A0A060X9P3_ONCMY Loading...

Homeobox B4a

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis.

AlphaFold DB , UniProt , Accession A0A060X9P3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110486168, Length 250 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
1M50.8Low54.8Low246 Ų246149.8 Ų149.8100%1.21283%0.826SS**  01050-86.8168.1169.900108.3
2A46.6Very low55.2Low106 Ų106153.3 Ų153.388%0.87682%0.82SS**  trans-90.1127.8173.300000108.7S4A2-S4 PolarHBondContact O-N 2.73Å
3M53Low56.3Low188 Ų188151.1 Ų151.193%0.92682%0.815SS**  trans-80.6102.1175.5-61.2-171.793.500108.6S5M3-S5 PolarHBondContact O-N 2.65Å
4S49.1Very low57.2Low93 Ų93148.7 Ų148.765%0.6580%0.802SS**  trans-69.2112.5170.2-173.50000108.8A2A2-S4 PolarHBondContact O-N 2.73Å
5S54.8Low57.6Low103 Ų103143.3 Ų143.372%0.7278%0.778SS**  trans-87.811117448.50000109.9M3 L7M3-S5 PolarHBondContact O-N 2.65Å; S5-L7 PolarHBondContact O-N 3.49Å
6Y52.7Low58.9Low197 Ų197147 Ų14777%0.77378%0.784SS**  trans-65.595.3171.6-47-89.7000109.7I8Y6-I8 VanDerWaalsContact C-N 3.28Å; Y6-I8 PolarHBondContact O-N 3.32Å; Y6-I8 VanDerWaalsContact O-N 3.12Å
7L67.1Low59Low161 Ų161148.3 Ų148.384%0.84378%0.782SS**  trans-7791.1157.9-77.5173.3000107.3S5 N9S5-L7 PolarHBondContact O-N 3.49Å; L7-N9 PolarHBondContact O-N 3.39Å
8I61Low59.8Low136 Ų136144.6 Ų144.670%0.69777%0.768SS**  trans-51.2126.3166.4-120.680.5000107.6Y6 S10Y6-I8 VanDerWaalsContact C-N 3.28Å; Y6-I8 PolarHBondContact O-N 3.32Å; Y6-I8 VanDerWaalsContact O-N 3.12Å; I8-S10 PolarHBondContact O-N 3.46Å
9N52.8Low60.2Low160 Ų160142.1 Ų142.186%0.85676%0.76SS**  trans-51.397.6177-60.813000110.2L7L7-N9 PolarHBondContact O-N 3.39Å
10S53.7Low59.9Low96 Ų96140.7 Ų140.767%0.67176%0.761SS**  trans-99.4115.6162.4-680000105.9I8 Y12I8-S10 PolarHBondContact O-N 3.46Å; S10-Y12 PolarHBondContact O-N 2.79Å
11N61.1Low59.9Low162 Ų162141.8 Ų141.887%0.86676%0.761SS**  trans-6283166.8-81-63.7000108.1V13N11-V13 VanDerWaalsContact C-N 3.35Å; N11-V13 PolarHBondContact O-N 3.11Å
12Y60.3Low60.1Low191 Ų191136.7 Ų136.775%0.74973%0.734SS**  trans-76.292.2174.6-168.7-90.2000106.9S10 D14S10-Y12 PolarHBondContact O-N 2.79Å; Y12-D14 PolarHBondContact O-N 3.39Å; Y12-D14 VanDerWaalsContact O-N 3.16Å
13V68.6Low60.4Low125 Ų125140.7 Ų140.776%0.75873%0.728SS**  trans-73.1104.8168.5-179.50000106.3N11 P15N11-V13 VanDerWaalsContact C-N 3.35Å; N11-V13 PolarHBondContact O-N 3.11Å; V13-P15 WeakPolarHBondContact O-CD 3.36Å
14D69.3Low60.5Low118 Ų118136.9 Ų136.963%0.63172%0.72SS**  trans-58.7119173.4-169.226.2000108.5Y12 K16Y12-D14 PolarHBondContact O-N 3.39Å; Y12-D14 VanDerWaalsContact O-N 3.16Å; D14-K16 PolarHBondContact O-N 3.39Å
15P63.3Low60.8Low68 Ų68140 Ų14044%0.44272%0.724SS.*  trans-61.9108.7179.922.8-31000109.2V13 F17V13-P15 WeakPolarHBondContact O-CD 3.36Å; P15-F17 HydrophobicContact CB-CE2 4.39Å; P15-F17 HydrophobicContact CG-CE2 4.08Å; P15-F17 WeakPolarHBondContact O-CD2 3.17Å; P15-F17 PolarHBondContact O-N 3.11Å
16K77.9Confident60.3Low202 Ų202139.8 Ų139.888%0.87872%0.715SS**  trans-67.196.6175.7-169.489.7177-175.30108.6D14D14-K16 PolarHBondContact O-N 3.39Å
17F60.9Low60.3Low169 Ų169138.2 Ų138.274%0.74172%0.72SS**PPolyproline II helixtrans-65.7133.5171.1-71.1-83.8000109.5P15P15-F17 HydrophobicContact CB-CE2 4.39Å; P15-F17 HydrophobicContact CG-CE2 4.08Å; P15-F17 WeakPolarHBondContact O-CD2 3.17Å; P15-F17 PolarHBondContact O-N 3.11Å
18P73.1Confident59.6Low81 Ų81139.7 Ų139.753%0.52672%0.716SS.*PPolyproline II helixtrans-55.9141.9175.3-22.231.5000110.7C20P18-C20 PolarHBondContact O-N 3.27Å
19P67.3Low59.2Low97 Ų97140.6 Ų140.663%0.6372%0.721SS**PPolyproline II helixtrans-55131.3172.8-19.430.3000110.2E21 E22P19-E21 PolarHBondContact O-N 2.96Å; P19-E22 PolarHBondContact O-N 3.28Å
20C55.6Low59Low114 Ų114137.7 Ų137.777%0.7771%0.711SS**G310 helixtrans-60.7-12.3-177-70.50000114.6P18 E22 Y23P18-C20 PolarHBondContact O-N 3.27Å; C20-E22 PolarHBondContact O-N 3.42Å; C20-Y23 PolarHBondContact O-N 3.16Å
21E59.6Low58.8Low164 Ų164138.8 Ų138.877%0.76672%0.719SS**G310 helixtrans-65-25.9-177.3-72.4-171.7150.800113.2P19 Y23 S24P19-E21 PolarHBondContact O-N 2.96Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.31Å; E21-S24 PolarHBondContact O-OG 3.08Å
22E54Low58.2Low139 Ų139138.7 Ų138.765%0.6571%0.713SS**G310 helixtrans-78.4-12.5-178.1-139.1174.3-174.300113.4P19 C20 N26P19-E22 PolarHBondContact O-N 3.28Å; C20-E22 PolarHBondContact O-N 3.42Å; E22-N26 PolarHBondContact O-ND2 3.24Å
23Y54.1Low57.5Low190 Ų190132.4 Ų132.475%0.74570%0.697SS**G310 helixtrans-85-18.5179.5-85.3-79.6000114.1C20 E21 Q25C20-Y23 PolarHBondContact O-N 3.16Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.31Å; Y23-Q25 VanDerWaalsContact C-N 3.33Å
24S55.2Low56.8Low108 Ų108131.9 Ų131.976%0.75570%0.696SS**SBendtrans-85.6-7.2177.967.40000113.8E21E21-S24 PolarHBondContact O-OG 3.08Å
25Q54.1Low55.8Low158 Ų158130.9 Ų130.974%0.73869%0.691SS**SBendtrans-101.62-169.7-150.3154.4-2.400113.8Y23Y23-Q25 VanDerWaalsContact C-N 3.33Å
26N45.2Very low55.3Low99 Ų99136.4 Ų136.453%0.52970%0.704SS.*  trans-10998.2179.9-83.3-60.4000109.3E22 Y28E22-N26 PolarHBondContact O-ND2 3.24Å; N26-Y28 HydrophobicContact CB-CD2 3.85Å; N26-Y28 PolarHBondContact O-N 3.12Å
27D52.5Low53.9Low165 Ų165136.9 Ų136.988%0.88270%0.702SS**  trans-63.949.3165.2-74-57.1000111.7L29D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å
28Y52.1Low53.3Low192 Ų192131.8 Ų131.875%0.75369%0.687SS**  trans-9324.2177.7-90.9-87.2000112.6N26N26-Y28 HydrophobicContact CB-CD2 3.85Å; N26-Y28 PolarHBondContact O-N 3.12Å
29L51.9Low51.8Low154 Ų154131.5 Ų131.581%0.80669%0.692SS**SBendtrans-107.1105.7157.4-74.3172.5000106.7D27 S31D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å; L29-S31 PolarHBondContact O-N 2.85Å
30P49.1Very low50.8Low99 Ų99135.6 Ų135.664%0.64370%0.703SS**  trans-46.5122.3159.9-25.334.4000107.2H32P30-H32 PolarHBondContact O-N 2.81Å
31S49.2Very low50.6Low120 Ų120140.8 Ų140.884%0.83971%0.706SS**  trans-56.888.8177.7330000108.8L29 S33L29-S31 PolarHBondContact O-N 2.85Å; S31-S33 VanDerWaalsContact C-N 3.33Å; S31-S33 PolarHBondContact O-N 3.41Å
32H49.9Very low50.3Low159 Ų159143.6 Ų143.674%0.73671%0.71SS**  trans-65.5103.6164.7-76.9-52.5000105.7P30P30-H32 PolarHBondContact O-N 2.81Å
33S45.3Very low49.5Very low60 Ų60145.5 Ų145.542%0.4272%0.719SS.*  trans-41.9136.2173.3-179.90000109.4S31 D35 Y36S31-S33 VanDerWaalsContact C-N 3.33Å; S31-S33 PolarHBondContact O-N 3.41Å; S33-D35 PolarHBondContact O-N 3.1Å; S33-D35 PolarHBondContact OG-N 2.96Å; S33-D35 PolarHBondContact OG-OD2 3.28Å; S33-D35 VanDerWaalsContact OG-OD2 3.04Å; S33-Y36 PolarHBondContact O-N 3.38Å; S33-Y36 VanDerWaalsContact O-N 3.12Å
34P52.9Low49.1Very low113 Ų113140.7 Ų140.773%0.73471%0.711SS**THydrogen-bonded Turntrans-51.8-16.6173.7-2433.1000113.4Y36P34-Y36 VanDerWaalsContact C-N 3.32Å; P34-Y36 PolarHBondContact O-N 3.13Å
35D49.4Very low48.5Very low98 Ų98140.2 Ų140.252%0.52471%0.713SS.*Hα-helixtrans-72.5-17-179.1-58.5-44.6000115.2S33 Y37 S38 A39S33-D35 PolarHBondContact O-N 3.1Å; S33-D35 PolarHBondContact OG-N 2.96Å; S33-D35 PolarHBondContact OG-OD2 3.28Å; S33-D35 VanDerWaalsContact OG-OD2 3.04Å; D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.37Å; D35-S38 VanDerWaalsContact CA-OG 3.3Å; D35-S38 WeakPolarHBondContact CA-OG 3.48Å; D35-S38 PolarHBondContact O-N 3.05Å; D35-S38 PolarHBondContact OD1-OG 3.02Å; D35-A39 VanDerWaalsContact O-CB 3.24Å; D35-A39 WeakPolarHBondContact O-CB 3.32Å; D35-A39 PolarHBondContact O-N 3.21Å
36Y51.7Low47.6Very low183 Ų183142.2 Ų142.272%0.71872%0.719SS**Hα-helixtrans-64.7-32.4178.9-167.8-95.4000112.6S33 P34S33-Y36 PolarHBondContact O-N 3.38Å; S33-Y36 VanDerWaalsContact O-N 3.12Å; P34-Y36 VanDerWaalsContact C-N 3.32Å; P34-Y36 PolarHBondContact O-N 3.13Å
