L109-Q112 PolarHBondContact O-N 3.05Å; L109-N113 PolarHBondContact O-N 3.24Å
110H82.6Confident73.6Confident127 Ų127109.1 Ų109.159%0.58860%0.595SS**Hα-helixtrans-67.1-34.4179.1-143.9177.5000111.7L106 E107 D108 Q114L106-H110 WeakPolarHBondContact O-CB 3.3Å; L106-H110 PolarHBondContact O-N 3.46Å; E107-H110 PolarHBondContact O-N 3.44Å; D108-H110 VanDerWaalsContact C-N 3.33Å; D108-H110 PolarHBondContact O-N 2.98Å; H110-Q114 WeakPolarHBondContact O-CG 3.46Å; H110-Q114 PolarHBondContact O-N 2.95Å; H110-Q114 VanDerWaalsContact O-N 3.16Å; H110-Q114 PolarHBondContact O-NE2 3.44Å
111K86Confident71.7Confident93 Ų93107.8 Ų107.840%0.40461%0.605SS.*Hα-helixtrans-68.2-40.3171.5-72.4169.8-176.5164.60111.7E107 D108 L109 Q114 L115E107-K111 VanDerWaalsContact CD-NZ 3.26Å; E107-K111 WeakPolarHBondContact O-CG 3.43Å; E107-K111 PolarHBondContact O-N 3.48Å; E107-K111 VanDerWaalsContact OE1-CE 3.29Å; E107-K111 WeakPolarHBondContact OE1-CE 3.44Å; E107-K111 IonicContact OE1-NZ 2.83Å; E107-K111 PolarHBondContact OE1-NZ 3.17Å; E107-K111 IonicContact OE2-NZ 3.73Å; D108-K111 PolarHBondContact O-N 3.46Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 3.17Å; K111-Q114 PolarHBondContact O-N 3.48Å; K111-L115 WeakPolarHBondContact O-CG 2.88Å; K111-L115 PolarHBondContact O-N 2.93Å; K111-L115 VanDerWaalsContact O-N 3.09Å
112Q79.4Confident69.6Low136 Ų136111.8 Ų111.864%0.63662%0.623SS**Hα-helixtrans-65.3-40.8177.6-173.4176.7-40.700112.3D108 L109 S116D108-Q112 WeakPolarHBondContact O-CB 3.47Å; D108-Q112 PolarHBondContact O-N 3.07Å; L109-Q112 PolarHBondContact O-N 3.05Å; Q112-S116 PolarHBondContact O-N 3.36Å; Q112-S116 PolarHBondContact O-OG 3.38Å
113N73.1Confident67.9Low89 Ų89110.7 Ų110.748%0.47663%0.63SS.*Hα-helixtrans-67.9-40.3175.6-84-32.1000112.2L109 L115 S116L109-N113 PolarHBondContact O-N 3.24Å; N113-L115 VanDerWaalsContact C-N 3.34Å; N113-L115 PolarHBondContact O-N 3.48Å; N113-S116 PolarHBondContact O-N 2.86Å; N113-S116 PolarHBondContact O-OG 3.47Å; N113-S116 VanDerWaalsContact O-OG 3.08Å
114Q66.2Low65.2Low131 Ų131114.6 Ų114.661%0.61264%0.642SS**Hα-helixtrans-68.1-28.9177.9-75.4173.997.300113.9H110 K111 S116H110-Q114 WeakPolarHBondContact O-CG 3.46Å; H110-Q114 PolarHBondContact O-N 2.95Å; H110-Q114 VanDerWaalsContact O-N 3.16Å; H110-Q114 PolarHBondContact O-NE2 3.44Å; K111-Q114 PolarHBondContact O-N 3.48Å; Q114-S116 VanDerWaalsContact C-N 3.32Å
115L60Low63Low160 Ų160118 Ų11884%0.83865%0.651SS**THydrogen-bonded Turntrans-85-1.1176.4-67.2171.9000113.8K111 N113K111-L115 WeakPolarHBondContact O-CG 2.88Å; K111-L115 PolarHBondContact O-N 2.93Å; K111-L115 VanDerWaalsContact O-N 3.09Å; N113-L115 VanDerWaalsContact C-N 3.34Å; N113-L115 PolarHBondContact O-N 3.48Å
116S51.9Low60.6Low82 Ų82122.9 Ų122.957%0.57367%0.668SS**THydrogen-bonded Turntrans-1137-178.857.30000114.9Q112 N113 Q114 G118Q112-S116 PolarHBondContact O-N 3.36Å; Q112-S116 PolarHBondContact O-OG 3.38Å; N113-S116 PolarHBondContact O-N 2.86Å; N113-S116 PolarHBondContact O-OG 3.47Å; N113-S116 VanDerWaalsContact O-OG 3.08Å; Q114-S116 VanDerWaalsContact C-N 3.32Å; S116-G118 PolarHBondContact O-N 3.23Å
117E46.3Very low58Low183 Ų183123.1 Ų123.186%0.85567%0.67SS**  trans-87.382.7168.3-72.2-171.4168.100111.2
118G49.7Very low55.4Low64 Ų64126.7 Ų126.766%0.6669%0.691SS**  trans-175.585170.500000113.7S116S116-G118 PolarHBondContact O-N 3.23Å
119T36.6Very low52.9Low136 Ų136130.7 Ų130.783%0.83471%0.711SS**  trans-173.5111.5143.2-72.30000111.9
120C33.2Very low50.2Low120 Ų120129.4 Ų129.481%0.81172%0.72SS**  trans56.4113.5139.5-65.30000125.2
121A37.4Very low48Very low95 Ų95129.5 Ų129.579%0.78573%0.734SS**  84.2128.9122.500000122
122P43.4Very low45.7Very low127 Ų127133.2 Ų133.283%0.82576%0.759SS**  trans-106.5152.2167.438.6-27.9000113.1
123P49.8Very low43.5Very low121 Ų121131.7 Ų131.779%0.78677%0.769SS**  trans-127.6156150.237.1-24.7000109.5
124E33.5Very low41.8Very low178 Ų178132 Ų13283%0.83278%0.784SS**  cis-159.6145.6-7.4-111.2-163153.600104.5
125R42.7Very low40.8Very low207 Ų207131.4 Ų131.478%0.78179%0.792SS**  trans-69.2132.8166.2-81-179.168.2140.60.6108.8D127R125-D127 IonicContact CZ-OD1 3.77Å; R125-D127 IonicContact NE-OD1 2.79Å; R125-D127 IonicContact NH2-OD1 3.71Å; R125-D127 PolarHBondContact NH2-OD1 3.34Å
126L39.6Very low39.5Very low162 Ų162130.9 Ų130.985%0.84880%0.795SS**  trans-122.3117.8151.1-13394.6000109.4
127D37.3Very low38.7Very low97 Ų97130 Ų13052%0.51980%0.799SS.*  trans-67.8137.5171.8-61.5-58.2000110.2R125R125-D127 IonicContact CZ-OD1 3.77Å; R125-D127 IonicContact NE-OD1 2.79Å; R125-D127 IonicContact NH2-OD1 3.71Å; R125-D127 PolarHBondContact NH2-OD1 3.34Å
128L34.1Very low38.1Very low176 Ų176129.2 Ų129.292%0.92180%0.8SS**  trans-15188.3148.7-133.474.4000110
129I38.1Very low37.7Very low170 Ų170131.3 Ų131.387%0.87280%0.802SS**  trans-81.3128.7166.3-67.3169.1000107.4
130G32.5Very low37.8Very low64 Ų64129.8 Ų129.866%0.6680%0.797SS**  trans-175.286.9173.500000115.1
131S36.3Very low37.9Very low128 Ų128132 Ų13290%0.89580%0.8SS**  trans103.6113.7143.7-50.20000119.2
132N38.4Very low38.4Very low172 Ų172134.1 Ų134.192%0.9280%0.798SS**  trans-58.8137.1164.7-75.3-50.5000113.2
133A33.3Very low38.8Very low103 Ų103133.1 Ų133.185%0.85179%0.791SS**  trans-158.5118.6139.600000109.4
134A37Very low38.6Very low95 Ų95133.9 Ų133.979%0.78579%0.793SS**  trans-94.2-175.6168.200000109.6
135P45.1Very low39Very low119 Ų119135.1 Ų135.177%0.77379%0.792SS**  -122151-69.634.4-20.6000110.5
136V33.9Very low38.9Very low150 Ų150131.6 Ų131.691%0.90979%0.794SS**  trans-129.3118.1166.3176.80000108.6
137G35.1Very low39.3Very low64 Ų64129.6 Ų129.666%0.6679%0.788SS**  trans-81.7156.818000000113.1
138L34.2Very low40.1Very low166 Ų166133.3 Ų133.387%0.86981%0.807SS**  trans-176.7152.6139-95.1164.4000107.7
139P39.7Very low40.9Very low108 Ų108131.8 Ų131.870%0.70180%0.8SS**  trans-81140.3-151.533.5-35.7000111.9
140S39Very low41.3Very low104 Ų104130.4 Ų130.473%0.72779%0.794SS**  trans-104102168-50.60000107.9L142S140-L142 PolarHBondContact O-N 2.95Å
141D35.8Very low41.8Very low165 Ų165139.3 Ų139.388%0.88281%0.81SS**  trans-60.7111166.7-87.4-33.3000109
142L46.8Very low42.4Very low140 Ų140136.5 Ų136.573%0.73380%0.801SS**  trans-77.6145.1167.8-91.876.5000109.7S140 V144S140-L142 PolarHBondContact O-N 2.95Å; L142-V144 PolarHBondContact O-N 3.11Å; L142-V144 VanDerWaalsContact O-N 3.17Å
143P52.1Low42.9Very low106 Ų106136 Ų13669%0.68880%0.798SS**  trans-67.3116.6173.927-31.3000110.2Y145P143-Y145 PolarHBondContact O-N 3.34Å; P143-Y145 VanDerWaalsContact O-N 3.07Å
144V46.6Very low43.2Very low138 Ų138136.9 Ų136.984%0.83680%0.798SS**  trans-59.2106.9170.91760000108.9L142L142-V144 PolarHBondContact O-N 3.11Å; L142-V144 VanDerWaalsContact O-N 3.17Å
145Y40.7Very low43.9Very low204 Ų204138 Ų13880%0.880%0.797SS**  trans-76.8123.4165.2-95-94.6000108.7P143 T147P143-Y145 PolarHBondContact O-N 3.34Å; P143-Y145 VanDerWaalsContact O-N 3.07Å; Y145-T147 PolarHBondContact O-N 3.03Å
146T40.9Very low43.7Very low133 Ų133140.4 Ų140.482%0.81680%0.803SS**  trans-64.5102.3178.448.80000110.8
147T48.6Very low44.6Very low119 Ų119136.8 Ų136.873%0.7380%0.796SS**  trans-83.3114.916450.10000108.8Y145 N149Y145-T147 PolarHBondContact O-N 3.03Å; T147-N149 VanDerWaalsContact C-N 3.28Å; T147-N149 PolarHBondContact O-N 3.38Å; T147-N149 VanDerWaalsContact O-N 3.1Å
148L54.1Low44.8Very low175 Ų175139.9 Ų139.992%0.91680%0.802SS**SBendtrans-85.569.3179.9-152.3147.2000108.6