37Y48.7Very low47.7Very low212 Ų212147 Ų14783%0.83174%0.739SS**Hα-helixtrans-93.7-17.8173.9-79.1-83.9000113.4D35D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.37Å
38S49.1Very low46.6Very low63 Ų63146.8 Ų146.844%0.44174%0.737SS.*Hα-helixtrans-88.4-29.9-178.285.30000112.9D35 Q40 R41D35-S38 VanDerWaalsContact CA-OG 3.3Å; D35-S38 WeakPolarHBondContact CA-OG 3.48Å; D35-S38 PolarHBondContact O-N 3.05Å; D35-S38 PolarHBondContact OD1-OG 3.02Å; S38-Q40 PolarHBondContact O-N 2.99Å; S38-Q40 VanDerWaalsContact O-N 3.14Å; S38-R41 PolarHBondContact O-N 3.06Å; S38-R41 VanDerWaalsContact O-N 3.14Å
39A42.1Very low45.6Very low75 Ų75145.1 Ų145.162%0.6274%0.737SS**G310 helixtrans-68.2-11.3-178.100000114.3D35 R41D35-A39 VanDerWaalsContact O-CB 3.24Å; D35-A39 WeakPolarHBondContact O-CB 3.32Å; D35-A39 PolarHBondContact O-N 3.21Å; A39-R41 PolarHBondContact O-N 3.01Å
40Q45.5Very low45.2Very low183 Ų183141.8 Ų141.886%0.85573%0.726SS**G310 helixtrans-83.32.9174.3-148.412724.400113.5S38S38-Q40 PolarHBondContact O-N 2.99Å; S38-Q40 VanDerWaalsContact O-N 3.14Å
41R52.1Low44.9Very low222 Ų222143.5 Ų143.584%0.83873%0.728SS**G310 helixtrans-114.56.4-173.6-112.6-75.1-163.3-164.81.3115.5S38 A39S38-R41 PolarHBondContact O-N 3.06Å; S38-R41 VanDerWaalsContact O-N 3.14Å; A39-R41 PolarHBondContact O-N 3.01Å
42R53.4Low44.3Very low224 Ų224148.4 Ų148.485%0.84573%0.73SS**  trans-153.7107.1164.3-80.9-160174.9131.7-1.9111.5
43E35.9Very low43.8Very low179 Ų179148.5 Ų148.584%0.83673%0.731SS**  trans-132.3147.5137.7-94.4-65.8105.400108.5
44P46.2Very low43.4Very low89 Ų89152.5 Ų152.558%0.57874%0.743SS**  trans-93.5165.3-168.737.9-30000112.6F46P44-F46 PolarHBondContact O-N 3.23Å
45A42.8Very low42.4Very low97 Ų97159.1 Ų159.180%0.80275%0.753SS**  trans10.798.4158.800000118.1
46F35Very low41.9Very low200 Ų200159.1 Ų159.188%0.87776%0.76SS**  trans-119.4119.4142.3-87.2-85.7000108.5P44 N48P44-F46 PolarHBondContact O-N 3.23Å; F46-N48 PolarHBondContact O-N 3.05Å
47Q46.8Very low41.1Very low201 Ų201153.6 Ų153.694%0.93976%0.76SS**  trans-48.2122.5169.1-67.8159.3-18.500109
48N29.7Very low40.2Very low159 Ų159150.1 Ų150.185%0.8576%0.764SS**  trans-126.5113.1155.3-156.711.5000107.7F46 S50F46-N48 PolarHBondContact O-N 3.05Å; N48-S50 PolarHBondContact O-N 3.26Å
49E30.8Very low39.6Very low158 Ų158151.7 Ų151.774%0.73878%0.782SS**  trans-51.4126.7179.1-72-153.596.900112I51E49-I51 PolarHBondContact O-N 3.22Å
50S43.6Very low39.4Very low84 Ų84155.5 Ų155.559%0.58779%0.792SS**  28.567.3114.1-47.70000117.5N48N48-S50 PolarHBondContact O-N 3.26Å
51I42.8Very low39.5Very low134 Ų134152.3 Ų152.369%0.68779%0.787SS**  trans-118.82.7164.6-130.171.8000115.8E49E49-I51 PolarHBondContact O-N 3.22Å
52Y36.6Very low39.4Very low223 Ų223147.1 Ų147.188%0.87578%0.782SS**  trans-12469.5168.3-63.1-73000111.1Q54Y52-Q54 PolarHBondContact O-N 3.3Å
53H39.8Very low38.7Very low162 Ų162145.4 Ų145.475%0.7578%0.777SS**  trans-64.9110.4155.4-82.984.6000109
54Q37.2Very low38.8Very low144 Ų144142.4 Ų142.467%0.67377%0.77SS**  40.7103.8122.4-156.88459.300116.9Y52 S56Y52-Q54 PolarHBondContact O-N 3.3Å; Q54-S56 PolarHBondContact NE2-OG 3.33Å
55R30.8Very low38.3Very low252 Ų252142.5 Ų142.595%0.95177%0.769SS**  -126.997.9127.4-84.4-162-165.1-93.60.9109.2
56S39.7Very low38Very low97 Ų97144.2 Ų144.268%0.67877%0.774SS**  trans-70.9148.6149.2-72.50000108.8Q54Q54-S56 PolarHBondContact NE2-OG 3.33Å
57G34.8Very low38.1Very low68 Ų68143.5 Ų143.570%0.70177%0.773SS**  trans134.697.6158.700000112.1
58C30.1Very low37.5Very low138 Ų138137.5 Ų137.593%0.93277%0.766SS**  -168.2138.7105.3-92.70000109.9
59A36Very low37.7Very low97 Ų97136.2 Ų136.280%0.80277%0.769SS**  trans-79.5155.8-173.700000112.5
60D38.3Very low37.9Very low155 Ų155132.5 Ų132.583%0.82977%0.773SS**  trans-55.4156.4147.4-69.2-51.1000109.3
61P47.8Very low37.6Very low116 Ų116136.7 Ų136.775%0.75378%0.784SS**  cis-151.1-139.840.735.6-8.4000112.6
62P48.2Very low37.8Very low112 Ų112136 Ų13673%0.72779%0.788SS**  -117173-71.129.8-10.8000113.8
63Y40.1Very low37.6Very low189 Ų189129 Ų12974%0.74178%0.776SS**  trans30.9133.6153.2142.6-84.9000120.9
64T36.9Very low37.5Very low115 Ų115128.2 Ų128.271%0.70678%0.782SS**  -165.8133.5127.1-68.70000111.6
65T36.1Very low37.7Very low91 Ų91127.2 Ų127.256%0.55879%0.786SS**  trans-59.9147.6170.3-65.90000114.6Q67T65-Q67 HydrophobicContact CG2-CG 4.11Å
66C36.5Very low38.2Very low133 Ų133123.9 Ų123.990%0.89978%0.783SS**  trans-136.8115.8146.527.80000111.8
67Q38.3Very low38.3Very low185 Ų185124.5 Ų124.586%0.86479%0.788SS**  trans-75.3145.7170.3-75.7168.2-17.200111.2T65T65-Q67 HydrophobicContact CG2-CG 4.11Å
68G33.7Very low38.9Very low76 Ų76126.4 Ų126.478%0.78479%0.788SS**  118.8143.7121.600000111.6
69S33.9Very low39.1Very low131 Ų131131 Ų13192%0.91679%0.786SS**  cis-166.8155.39.847.40000108.8
70G33.9Very low38.8Very low80 Ų80130.1 Ų130.183%0.82579%0.786SS**  trans145.579.2165.900000116.5
71Q37.9Very low39.1Very low173 Ų173131 Ų13181%0.80878%0.784SS**  trans-76.7179164.8-72.7-78-3.100110.9
72P46.9Very low38.5Very low118 Ų118132.6 Ų132.677%0.76679%0.792SS**  cis-135.8159.86.527.8-3.9000118.4
73A33.7Very low38.3Very low77 Ų77135 Ų13564%0.63680%0.797SS**  trans12.1130.3141.600000121.8
74V37.4Very low38.7Very low145 Ų145131 Ų13188%0.87980%0.795SS**  -136.7120.4126.4-172.50000109.1
75V40.6Very low39.3Very low123 Ų123132 Ų13275%0.74580%0.803SS**  trans-68.5131.1170.4163.80000109.4
76M40.9Very low39.3Very low183 Ų183132.7 Ų132.790%0.90182%0.818SS**  trans-156.1112.3144.6-75.2-144.788.500112
77S41.8Very low39.1Very low110 Ų110129.6 Ų129.677%0.76981%0.809SS**  trans-143.4149.3145.1-116.80000104.2
78P47.9Very low38.8Very low108 Ų108128.6 Ų128.670%0.70181%0.809SS**  -154.1-179.455.137.3-14.6000116.8
79R34.1Very low38.9Very low235 Ų235129.3 Ų129.389%0.88780%0.802SS**  trans75.7128.1143.2-105.2174162.1160-5.9120.3
80G30.4Very low38.9Very low78 Ų78129.4 Ų129.480%0.80480%0.797SS**  trans-17995.3157.300000113.2
81H43.8Very low39.3Very low173 Ų173130.9 Ų130.980%0.80179%0.792SS**  trans-69.3137.9162.5-75.5-95.6000110.2
82V36.3Very low39.1Very low150 Ų150130.5 Ų130.591%0.90980%0.795SS**  trans-145.9128147.2-174.10000110.2
83L43.9Very low39.2Very low161 Ų161130.2 Ų130.284%0.84379%0.793SS**PPolyproline II helixtrans-70.9169.3174.8-89.1144.5000112.9
84P48.2Very low39.2Very low107 Ų107133.6 Ų133.670%0.69580%0.796SS**PPolyproline II helixtrans-82164.5179.636.4-33.5000111.3
85P49.2Very low39.5Very low134 Ų134132.1 Ų132.187%0.8779%0.789SS**PPolyproline II helixtrans-94.8127.5163.832.9-24.8000110.8
86A35.6Very low39.2Very low106 Ų106129.6 Ų129.688%0.87678%0.777SS**  trans-105.7149.2157.600000108.6
87G32.6Very low39.2Very low69 Ų69130 Ų13071%0.71178%0.776SS**  trans134.2119.7147.400000117.4
88L32.2Very low39.2Very low164 Ų164132.3 Ų132.386%0.85977%0.774SS**  trans14696.3132.9-75.4164.8000109.6
89S36Very low38.6Very low91 Ų91132.6 Ų132.664%0.63678%0.778SS**  54.6126.791.763.10000113.3
90T33.4Very low38.6Very low132 Ų132127.1 Ų127.181%0.8177%0.766SS**  -177.3-170.958.3-19.50000109.3
91P43.5Very low38.8Very low111 Ų111129 Ų12972%0.72177%0.767SS**  -124.2175.7-129.338.9-17.1000118.3
92L31.9Very low38.8Very low166 Ų166127 Ų12787%0.86977%0.767SS**  trans78.7154.1147.6-157.970.1000119.7
93P49Very low39.5Very low112 Ų112125.2 Ų125.273%0.72776%0.756SS**  cis-122.4172.4-16.117.27.3000116.7
94E34.3Very low39.6Very low148 Ų148123.1 Ų123.169%0.69275%0.752SS**  trans-48164.1161.9-139.2-161.6100.400115.9S96E94-S96 WeakPolarHBondContact OE1-CA 3.45Å; E94-S96 WeakPolarHBondContact OE1-CB 3.25Å; E94-S96 PolarHBondContact OE1-N 3.04Å; E94-S96 PolarHBondContact OE1-OG 3.08Å
95P43.6Very low39.8Very low113 Ų113122.9 Ų122.973%0.73475%0.753SS**  -141.3129.484.633.9-15.8000116.3
96S34.7Very low40.6Very low71 Ų71121.9 Ų121.950%0.49775%0.746SS.*  59.784.5118.3-31.50000119.1E94E94-S96 WeakPolarHBondContact OE1-CA 3.45Å; E94-S96 WeakPolarHBondContact OE1-CB 3.25Å; E94-S96 PolarHBondContact OE1-N 3.04Å; E94-S96 PolarHBondContact OE1-OG 3.08Å