149N51.8Low45.2Very low144 Ų144138.7 Ų138.777%0.7780%0.802SS**  trans-160.544.9175.3-14962.8000115.2T147T147-N149 VanDerWaalsContact C-N 3.28Å; T147-N149 PolarHBondContact O-N 3.38Å; T147-N149 VanDerWaalsContact O-N 3.1Å
150D44.6Very low45.2Very low142 Ų142138.5 Ų138.576%0.75980%0.799SS**  trans-145.284.6169.9-92.9-39.7000111.2
151Y44.7Very low45.3Very low251 Ų251140.7 Ų140.798%0.98480%0.802SS**  trans-147.689154.9-84.5-75.6000108.8
152G47.7Very low45.2Very low68 Ų68142.4 Ų142.470%0.70180%0.798SS**  trans-160.452.1177.300000112.4
153N48.7Very low44.6Very low162 Ų162140.8 Ų140.887%0.86680%0.798SS**  trans161.698.5145.4-93.1-0.7000112
154S40.2Very low43.9Very low122 Ų122141.9 Ų141.985%0.85380%0.803SS**  trans-173150132.9-97.90000112.6
155P50.9Low43.4Very low118 Ų118141.5 Ų141.577%0.76680%0.797SS**  trans-95.8105-163.935-26.2000110.4
156L42.8Very low43.5Very low169 Ų169137.4 Ų137.489%0.88579%0.793SS**  trans-154.4123.6155.4-146.963.7000109.8T158L156-T158 PolarHBondContact O-N 3Å
157G51.6Low43.5Very low75 Ų75137.3 Ų137.377%0.77379%0.786SS**  trans-59.1132.6-172.100000112.9
158T38.8Very low43Very low128 Ų128137 Ų13779%0.78579%0.786SS**  trans-146.8102.8149.7-28.40000107.3L156 V160L156-T158 PolarHBondContact O-N 3Å; T158-V160 PolarHBondContact O-N 3.44Å; T158-V160 VanDerWaalsContact O-N 3.15Å
159T42.4Very low42.3Very low141 Ų141138.3 Ų138.387%0.86579%0.785SS**  trans-71.6102.7176.558.30000108.5
160V40.9Very low42.3Very low104 Ų104136.4 Ų136.463%0.6378%0.78SS**  trans-105.5105.1161.9-92.40000107.9T158 Y162T158-V160 PolarHBondContact O-N 3.44Å; T158-V160 VanDerWaalsContact O-N 3.15Å; V160-Y162 HydrophobicContact CG2-CE1 4.35Å; V160-Y162 WeakPolarHBondContact O-CD1 3.31Å; V160-Y162 WeakPolarHBondContact O-CE1 3.41Å; V160-Y162 PolarHBondContact O-N 3.49Å
161N40.6Very low43Very low151 Ų151135.1 Ų135.181%0.80778%0.779SS**  trans-74.5103.8-179.7-167.214.3000109.1
162Y33.9Very low43.1Very low200 Ų200128.7 Ų128.778%0.78477%0.769SS**  trans-95.9103.3166.316.4-93.5000108.5V160 T164V160-Y162 HydrophobicContact CG2-CE1 4.35Å; V160-Y162 WeakPolarHBondContact O-CD1 3.31Å; V160-Y162 WeakPolarHBondContact O-CE1 3.41Å; V160-Y162 PolarHBondContact O-N 3.49Å; Y162-T164 PolarHBondContact O-N 3.23Å; Y162-T164 VanDerWaalsContact O-N 3.12Å
163S34.9Very low43.1Very low107 Ų107130.8 Ų130.875%0.74877%0.77SS**  trans-61.4110.7164.8-68.20000109.1D165S163-D165 PolarHBondContact O-N 3.47Å
164T37.1Very low43Very low129 Ų129128.6 Ų128.679%0.79177%0.767SS**  trans-7797.1163.1-179.70000107.9Y162 T166Y162-T164 PolarHBondContact O-N 3.23Å; Y162-T164 VanDerWaalsContact O-N 3.12Å; T164-T166 PolarHBondContact O-N 3.12Å
165D34.8Very low42.8Very low130 Ų130130.1 Ų130.170%0.69577%0.766SS**  trans-88.490.3175.3-150.9-3.2000108.9S163 I167S163-D165 PolarHBondContact O-N 3.47Å; D165-I167 PolarHBondContact O-N 2.78Å; D165-I167 VanDerWaalsContact O-N 3.08Å
166T44.7Very low42.1Very low117 Ų117132.5 Ų132.572%0.71877%0.771SS**  trans-64.596.7162.410.40000107.7T164 P168T164-T166 PolarHBondContact O-N 3.12Å; T166-P168 WeakPolarHBondContact O-CD 3.37Å
167I39.3Very low41.9Very low131 Ų131133.2 Ų133.267%0.67277%0.772SS**PPolyproline II helixtrans-66.8116.2173.2-56.5-74.9000109.1D165D165-I167 PolarHBondContact O-N 2.78Å; D165-I167 VanDerWaalsContact O-N 3.08Å
168P39.2Very low41.1Very low114 Ų114135.1 Ų135.174%0.7477%0.774SS**PPolyproline II helixtrans-76.3130.1164.3-11.431.5000108.8T166T166-P168 WeakPolarHBondContact O-CD 3.37Å
169F38Very low41Very low202 Ų202133.2 Ų133.289%0.88677%0.771SS**PPolyproline II helixtrans-57.7128.1175-118.6-95.1000110.7
170P53.7Low40.8Very low104 Ų104134.8 Ų134.868%0.67577%0.768SS**PPolyproline II helixtrans-80.1141.2169.831.2-30.1000110.2
171P58.1Low40.7Very low114 Ų114135.9 Ų135.974%0.7477%0.766SS**PPolyproline II helixtrans-71.9156.3174.630.5-33.6000111.5
172P46.9Very low40.7Very low117 Ų117136.7 Ų136.776%0.7677%0.765SS**PPolyproline II helixtrans-70.7143.6-177.529.2-33.9000111.7
173P47.4Very low40.8Very low112 Ų112132.2 Ų132.273%0.72777%0.77SS**PPolyproline II helixtrans-76.8134177.730-32.3000111.8N175P173-N175 PolarHBondContact O-N 2.83Å
174S46.7Very low41.1Very low115 Ų115132 Ų13280%0.80478%0.775SS**  trans-71.6106.6165.8-42.40000109L176S174-L176 PolarHBondContact O-N 3.12Å
175N37Very low41.4Very low155 Ų155130.9 Ų130.983%0.82978%0.778SS**  trans-78.6104175-80.11.4000110.5P173P173-N175 PolarHBondContact O-N 2.83Å
176L34.6Very low41.8Very low168 Ų168129.8 Ų129.888%0.8879%0.787SS**  trans-66.4141.8156.2-89.6144.6000110.2S174S174-L176 PolarHBondContact O-N 3.12Å
177M39.3Very low41.6Very low183 Ų183128.7 Ų128.790%0.90179%0.79SS**  trans-57.3141.3169.9-64-163.677.900112.2
178S34.9Very low42Very low115 Ų115131 Ų13180%0.80480%0.803SS**  179.8129.1115.2-149.10000113.3
179A37.4Very low42.1Very low88 Ų88131.5 Ų131.573%0.72781%0.809SS**  trans58.6136.3139.200000124.8
180H37.6Very low42.3Very low174 Ų174132.9 Ų132.981%0.80681%0.808SS**  trans88.3133.4149.8-133.270.1000116.5
181Q39.3Very low41.6Very low127 Ų127135.2 Ų135.259%0.59382%0.815SS**  cis-179.8144.4-10.316997.482.500105
182Q39.4Very low40.8Very low168 Ų168138.4 Ų138.479%0.78582%0.82SS**  trans69.7104.3160.5-77.9151.821.300119.9
183A37.3Very low40.2Very low107 Ų107140.9 Ų140.988%0.88482%0.823SS**  -170.2113.8115.900000109.4
184A40Very low39.6Very low103 Ų103145 Ų14585%0.85183%0.83SS**  trans-84158.8-177.700000112.1
185A43.1Very low39.1Very low105 Ų105148.7 Ų148.787%0.86883%0.831SS**  trans113.972.1156.500000116.3
186A43.4Very low39.8Very low107 Ų107148.6 Ų148.688%0.88483%0.831SS**SBendtrans-164.610.8151.500000116.4
187A40.6Very low40Very low94 Ų94149.2 Ų149.278%0.77783%0.829SS**  trans-123.823.7-168.100000116.1S189A187-S189 PolarHBondContact O-N 3.27Å
188L47.3Very low40.6Very low178 Ų178145.3 Ų145.393%0.93282%0.817SS**THydrogen-bonded Turntrans-90.653.8-180-73.5177.5000114.1
189S42.4Very low41.3Very low125 Ų125149.3 Ų149.387%0.87482%0.823SS**THydrogen-bonded Turntrans-140.515.8168.4-62.80000115.2A187A187-S189 PolarHBondContact O-N 3.27Å
190R41.5Very low41.9Very low231 Ų231150.7 Ų150.787%0.87282%0.823SS**SBendtrans-139.339.5-176.4-151.9-175.2173.7-113.5-1.1116.1
191L38.9Very low42.4Very low154 Ų154148.2 Ų148.281%0.80682%0.82SS**  trans-150.294.7159.6-77.3-179.3000109.8F194L191-F194 HydrophobicContact CD2-CE2 4.4Å
192Q41.1Very low43.3Very low181 Ų181148.2 Ų148.285%0.84683%0.831SS**  trans-116.6127.3149.5-73.3-146.8-52.800108.7
193M34.8Very low43.7Very low169 Ų169146.2 Ų146.283%0.83383%0.826SS**  trans83.182.4150.4-131.1108.367.500117.8
194F33.9Very low44.4Very low198 Ų198148.7 Ų148.787%0.86882%0.821SS**  trans-88.2132.1142.8-75.3-83.1000108.2L191L191-F194 HydrophobicContact CD2-CE2 4.4Å
195K37.7Very low45.1Very low193 Ų193150.4 Ų150.484%0.83981%0.811SS**  trans-140.7129.9153.8-170.6165178.7176.30108.6
196D51.7Low45.3Very low153 Ų153151.1 Ų151.182%0.81881%0.809SS**  trans-41.2144.6180-67.6-79.2000116.8
197E38.1Very low45.6Very low181 Ų181154.7 Ų154.785%0.84680%0.804SS**  174.9169.7112.6-138.3176.296.700111.4
198P51.2Low46.2Very low100 Ų100155.9 Ų155.965%0.64980%0.802SS**  -83.3163.9-111.636.6-21.1000116.4T200P198-T200 PolarHBondContact O-N 3.41Å
199Q51.1Low46.4Very low199 Ų199155 Ų15593%0.9380%0.798SS**  trans-42.4103.9171.4-179.9164.3-1600113.4
200T50.1Low46.7Very low117 Ų117154 Ų15472%0.71879%0.791SS**  trans-119.9131.5158.9-57.80000107.2P198P198-T200 PolarHBondContact O-N 3.41Å
201V46.6Very low47.5Very low122 Ų122147.9 Ų147.974%0.73978%0.781SS**  trans-37126.2175.5-130.30000109.8D203V201-D203 VanDerWaalsContact C-N 3.32Å; V201-D203 PolarHBondContact O-N 3.43Å
202P59.1Low48.2Very low128 Ų128146.1 Ų146.183%0.83178%0.779SS**  trans-59.7100172.9-22.833.3000108.9M204P202-M204 PolarHBondContact O-N 2.85Å
203D46.9Very low49.1Very low126 Ų126145.1 Ų145.167%0.67478%0.779SS**  trans-62.2132.8177.3-153.617.2000107.9V201 Q205V201-D203 VanDerWaalsContact C-N 3.32Å; V201-D203 PolarHBondContact O-N 3.43Å; D203-Q205 PolarHBondContact O-N 2.96Å
204M52.4Low50.3Low159 Ų159141.4 Ų141.478%0.78377%0.769SS**SBendtrans-73.141.3179.8-93-101.7154.500111.5P202P202-M204 PolarHBondContact O-N 2.85Å
205Q55.8Low52Low139 Ų139138.2 Ų138.265%0.6577%0.769SS**  trans-118.362.4178.5-99.589.9-33.200109.9D203D203-Q205 PolarHBondContact O-N 2.96Å
206C45.8Very low53.4Low120 Ų120133.1 Ų133.181%0.81175%0.75SS**SBendtrans-139.833.2160.2-159.10000111.1
207F50.1Low54.8Low181 Ų181129.9 Ų129.979%0.79473%0.732SS**SBendtrans-112.48175.1-93.6-81.4000113.3
208V52.9Low56.9Low120 Ų120126.4 Ų126.473%0.72772%0.717SS**SBendtrans-113.9-6.2-171.9-1660000113.9
209D51.7Low58.5Low159 Ų159126.5 Ų126.585%0.8571%0.712SS**SBendtrans-115.220.3179-75.7-22.8000114.5
210S49.3Very low60.3Low105 Ų105120.3 Ų120.373%0.73469%0.685SS**SBendtrans-89.1116.9150.2-88.20000107
211P58.4Low62.2Low101 Ų101118 Ų11866%0.65667%0.667SS**PPolyproline II helixtrans-46.9139.3176.4-26.433000109.9L213P211-L213 PolarHBondContact O-N 3.16Å; P211-L213 VanDerWaalsContact O-N 3.12Å
212P53.8Low64.3Low117 Ų117118.1 Ų118.176%0.7666%0.659SS**PPolyproline II helixtrans-50128.1174.524.2-33.4000106.4S214P212-S214 VanDerWaalsContact C-N 3.29Å; P212-S214 PolarHBondContact O-N 3.41Å
213L59.4Low65.9Low161 Ų161119.1 Ų119.184%0.84365%0.646SS**  trans-46.4101.2-178.1-65.9172.2000107.5P211P211-L213 PolarHBondContact O-N 3.16Å; P211-L213 VanDerWaalsContact O-N 3.12Å
214S59.5Low68Low91 Ų91117.6 Ų117.664%0.63664%0.637SS**  trans-49.2132.5176.2-46.90000105.2P212 I216P212-S214 VanDerWaalsContact C-N 3.29Å; P212-S214 PolarHBondContact O-N 3.41Å; S214-I216 WeakPolarHBondContact O-CA 3.35Å; S214-I216 PolarHBondContact O-N 2.92Å
215P70.8Confident70.1Confident131 Ų131115.7 Ų115.785%0.85162%0.624SS**  trans-40.5105.7-176.3-32.335.3000109.1D217P215-D217 PolarHBondContact O-N 3.41Å
216I67.6Low72Confident86 Ų86111.2 Ų111.244%0.44161%0.612SS.*  trans-69.2117.4-167.4-128.1162.5000103.6S214 M218 Q221S214-I216 WeakPolarHBondContact O-CA 3.35Å; S214-I216 PolarHBondContact O-N 2.92Å; I216-M218 HydrophobicContact CG2-CE 3.31Å; I216-M218 WeakPolarHBondContact O-CE 3.31Å; I216-M218 PolarHBondContact O-N 3.28Å; I216-Q221 HydrophobicContact CG2-CB 4.22Å
217D79.8Confident74.5Confident85 Ų85111.6 Ų111.646%0.45560%0.601SS.*  trans-54.4110.217817322000107.6P215 D219 N220 Q221P215-D217 PolarHBondContact O-N 3.41Å; D217-D219 PolarHBondContact O-N 3.37Å; D217-D219 PolarHBondContact OD1-N 2.86Å; D217-N220 HydrophobicContact CB-CB 3.86Å; D217-N220 WeakPolarHBondContact O-CB 3.19Å; D217-N220 PolarHBondContact O-N 3.13Å; D217-N220 WeakPolarHBondContact OD2-CB 3.33Å; D217-N220 PolarHBondContact OD2-N 3.38Å; D217-Q221 PolarHBondContact O-N 2.99Å
218M82.6Confident76.7Confident107 Ų107111 Ų11153%0.52759%0.594SS.*Hα-helixtrans-55.5-40.2-175.3-71.8-7096.200109.8I216 N220 Q221 E222I216-M218 HydrophobicContact CG2-CE 3.31Å; I216-M218 WeakPolarHBondContact O-CE 3.31Å; I216-M218 PolarHBondContact O-N 3.28Å; M218-N220 PolarHBondContact O-N 2.9Å; M218-Q221 PolarHBondContact O-N 3.08Å; M218-E222 WeakPolarHBondContact O-CB 3.46Å; M218-E222 WeakPolarHBondContact O-CG 3.33Å; M218-E222 PolarHBondContact O-N 3.41Å
219D83.8Confident78.9Confident102 Ų102112.5 Ų112.555%0.54559%0.59SS.*Hα-helixtrans-65.6-39.6179.5-65.7-21.9000111.9D217 R223D217-D219 PolarHBondContact O-N 3.37Å; D217-D219 PolarHBondContact OD1-N 2.86Å; D219-R223 WeakPolarHBondContact O-CB 3.35Å; D219-R223 PolarHBondContact O-N 3.31Å
220N90.6Very high81.1Confident69 Ų69112.1 Ų112.137%0.36958%0.581SS.*Hα-helixtrans-66.9-43.2175-174.434.1000111.6D217 M218 E222 R223 I224D217-N220 HydrophobicContact CB-CB 3.86Å; D217-N220 WeakPolarHBondContact O-CB 3.19Å; D217-N220 PolarHBondContact O-N 3.13Å; D217-N220 WeakPolarHBondContact OD2-CB 3.33Å; D217-N220 PolarHBondContact OD2-N 3.38Å; M218-N220 PolarHBondContact O-N 2.9Å; N220-E222 VanDerWaalsContact C-N 3.34Å; N220-E222 PolarHBondContact O-N 3.28Å; N220-R223 PolarHBondContact O-N 3.29Å; N220-I224 VanDerWaalsContact O-CG1 3.29Å; N220-I224 WeakPolarHBondContact O-CG1 3.25Å; N220-I224 PolarHBondContact O-N 2.67Å
221Q89.1Confident83.4Confident69 Ų69111.5 Ų111.532%0.32257%0.569SS.*Hα-helixtrans-64.7-39.4178.1-163.8-173.473.700111.7I216 D217 M218 K225I216-Q221 HydrophobicContact CG2-CB 4.22Å; D217-Q221 PolarHBondContact O-N 2.99Å; M218-Q221 PolarHBondContact O-N 3.08Å; Q221-K225 HydrophobicContact CG-CD 4.48Å; Q221-K225 WeakPolarHBondContact O-CB 3.35Å; Q221-K225 VanDerWaalsContact O-CG 3.31Å; Q221-K225 WeakPolarHBondContact O-CG 3.35Å; Q221-K225 PolarHBondContact O-N 3.29Å
222E89.8Confident85.3Confident125 Ų125112.9 Ų112.958%0.58456%0.562SS**Hα-helixtrans-63.6-44.8174.4-76.1-173.4-175.700112.1M218 N220 I224 K225 A226M218-E222 WeakPolarHBondContact O-CB 3.46Å; M218-E222 WeakPolarHBondContact O-CG 3.33Å; M218-E222 PolarHBondContact O-N 3.41Å; N220-E222 VanDerWaalsContact C-N 3.34Å; N220-E222 PolarHBondContact O-N 3.28Å; E222-I224 PolarHBondContact O-N 3.08Å; E222-K225 PolarHBondContact O-N 2.93Å; E222-A226 WeakPolarHBondContact O-CB 3.28Å; E222-A226 PolarHBondContact O-N 2.92Å
223R94.5Very high87.4Confident148 Ų148112.8 Ų112.856%0.55856%0.555SS**Hα-helixtrans-59.2-48176.5-165.6-176.6-54.1144.48111.6D219 N220 K225 A226 E227D219-R223 WeakPolarHBondContact O-CB 3.35Å; D219-R223 PolarHBondContact O-N 3.31Å; N220-R223 PolarHBondContact O-N 3.29Å; R223-K225 PolarHBondContact O-N 3.32Å; R223-A226 PolarHBondContact O-N 3.34Å; R223-E227 WeakPolarHBondContact O-CG 3.28Å; R223-E227 PolarHBondContact O-N 2.87Å
224I91.2Very high89.3Confident94 Ų94113.2 Ų113.248%0.48255%0.545SS..Hα-helixtrans-62.8-42.3178.8-67.3166.9000111.2N220 E222 E227 R228N220-I224 VanDerWaalsContact O-CG1 3.29Å; N220-I224 WeakPolarHBondContact O-CG1 3.25Å; N220-I224 PolarHBondContact O-N 2.67Å; E222-I224 PolarHBondContact O-N 3.08Å; I224-E227 PolarHBondContact O-N 2.93Å; I224-R228 WeakPolarHBondContact O-CB 3.36Å; I224-R228 PolarHBondContact O-N 2.91Å
225K95.9Very high91.1Very high119 Ų119113.9 Ų113.952%0.51754%0.54SS..Hα-helixtrans-62.8-43.5175.9-76.4171.4-177.9165.30111.4Q221 E222 R223 R228 K229Q221-K225 HydrophobicContact CG-CD 4.48Å; Q221-K225 WeakPolarHBondContact O-CB 3.35Å; Q221-K225 VanDerWaalsContact O-CG 3.31Å; Q221-K225 WeakPolarHBondContact O-CG 3.35Å; Q221-K225 PolarHBondContact O-N 3.29Å; E222-K225 PolarHBondContact O-N 2.93Å; R223-K225 PolarHBondContact O-N 3.32Å; K225-R228 PolarHBondContact O-N 3.14Å; K225-K229 WeakPolarHBondContact O-CB 3.41Å; K225-K229 PolarHBondContact O-N 3.25Å
226A95.9Very high92.4Very high46 Ų46110.2 Ų110.238%0.3852%0.521SS..Hα-helixtrans-63.8-44177.900000111.6E222 R223 K229 K230E222-A226 WeakPolarHBondContact O-CB 3.28Å; E222-A226 PolarHBondContact O-N 2.92Å; R223-A226 PolarHBondContact O-N 3.34Å; A226-K229 WeakPolarHBondContact O-CB 3.38Å; A226-K229 PolarHBondContact O-N 2.91Å; A226-K230 WeakPolarHBondContact O-CG 3.23Å; A226-K230 PolarHBondContact O-N 3.35Å