97H40.1Very low41.8Very low192 Ų192122.2 Ų122.289%0.88974%0.74SS**  trans-133.495.2140.8-75.3-65.8000110.4C99H97-C99 PolarHBondContact O-N 3.28Å
98H42.2Very low42.7Very low157 Ų157124.8 Ų124.873%0.72774%0.744SS**  trans-52.8121.2163.4176.667.8000110.7D100H98-D100 IonicContact CE1-OD1 3.11Å; H98-D100 PolarHBondContact CE1-OD1 3.28Å; H98-D100 IonicContact CE1-OD2 3.46Å; H98-D100 PolarHBondContact CE1-OD2 3.41Å; H98-D100 IonicContact ND1-OD1 3.89Å; H98-D100 IonicContact NE2-OD1 3.81Å; H98-D100 IonicContact NE2-OD2 3.32Å; H98-D100 PolarHBondContact NE2-OD2 3.42Å
99C34.7Very low43.5Very low115 Ų115121.6 Ų121.678%0.77774%0.741SS**  trans-139.2116.515461.80000108.1H97 S101H97-C99 PolarHBondContact O-N 3.28Å; C99-S101 PolarHBondContact O-N 2.93Å
100D35.1Very low43.7Very low120 Ų120123.4 Ų123.464%0.64275%0.753SS**  trans-58.4127.6-176.9-66.8-62.9000112.2H98 V102H98-D100 IonicContact CE1-OD1 3.11Å; H98-D100 PolarHBondContact CE1-OD1 3.28Å; H98-D100 IonicContact CE1-OD2 3.46Å; H98-D100 PolarHBondContact CE1-OD2 3.41Å; H98-D100 IonicContact ND1-OD1 3.89Å; H98-D100 IonicContact NE2-OD1 3.81Å; H98-D100 IonicContact NE2-OD2 3.32Å; H98-D100 PolarHBondContact NE2-OD2 3.42Å; D100-V102 PolarHBondContact O-N 2.86Å; D100-V102 VanDerWaalsContact O-N 3.11Å
101S34.9Very low44.3Very low118 Ų118120.4 Ų120.483%0.82575%0.747SS**  trans-67.1101.4167-710000109.3C99 T103C99-S101 PolarHBondContact O-N 2.93Å; S101-T103 PolarHBondContact O-N 3.37Å
102V44.3Very low44.5Very low131 Ų131124 Ų12479%0.79476%0.755SS**  trans-80.6100.6163.9-170.60000107.7D100 P104D100-V102 PolarHBondContact O-N 2.86Å; D100-V102 VanDerWaalsContact O-N 3.11Å; V102-P104 VanDerWaalsContact O-CD 3.3Å; V102-P104 WeakPolarHBondContact O-CD 3.32Å
103T50.8Low44.9Very low111 Ų111122.7 Ų122.768%0.68175%0.749SS**  trans-53.8117.5164.4-57.10000109.6S101 S105S101-T103 PolarHBondContact O-N 3.37Å; T103-S105 PolarHBondContact O-N 2.7Å
104P45.6Very low44.8Very low117 Ų117123.4 Ų123.476%0.7675%0.753SS**  trans-76.8114.2163.729.6-27000107.7V102V102-P104 VanDerWaalsContact O-CD 3.3Å; V102-P104 WeakPolarHBondContact O-CD 3.32Å
105S52.4Low45.2Very low102 Ų102122.5 Ų122.571%0.71375%0.752SS**PPolyproline II helixtrans-46.3145.1171.2-54.10000111.9T103T103-S105 PolarHBondContact O-N 2.7Å
106P65.3Low45.5Very low113 Ų113124.7 Ų124.773%0.73476%0.758SS**PPolyproline II helixtrans-62.8146.5167.728.5-32.1000109.2
107P60.8Low46.1Very low114 Ų114128.9 Ų128.974%0.7477%0.769SS**PPolyproline II helixtrans-60.2148.6173.628-33.3000109.1A109P107-A109 PolarHBondContact O-N 2.99Å; P107-A109 VanDerWaalsContact O-N 3.15Å
108P52.3Low46.2Very low122 Ų122124.9 Ų124.979%0.79276%0.763SS**PPolyproline II helixtrans-58.4126.4177.924.4-31.8000108.8C110P108-C110 PolarHBondContact O-N 3.12Å
109A48.7Very low46.4Very low97 Ų97122.5 Ų122.580%0.80276%0.762SS**  trans-57113.8163.900000106.8P107 G111P107-A109 PolarHBondContact O-N 2.99Å; P107-A109 VanDerWaalsContact O-N 3.15Å; A109-G111 VanDerWaalsContact C-N 3.26Å; A109-G111 PolarHBondContact O-N 3.47Å
110C39.5Very low47.1Very low130 Ų130122.8 Ų122.888%0.87877%0.765SS**  trans-59.498167.3-88.70000107.5P108 Q112P108-C110 PolarHBondContact O-N 3.12Å; C110-Q112 PolarHBondContact O-N 3.3Å
111G45.9Very low47.5Very low68 Ų68122.7 Ų122.770%0.70177%0.768SS**  trans-56.1129.4167.500000108.9A109 N113A109-G111 VanDerWaalsContact C-N 3.26Å; A109-G111 PolarHBondContact O-N 3.47Å; G111-N113 PolarHBondContact O-N 2.88Å
112Q48.7Very low48.3Very low188 Ų188122.6 Ų122.688%0.87978%0.775SS**  trans-62.3114.9170.6-62.7171.48.600108.2C110C110-Q112 PolarHBondContact O-N 3.3Å
113N40.1Very low48.6Very low138 Ų138120.9 Ų120.974%0.73877%0.769SS**  trans-109.2120.3153.6-86.5-14.8000106.8G111 L115G111-N113 PolarHBondContact O-N 2.88Å; N113-L115 VanDerWaalsContact C-N 3.25Å; N113-L115 HydrophobicContact CB-CD1 4.28Å; N113-L115 PolarHBondContact O-N 3.33Å
114P47.4Very low48.8Very low126 Ų126120.2 Ų120.282%0.81877%0.769SS**  trans-7982.7168.432.3-27.9000107.3N116P114-N116 PolarHBondContact O-N 3.06Å
115L41.3Very low49.4Very low129 Ų129125.9 Ų125.968%0.67578%0.775SS**  trans-77105.4164.8-112.278.8000108.1N113 H117N113-L115 VanDerWaalsContact C-N 3.25Å; N113-L115 HydrophobicContact CB-CD1 4.28Å; N113-L115 PolarHBondContact O-N 3.33Å; L115-H117 PolarHBondContact O-N 3.07Å
116N49.8Very low50Low159 Ų159129.7 Ų129.785%0.8578%0.779SS**  trans-48.999.6160.1-94-14.9000109.7P114P114-N116 PolarHBondContact O-N 3.06Å
117H47.5Very low50.5Low159 Ų159131.2 Ų131.274%0.73678%0.78SS**  trans-121.496.8155.1-83.2-76.8000107.6L115 P119L115-H117 PolarHBondContact O-N 3.07Å; H117-P119 VanDerWaalsContact O-CD 3.31Å; H117-P119 WeakPolarHBondContact O-CD 3.49Å
118S43.2Very low51.3Low108 Ų108131.1 Ų131.176%0.75578%0.78SS**  trans-70127.4157.5-670000108.7
119P46Very low53Low108 Ų108130.2 Ų130.270%0.70177%0.772SS**  trans-100.3109.114429.6-17.6000107.4H117 T121H117-P119 VanDerWaalsContact O-CD 3.31Å; H117-P119 WeakPolarHBondContact O-CD 3.49Å; P119-T121 VanDerWaalsContact C-N 3.3Å; P119-T121 PolarHBondContact O-N 2.86Å
120S48.6Very low54.8Low121 Ų121129.4 Ų129.485%0.84676%0.757SS**  trans-63.792.8162.2-61.20000108.7
121T45.2Very low57.2Low117 Ų117129.2 Ų129.272%0.71874%0.739SS**  trans-142.2101.3153.752.90000107.7P119 S123P119-T121 VanDerWaalsContact C-N 3.3Å; P119-T121 PolarHBondContact O-N 2.86Å; T121-S123 PolarHBondContact O-N 2.84Å
122A51.7Low59.2Low117 Ų117130.8 Ų130.897%0.96774%0.737SS**  trans-63.4102.8169.200000108.9
123S49.8Very low61Low94 Ų94131.6 Ų131.666%0.65773%0.732SS**  trans-140.9110.7168.7159.50000106.7T121 R125T121-S123 PolarHBondContact O-N 2.84Å; S123-R125 PolarHBondContact O-N 2.97Å
124S55.8Low63.3Low97 Ų97129.5 Ų129.568%0.67872%0.718SS**  trans-20.999.9169.8177.90000112.7K126S124-K126 VanDerWaalsContact C-N 3.27Å; S124-K126 PolarHBondContact O-N 3.43Å
125R57Low64.9Low236 Ų236129.6 Ų129.689%0.89171%0.706SS**  trans-73.589171.3-66.5-112.7-173.5171.12.1106.3S123 D127S123-R125 PolarHBondContact O-N 2.97Å; R125-D127 PolarHBondContact O-N 3.33Å
126K66.3Low66.7Low183 Ų183130.4 Ų130.480%0.79670%0.704SS**PPolyproline II helixtrans-62.1116.9171.4-60.2-178.1-176.2-175.40106.9S124S124-K126 VanDerWaalsContact C-N 3.27Å; S124-K126 PolarHBondContact O-N 3.43Å
127D74.2Confident67.9Low144 Ų144127.2 Ų127.277%0.7769%0.69SS**PPolyproline II helixtrans-52.1138.3172.6-72.6-42.1000109.3R125 V129R125-D127 PolarHBondContact O-N 3.33Å; D127-V129 PolarHBondContact O-N 3.11Å; D127-V129 VanDerWaalsContact O-N 3.15Å
128P79.2Confident68.7Low113 Ų113126.6 Ų126.673%0.73469%0.687SS**PPolyproline II helixtrans-59.6122.4-178.422.6-31.7000110.3V130P128-V130 PolarHBondContact O-N 2.93Å; P128-V130 VanDerWaalsContact O-N 3.13Å
129V86.6Confident69.3Low102 Ų102125 Ų12562%0.61867%0.673SS**  trans-67.5111178.9179.80000109.3D127 Y131D127-V129 PolarHBondContact O-N 3.11Å; D127-V129 VanDerWaalsContact O-N 3.15Å; V129-Y131 HydrophobicContact CG1-CD1 4.42Å; V129-Y131 HydrophobicContact CG1-CE1 4.05Å; V129-Y131 HydrophobicContact CG1-CE2 4.41Å; V129-Y131 PolarHBondContact O-N 3.07Å
130V87.8Confident69.6Low81 Ų81125.7 Ų125.749%0.49167%0.671SS.*  trans-87.7103.5176.2-177.30000109.9P128 M134 K135P128-V130 PolarHBondContact O-N 2.93Å; P128-V130 VanDerWaalsContact O-N 3.13Å; V130-M134 HydrophobicContact CG1-CB 3.99Å; V130-K135 HydrophobicContact CG1-CG 4Å
131Y88.9Confident70.1Confident126 Ų126126.7 Ų126.749%0.49467%0.665SS.*  trans-68.4152.9177.7-63.1-77.9000112.3V129 W133 M134V129-Y131 HydrophobicContact CG1-CD1 4.42Å; V129-Y131 HydrophobicContact CG1-CE1 4.05Å; V129-Y131 HydrophobicContact CG1-CE2 4.41Å; V129-Y131 PolarHBondContact O-N 3.07Å; Y131-W133 VanDerWaalsContact C-N 3.25Å; Y131-W133 VanDerWaalsContact CB-NE1 3.3Å; Y131-W133 AromaticContact CG-NE1 3.86Å; Y131-W133 PolarHBondContact O-N 2.81Å; Y131-W133 VanDerWaalsContact O-N 3.12Å; Y131-M134 HydrophobicContact CD2-SD 3.68Å; Y131-M134 HydrophobicContact CG-SD 4.35Å; Y131-M134 VanDerWaalsContact O-CB 3.32Å; Y131-M134 WeakPolarHBondContact O-CB 3.45Å; Y131-M134 PolarHBondContact O-N 3.33Å