227E97.1Very high93.9Very high128 Ų128108 Ų10860%0.59852%0.515SS*.Hα-helixtrans-62.7-44.1175.4-74.4-157.1139.100112.2R223 I224 K229 K230 L231R223-E227 WeakPolarHBondContact O-CG 3.28Å; R223-E227 PolarHBondContact O-N 2.87Å; I224-E227 PolarHBondContact O-N 2.93Å; E227-K229 VanDerWaalsContact C-N 3.28Å; E227-K229 PolarHBondContact O-N 2.97Å; E227-K230 PolarHBondContact O-N 3.47Å; E227-L231 WeakPolarHBondContact O-CB 3.33Å; E227-L231 PolarHBondContact O-N 3.42Å
228R97.6Very high94.8Very high168 Ų168107.2 Ų107.263%0.63452%0.517SS*.Hα-helixtrans-61.5-38.3175.4-166.8-179.4177.9-172.7-1111.6I224 K225 L231 R232I224-R228 WeakPolarHBondContact O-CB 3.36Å; I224-R228 PolarHBondContact O-N 2.91Å; K225-R228 PolarHBondContact O-N 3.14Å; R228-L231 PolarHBondContact O-N 2.79Å; R228-R232 VanDerWaalsContact NE-NH1 3.18Å; R228-R232 WeakPolarHBondContact O-CG 3.43Å; R228-R232 PolarHBondContact O-N 3.3Å
229K98.1Very high95.6Very high151 Ų151107.8 Ų107.866%0.65752%0.516SS*.Hα-helixtrans-64.7-45.3174.2-172.1177.8179.9179.80111.2K225 A226 E227 L231 R232 N233K225-K229 WeakPolarHBondContact O-CB 3.41Å; K225-K229 PolarHBondContact O-N 3.25Å; A226-K229 WeakPolarHBondContact O-CB 3.38Å; A226-K229 PolarHBondContact O-N 2.91Å; E227-K229 VanDerWaalsContact C-N 3.28Å; E227-K229 PolarHBondContact O-N 2.97Å; K229-L231 PolarHBondContact O-N 3.03Å; K229-R232 PolarHBondContact O-N 2.97Å; K229-N233 WeakPolarHBondContact O-CB 3.42Å; K229-N233 PolarHBondContact O-N 3.46Å
230K98.2Very high96.3Very high151 Ų151107.1 Ų107.166%0.65752%0.518SS*.Hα-helixtrans-60.1-43.7175-74.8178.1179.8177.50111.7A226 E227 N233 R234A226-K230 WeakPolarHBondContact O-CG 3.23Å; A226-K230 PolarHBondContact O-N 3.35Å; E227-K230 PolarHBondContact O-N 3.47Å; K230-N233 PolarHBondContact O-N 3.04Å; K230-R234 WeakPolarHBondContact O-CB 3.11Å; K230-R234 PolarHBondContact O-N 3.16Å
231L97.9Very high96.7Very high92 Ų92112.4 Ų112.448%0.48253%0.533SS..Hα-helixtrans-63.9-46.5178.1-179.260.4000111.8E227 R228 K229 N233 R234 I235E227-L231 WeakPolarHBondContact O-CB 3.33Å; E227-L231 PolarHBondContact O-N 3.42Å; R228-L231 PolarHBondContact O-N 2.79Å; K229-L231 PolarHBondContact O-N 3.03Å; L231-N233 VanDerWaalsContact C-N 3.34Å; L231-N233 PolarHBondContact O-N 3.23Å; L231-R234 PolarHBondContact O-N 3.47Å; L231-I235 HydrophobicContact CD1-CD1 4.15Å; L231-I235 HydrophobicContact CD1-CG1 4.42Å; L231-I235 HydrophobicContact CG-CD1 4.07Å; L231-I235 WeakPolarHBondContact O-CG1 3.32Å; L231-I235 PolarHBondContact O-N 3.12Å
232R98.1Very high97.1Very high131 Ų131115.4 Ų115.449%0.49455%0.545SS..Hα-helixtrans-59.5-43.7175.4-75.2-171.6-62.5-111.7-3.6112R228 K229 I235 A236R228-R232 VanDerWaalsContact NE-NH1 3.18Å; R228-R232 WeakPolarHBondContact O-CG 3.43Å; R228-R232 PolarHBondContact O-N 3.3Å; K229-R232 PolarHBondContact O-N 2.97Å; R232-I235 PolarHBondContact O-N 3Å; R232-A236 WeakPolarHBondContact O-CB 3.41Å; R232-A236 PolarHBondContact O-N 2.9Å
233N98.4Very high97.5Very high115 Ų115116.7 Ų116.762%0.61555%0.545SS*.Hα-helixtrans-64.4-42.5177.2-178-93000111.8K229 K230 L231 I235 A236 A237K229-N233 WeakPolarHBondContact O-CB 3.42Å; K229-N233 PolarHBondContact O-N 3.46Å; K230-N233 PolarHBondContact O-N 3.04Å; L231-N233 VanDerWaalsContact C-N 3.34Å; L231-N233 PolarHBondContact O-N 3.23Å; N233-I235 VanDerWaalsContact C-N 3.35Å; N233-I235 PolarHBondContact O-N 3.33Å; N233-A236 PolarHBondContact O-N 2.87Å; N233-A237 WeakPolarHBondContact O-CB 3.27Å; N233-A237 PolarHBondContact O-N 3.32Å
234R98.4Very high97.8Very high170 Ų170116.5 Ų116.564%0.64255%0.548SS*.Hα-helixtrans-57.4-47175.3-172.9-177.3-64171.9-0.2111.5K230 L231 A237 S238K230-R234 WeakPolarHBondContact O-CB 3.11Å; K230-R234 PolarHBondContact O-N 3.16Å; L231-R234 PolarHBondContact O-N 3.47Å; R234-A237 PolarHBondContact O-N 2.92Å; R234-S238 PolarHBondContact O-N 3.43Å; R234-S238 PolarHBondContact O-OG 3.04Å
235I98.1Very high98.1Very high104 Ų104117.6 Ų117.653%0.53355%0.554SS.*Hα-helixtrans-63.7-44.4177.6-66.1166.8000110.8L231 R232 N233 S238 K239L231-I235 HydrophobicContact CD1-CD1 4.15Å; L231-I235 HydrophobicContact CD1-CG1 4.42Å; L231-I235 HydrophobicContact CG-CD1 4.07Å; L231-I235 WeakPolarHBondContact O-CG1 3.32Å; L231-I235 PolarHBondContact O-N 3.12Å; R232-I235 PolarHBondContact O-N 3Å; N233-I235 VanDerWaalsContact C-N 3.35Å; N233-I235 PolarHBondContact O-N 3.33Å; I235-S238 PolarHBondContact O-N 3.24Å; I235-K239 WeakPolarHBondContact O-CB 3.35Å; I235-K239 PolarHBondContact O-N 2.88Å
236A98.6Very high98.2Very high55 Ų55115.5 Ų115.546%0.45555%0.546SS..Hα-helixtrans-62.3-43.4178.600000112.2R232 N233 K239 C240R232-A236 WeakPolarHBondContact O-CB 3.41Å; R232-A236 PolarHBondContact O-N 2.9Å; N233-A236 PolarHBondContact O-N 2.87Å; A236-K239 PolarHBondContact O-N 3.21Å; A236-C240 WeakPolarHBondContact O-CB 3.39Å; A236-C240 PolarHBondContact O-N 2.96Å
237A98.6Very high98.4Very high38 Ų38121.5 Ų121.531%0.31456%0.559SS.*Hα-helixtrans-61.4-45.3176.300000111.5N233 R234 K239 C240 R241N233-A237 WeakPolarHBondContact O-CB 3.27Å; N233-A237 PolarHBondContact O-N 3.32Å; R234-A237 PolarHBondContact O-N 2.92Å; A237-K239 PolarHBondContact O-N 3.26Å; A237-C240 PolarHBondContact O-N 3.24Å; A237-R241 WeakPolarHBondContact O-CG 3.42Å; A237-R241 PolarHBondContact O-N 3.41Å
238S98.5Very high98.5Very high69 Ų69118.6 Ų118.648%0.48355%0.547SS..Hα-helixtrans-60.7-42.6174.6-65.70000112.1R234 I235 R241 K242R234-S238 PolarHBondContact O-N 3.43Å; R234-S238 PolarHBondContact O-OG 3.04Å; I235-S238 PolarHBondContact O-N 3.24Å; S238-R241 PolarHBondContact O-N 3.09Å; S238-K242 WeakPolarHBondContact O-CB 3.34Å; S238-K242 PolarHBondContact O-N 3.24Å
239K98.8Very high98.5Very high120 Ų120113.1 Ų113.152%0.52254%0.535SS..Hα-helixtrans-65.6-38.6176.5-170.4175.5-178.1177.90112.1I235 A236 A237 K242 R243I235-K239 WeakPolarHBondContact O-CB 3.35Å; I235-K239 PolarHBondContact O-N 2.88Å; A236-K239 PolarHBondContact O-N 3.21Å; A237-K239 PolarHBondContact O-N 3.26Å; K239-K242 PolarHBondContact O-N 3.08Å; K239-R243 WeakPolarHBondContact O-CB 3.31Å; K239-R243 WeakPolarHBondContact O-CG 3.4Å; K239-R243 PolarHBondContact O-N 2.89Å
240C98.7Very high98.6Very high87 Ų87114.2 Ų114.259%0.58854%0.535SS*.Hα-helixtrans-63.5-48.4175.4-175.30000111.1A236 A237 K242 R243 K244A236-C240 WeakPolarHBondContact O-CB 3.39Å; A236-C240 PolarHBondContact O-N 2.96Å; A237-C240 PolarHBondContact O-N 3.24Å; C240-K242 PolarHBondContact O-N 3.43Å; C240-R243 PolarHBondContact O-N 3.47Å; C240-K244 PolarHBondContact O-N 3.2Å
241R98.8Very high98.6Very high180 Ų180111 Ų11168%0.67952%0.524SS*.Hα-helixtrans-58.6-46.2174.8-71.1175.4-178.3178.8-0.2111.6A237 S238 R243 K244 L245A237-R241 WeakPolarHBondContact O-CG 3.42Å; A237-R241 PolarHBondContact O-N 3.41Å; S238-R241 PolarHBondContact O-N 3.09Å; R241-R243 PolarHBondContact O-N 2.94Å; R241-K244 PolarHBondContact O-N 3.5Å; R241-L245 WeakPolarHBondContact O-CG 3.41Å; R241-L245 PolarHBondContact O-N 2.95Å
242K98.6Very high98.6Very high132 Ų132112.4 Ų112.457%0.57453%0.528SS*.Hα-helixtrans-58-49.3176.7-177.6173.8176.91740111.7S238 K239 C240 K244 L245 E246S238-K242 WeakPolarHBondContact O-CB 3.34Å; S238-K242 PolarHBondContact O-N 3.24Å; K239-K242 PolarHBondContact O-N 3.08Å; C240-K242 PolarHBondContact O-N 3.43Å; K242-K244 VanDerWaalsContact C-N 3.33Å; K242-K244 PolarHBondContact O-N 3.03Å; K242-L245 PolarHBondContact O-N 3.09Å; K242-E246 WeakPolarHBondContact CE-OE1 3.48Å; K242-E246 HydrophobicContact CG-CG 4.5Å; K242-E246 WeakPolarHBondContact CG-OE1 3.49Å; K242-E246 WeakPolarHBondContact O-CG 3.29Å; K242-E246 PolarHBondContact O-N 3.45Å
243R98.8Very high98.7Very high152 Ų152110.7 Ų110.757%0.57453%0.529SS*.Hα-helixtrans-62.6-37.9177.8-75.3-179.3179.5-130.7-5.4112.9K239 C240 R241 E246 R247K239-R243 WeakPolarHBondContact O-CB 3.31Å; K239-R243 WeakPolarHBondContact O-CG 3.4Å; K239-R243 PolarHBondContact O-N 2.89Å; C240-R243 PolarHBondContact O-N 3.47Å; R241-R243 PolarHBondContact O-N 2.94Å; R243-E246 PolarHBondContact O-N 3.47Å; R243-R247 WeakPolarHBondContact O-CB 3.46Å; R243-R247 PolarHBondContact O-N 2.89Å
244K98.8Very high98.7Very high145 Ų145111.6 Ų111.663%0.6353%0.527SS*.Hα-helixtrans-61.7-47.4175.4-175.7176179.5178.70110.7C240 R241 K242 R247 I248C240-K244 PolarHBondContact O-N 3.2Å; R241-K244 PolarHBondContact O-N 3.5Å; K242-K244 VanDerWaalsContact C-N 3.33Å; K242-K244 PolarHBondContact O-N 3.03Å; K244-R247 PolarHBondContact O-N 3.1Å; K244-I248 HydrophobicContact CG-CD1 4.1Å; K244-I248 WeakPolarHBondContact O-CG1 3.43Å; K244-I248 PolarHBondContact O-N 3.28Å
245L98.8Very high98.7Very high117 Ų117107.1 Ų107.161%0.61352%0.519SS*.Hα-helixtrans-64.3-43.3177.8-69.1172.5000112.2R241 K242 R247 I248 S249R241-L245 WeakPolarHBondContact O-CG 3.41Å; R241-L245 PolarHBondContact O-N 2.95Å; K242-L245 PolarHBondContact O-N 3.09Å; L245-R247 VanDerWaalsContact C-N 3.29Å; L245-R247 PolarHBondContact O-N 3.27Å; L245-I248 PolarHBondContact O-N 3.36Å; L245-S249 WeakPolarHBondContact O-CB 3.38Å; L245-S249 PolarHBondContact O-N 3.28Å
246E98.8Very high98.7Very high75 Ų75109.2 Ų109.235%0.3552%0.524SS..Hα-helixtrans-59.4-40.4173.9-74.2172.5-175.400111.8K242 R243 R250K242-E246 WeakPolarHBondContact CE-OE1 3.48Å; K242-E246 HydrophobicContact CG-CG 4.5Å; K242-E246 WeakPolarHBondContact CG-OE1 3.49Å; K242-E246 WeakPolarHBondContact O-CG 3.29Å; K242-E246 PolarHBondContact O-N 3.45Å; R243-E246 PolarHBondContact O-N 3.47Å; E246-R250 VanDerWaalsContact O-CG 3.3Å; E246-R250 WeakPolarHBondContact O-CG 3.28Å; E246-R250 PolarHBondContact O-N 3.17Å
247R98.8Very high98.8Very high171 Ų171110.9 Ų110.965%0.64553%0.525SS*.Hα-helixtrans-66.3-41.2176.3-173171.5-174.4-89.83111.8R243 K244 L245 L251R243-R247 WeakPolarHBondContact O-CB 3.46Å; R243-R247 PolarHBondContact O-N 2.89Å; K244-R247 PolarHBondContact O-N 3.1Å; L245-R247 VanDerWaalsContact C-N 3.29Å; L245-R247 PolarHBondContact O-N 3.27Å; R247-L251 HydrophobicContact CG-CD1 4.27Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.48Å; R247-L251 PolarHBondContact O-N 2.95Å; R247-L251 VanDerWaalsContact O-N 3.11Å
248I98.7Very high98.8Very high67 Ų67113.3 Ų113.334%0.34453%0.533SS..Hα-helixtrans-60.5-52.6175.2-70165.3000109.7K244 L245 R250 L251 E252K244-I248 HydrophobicContact CG-CD1 4.1Å; K244-I248 WeakPolarHBondContact O-CG1 3.43Å; K244-I248 PolarHBondContact O-N 3.28Å; L245-I248 PolarHBondContact O-N 3.36Å; I248-R250 VanDerWaalsContact C-N 3.34Å; I248-R250 PolarHBondContact O-N 3.39Å; I248-L251 WeakPolarHBondContact O-CB 3.46Å; I248-L251 PolarHBondContact O-N 3.25Å; I248-E252 HydrophobicContact CG2-CG 4.24Å; I248-E252 WeakPolarHBondContact CG2-OE1 3.47Å; I248-E252 WeakPolarHBondContact O-CG 3.4Å; I248-E252 PolarHBondContact O-N 3.16Å
249S98.8Very high98.8Very high54 Ų54116.8 Ų116.838%0.37854%0.539SS..Hα-helixtrans-55.5-45.5178.4162.10000112.6L245 L251 E252 D253L245-S249 WeakPolarHBondContact O-CB 3.38Å; L245-S249 PolarHBondContact O-N 3.28Å; S249-L251 VanDerWaalsContact C-N 3.3Å; S249-L251 PolarHBondContact O-N 3.13Å; S249-E252 PolarHBondContact O-N 3.25Å; S249-D253 PolarHBondContact O-N 3.43Å
250R98.8Very high98.8Very high174 Ų174114 Ų11466%0.65753%0.532SS*.Hα-helixtrans-61.5-37.3176.1-73.4176.1-170.51685.2113.2E246 I248 K254E246-R250 VanDerWaalsContact O-CG 3.3Å; E246-R250 WeakPolarHBondContact O-CG 3.28Å; E246-R250 PolarHBondContact O-N 3.17Å; I248-R250 VanDerWaalsContact C-N 3.34Å; I248-R250 PolarHBondContact O-N 3.39Å; R250-K254 WeakPolarHBondContact O-CB 3.35Å; R250-K254 PolarHBondContact O-N 3.35Å
251L98.9Very high98.8Very high84 Ų84114 Ų11444%0.4452%0.523SS..Hα-helixtrans-71.3-40.3177.8-70.9171.9000111R247 I248 S249 K254 V255R247-L251 HydrophobicContact CG-CD1 4.27Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.48Å; R247-L251 PolarHBondContact O-N 2.95Å; R247-L251 VanDerWaalsContact O-N 3.11Å; I248-L251 WeakPolarHBondContact O-CB 3.46Å; I248-L251 PolarHBondContact O-N 3.25Å; S249-L251 VanDerWaalsContact C-N 3.3Å; S249-L251 PolarHBondContact O-N 3.13Å; L251-K254 PolarHBondContact O-N 3.45Å; L251-V255 WeakPolarHBondContact O-CG2 3.37Å; L251-V255 PolarHBondContact O-N 3.27Å
252E98.8Very high98.8Very high120 Ų120110.8 Ų110.856%0.56152%0.52SS*.Hα-helixtrans-60.4-44.9174-69.8170.7161.100111.3I248 S249 K254 V255 K256I248-E252 HydrophobicContact CG2-CG 4.24Å; I248-E252 WeakPolarHBondContact CG2-OE1 3.47Å; I248-E252 WeakPolarHBondContact O-CG 3.4Å; I248-E252 PolarHBondContact O-N 3.16Å; S249-E252 PolarHBondContact O-N 3.25Å; E252-K254 VanDerWaalsContact C-N 3.34Å; E252-K254 PolarHBondContact O-N 2.88Å; E252-V255 PolarHBondContact O-N 3.27Å; E252-K256 WeakPolarHBondContact O-CB 3.38Å; E252-K256 PolarHBondContact O-N 2.92Å
253D98.8Very high98.8Very high96 Ų96108.8 Ų108.851%0.51352%0.519SS..Hα-helixtrans-61.6-41174.7-72.5-27.1000111.9S249 K256 N257S249-D253 PolarHBondContact O-N 3.43Å; D253-K256 PolarHBondContact O-N 3.35Å; D253-N257 WeakPolarHBondContact O-CB 3.48Å; D253-N257 PolarHBondContact O-N 3.45Å
254K98.8Very high98.8Very high134 Ų134107 Ų10758%0.58352%0.517SS*.Hα-helixtrans-64.9-42176.4-172.3173-178.3177.50111.7R250 L251 E252 K256 N257 L258R250-K254 WeakPolarHBondContact O-CB 3.35Å; R250-K254 PolarHBondContact O-N 3.35Å; L251-K254 PolarHBondContact O-N 3.45Å; E252-K254 VanDerWaalsContact C-N 3.34Å; E252-K254 PolarHBondContact O-N 2.88Å; K254-K256 VanDerWaalsContact C-N 3.34Å; K254-N257 PolarHBondContact O-N 2.94Å; K254-L258 HydrophobicContact CG-CD1 4.1Å; K254-L258 HydrophobicContact CG-CG 4.45Å; K254-L258 WeakPolarHBondContact O-CB 3.41Å; K254-L258 VanDerWaalsContact O-CG 3.31Å; K254-L258 WeakPolarHBondContact O-CG 3.4Å; K254-L258 PolarHBondContact O-N 3.2Å
255V98.9Very high98.8Very high76 Ų76106 Ų10646%0.46152%0.517SS..Hα-helixtrans-63-43.51751690000110.5L251 E252 L258 K259L251-V255 WeakPolarHBondContact O-CG2 3.37Å; L251-V255 PolarHBondContact O-N 3.27Å; E252-V255 PolarHBondContact O-N 3.27Å; V255-L258 PolarHBondContact O-N 3.38Å; V255-K259 HydrophobicContact CG1-CD 4.14Å; V255-K259 HydrophobicContact CG1-CG 4.46Å; V255-K259 WeakPolarHBondContact O-CB 3.44Å; V255-K259 VanDerWaalsContact O-CG 3.32Å; V255-K259 WeakPolarHBondContact O-CG 3.37Å; V255-K259 PolarHBondContact O-N 3.32Å
256K98.9Very high98.8Very high147 Ų147102.8 Ų102.864%0.63951%0.508SS*.Hα-helixtrans-59.3-49.5176.5-175.8-178.6177.3-176.30111.2E252 D253 K254 K259 T260E252-K256 WeakPolarHBondContact O-CB 3.38Å; E252-K256 PolarHBondContact O-N 2.92Å; D253-K256 PolarHBondContact O-N 3.35Å; K254-K256 VanDerWaalsContact C-N 3.34Å; K256-K259 PolarHBondContact O-N 2.98Å; K256-T260 PolarHBondContact O-N 2.89Å; K256-T260 PolarHBondContact O-OG1 3.01Å