132P87.6Confident70.6Confident101 Ų101125.2 Ų125.266%0.65666%0.656SS**G310 helixtrans-53.9-35.1-177.9-29.136.1000115.2M134 K135P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 3.35Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.27Å
133W87.9Confident70.6Confident204 Ų204123.7 Ų123.777%0.77363%0.631SS**G310 helixtrans-71.6-22.5177.865.5-95.2000113.5Y131Y131-W133 VanDerWaalsContact C-N 3.25Å; Y131-W133 VanDerWaalsContact CB-NE1 3.3Å; Y131-W133 AromaticContact CG-NE1 3.86Å; Y131-W133 PolarHBondContact O-N 2.81Å; Y131-W133 VanDerWaalsContact O-N 3.12Å
134M86.9Confident71Confident94 Ų94124.5 Ų124.546%0.46363%0.634SS.*G310 helixtrans-77.1-15.2175.3-58.7173.272.200111.6V130 Y131 P132V130-M134 HydrophobicContact CG1-CB 3.99Å; Y131-M134 HydrophobicContact CD2-SD 3.68Å; Y131-M134 HydrophobicContact CG-SD 4.35Å; Y131-M134 VanDerWaalsContact O-CB 3.32Å; Y131-M134 WeakPolarHBondContact O-CB 3.45Å; Y131-M134 PolarHBondContact O-N 3.33Å; P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 3.35Å
135K82.3Confident71Confident129 Ų129126 Ų12656%0.56164%0.635SS**SBendtrans-79.3136.9177.5-58.6-178.4178.3178.20109.9V130 P132 V137V130-K135 HydrophobicContact CG1-CG 4Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.27Å; K135-V137 PolarHBondContact O-N 3.13Å
136K78.9Confident70.7Confident145 Ų145122.8 Ų122.863%0.6362%0.624SS**  trans-76.482.3-178.2-61.5173.983.1-172.70110.8H138 V139K136-H138 PolarHBondContact O-N 3.5Å; K136-H138 VanDerWaalsContact O-N 3.14Å; K136-V139 HydrophobicContact CB-CB 4.35Å; K136-V139 HydrophobicContact CB-CG2 3.87Å; K136-V139 PolarHBondContact O-N 3.39Å; K136-V139 VanDerWaalsContact O-N 3.12Å
137V73.7Confident70.1Confident92 Ų92120.2 Ų120.256%0.55862%0.624SS**Hα-helixtrans-52.8-37.5-176.6-178.60000113.4K135 V139K135-V137 PolarHBondContact O-N 3.13Å; V137-V139 PolarHBondContact O-N 2.63Å
138H64.6Low69.2Low147 Ų147117.3 Ų117.368%0.68163%0.627SS**Hα-helixtrans-72.5-9.3-175.7-62.194000115K136K136-H138 PolarHBondContact O-N 3.5Å; K136-H138 VanDerWaalsContact O-N 3.14Å
139V56.5Low67.8Low74 Ų74119 Ų11945%0.44864%0.635SS.*Hα-helixtrans-96.7-40-173.8-177.30000111K136 V137 I141 V142K136-V139 HydrophobicContact CB-CB 4.35Å; K136-V139 HydrophobicContact CB-CG2 3.87Å; K136-V139 PolarHBondContact O-N 3.39Å; K136-V139 VanDerWaalsContact O-N 3.12Å; V137-V139 PolarHBondContact O-N 2.63Å; V139-I141 VanDerWaalsContact C-N 3.32Å; V139-I141 PolarHBondContact O-N 2.85Å; V139-V142 PolarHBondContact O-N 2.95Å
140N52.6Low66.5Low123 Ų123117.7 Ų117.766%0.65864%0.643SS**Hα-helixtrans-69-23-177.6-84.837.4000115V142N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.48Å
141I57.8Low65Low142 Ų142120.4 Ų120.473%0.72865%0.65SS**THydrogen-bonded Turntrans-74.7-21.4-176.2-67164.7000112.2V139V139-I141 VanDerWaalsContact C-N 3.32Å; V139-I141 PolarHBondContact O-N 2.85Å
142V56.4Low63.6Low85 Ų85119 Ų11952%0.51566%0.657SS.*THydrogen-bonded Turntrans-107.9-19-171.5-142.30000112.7V139 N140 R154V139-V142 PolarHBondContact O-N 2.95Å; N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.48Å; V142-R154 VanDerWaalsContact CG2-NH2 3.27Å
143N51.1Low62.7Low86 Ų86122.9 Ų122.946%0.4666%0.663SS.*  trans-158.8100.7173.9-120.32.7000109.9N145N143-N145 PolarHBondContact O-N 3.36Å
144P58.8Low62Low111 Ų111121.9 Ų121.972%0.72166%0.659SS**THydrogen-bonded Turntrans-70.7-3.5-179.920-22.5000114.5
145N55.3Low61.8Low128 Ų128122.7 Ų122.768%0.68467%0.674SS**THydrogen-bonded Turntrans-111.3-1.3-166-3735.9000114.3N143N143-N145 PolarHBondContact O-N 3.36Å
146Y51.1Low62.2Low168 Ų168127.9 Ų127.966%0.65969%0.69SS**  trans-102.5107-171.5-105.6-95000112.7G148 E151Y146-G148 PolarHBondContact O-N 3.11Å; Y146-E151 HydrophobicContact CD1-CG 4.25Å
147T53.4Low62.8Low130 Ų130126.6 Ų126.680%0.79870%0.695SS**  trans-78.598.617743.90000111.2V149T147-V149 VanDerWaalsContact C-N 3.28Å; T147-V149 PolarHBondContact O-N 3.48Å
148G56.6Low63.9Low82 Ų82126.3 Ų126.385%0.84570%0.702SS**SBendtrans63.5-15.3134.200000122.2Y146Y146-G148 PolarHBondContact O-N 3.11Å
149V50.1Low65.5Low148 Ų148122.8 Ų122.890%0.89768%0.683SS**SBendtrans-125.394.8-171.2-171.70000110.1T147T147-V149 VanDerWaalsContact C-N 3.28Å; T147-V149 PolarHBondContact O-N 3.48Å
150G59.1Low67.5Low75 Ų75122.8 Ų122.877%0.77368%0.683SS**SBendtrans115-4.8160.800000118.5
151E55.9Low69.7Low139 Ų139126.4 Ų126.465%0.6569%0.688SS**PPolyproline II helixtrans-77.4139-170.9-98.6-77.7123.700114.9Y146Y146-E151 HydrophobicContact CD1-CG 4.25Å
152P58.4Low71.6Confident97 Ų97126.3 Ų126.363%0.6368%0.684SS**PPolyproline II helixtrans-63.6133.9-171.8-19.532.8000112.2R154P152-R154 PolarHBondContact O-N 3Å; P152-R154 VanDerWaalsContact O-N 3.1Å
153K69.7Low73.6Confident182 Ų182123.6 Ų123.679%0.79167%0.666SS**PPolyproline II helixtrans-55.4123.1163.1-68.382.5169-175.90106.1S155K153-S155 PolarHBondContact O-N 3.46Å
154R72.9Confident75.9Confident182 Ų182121.8 Ų121.869%0.68766%0.658SS**  trans-44.4106.7173.8-91.7-177.3173.1157.7-5.1108.3V142 P152 R156V142-R154 VanDerWaalsContact CG2-NH2 3.27Å; P152-R154 PolarHBondContact O-N 3Å; P152-R154 VanDerWaalsContact O-N 3.1Å; R154-R156 PolarHBondContact O-N 3.41Å
155S83.3Confident77.8Confident112 Ų112120.2 Ų120.278%0.78364%0.643SS**PPolyproline II helixtrans-67.8131.7-176.1-175.60000108.3K153 T157K153-S155 PolarHBondContact O-N 3.46Å; S155-T157 PolarHBondContact O-N 2.79Å
156R89.6Confident79.8Confident238 Ų238117.2 Ų117.290%0.89863%0.625SS**PPolyproline II helixtrans-81.6117175.8-73.5-179.2176.1-96.22.4108.2R154R154-R156 PolarHBondContact O-N 3.41Å
157T92.9Very high82.1Confident118 Ų118109.3 Ų109.372%0.72459%0.594SS**PPolyproline II helixtrans-74126.3168.4-43.80000109.5S155S155-T157 PolarHBondContact O-N 2.79Å
158A95.6Very high84.2Confident86 Ų86106.4 Ų106.471%0.71157%0.571SS**PPolyproline II helixtrans-83.3145.3172.100000110.4
159Y98.2Very high86.2Confident73 Ų73108.2 Ų108.229%0.28656%0.556SS.*PPolyproline II helixtrans-80.4145.9170.8-60.4-46.7000110.3L191 W199Y159-L191 HydrophobicContact CD1-CD1 4.13Å; Y159-L191 HydrophobicContact CD1-CD2 3.89Å; Y159-L191 HydrophobicContact CE1-CD1 4.02Å; Y159-L191 HydrophobicContact CE1-CD2 3.66Å; Y159-W199 AromaticContact CD2-CD1 3.91Å; Y159-W199 AromaticContact CE2-CD1 3.67Å
160T98.6Very high88.5Confident74 Ų74101.9 Ų101.945%0.45452%0.517SS..PPolyproline II helixtrans-69.1159.2174.974.70000110.4Q162 Q163 V164T160-Q162 VanDerWaalsContact C-N 3.27Å; T160-Q162 PolarHBondContact O-N 3.05Å; T160-Q163 PolarHBondContact O-N 3.45Å; T160-Q163 VanDerWaalsContact O-N 3.16Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.49Å; T160-Q163 PolarHBondContact OG1-N 3.33Å; T160-V164 WeakPolarHBondContact O-CG2 3.46Å; T160-V164 PolarHBondContact O-N 2.85Å
161R98.3Very high90.4Very high198 Ų19898.5 Ų98.575%0.74748%0.48SS*.Hα-helixtrans-56.3-42.7177.2-174.7173.2-178-86.2-1.1111.9V164 L165R161-V164 PolarHBondContact O-N 3Å; R161-L165 HydrophobicContact CG-CD1 4.22Å; R161-L165 WeakPolarHBondContact O-CG 3.36Å; R161-L165 PolarHBondContact O-N 3.02Å
162Q98.3Very high92.4Very high140 Ų14097.6 Ų97.665%0.65448%0.476SS*.Hα-helixtrans-61.2-45.3177.3-178.2-175.6-17.600112T160 V164 L165 E166T160-Q162 VanDerWaalsContact C-N 3.27Å; T160-Q162 PolarHBondContact O-N 3.05Å; Q162-V164 VanDerWaalsContact C-N 3.32Å; Q162-V164 PolarHBondContact O-N 2.91Å; Q162-L165 PolarHBondContact O-N 3.42Å; Q162-E166 PolarHBondContact O-N 3.32Å; Q162-E166 VanDerWaalsContact O-N 3.08Å
163Q98.5Very high94.3Very high29 Ų29102.2 Ų102.214%0.13648%0.482CS..Hα-helixtrans-59.3-44.6177.4-73.3171.8-26.600111.4T160 L167 L189T160-Q163 PolarHBondContact O-N 3.45Å; T160-Q163 VanDerWaalsContact O-N 3.16Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.49Å; T160-Q163 PolarHBondContact OG1-N 3.33Å; Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 WeakPolarHBondContact O-CD1 3.33Å; Q163-L167 WeakPolarHBondContact O-CG 3.3Å; Q163-L167 PolarHBondContact O-N 3.28Å; Q163-L189 HydrophobicContact CG-CB 4.33Å; Q163-L189 PolarHBondContact NE2-O 3.17Å
164V98.5Very high95.6Very high47 Ų4797 Ų9729%0.28546%0.463SS..Hα-helixtrans-62.5-44.5178.5177.30000111.3T160 R161 Q162 L167 E168T160-V164 WeakPolarHBondContact O-CG2 3.46Å; T160-V164 PolarHBondContact O-N 2.85Å; R161-V164 PolarHBondContact O-N 3Å; Q162-V164 VanDerWaalsContact C-N 3.32Å; Q162-V164 PolarHBondContact O-N 2.91Å; V164-L167 PolarHBondContact O-N 3.23Å; V164-E168 HydrophobicContact CG1-CG 4.38Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å; V164-E168 PolarHBondContact O-N 3.28Å
165L98.5Very high96.8Very high79 Ų7993.1 Ų93.141%0.41445%0.448SS..Hα-helixtrans-62.6-45.9-179.3-71.4173.2000112.6R161 Q162 L167 E168 K169R161-L165 HydrophobicContact CG-CD1 4.22Å; R161-L165 WeakPolarHBondContact O-CG 3.36Å; R161-L165 PolarHBondContact O-N 3.02Å; Q162-L165 PolarHBondContact O-N 3.42Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L165-E168 PolarHBondContact O-N 3.3Å; L165-K169 WeakPolarHBondContact O-CB 3.4Å; L165-K169 PolarHBondContact O-N 3.47Å
166E98.6Very high97.5Very high65 Ų6594.5 Ų94.530%0.30444%0.438SS..Hα-helixtrans-65.8-38.8177.3-72.3-62.6149.100111.7Q162 E168 K169 E170 L189Q162-E166 PolarHBondContact O-N 3.32Å; Q162-E166 VanDerWaalsContact O-N 3.08Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 3.45Å; E166-K169 PolarHBondContact O-N 3.36Å; E166-K169 IonicContact OE1-NZ 3.56Å; E166-K169 IonicContact OE2-NZ 2.96Å; E166-K169 PolarHBondContact OE2-NZ 3.44Å; E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.23Å; E166-L189 HydrophobicContact CB-CD1 4.12Å; E166-L189 HydrophobicContact CB-CD2 3.71Å; E166-L189 HydrophobicContact CB-CG 4.49Å; E166-L189 HydrophobicContact CG-CD2 3.99Å
167L98.6Very high97.9Very high1 Ų184.7 Ų84.71%0.00540%0.403CS..Hα-helixtrans-63-40.7174.4-71.5167.2000112.1Q163 V164 L165 F171 I185 L189 L191 I196 W199 F200Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 WeakPolarHBondContact O-CD1 3.33Å; Q163-L167 WeakPolarHBondContact O-CG 3.3Å; Q163-L167 PolarHBondContact O-N 3.28Å; V164-L167 PolarHBondContact O-N 3.23Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L167-F171 WeakPolarHBondContact O-CB 3.46Å; L167-F171 PolarHBondContact O-N 2.9Å; L167-I185 HydrophobicContact CD2-CG2 4.19Å; L167-L189 HydrophobicContact CD1-CD1 4.41Å; L167-L189 HydrophobicContact CD2-CD1 3.85Å; L167-L189 HydrophobicContact CG-CD1 3.68Å; L167-L191 HydrophobicContact CD1-CD1 4.32Å; L167-I196 HydrophobicContact CD2-CD1 3.78Å; L167-W199 VanDerWaalsContact C-CH2 3.48Å; L167-W199 HydrophobicContact CB-CD2 3.93Å; L167-W199 HydrophobicContact CB-CE3 3.94Å; L167-W199 HydrophobicContact CB-CH2 3.62Å; L167-W199 HydrophobicContact CB-CZ2 3.58Å; L167-W199 HydrophobicContact CB-CZ3 3.79Å; L167-W199 HydrophobicContact CD1-CD2 3.88Å; L167-W199 HydrophobicContact CD1-CG 3.85Å; L167-W199 HydrophobicContact CD2-CD2 4.35Å; L167-W199 HydrophobicContact CD2-CE3 4.27Å; L167-W199 HydrophobicContact CG-CD2 4.28Å; L167-W199 HydrophobicContact CG-CE3 4.49Å; L167-W199 WeakPolarHBondContact O-CH2 3.47Å; L167-W199 WeakPolarHBondContact O-CZ3 3.36Å; L167-F200 HydrophobicContact CD2-CE2 4.1Å
168E98.6Very high98.2Very high70 Ų7083.2 Ų83.233%0.32739%0.394SS..Hα-helixtrans-66-46175.2-75.4-168.7171.500111.6V164 L165 E166 E170 F171 H172 W199V164-E168 HydrophobicContact CG1-CG 4.38Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å; V164-E168 PolarHBondContact O-N 3.28Å; L165-E168 PolarHBondContact O-N 3.3Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 3.45Å; E168-E170 VanDerWaalsContact C-N 3.33Å; E168-E170 PolarHBondContact O-N 2.9Å; E168-F171 WeakPolarHBondContact O-CB 3.15Å; E168-F171 PolarHBondContact O-N 3.15Å; E168-F171 VanDerWaalsContact O-N 3.12Å; E168-H172 PolarHBondContact O-N 2.86Å; E168-H172 PolarHBondContact O-ND1 3.39Å; E168-W199 HydrophobicContact CG-CH2 3.99Å; E168-W199 HydrophobicContact CG-CZ2 4.02Å
169K98.6Very high98.3Very high120 Ų12086 Ų8652%0.52239%0.386SS..Hα-helixtrans-54.6-49.1175.2174.1-178.3157.3-155.20111.4L165 E166 F171 H172 Y173L165-K169 WeakPolarHBondContact O-CB 3.4Å; L165-K169 PolarHBondContact O-N 3.47Å; E166-K169 PolarHBondContact O-N 3.36Å; E166-K169 IonicContact OE1-NZ 3.56Å; E166-K169 IonicContact OE2-NZ 2.96Å; E166-K169 PolarHBondContact OE2-NZ 3.44Å; K169-F171 VanDerWaalsContact C-N 3.32Å; K169-F171 PolarHBondContact O-N 3.07Å; K169-H172 PolarHBondContact O-N 2.8Å; K169-Y173 PolarHBondContact O-N 3.22Å; K169-Y173 VanDerWaalsContact O-N 3.08Å
170E98.4Very high98.3Very high15 Ų1591.5 Ų91.57%0.0741%0.406CS..Hα-helixtrans-62.8-37.8176.5-73-64.2132.100112.6E166 E168 H172 Y173 N174 R181 I185 F200E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.23Å; E168-E170 VanDerWaalsContact C-N 3.33Å; E168-E170 PolarHBondContact O-N 2.9Å; E170-H172 VanDerWaalsContact C-N 3.34Å; E170-H172 PolarHBondContact O-N 3.49Å; E170-Y173 WeakPolarHBondContact O-CB 3.5Å; E170-Y173 PolarHBondContact O-N 3.02Å; E170-N174 PolarHBondContact O-N 3.36Å; E170-R181 IonicContact OE1-CZ 3.92Å; E170-R181 IonicContact OE1-NE 3.8Å; E170-R181 IonicContact OE1-NH2 2.68Å; E170-R181 PolarHBondContact OE1-NH2 3.32Å; E170-R181 IonicContact OE2-CZ 2.84Å; E170-R181 IonicContact OE2-NE 3.71Å; E170-R181 PolarHBondContact OE2-NE 3.37Å; E170-R181 IonicContact OE2-NH2 3.12Å; E170-R181 PolarHBondContact OE2-NH2 2.91Å; E170-R181 VanDerWaalsContact OE2-NH2 3.12Å; E170-I185 HydrophobicContact CB-CD1 4.07Å; E170-I185 HydrophobicContact CG-CD1 3.69Å; E170-I185 HydrophobicContact CG-CG1 4.11Å; E170-F200 HydrophobicContact CB-CZ 4.06Å
171F98.6Very high98.3Very high3 Ų392.1 Ų92.11%0.01340%0.4CS..Hα-helixtrans-65.5-36.6177.5-177.1-98.7000113.2L167 E168 K169 N174 R175 W199 F200 R203 R204 W207L167-F171 WeakPolarHBondContact O-CB 3.46Å; L167-F171 PolarHBondContact O-N 2.9Å; E168-F171 WeakPolarHBondContact O-CB 3.15Å; E168-F171 PolarHBondContact O-N 3.15Å; E168-F171 VanDerWaalsContact O-N 3.12Å; K169-F171 VanDerWaalsContact C-N 3.32Å; K169-F171 PolarHBondContact O-N 3.07Å; F171-N174 CarbonylContact O-C 3.26Å; F171-N174 VanDerWaalsContact O-C 3.26Å; F171-R175 HydrophobicContact CE1-CG 4.2Å; F171-R175 HydrophobicContact CE2-CB 4.03Å; F171-R175 HydrophobicContact CE2-CG 4.11Å; F171-R175 HydrophobicContact CZ-CB 4.23Å; F171-R175 HydrophobicContact CZ-CG 3.86Å; F171-R175 PolarHBondContact O-N 2.97Å; F171-W199 HydrophobicContact CB-CH2 4.32Å; F171-W199 HydrophobicContact CB-CZ3 4.06Å; F171-F200 HydrophobicContact CB-CE1 4.2Å; F171-F200 HydrophobicContact CB-CZ 4.31Å; F171-F200 AromaticContact CD2-CD1 3.96Å; F171-F200 HydrophobicContact CD2-CD1 3.96Å; F171-F200 AromaticContact CD2-CE1 3.9Å; F171-F200 HydrophobicContact CD2-CE1 3.9Å; F171-R203 HydrophobicContact CB-CG 4.41Å; F171-R203 HydrophobicContact CD1-CG 3.73Å; F171-R203 HydrophobicContact CD2-CB 4.21Å; F171-R203 HydrophobicContact CD2-CG 3.57Å; F171-R203 HydrophobicContact CE1-CG 3.79Å; F171-R203 HydrophobicContact CE2-CB 4.19Å; F171-R203 HydrophobicContact CE2-CG 3.65Å; F171-R203 HydrophobicContact CG-CG 3.61Å; F171-R203 HydrophobicContact CZ-CG 3.76Å; F171-R204 HydrophobicContact CE2-CG 3.74Å; F171-R204 HydrophobicContact CZ-CG 4.26Å; F171-W207 HydrophobicContact CE1-CB 4.3Å; F171-W207 HydrophobicContact CE1-CG 4.25Å; F171-W207 HydrophobicContact CZ-CB 4.03Å; F171-W207 HydrophobicContact CZ-CG 4.17Å