257N98.8Very high98.8Very high90 Ų90102.6 Ų102.648%0.48152%0.515SS..Hα-helixtrans-60.8-49.3178.4-172.55.6000111.8D253 K254 K259 T260 Q261D253-N257 WeakPolarHBondContact O-CB 3.48Å; D253-N257 PolarHBondContact O-N 3.45Å; K254-N257 PolarHBondContact O-N 2.94Å; N257-K259 VanDerWaalsContact C-N 3.28Å; N257-K259 PolarHBondContact O-N 2.9Å; N257-T260 WeakPolarHBondContact O-CB 3.35Å; N257-T260 PolarHBondContact O-N 3.16Å; N257-T260 VanDerWaalsContact O-N 3.12Å; N257-Q261 WeakPolarHBondContact O-CG 3.33Å; N257-Q261 PolarHBondContact O-N 3.08Å
258L98.8Very high98.8Very high90 Ų9098.2 Ų98.247%0.47151%0.507SS..Hα-helixtrans-61.1-35.9178.2-73.1173.8000112.5K254 V255 N262K254-L258 HydrophobicContact CG-CD1 4.1Å; K254-L258 HydrophobicContact CG-CG 4.45Å; K254-L258 WeakPolarHBondContact O-CB 3.41Å; K254-L258 VanDerWaalsContact O-CG 3.31Å; K254-L258 WeakPolarHBondContact O-CG 3.4Å; K254-L258 PolarHBondContact O-N 3.2Å; V255-L258 PolarHBondContact O-N 3.38Å; L258-N262 VanDerWaalsContact O-CB 3.27Å; L258-N262 WeakPolarHBondContact O-CB 3.38Å; L258-N262 PolarHBondContact O-N 3.11Å
259K98.8Very high98.7Very high141 Ų14196.4 Ų96.461%0.61350%0.503SS*.Hα-helixtrans-64.4-47.1173.3-78.3180177.1-176.50111.4V255 K256 N257 N262 T263V255-K259 HydrophobicContact CG1-CD 4.14Å; V255-K259 HydrophobicContact CG1-CG 4.46Å; V255-K259 WeakPolarHBondContact O-CB 3.44Å; V255-K259 VanDerWaalsContact O-CG 3.32Å; V255-K259 WeakPolarHBondContact O-CG 3.37Å; V255-K259 PolarHBondContact O-N 3.32Å; K256-K259 PolarHBondContact O-N 2.98Å; N257-K259 VanDerWaalsContact C-N 3.28Å; N257-K259 PolarHBondContact O-N 2.9Å; K259-N262 PolarHBondContact O-N 2.88Å; K259-T263 WeakPolarHBondContact O-CG2 3.48Å; K259-T263 PolarHBondContact O-N 3.41Å; K259-T263 PolarHBondContact O-OG1 3.31Å
260T98.8Very high98.7Very high61 Ų6197.1 Ų97.137%0.37451%0.507SS..Hα-helixtrans-57.9-49.7176-620000111.2K256 N257 N262 T263 E264K256-T260 PolarHBondContact O-N 2.89Å; K256-T260 PolarHBondContact O-OG1 3.01Å; N257-T260 WeakPolarHBondContact O-CB 3.35Å; N257-T260 PolarHBondContact O-N 3.16Å; N257-T260 VanDerWaalsContact O-N 3.12Å; T260-N262 VanDerWaalsContact C-N 3.32Å; T260-N262 PolarHBondContact O-N 3.27Å; T260-T263 WeakPolarHBondContact CA-OG1 3.39Å; T260-T263 PolarHBondContact O-N 3.49Å; T260-T263 VanDerWaalsContact O-N 3.14Å; T260-T263 PolarHBondContact O-OG1 2.95Å; T260-E264 WeakPolarHBondContact CG2-OE1 3.44Å; T260-E264 WeakPolarHBondContact O-CG 3.3Å; T260-E264 PolarHBondContact O-N 3.39Å
261Q98.7Very high98.7Very high88 Ų8892.1 Ų92.141%0.41150%0.496SS..Hα-helixtrans-59.4-41.2176.5-70.9-175.4-30.300112.5N257 E264 L265N257-Q261 WeakPolarHBondContact O-CG 3.33Å; N257-Q261 PolarHBondContact O-N 3.08Å; Q261-E264 PolarHBondContact O-N 3.12Å; Q261-L265 WeakPolarHBondContact O-CB 3.36Å; Q261-L265 VanDerWaalsContact O-CG 3.28Å; Q261-L265 WeakPolarHBondContact O-CG 3.47Å; Q261-L265 PolarHBondContact O-N 3.27Å
262N98.7Very high98.7Very high112 Ų11292.5 Ų92.560%0.59950%0.498SS*.Hα-helixtrans-63.4-44176.7-167.5-35.9000111.1L258 K259 T260 E264 L265 A266L258-N262 VanDerWaalsContact O-CB 3.27Å; L258-N262 WeakPolarHBondContact O-CB 3.38Å; L258-N262 PolarHBondContact O-N 3.11Å; K259-N262 PolarHBondContact O-N 2.88Å; T260-N262 VanDerWaalsContact C-N 3.32Å; T260-N262 PolarHBondContact O-N 3.27Å; N262-E264 VanDerWaalsContact C-N 3.34Å; N262-E264 PolarHBondContact O-N 2.84Å; N262-L265 PolarHBondContact O-N 3.26Å; N262-A266 VanDerWaalsContact O-CB 3.23Å; N262-A266 WeakPolarHBondContact O-CB 3.37Å; N262-A266 PolarHBondContact O-N 2.93Å
263T98.8Very high98.7Very high91 Ų9195.4 Ų95.456%0.55850%0.504SS*.Hα-helixtrans-62.6-39.3176.155.30000112.8K259 T260 S267K259-T263 WeakPolarHBondContact O-CG2 3.48Å; K259-T263 PolarHBondContact O-N 3.41Å; K259-T263 PolarHBondContact O-OG1 3.31Å; T260-T263 WeakPolarHBondContact CA-OG1 3.39Å; T260-T263 PolarHBondContact O-N 3.49Å; T260-T263 VanDerWaalsContact O-N 3.14Å; T260-T263 PolarHBondContact O-OG1 2.95Å; T263-S267 WeakPolarHBondContact O-CB 3.49Å; T263-S267 PolarHBondContact O-N 3.47Å
264E98.6Very high98.7Very high114 Ų11496.1 Ų96.153%0.53350%0.504SS..Hα-helixtrans-65.4-49.5176.6-72.2171.4-175.700111.3T260 Q261 N262 A266 S267 T268T260-E264 WeakPolarHBondContact CG2-OE1 3.44Å; T260-E264 WeakPolarHBondContact O-CG 3.3Å; T260-E264 PolarHBondContact O-N 3.39Å; Q261-E264 PolarHBondContact O-N 3.12Å; N262-E264 VanDerWaalsContact C-N 3.34Å; N262-E264 PolarHBondContact O-N 2.84Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 3.43Å; E264-S267 WeakPolarHBondContact O-CB 3.4Å; E264-S267 PolarHBondContact O-N 3.5Å; E264-S267 VanDerWaalsContact O-N 3.16Å; E264-T268 PolarHBondContact O-N 3.24Å; E264-T268 PolarHBondContact O-OG1 3.34Å; E264-T268 VanDerWaalsContact O-OG1 3.13Å
265L98.7Very high98.7Very high123 Ų12394.3 Ų94.364%0.64450%0.498SS*.Hα-helixtrans-61.9-39.9177.4-70.5173.8000112Q261 N262 S267 T268 A269Q261-L265 WeakPolarHBondContact O-CB 3.36Å; Q261-L265 VanDerWaalsContact O-CG 3.28Å; Q261-L265 WeakPolarHBondContact O-CG 3.47Å; Q261-L265 PolarHBondContact O-N 3.27Å; N262-L265 PolarHBondContact O-N 3.26Å; L265-S267 VanDerWaalsContact C-N 3.34Å; L265-T268 PolarHBondContact O-N 3Å; L265-A269 WeakPolarHBondContact O-CB 3.37Å; L265-A269 PolarHBondContact O-N 3.18Å
266A98.7Very high98.7Very high50 Ų5094.1 Ų94.141%0.41350%0.497SS..Hα-helixtrans-63.2-41175.200000111.7N262 E264 A269 S270N262-A266 VanDerWaalsContact O-CB 3.23Å; N262-A266 WeakPolarHBondContact O-CB 3.37Å; N262-A266 PolarHBondContact O-N 2.93Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 3.43Å; A266-A269 PolarHBondContact O-N 2.91Å; A266-S270 PolarHBondContact O-N 3.46Å
267S98.7Very high98.6Very high72 Ų7289.7 Ų89.750%0.50349%0.488SS..Hα-helixtrans-61.2-49.6173.5178.20000111.3T263 E264 L265 A269 S270 V271T263-S267 WeakPolarHBondContact O-CB 3.49Å; T263-S267 PolarHBondContact O-N 3.47Å; E264-S267 WeakPolarHBondContact O-CB 3.4Å; E264-S267 PolarHBondContact O-N 3.5Å; E264-S267 VanDerWaalsContact O-N 3.16Å; L265-S267 VanDerWaalsContact C-N 3.34Å; S267-A269 VanDerWaalsContact C-N 3.33Å; S267-A269 PolarHBondContact O-N 2.89Å; S267-S270 WeakPolarHBondContact O-CB 3.49Å; S267-S270 PolarHBondContact O-N 3.42Å; S267-S270 VanDerWaalsContact O-N 3.08Å; S267-V271 PolarHBondContact O-N 3.36Å
268T98.6Very high98.6Very high78 Ų7890.8 Ų90.848%0.47949%0.49SS..Hα-helixtrans-59.1-43.6176.4-52.80000111.7E264 L265 S270 V271 L272E264-T268 PolarHBondContact O-N 3.24Å; E264-T268 PolarHBondContact O-OG1 3.34Å; E264-T268 VanDerWaalsContact O-OG1 3.13Å; L265-T268 PolarHBondContact O-N 3Å; T268-S270 VanDerWaalsContact C-N 3.3Å; T268-S270 PolarHBondContact O-N 3.22Å; T268-V271 PolarHBondContact O-N 2.97Å; T268-L272 HydrophobicContact CG2-CD1 4.2Å; T268-L272 WeakPolarHBondContact O-CG 3.4Å; T268-L272 PolarHBondContact O-N 3.46Å
269A98.6Very high98.5Very high30 Ų3091.8 Ų91.825%0.24850%0.495CS..Hα-helixtrans-62.6-37.4176.200000112.2L265 A266 S267 L272 R273L265-A269 WeakPolarHBondContact O-CB 3.37Å; L265-A269 PolarHBondContact O-N 3.18Å; A266-A269 PolarHBondContact O-N 2.91Å; S267-A269 VanDerWaalsContact C-N 3.33Å; S267-A269 PolarHBondContact O-N 2.89Å; A269-L272 PolarHBondContact O-N 3.29Å; A269-R273 WeakPolarHBondContact O-CB 3.49Å; A269-R273 VanDerWaalsContact O-CG 3.25Å; A269-R273 WeakPolarHBondContact O-CG 2.98Å; A269-R273 PolarHBondContact O-N 3.25Å