172H98Very high98.3Very high120 Ų12085.4 Ų85.456%0.55638%0.375SS*.Hα-helixtrans-68.4-39.4174.3-69.891.9000111.2E168 K169 E170E168-H172 PolarHBondContact O-N 2.86Å; E168-H172 PolarHBondContact O-ND1 3.39Å; K169-H172 PolarHBondContact O-N 2.8Å; E170-H172 VanDerWaalsContact C-N 3.34Å; E170-H172 PolarHBondContact O-N 3.49Å
173Y98.3Very high98.3Very high194 Ų19480.6 Ų80.676%0.76136%0.355SS*.Hα-helixtrans-62.5-49.9174.4179-106.5000111.7K169 E170K169-Y173 PolarHBondContact O-N 3.22Å; K169-Y173 VanDerWaalsContact O-N 3.08Å; E170-Y173 WeakPolarHBondContact O-CB 3.5Å; E170-Y173 PolarHBondContact O-N 3.02Å
174N97.2Very high98.3Very high72 Ų7282.4 Ų82.439%0.38536%0.363SS..  trans-147.5123.1174.2-168.7-12.4000111.4E170 F171 Y176E170-N174 PolarHBondContact O-N 3.36Å; F171-N174 CarbonylContact O-C 3.26Å; F171-N174 VanDerWaalsContact O-C 3.26Å; N174-Y176 PolarHBondContact ND2-O 2.92Å; N174-Y176 PolarHBondContact O-N 3.1Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 PolarHBondContact OD1-N 3Å; N174-Y176 PolarHBondContact OD1-O 3.5Å
175R97.6Very high98.3Very high101 Ų10180.5 Ų80.538%0.38135%0.352SS..SBendtrans-65.8-14.8179.7-69.2174.716971.80.2113.2F171 R204F171-R175 HydrophobicContact CE1-CG 4.2Å; F171-R175 HydrophobicContact CE2-CB 4.03Å; F171-R175 HydrophobicContact CE2-CG 4.11Å; F171-R175 HydrophobicContact CZ-CB 4.23Å; F171-R175 HydrophobicContact CZ-CG 3.86Å; F171-R175 PolarHBondContact O-N 2.97Å; R175-R204 WeakPolarHBondContact O-CD 3.24Å
176Y98.3Very high98.3Very high142 Ų14277 Ų7756%0.55733%0.334SS*.SBendtrans-132.6133.1-178.7-64.1-106.9000109.9N174N174-Y176 PolarHBondContact ND2-O 2.92Å; N174-Y176 PolarHBondContact O-N 3.1Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 PolarHBondContact OD1-N 3Å; N174-Y176 PolarHBondContact OD1-O 3.5Å
177L98.3Very high98.3Very high31 Ų3180.7 Ų80.716%0.16235%0.351CS..  trans-94.8139.4178.2-63.5179.2000112R181 R182 I185 I196 F200L177-R181 HydrophobicContact CD2-CG 3.94Å; L177-R182 HydrophobicContact CD1-CB 4.49Å; L177-I185 HydrophobicContact CD1-CD1 3.88Å; L177-I185 HydrophobicContact CD2-CD1 3.74Å; L177-I185 HydrophobicContact CG-CD1 4.48Å; L177-I196 HydrophobicContact CD1-CG2 3.49Å; L177-I196 VanDerWaalsContact CD1-CG2 3.49Å; L177-F200 HydrophobicContact CD1-CD1 4.15Å; L177-F200 HydrophobicContact CD1-CD2 3.59Å; L177-F200 HydrophobicContact CD1-CE1 3.98Å; L177-F200 HydrophobicContact CD1-CE2 3.43Å; L177-F200 VanDerWaalsContact CD1-CE2 3.43Å; L177-F200 HydrophobicContact CD1-CG 3.97Å; L177-F200 HydrophobicContact CD1-CZ 3.63Å; L177-F200 HydrophobicContact CD2-CE1 3.76Å; L177-F200 HydrophobicContact CD2-CE2 4.34Å; L177-F200 HydrophobicContact CD2-CZ 3.67Å; L177-F200 HydrophobicContact CG-CD1 3.8Å; L177-F200 HydrophobicContact CG-CD2 4.17Å; L177-F200 HydrophobicContact CG-CE1 3.53Å; L177-F200 HydrophobicContact CG-CE2 3.96Å; L177-F200 HydrophobicContact CG-CG 4.11Å; L177-F200 HydrophobicContact CG-CZ 3.63Å
178T98.5Very high98.3Very high88 Ų8885.7 Ų85.754%0.5438%0.381SS..  trans-72.7166.8162.665.80000110.7R181 R182T178-R181 WeakPolarHBondContact OG1-CB 3.43Å; T178-R181 PolarHBondContact OG1-N 3.05Å; T178-R182 WeakPolarHBondContact O-CB 3.35Å; T178-R182 PolarHBondContact O-N 3.41Å; T178-R182 VanDerWaalsContact O-N 3.13Å
179R98.3Very high98.3Very high143 Ų14382.8 Ų82.854%0.5437%0.368SS..Hα-helixtrans-59.9-50.7177.6-178.366177.182.4-2.7111.4R181 R182 V183 E193R179-R181 PolarHBondContact O-N 3.21Å; R179-R182 WeakPolarHBondContact O-CB 3.41Å; R179-R182 PolarHBondContact O-N 2.8Å; R179-V183 PolarHBondContact O-N 3.3Å; R179-E193 IonicContact CZ-OE1 3.26Å; R179-E193 VanDerWaalsContact CZ-OE1 3.26Å; R179-E193 IonicContact CZ-OE2 3.03Å; R179-E193 IonicContact NE-OE2 3.69Å; R179-E193 IonicContact NH1-OE1 2.95Å; R179-E193 PolarHBondContact NH1-OE1 3.31Å; R179-E193 IonicContact NH1-OE2 2.63Å; R179-E193 PolarHBondContact NH1-OE2 3.14Å; R179-E193 IonicContact NH2-OE1 2.85Å; R179-E193 PolarHBondContact NH2-OE1 3.23Å; R179-E193 IonicContact NH2-OE2 3.39Å; R179-E193 PolarHBondContact NH2-OE2 3.21Å
180R98.3Very high98.3Very high189 Ų18983.2 Ų83.271%0.71338%0.381SS*.Hα-helixtrans-57.8-50.5179.4178.4178.4167.6168.22.1111.7R182 V183 E184R180-R182 VanDerWaalsContact C-N 3.25Å; R180-R182 PolarHBondContact O-N 2.93Å; R180-V183 WeakPolarHBondContact O-CB 3.44Å; R180-V183 PolarHBondContact O-N 3.01Å; R180-E184 WeakPolarHBondContact CG-OE1 3.39Å; R180-E184 IonicContact CZ-OE1 3.01Å; R180-E184 IonicContact NE-OE1 3.39Å; R180-E184 PolarHBondContact NE-OE1 3.42Å; R180-E184 IonicContact NH2-OE1 3.9Å; R180-E184 PolarHBondContact O-N 2.86Å
181R98.4Very high98.2Very high87 Ų8783.3 Ų83.333%0.32838%0.382SS..Hα-helixtrans-61.7-35-178.6-172.256.7177.2174-1112.4E170 L177 T178 R179 V183 E184 I185E170-R181 IonicContact OE1-CZ 3.92Å; E170-R181 IonicContact OE1-NE 3.8Å; E170-R181 IonicContact OE1-NH2 2.68Å; E170-R181 PolarHBondContact OE1-NH2 3.32Å; E170-R181 IonicContact OE2-CZ 2.84Å; E170-R181 IonicContact OE2-NE 3.71Å; E170-R181 PolarHBondContact OE2-NE 3.37Å; E170-R181 IonicContact OE2-NH2 3.12Å; E170-R181 PolarHBondContact OE2-NH2 2.91Å; E170-R181 VanDerWaalsContact OE2-NH2 3.12Å; L177-R181 HydrophobicContact CD2-CG 3.94Å; T178-R181 WeakPolarHBondContact OG1-CB 3.43Å; T178-R181 PolarHBondContact OG1-N 3.05Å; R179-R181 PolarHBondContact O-N 3.21Å; R181-V183 VanDerWaalsContact C-N 3.32Å; R181-V183 PolarHBondContact O-N 3.45Å; R181-E184 VanDerWaalsContact CD-OE2 3.25Å; R181-E184 WeakPolarHBondContact CD-OE2 3.49Å; R181-E184 IonicContact CZ-OE2 2.81Å; R181-E184 IonicContact NE-OE2 3.89Å; R181-E184 IonicContact NH1-OE2 3.98Å; R181-E184 PolarHBondContact NH1-OE2 3.39Å; R181-E184 PolarHBondContact O-N 2.96Å; R181-I185 HydrophobicContact CG-CD1 3.89Å; R181-I185 HydrophobicContact CG-CG1 4.44Å; R181-I185 WeakPolarHBondContact O-CG1 3.21Å; R181-I185 PolarHBondContact O-N 3.4Å; R181-I185 VanDerWaalsContact O-N 3.1Å
182R98.6Very high98.2Very high57 Ų5785.9 Ų85.922%0.21540%0.4CS..Hα-helixtrans-60-40.7175-171.4-172.2-57170.86.6112.5L177 T178 R179 R180 A186 E193 I196L177-R182 HydrophobicContact CD1-CB 4.49Å; T178-R182 WeakPolarHBondContact O-CB 3.35Å; T178-R182 PolarHBondContact O-N 3.41Å; T178-R182 VanDerWaalsContact O-N 3.13Å; R179-R182 WeakPolarHBondContact O-CB 3.41Å; R179-R182 PolarHBondContact O-N 2.8Å; R180-R182 VanDerWaalsContact C-N 3.25Å; R180-R182 PolarHBondContact O-N 2.93Å; R182-A186 WeakPolarHBondContact O-CB 3.44Å; R182-A186 PolarHBondContact O-N 2.95Å; R182-E193 HydrophobicContact CG-CB 4.34Å; R182-E193 HydrophobicContact CG-CG 4.5Å; R182-I196 HydrophobicContact CG-CB 4.11Å; R182-I196 HydrophobicContact CG-CG2 3.92Å
183V98.6Very high98.2Very high40 Ų4082.9 Ų82.924%0.24239%0.386CS..Hα-helixtrans-64-47.6177.2-177.70000110.5R179 R180 R181 I185 A186 H187R179-V183 PolarHBondContact O-N 3.3Å; R180-V183 WeakPolarHBondContact O-CB 3.44Å; R180-V183 PolarHBondContact O-N 3.01Å; R181-V183 VanDerWaalsContact C-N 3.32Å; R181-V183 PolarHBondContact O-N 3.45Å; V183-I185 VanDerWaalsContact C-N 3.34Å; V183-I185 PolarHBondContact O-N 3.01Å; V183-A186 WeakPolarHBondContact O-CB 3.18Å; V183-A186 PolarHBondContact O-N 3.07Å; V183-H187 WeakPolarHBondContact CG1-NE2 3.45Å; V183-H187 PolarHBondContact O-CD2 3.21Å; V183-H187 VanDerWaalsContact O-CD2 3.22Å; V183-H187 PolarHBondContact O-N 3.21Å
184E98.5Very high98.2Very high66 Ų6682.2 Ų82.231%0.30838%0.382SS..Hα-helixtrans-57.6-46.7-178.8-65.2169.4-175.100111.7R180 R181 T188R180-E184 WeakPolarHBondContact CG-OE1 3.39Å; R180-E184 IonicContact CZ-OE1 3.01Å; R180-E184 IonicContact NE-OE1 3.39Å; R180-E184 PolarHBondContact NE-OE1 3.42Å; R180-E184 IonicContact NH2-OE1 3.9Å; R180-E184 PolarHBondContact O-N 2.86Å; R181-E184 VanDerWaalsContact CD-OE2 3.25Å; R181-E184 WeakPolarHBondContact CD-OE2 3.49Å; R181-E184 IonicContact CZ-OE2 2.81Å; R181-E184 IonicContact NE-OE2 3.89Å; R181-E184 IonicContact NH1-OE2 3.98Å; R181-E184 PolarHBondContact NH1-OE2 3.39Å; R181-E184 PolarHBondContact O-N 2.96Å; E184-T188 PolarHBondContact O-N 3.12Å; E184-T188 VanDerWaalsContact O-N 3.13Å; E184-T188 PolarHBondContact O-OG1 3.27Å