270S98.6Very high98.4Very high68 Ų6891.6 Ų91.648%0.47650%0.495SS..Hα-helixtrans-61.8-48.2174.3-167.30000111.4A266 S267 T268 L272 R273 E274A266-S270 PolarHBondContact O-N 3.46Å; S267-S270 WeakPolarHBondContact O-CB 3.49Å; S267-S270 PolarHBondContact O-N 3.42Å; S267-S270 VanDerWaalsContact O-N 3.08Å; T268-S270 VanDerWaalsContact C-N 3.3Å; T268-S270 PolarHBondContact O-N 3.22Å; S270-L272 VanDerWaalsContact C-N 3.35Å; S270-L272 PolarHBondContact O-N 2.84Å; S270-R273 PolarHBondContact O-N 2.94Å; S270-E274 PolarHBondContact O-N 3.44Å
271V98.6Very high98.3Very high69 Ų6993.3 Ų93.342%0.41850%0.498SS..Hα-helixtrans-60.2-44.7177.7173.90000111.1S267 T268 R273 E274 Q275S267-V271 PolarHBondContact O-N 3.36Å; T268-V271 PolarHBondContact O-N 2.97Å; V271-R273 PolarHBondContact O-N 3.06Å; V271-E274 PolarHBondContact O-N 3.45Å; V271-Q275 HydrophobicContact CG1-CG 4.44Å; V271-Q275 WeakPolarHBondContact O-CG 3.48Å; V271-Q275 PolarHBondContact O-N 2.64Å
272L98.7Very high98.2Very high93 Ų9396 Ų9649%0.48751%0.508SS..Hα-helixtrans-64.1-40.8178-70.3172.6000112.1T268 A269 S270 E274 Q275 V276T268-L272 HydrophobicContact CG2-CD1 4.2Å; T268-L272 WeakPolarHBondContact O-CG 3.4Å; T268-L272 PolarHBondContact O-N 3.46Å; A269-L272 PolarHBondContact O-N 3.29Å; S270-L272 VanDerWaalsContact C-N 3.35Å; S270-L272 PolarHBondContact O-N 2.84Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.89Å; L272-Q275 PolarHBondContact O-N 3.41Å; L272-V276 VanDerWaalsContact O-CG2 3.31Å; L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 3.24Å
273R98.5Very high98Very high180 Ų18094.1 Ų94.168%0.67950%0.501SS*.Hα-helixtrans-61.7-41174.3-74.2174.9-167.5133.40.6111.4A269 S270 V271 V276 A277A269-R273 WeakPolarHBondContact O-CB 3.49Å; A269-R273 VanDerWaalsContact O-CG 3.25Å; A269-R273 WeakPolarHBondContact O-CG 2.98Å; A269-R273 PolarHBondContact O-N 3.25Å; S270-R273 PolarHBondContact O-N 2.94Å; V271-R273 PolarHBondContact O-N 3.06Å; R273-V276 PolarHBondContact O-N 3.36Å; R273-A277 WeakPolarHBondContact O-CB 3.37Å; R273-A277 PolarHBondContact O-N 3.25Å
274E98.4Very high97.8Very high112 Ų11294.7 Ų94.752%0.52350%0.499SS..Hα-helixtrans-64.9-45.6175.9-176.4170.8-172.700111.7S270 V271 L272 V276 A277 Q278S270-E274 PolarHBondContact O-N 3.44Å; V271-E274 PolarHBondContact O-N 3.45Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.89Å; E274-V276 VanDerWaalsContact C-N 3.31Å; E274-V276 PolarHBondContact O-N 2.95Å; E274-A277 WeakPolarHBondContact O-CB 3.38Å; E274-A277 PolarHBondContact O-N 2.88Å; E274-A277 VanDerWaalsContact O-N 3.1Å; E274-Q278 HydrophobicContact CG-CG 4.38Å; E274-Q278 WeakPolarHBondContact O-CG 3.44Å; E274-Q278 PolarHBondContact O-N 2.82Å; E274-Q278 PolarHBondContact OE1-NE2 3.17Å
275Q98.5Very high97.6Very high95 Ų9592.9 Ų92.944%0.44449%0.493SS..Hα-helixtrans-57.9-43.8174.7-73.3176.9-10.100111.8V271 L272 A277 Q278 L279V271-Q275 HydrophobicContact CG1-CG 4.44Å; V271-Q275 WeakPolarHBondContact O-CG 3.48Å; V271-Q275 PolarHBondContact O-N 2.64Å; L272-Q275 PolarHBondContact O-N 3.41Å; Q275-A277 VanDerWaalsContact C-N 3.35Å; Q275-A277 PolarHBondContact O-N 3.5Å; Q275-Q278 PolarHBondContact O-N 3.5Å; Q275-L279 WeakPolarHBondContact O-CB 3.31Å; Q275-L279 WeakPolarHBondContact O-CD1 3.45Å; Q275-L279 WeakPolarHBondContact O-CG 3.47Å; Q275-L279 PolarHBondContact O-N 3.4Å
276V98.4Very high97.4Very high72 Ų7291.7 Ų91.744%0.43648%0.484SS..Hα-helixtrans-62.5-42.1175.1169.80000111.1L272 R273 E274 L279 K280L272-V276 VanDerWaalsContact O-CG2 3.31Å; L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 3.24Å; R273-V276 PolarHBondContact O-N 3.36Å; E274-V276 VanDerWaalsContact C-N 3.31Å; E274-V276 PolarHBondContact O-N 2.95Å; V276-L279 PolarHBondContact O-N 2.87Å; V276-K280 HydrophobicContact CG1-CD 4.08Å; V276-K280 HydrophobicContact CG1-CG 4.42Å; V276-K280 WeakPolarHBondContact O-CB 3.39Å; V276-K280 VanDerWaalsContact O-CG 3.27Å; V276-K280 WeakPolarHBondContact O-CG 3.46Å; V276-K280 PolarHBondContact O-N 3.4Å
277A98.1Very high97.1Very high55 Ų5592.9 Ų92.946%0.45549%0.486SS..Hα-helixtrans-64-44.517700000111.8R273 E274 Q275 K280 Q281R273-A277 WeakPolarHBondContact O-CB 3.37Å; R273-A277 PolarHBondContact O-N 3.25Å; E274-A277 WeakPolarHBondContact O-CB 3.38Å; E274-A277 PolarHBondContact O-N 2.88Å; E274-A277 VanDerWaalsContact O-N 3.1Å; Q275-A277 VanDerWaalsContact C-N 3.35Å; Q275-A277 PolarHBondContact O-N 3.5Å; A277-K280 PolarHBondContact O-N 3.27Å; A277-Q281 PolarHBondContact O-N 3Å
278Q98.1Very high96.8Very high113 Ų11393.7 Ų93.753%0.52849%0.491SS..Hα-helixtrans-61.6-43.9175.8-70.2177.41100111.7E274 Q275 Q281 K282E274-Q278 HydrophobicContact CG-CG 4.38Å; E274-Q278 WeakPolarHBondContact O-CG 3.44Å; E274-Q278 PolarHBondContact O-N 2.82Å; E274-Q278 PolarHBondContact OE1-NE2 3.17Å; Q275-Q278 PolarHBondContact O-N 3.5Å; Q278-Q281 PolarHBondContact O-N 2.96Å; Q278-K282 WeakPolarHBondContact O-CB 3.35Å; Q278-K282 PolarHBondContact O-N 2.87Å
279L97.7Very high96.6Very high111 Ų11196.3 Ų96.358%0.58150%0.502SS*.Hα-helixtrans-63-45.3175.8-80.8158.2000111.6Q275 V276 Q281 K282 V283Q275-L279 WeakPolarHBondContact O-CB 3.31Å; Q275-L279 WeakPolarHBondContact O-CD1 3.45Å; Q275-L279 WeakPolarHBondContact O-CG 3.47Å; Q275-L279 PolarHBondContact O-N 3.4Å; V276-L279 PolarHBondContact O-N 2.87Å; L279-Q281 VanDerWaalsContact C-N 3.34Å; L279-Q281 PolarHBondContact O-N 3.33Å; L279-K282 PolarHBondContact O-N 3.47Å; L279-V283 WeakPolarHBondContact O-CB 3.45Å; L279-V283 VanDerWaalsContact O-CG2 3.3Å; L279-V283 WeakPolarHBondContact O-CG2 3.35Å; L279-V283 PolarHBondContact O-N 2.99Å
280K96Very high96.1Very high137 Ų13798 Ų9860%0.59652%0.522SS*.Hα-helixtrans-58.9-44.6174.3-77177.4177.5-175.90111.4V276 A277 K282 V283 M284V276-K280 HydrophobicContact CG1-CD 4.08Å; V276-K280 HydrophobicContact CG1-CG 4.42Å; V276-K280 WeakPolarHBondContact O-CB 3.39Å; V276-K280 VanDerWaalsContact O-CG 3.27Å; V276-K280 WeakPolarHBondContact O-CG 3.46Å; V276-K280 PolarHBondContact O-N 3.4Å; A277-K280 PolarHBondContact O-N 3.27Å; K280-K282 PolarHBondContact O-N 3.22Å; K280-V283 WeakPolarHBondContact O-CB 3.32Å; K280-V283 PolarHBondContact O-N 3.42Å; K280-M284 WeakPolarHBondContact O-CG 3.41Å; K280-M284 PolarHBondContact O-N 2.94Å
281Q96.9Very high95.6Very high97 Ų9797.3 Ų97.345%0.45352%0.517SS..Hα-helixtrans-61.6-44.5176.5-173.761.948.900111.8A277 Q278 L279 V283 M284 N285A277-Q281 PolarHBondContact O-N 3Å; Q278-Q281 PolarHBondContact O-N 2.96Å; L279-Q281 VanDerWaalsContact C-N 3.34Å; L279-Q281 PolarHBondContact O-N 3.33Å; Q281-V283 VanDerWaalsContact C-N 3.33Å; Q281-V283 PolarHBondContact O-N 3.3Å; Q281-M284 HydrophobicContact CB-CE 4.47Å; Q281-M284 PolarHBondContact O-N 3.46Å; Q281-M284 VanDerWaalsContact OE1-CE 3.28Å; Q281-N285 PolarHBondContact NE2-OD1 2.95Å; Q281-N285 VanDerWaalsContact O-CG 3.25Å; Q281-N285 PolarHBondContact O-N 2.89Å; Q281-N285 PolarHBondContact O-OD1 3.03Å
282K95.8Very high94.9Very high143 Ų143101.7 Ų101.762%0.62253%0.533SS*.Hα-helixtrans-63-40.2177.7-170.5173.8-177.2176.60112Q278 L279 K280 N285 H286Q278-K282 WeakPolarHBondContact O-CB 3.35Å; Q278-K282 PolarHBondContact O-N 2.87Å; L279-K282 PolarHBondContact O-N 3.47Å; K280-K282 PolarHBondContact O-N 3.22Å; K282-N285 PolarHBondContact O-N 3.46Å; K282-H286 PolarHBondContact O-N 2.98Å
283V95.1Very high93.8Very high73 Ų73101.8 Ų101.844%0.44253%0.534SS..Hα-helixtrans-61.4-48.7173.41630000110.7L279 K280 Q281 N285 H286 V287 L293L279-V283 WeakPolarHBondContact O-CB 3.45Å; L279-V283 VanDerWaalsContact O-CG2 3.3Å; L279-V283 WeakPolarHBondContact O-CG2 3.35Å; L279-V283 PolarHBondContact O-N 2.99Å; K280-V283 WeakPolarHBondContact O-CB 3.32Å; K280-V283 PolarHBondContact O-N 3.42Å; Q281-V283 VanDerWaalsContact C-N 3.33Å; Q281-V283 PolarHBondContact O-N 3.3Å; V283-N285 VanDerWaalsContact C-N 3.33Å; V283-N285 PolarHBondContact O-N 2.88Å; V283-H286 WeakPolarHBondContact O-CB 3.48Å; V283-H286 PolarHBondContact O-N 3.45Å; V283-H286 VanDerWaalsContact O-N 3.13Å; V283-V287 WeakPolarHBondContact O-CG2 3.47Å; V283-V287 PolarHBondContact O-N 3.26Å; V283-L293 HydrophobicContact CB-CD1 4.5Å; V283-L293 HydrophobicContact CG1-CD1 3.55Å
284M93.9Very high92.1Very high104 Ų10499.5 Ų99.551%0.51253%0.532SS..Hα-helixtrans-59.3-42.6176.8-71.7-172.1-5900112.1K280 Q281 H286 V287 S288K280-M284 WeakPolarHBondContact O-CG 3.41Å; K280-M284 PolarHBondContact O-N 2.94Å; Q281-M284 HydrophobicContact CB-CE 4.47Å; Q281-M284 PolarHBondContact O-N 3.46Å; Q281-M284 VanDerWaalsContact OE1-CE 3.28Å; M284-H286 VanDerWaalsContact C-N 3.31Å; M284-H286 PolarHBondContact O-N 3.36Å; M284-V287 PolarHBondContact O-N 3.49Å; M284-S288 PolarHBondContact O-N 3.25Å; M284-S288 PolarHBondContact O-OG 3.08Å
285N95.1Very high90.6Very high76 Ų7699.4 Ų99.441%0.40654%0.541SS..Hα-helixtrans-62.1-37.1175.8-69.3-10000112.2Q281 K282 V283 S288 N289Q281-N285 PolarHBondContact NE2-OD1 2.95Å; Q281-N285 VanDerWaalsContact O-CG 3.25Å; Q281-N285 PolarHBondContact O-N 2.89Å; Q281-N285 PolarHBondContact O-OD1 3.03Å; K282-N285 PolarHBondContact O-N 3.46Å; V283-N285 VanDerWaalsContact C-N 3.33Å; V283-N285 PolarHBondContact O-N 2.88Å; N285-S288 WeakPolarHBondContact CA-OG 3.18Å; N285-S288 PolarHBondContact O-OG 3.43Å; N285-N289 WeakPolarHBondContact O-CB 3.29Å; N285-N289 PolarHBondContact O-N 3.41Å; N285-N289 VanDerWaalsContact O-N 3.07Å; N285-N289 PolarHBondContact O-ND2 3.31Å; N285-N289 VanDerWaalsContact O-ND2 3.13Å
286H93.7Very high88.7Confident98 Ų98104.2 Ų104.245%0.45456%0.561SS.*Hα-helixtrans-66.9-41.3175.6-114.2-60.6000112K282 V283 M284 N289 G290 C291K282-H286 PolarHBondContact O-N 2.98Å; V283-H286 WeakPolarHBondContact O-CB 3.48Å; V283-H286 PolarHBondContact O-N 3.45Å; V283-H286 VanDerWaalsContact O-N 3.13Å; M284-H286 VanDerWaalsContact C-N 3.31Å; M284-H286 PolarHBondContact O-N 3.36Å; H286-N289 CarbonylContact O-C 3.58Å; H286-N289 PolarHBondContact O-N 3.07Å; H286-G290 PolarHBondContact O-N 3.26Å; H286-C291 HydrophobicContact CB-CB 4.35Å; H286-C291 PolarHBondContact ND1-SG 3.02Å; H286-C291 VanDerWaalsContact O-CB 3.31Å; H286-C291 WeakPolarHBondContact O-CB 3.33Å; H286-C291 PolarHBondContact O-N 3.43Å
287V93.8Very high86.4Confident75 Ų75109.2 Ų109.246%0.45558%0.579SS.*Hα-helixtrans-64.2-43.6176.1175.70000110.7V283 M284 N289 G290 L293V283-V287 WeakPolarHBondContact O-CG2 3.47Å; V283-V287 PolarHBondContact O-N 3.26Å; M284-V287 PolarHBondContact O-N 3.49Å; V287-N289 PolarHBondContact O-N 3.46Å; V287-G290 PolarHBondContact O-N 2.88Å; V287-L293 HydrophobicContact CG2-CB 4.35Å; V287-L293 HydrophobicContact CG2-CD1 3.64Å; V287-L293 HydrophobicContact CG2-CG 4.1Å
288S91.9Very high84.3Confident89 Ų89112.5 Ų112.562%0.62259%0.593SS**Hα-helixtrans-64.4-27.3176.262.50000113.1M284 N285 G290M284-S288 PolarHBondContact O-N 3.25Å; M284-S288 PolarHBondContact O-OG 3.08Å; N285-S288 WeakPolarHBondContact CA-OG 3.18Å; N285-S288 PolarHBondContact O-OG 3.43Å; S288-G290 PolarHBondContact O-N 2.96Å
289N93.8Very high81.7Confident132 Ų132114.3 Ų114.371%0.70660%0.602SS**THydrogen-bonded Turntrans-83.69.3173.9-66.3-19.6000113.3N285 H286 V287N285-N289 WeakPolarHBondContact O-CB 3.29Å; N285-N289 PolarHBondContact O-N 3.41Å; N285-N289 VanDerWaalsContact O-N 3.07Å; N285-N289 PolarHBondContact O-ND2 3.31Å; N285-N289 VanDerWaalsContact O-ND2 3.13Å; H286-N289 CarbonylContact O-C 3.58Å; H286-N289 PolarHBondContact O-N 3.07Å; V287-N289 PolarHBondContact O-N 3.46Å
290G88.4Confident79.2Confident65 Ų65115.4 Ų115.467%0.6761%0.613SS**THydrogen-bonded Turntrans93.110.5172.400000115.5H286 V287 S288 Q292H286-G290 PolarHBondContact O-N 3.26Å; V287-G290 PolarHBondContact O-N 2.88Å; S288-G290 PolarHBondContact O-N 2.96Å; G290-Q292 PolarHBondContact O-N 2.73Å
291C89.2Confident76.6Confident54 Ų54121.8 Ų121.837%0.36564%0.635SS.*  trans-78.7118.8173.2-66.70000111.6H286 L293H286-C291 HydrophobicContact CB-CB 4.35Å; H286-C291 PolarHBondContact ND1-SG 3.02Å; H286-C291 VanDerWaalsContact O-CB 3.31Å; H286-C291 WeakPolarHBondContact O-CB 3.33Å; H286-C291 PolarHBondContact O-N 3.43Å; C291-L293 PolarHBondContact O-N 2.66Å; C291-L293 VanDerWaalsContact O-N 3.13Å
292Q81.9Confident75.6Confident161 Ų161123 Ų12375%0.75264%0.644SS**  trans-75.896174.7-166.485.926.300110.6G290 M294G290-Q292 PolarHBondContact O-N 2.73Å; Q292-M294 HydrophobicContact CG-CE 3.98Å; Q292-M294 HydrophobicContact CG-CG 4.32Å; Q292-M294 VanDerWaalsContact NE2-CE 3.27Å; Q292-M294 PolarHBondContact O-N 3.12Å
293L75.8Confident74.6Confident96 Ų96121.9 Ų121.950%0.50365%0.645SS.*  trans-85.6101.6170.2-66.9174.8000109V283 V287 C291 P295V283-L293 HydrophobicContact CB-CD1 4.5Å; V283-L293 HydrophobicContact CG1-CD1 3.55Å; V287-L293 HydrophobicContact CG2-CB 4.35Å; V287-L293 HydrophobicContact CG2-CD1 3.64Å; V287-L293 HydrophobicContact CG2-CG 4.1Å; C291-L293 PolarHBondContact O-N 2.66Å; C291-L293 VanDerWaalsContact O-N 3.13Å; L293-P295 VanDerWaalsContact O-CD 3.23Å; L293-P295 WeakPolarHBondContact O-CD 3.36Å
294M64.1Low73.4Confident131 Ų131124.7 Ų124.765%0.64566%0.656SS**  trans-80.1110.4169-67.8-74.783.500108.7Q292 K296Q292-M294 HydrophobicContact CG-CE 3.98Å; Q292-M294 HydrophobicContact CG-CG 4.32Å; Q292-M294 VanDerWaalsContact NE2-CE 3.27Å; Q292-M294 PolarHBondContact O-N 3.12Å; M294-K296 PolarHBondContact O-N 2.82Å
295P66.3Low72.2Confident110 Ų110125.9 Ų125.971%0.71467%0.665SS**  trans-67.2109176.327-30.5000108.1L293 Q297L293-P295 VanDerWaalsContact O-CD 3.23Å; L293-P295 WeakPolarHBondContact O-CD 3.36Å; P295-Q297 VanDerWaalsContact C-N 3.34Å; P295-Q297 PolarHBondContact O-N 2.79Å
296K58.5Low70.8Confident197 Ų197129 Ų12986%0.85768%0.681SS**  trans-68.198.8164.7-73.4-179.4179.21780106.6M294 V298M294-K296 PolarHBondContact O-N 2.82Å; K296-V298 PolarHBondContact O-N 3.47Å
297Q51.1Low69.3Low177 Ų177131.1 Ų131.183%0.82770%0.696SS**  trans-60.7101169-77.6173.5-30.100107.9P295 Q299P295-Q297 VanDerWaalsContact C-N 3.34Å; P295-Q297 PolarHBondContact O-N 2.79Å; Q297-Q299 PolarHBondContact O-N 3.02Å
298V53Low67.5Low123 Ų123135.1 Ų135.175%0.74571%0.713SS**  trans-78.899.3164.3-179.10000105.5K296 V300K296-V298 PolarHBondContact O-N 3.47Å; V298-V300 PolarHBondContact O-N 3.23Å; V298-V300 VanDerWaalsContact O-N 3.1Å
299Q44.7Very low65.6Low151 Ų151138.6 Ų138.671%0.70672%0.72SS**  trans-61.2107.8165.8-88.9169.6-13.700107.6Q297 Y301Q297-Q299 PolarHBondContact O-N 3.02Å; Q299-Y301 HydrophobicContact CB-CE2 4.48Å; Q299-Y301 PolarHBondContact O-N 3.38Å
300V44.5Very low63.3Low134 Ų134139.2 Ų139.281%0.81272%0.722SS**  trans-83.2108.4167.1-177.40000105.9V298V298-V300 PolarHBondContact O-N 3.23Å; V298-V300 VanDerWaalsContact O-N 3.1Å
301Y41.8Very low61Low271 Ų271145.9 Ų145.9100%1.06373%0.726SS**  trans-79.90164.2-85.7-88.7000110Q299Q299-Y301 HydrophobicContact CB-CE2 4.48Å; Q299-Y301 PolarHBondContact O-N 3.38Å

Retrieved 301 of 301 residues in 252.2 ms (Link to these results)