185I98.4Very high98.3Very high8 Ų881.6 Ų81.64%0.04138%0.377CS..Hα-helixtrans-67.9-42178.6-61.8165.4000111.1L167 E170 L177 R181 V183 H187 T188 L189 I196L167-I185 HydrophobicContact CD2-CG2 4.19Å; E170-I185 HydrophobicContact CB-CD1 4.07Å; E170-I185 HydrophobicContact CG-CD1 3.69Å; E170-I185 HydrophobicContact CG-CG1 4.11Å; L177-I185 HydrophobicContact CD1-CD1 3.88Å; L177-I185 HydrophobicContact CD2-CD1 3.74Å; L177-I185 HydrophobicContact CG-CD1 4.48Å; R181-I185 HydrophobicContact CG-CD1 3.89Å; R181-I185 HydrophobicContact CG-CG1 4.44Å; R181-I185 WeakPolarHBondContact O-CG1 3.21Å; R181-I185 PolarHBondContact O-N 3.4Å; R181-I185 VanDerWaalsContact O-N 3.1Å; V183-I185 VanDerWaalsContact C-N 3.34Å; V183-I185 PolarHBondContact O-N 3.01Å; I185-H187 VanDerWaalsContact C-N 3.29Å; I185-H187 PolarHBondContact O-N 3.07Å; I185-T188 PolarHBondContact O-N 2.73Å; I185-L189 HydrophobicContact CG2-CD1 3.66Å; I185-L189 HydrophobicContact CG2-CG 4.13Å; I185-L189 WeakPolarHBondContact O-CB 3.38Å; I185-L189 WeakPolarHBondContact O-CG 3.3Å; I185-L189 PolarHBondContact O-N 3.45Å; I185-I196 HydrophobicContact CG2-CD1 3.89Å
186A98.5Very high98.3Very high5 Ų576.8 Ų76.84%0.04136%0.359CS..Hα-helixtrans-56-45.5178.800000111.6R182 V183 V190 L191 E193 I196R182-A186 WeakPolarHBondContact O-CB 3.44Å; R182-A186 PolarHBondContact O-N 2.95Å; V183-A186 WeakPolarHBondContact O-CB 3.18Å; V183-A186 PolarHBondContact O-N 3.07Å; A186-V190 WeakPolarHBondContact O-CA 3.49Å; A186-V190 PolarHBondContact O-N 3.19Å; A186-L191 CarbonylContact C-O 3.45Å; A186-L191 VanDerWaalsContact CA-O 3.32Å; A186-L191 WeakPolarHBondContact CA-O 3.37Å; A186-L191 WeakPolarHBondContact CB-O 3.29Å; A186-L191 PolarHBondContact O-N 3.12Å; A186-L191 VanDerWaalsContact O-O 3.09Å; A186-E193 HydrophobicContact CB-CG 4.27Å; A186-I196 HydrophobicContact CB-CG1 4.07Å
187H98.4Very high98.3Very high142 Ų14275.9 Ų75.966%0.65736%0.358SS*.Hα-helixtrans-67.9-44.7179.3-69.2-157.2000111.4V183 I185 L189 V190V183-H187 WeakPolarHBondContact CG1-NE2 3.45Å; V183-H187 PolarHBondContact O-CD2 3.21Å; V183-H187 VanDerWaalsContact O-CD2 3.22Å; V183-H187 PolarHBondContact O-N 3.21Å; I185-H187 VanDerWaalsContact C-N 3.29Å; I185-H187 PolarHBondContact O-N 3.07Å; H187-L189 VanDerWaalsContact C-N 3.32Å; H187-L189 PolarHBondContact O-N 3.47Å; H187-V190 PolarHBondContact O-N 3.3Å
188T98Very high98.3Very high106 Ų10677.3 Ų77.365%0.6537%0.365SS*.Hα-helixtrans-63.2-37.5-178.7-53.10000112.4E184 I185E184-T188 PolarHBondContact O-N 3.12Å; E184-T188 VanDerWaalsContact O-N 3.13Å; E184-T188 PolarHBondContact O-OG1 3.27Å; I185-T188 PolarHBondContact O-N 2.73Å
189L98.1Very high98.3Very high9 Ų974.6 Ų74.65%0.04735%0.345CS..Hα-helixtrans-96.8-1.3-176-59.9-173.4000113.9Q163 E166 L167 I185 H187 L191Q163-L189 HydrophobicContact CG-CB 4.33Å; Q163-L189 PolarHBondContact NE2-O 3.17Å; E166-L189 HydrophobicContact CB-CD1 4.12Å; E166-L189 HydrophobicContact CB-CD2 3.71Å; E166-L189 HydrophobicContact CB-CG 4.49Å; E166-L189 HydrophobicContact CG-CD2 3.99Å; L167-L189 HydrophobicContact CD1-CD1 4.41Å; L167-L189 HydrophobicContact CD2-CD1 3.85Å; L167-L189 HydrophobicContact CG-CD1 3.68Å; I185-L189 HydrophobicContact CG2-CD1 3.66Å; I185-L189 HydrophobicContact CG2-CG 4.13Å; I185-L189 WeakPolarHBondContact O-CB 3.38Å; I185-L189 WeakPolarHBondContact O-CG 3.3Å; I185-L189 PolarHBondContact O-N 3.45Å; H187-L189 VanDerWaalsContact C-N 3.32Å; H187-L189 PolarHBondContact O-N 3.47Å; L189-L191 VanDerWaalsContact C-N 3.28Å; L189-L191 HydrophobicContact CB-CD1 4.17Å; L189-L191 HydrophobicContact CB-CG 4.18Å; L189-L191 PolarHBondContact O-N 2.84Å
190V98.3Very high98.3Very high129 Ų12968.1 Ų68.178%0.78232%0.32SS*.THydrogen-bonded Turntrans53.348.2-174.8-162.60000110.9A186 H187A186-V190 WeakPolarHBondContact O-CA 3.49Å; A186-V190 PolarHBondContact O-N 3.19Å; H187-V190 PolarHBondContact O-N 3.3Å
191L97.8Very high98.3Very high18 Ų1863 Ų639%0.09431%0.305CS..  trans-123.8148.5176.8-66.7178.6000109.4Y159 L167 A186 L189 Q195 I196Y159-L191 HydrophobicContact CD1-CD1 4.13Å; Y159-L191 HydrophobicContact CD1-CD2 3.89Å; Y159-L191 HydrophobicContact CE1-CD1 4.02Å; Y159-L191 HydrophobicContact CE1-CD2 3.66Å; L167-L191 HydrophobicContact CD1-CD1 4.32Å; A186-L191 CarbonylContact C-O 3.45Å; A186-L191 VanDerWaalsContact CA-O 3.32Å; A186-L191 WeakPolarHBondContact CA-O 3.37Å; A186-L191 WeakPolarHBondContact CB-O 3.29Å; A186-L191 PolarHBondContact O-N 3.12Å; A186-L191 VanDerWaalsContact O-O 3.09Å; L189-L191 VanDerWaalsContact C-N 3.28Å; L189-L191 HydrophobicContact CB-CD1 4.17Å; L189-L191 HydrophobicContact CB-CG 4.18Å; L189-L191 PolarHBondContact O-N 2.84Å; L191-Q195 HydrophobicContact CB-CB 4.36Å; L191-I196 HydrophobicContact CB-CD1 3.88Å; L191-I196 HydrophobicContact CB-CG1 4.39Å; L191-I196 HydrophobicContact CD1-CD1 3.88Å
192S98.4Very high98.3Very high56 Ų5663.7 Ų63.739%0.39232%0.315SS..  trans-67149.6172.564.30000111.4R194 Q195 I196S192-R194 PolarHBondContact O-N 3.28Å; S192-Q195 WeakPolarHBondContact O-CB 3.39Å; S192-Q195 PolarHBondContact O-N 3.06Å; S192-Q195 VanDerWaalsContact OG-CG 3.29Å; S192-Q195 WeakPolarHBondContact OG-CG 3.34Å; S192-Q195 PolarHBondContact OG-N 3.01Å; S192-Q195 PolarHBondContact OG-OE1 2.9Å; S192-I196 PolarHBondContact O-N 3.39Å; S192-I196 VanDerWaalsContact O-N 3.11Å
193E98.4Very high98.3Very high58 Ų5863 Ų6327%0.27131%0.312SS..Hα-helixtrans-51.9-34.5172.9-68.3-162.5-129.200113R179 R182 A186 I196 K197R179-E193 IonicContact CZ-OE1 3.26Å; R179-E193 VanDerWaalsContact CZ-OE1 3.26Å; R179-E193 IonicContact CZ-OE2 3.03Å; R179-E193 IonicContact NE-OE2 3.69Å; R179-E193 IonicContact NH1-OE1 2.95Å; R179-E193 PolarHBondContact NH1-OE1 3.31Å; R179-E193 IonicContact NH1-OE2 2.63Å; R179-E193 PolarHBondContact NH1-OE2 3.14Å; R179-E193 IonicContact NH2-OE1 2.85Å; R179-E193 PolarHBondContact NH2-OE1 3.23Å; R179-E193 IonicContact NH2-OE2 3.39Å; R179-E193 PolarHBondContact NH2-OE2 3.21Å; R182-E193 HydrophobicContact CG-CB 4.34Å; R182-E193 HydrophobicContact CG-CG 4.5Å; A186-E193 HydrophobicContact CB-CG 4.27Å; E193-I196 PolarHBondContact O-N 3.23Å; E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 PolarHBondContact O-N 2.74Å
194R97.9Very high98.3Very high180 Ų18064 Ų6468%0.67931%0.312SS*.Hα-helixtrans-64.5-43.5176.7-175.7177.9-176.5-83.2-1.5111.5S192 K197 I198S192-R194 PolarHBondContact O-N 3.28Å; R194-K197 PolarHBondContact O-N 3.06Å; R194-I198 HydrophobicContact CG-CD1 3.88Å; R194-I198 WeakPolarHBondContact O-CB 3.37Å; R194-I198 VanDerWaalsContact O-CG1 3.3Å; R194-I198 WeakPolarHBondContact O-CG1 3.42Å; R194-I198 PolarHBondContact O-N 2.82Å
195Q98.2Very high98.3Very high59 Ų5965.6 Ų65.628%0.27632%0.32SS..Hα-helixtrans-62.6-45.1176.2-76.7163.4-51.700110.9L191 S192 K197 I198 W199L191-Q195 HydrophobicContact CB-CB 4.36Å; S192-Q195 WeakPolarHBondContact O-CB 3.39Å; S192-Q195 PolarHBondContact O-N 3.06Å; S192-Q195 VanDerWaalsContact OG-CG 3.29Å; S192-Q195 WeakPolarHBondContact OG-CG 3.34Å; S192-Q195 PolarHBondContact OG-N 3.01Å; S192-Q195 PolarHBondContact OG-OE1 2.9Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 3.16Å; Q195-I198 PolarHBondContact O-N 3.23Å; Q195-W199 WeakPolarHBondContact O-CB 3.47Å; Q195-W199 PolarHBondContact O-N 2.95Å
196I98.5Very high98.2Very high0 Ų071 Ų710%034%0.344CS..Hα-helixtrans-57.9-47.1174.7-55.4-58.6000110.7L167 L177 R182 I185 A186 L191 S192 E193 I198 W199 F200L167-I196 HydrophobicContact CD2-CD1 3.78Å; L177-I196 HydrophobicContact CD1-CG2 3.49Å; L177-I196 VanDerWaalsContact CD1-CG2 3.49Å; R182-I196 HydrophobicContact CG-CB 4.11Å; R182-I196 HydrophobicContact CG-CG2 3.92Å; I185-I196 HydrophobicContact CG2-CD1 3.89Å; A186-I196 HydrophobicContact CB-CG1 4.07Å; L191-I196 HydrophobicContact CB-CD1 3.88Å; L191-I196 HydrophobicContact CB-CG1 4.39Å; L191-I196 HydrophobicContact CD1-CD1 3.88Å; S192-I196 PolarHBondContact O-N 3.39Å; S192-I196 VanDerWaalsContact O-N 3.11Å; E193-I196 PolarHBondContact O-N 3.23Å; I196-I198 PolarHBondContact O-N 3.44Å; I196-W199 PolarHBondContact O-N 2.92Å; I196-F200 HydrophobicContact CG2-CD2 4.1Å; I196-F200 HydrophobicContact CG2-CE2 4.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.43Å
197K98.3Very high98Very high123 Ų12374.6 Ų74.654%0.53536%0.356SS..Hα-helixtrans-58.8-47.2177.7-177.6-176.6177-177.60112.1E193 R194 Q195 Q201E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 PolarHBondContact O-N 2.74Å; R194-K197 PolarHBondContact O-N 3.06Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 3.16Å; K197-Q201 WeakPolarHBondContact O-CB 3.36Å; K197-Q201 PolarHBondContact O-N 2.93Å
198I98.4Very high97.8Very high60 Ų6072.7 Ų72.731%0.30835%0.346SS..Hα-helixtrans-65.5-42.9179.8-71169.2000110.5R194 Q195 I196 F200 Q201 N202R194-I198 HydrophobicContact CG-CD1 3.88Å; R194-I198 WeakPolarHBondContact O-CB 3.37Å; R194-I198 VanDerWaalsContact O-CG1 3.3Å; R194-I198 WeakPolarHBondContact O-CG1 3.42Å; R194-I198 PolarHBondContact O-N 2.82Å; Q195-I198 PolarHBondContact O-N 3.23Å; I196-I198 PolarHBondContact O-N 3.44Å; I198-F200 PolarHBondContact O-N 3.13Å; I198-Q201 WeakPolarHBondContact O-CB 3.34Å; I198-Q201 PolarHBondContact O-N 2.95Å; I198-N202 VanDerWaalsContact O-CG 3.31Å; I198-N202 PolarHBondContact O-N 3.15Å; I198-N202 PolarHBondContact O-ND2 3.39Å
199W98.5Very high97.6Very high31 Ų3174.9 Ų74.912%0.11735%0.347CS..Hα-helixtrans-60.3-47.8178.5-170.1100.4000111.1Y159 L167 E168 F171 Q195 I196 Q201 N202 R203Y159-W199 AromaticContact CD2-CD1 3.91Å; Y159-W199 AromaticContact CE2-CD1 3.67Å; L167-W199 VanDerWaalsContact C-CH2 3.48Å; L167-W199 HydrophobicContact CB-CD2 3.93Å; L167-W199 HydrophobicContact CB-CE3 3.94Å; L167-W199 HydrophobicContact CB-CH2 3.62Å; L167-W199 HydrophobicContact CB-CZ2 3.58Å; L167-W199 HydrophobicContact CB-CZ3 3.79Å; L167-W199 HydrophobicContact CD1-CD2 3.88Å; L167-W199 HydrophobicContact CD1-CG 3.85Å; L167-W199 HydrophobicContact CD2-CD2 4.35Å; L167-W199 HydrophobicContact CD2-CE3 4.27Å; L167-W199 HydrophobicContact CG-CD2 4.28Å; L167-W199 HydrophobicContact CG-CE3 4.49Å; L167-W199 WeakPolarHBondContact O-CH2 3.47Å; L167-W199 WeakPolarHBondContact O-CZ3 3.36Å; E168-W199 HydrophobicContact CG-CH2 3.99Å; E168-W199 HydrophobicContact CG-CZ2 4.02Å; F171-W199 HydrophobicContact CB-CH2 4.32Å; F171-W199 HydrophobicContact CB-CZ3 4.06Å; Q195-W199 WeakPolarHBondContact O-CB 3.47Å; Q195-W199 PolarHBondContact O-N 2.95Å; I196-W199 PolarHBondContact O-N 2.92Å; W199-Q201 VanDerWaalsContact C-N 3.31Å; W199-Q201 PolarHBondContact O-N 3.12Å; W199-N202 PolarHBondContact O-N 3.19Å; W199-R203 HydrophobicContact CE3-CB 3.95Å; W199-R203 HydrophobicContact CE3-CG 4.49Å; W199-R203 HydrophobicContact CH2-CB 4.05Å; W199-R203 HydrophobicContact CH2-CG 3.76Å; W199-R203 HydrophobicContact CZ3-CB 3.7Å; W199-R203 HydrophobicContact CZ3-CG 3.74Å; W199-R203 WeakPolarHBondContact O-CB 3.43Å; W199-R203 PolarHBondContact O-N 3.31Å
200F98.7Very high97.2Very high7 Ų778.9 Ų78.93%0.03137%0.368CS..Hα-helixtrans-64.5-33.1176.9-91.6-102.9000112.9L167 E170 F171 L177 I196 I198 R204L167-F200 HydrophobicContact CD2-CE2 4.1Å; E170-F200 HydrophobicContact CB-CZ 4.06Å; F171-F200 HydrophobicContact CB-CE1 4.2Å; F171-F200 HydrophobicContact CB-CZ 4.31Å; F171-F200 AromaticContact CD2-CD1 3.96Å; F171-F200 HydrophobicContact CD2-CD1 3.96Å; F171-F200 AromaticContact CD2-CE1 3.9Å; F171-F200 HydrophobicContact CD2-CE1 3.9Å; L177-F200 HydrophobicContact CD1-CD1 4.15Å; L177-F200 HydrophobicContact CD1-CD2 3.59Å; L177-F200 HydrophobicContact CD1-CE1 3.98Å; L177-F200 HydrophobicContact CD1-CE2 3.43Å; L177-F200 VanDerWaalsContact CD1-CE2 3.43Å; L177-F200 HydrophobicContact CD1-CG 3.97Å; L177-F200 HydrophobicContact CD1-CZ 3.63Å; L177-F200 HydrophobicContact CD2-CE1 3.76Å; L177-F200 HydrophobicContact CD2-CE2 4.34Å; L177-F200 HydrophobicContact CD2-CZ 3.67Å; L177-F200 HydrophobicContact CG-CD1 3.8Å; L177-F200 HydrophobicContact CG-CD2 4.17Å; L177-F200 HydrophobicContact CG-CE1 3.53Å; L177-F200 HydrophobicContact CG-CE2 3.96Å; L177-F200 HydrophobicContact CG-CG 4.11Å; L177-F200 HydrophobicContact CG-CZ 3.63Å; I196-F200 HydrophobicContact CG2-CD2 4.1Å; I196-F200 HydrophobicContact CG2-CE2 4.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.43Å; I198-F200 PolarHBondContact O-N 3.13Å; F200-R204 WeakPolarHBondContact O-CB 3.49Å; F200-R204 WeakPolarHBondContact O-CG 3.34Å; F200-R204 PolarHBondContact O-N 2.97Å; F200-R204 VanDerWaalsContact O-N 3.07Å; F200-R204 PolarHBondContact O-NE 3.02Å
201Q98.6Very high96.6Very high82 Ų8278.6 Ų78.638%0.38336%0.358SS..Hα-helixtrans-64.7-50.4172.7-17364.449.500111K197 I198 W199 R203 R204 M205K197-Q201 WeakPolarHBondContact O-CB 3.36Å; K197-Q201 PolarHBondContact O-N 2.93Å; I198-Q201 WeakPolarHBondContact O-CB 3.34Å; I198-Q201 PolarHBondContact O-N 2.95Å; W199-Q201 VanDerWaalsContact C-N 3.31Å; W199-Q201 PolarHBondContact O-N 3.12Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; Q201-R204 PolarHBondContact O-N 3.05Å; Q201-M205 WeakPolarHBondContact O-CG 3.4Å; Q201-M205 PolarHBondContact O-N 3.4Å
202N98.1Very high95.2Very high102 Ų10285.5 Ų85.555%0.54539%0.387SS..Hα-helixtrans-61.5-42.5178.4-69-17.2000111.4I198 W199 R204 M205 K206I198-N202 VanDerWaalsContact O-CG 3.31Å; I198-N202 PolarHBondContact O-N 3.15Å; I198-N202 PolarHBondContact O-ND2 3.39Å; W199-N202 PolarHBondContact O-N 3.19Å; N202-R204 PolarHBondContact O-N 3.21Å; N202-M205 PolarHBondContact O-N 3.14Å; N202-K206 PolarHBondContact O-N 3.36Å
203R98.3Very high93.2Very high41 Ų4188.5 Ų88.516%0.15540%0.398CS..Hα-helixtrans-62.9-42.1179.5-175.264.7-171.2107.8-8.5112F171 W199 Q201 K206 W207F171-R203 HydrophobicContact CB-CG 4.41Å; F171-R203 HydrophobicContact CD1-CG 3.73Å; F171-R203 HydrophobicContact CD2-CB 4.21Å; F171-R203 HydrophobicContact CD2-CG 3.57Å; F171-R203 HydrophobicContact CE1-CG 3.79Å; F171-R203 HydrophobicContact CE2-CB 4.19Å; F171-R203 HydrophobicContact CE2-CG 3.65Å; F171-R203 HydrophobicContact CG-CG 3.61Å; F171-R203 HydrophobicContact CZ-CG 3.76Å; W199-R203 HydrophobicContact CE3-CB 3.95Å; W199-R203 HydrophobicContact CE3-CG 4.49Å; W199-R203 HydrophobicContact CH2-CB 4.05Å; W199-R203 HydrophobicContact CH2-CG 3.76Å; W199-R203 HydrophobicContact CZ3-CB 3.7Å; W199-R203 HydrophobicContact CZ3-CG 3.74Å; W199-R203 WeakPolarHBondContact O-CB 3.43Å; W199-R203 PolarHBondContact O-N 3.31Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; R203-K206 PolarHBondContact O-N 2.95Å; R203-W207 WeakPolarHBondContact O-CB 3.35Å; R203-W207 PolarHBondContact O-N 2.94Å
204R97.9Very high91.6Very high63 Ų6392.1 Ų92.124%0.23843%0.427CS..Hα-helixtrans-63.9-40173.5-75.8-175.3-69.2150.90.6112.5F171 R175 F200 Q201 N202 W207 K208F171-R204 HydrophobicContact CE2-CG 3.74Å; F171-R204 HydrophobicContact CZ-CG 4.26Å; R175-R204 WeakPolarHBondContact O-CD 3.24Å; F200-R204 WeakPolarHBondContact O-CB 3.49Å; F200-R204 WeakPolarHBondContact O-CG 3.34Å; F200-R204 PolarHBondContact O-N 2.97Å; F200-R204 VanDerWaalsContact O-N 3.07Å; F200-R204 PolarHBondContact O-NE 3.02Å; Q201-R204 PolarHBondContact O-N 3.05Å; N202-R204 PolarHBondContact O-N 3.21Å; R204-W207 PolarHBondContact O-N 3.32Å; R204-K208 WeakPolarHBondContact O-CB 3.41Å; R204-K208 PolarHBondContact O-N 3.45Å
205M97.8Very high88.8Confident98 Ų9889.1 Ų89.148%0.48342%0.424SS..Hα-helixtrans-63.1-43.5176.1-66.4-62.5-90.400111.6Q201 N202 K208 K209Q201-M205 WeakPolarHBondContact O-CG 3.4Å; Q201-M205 PolarHBondContact O-N 3.4Å; N202-M205 PolarHBondContact O-N 3.14Å; M205-K208 PolarHBondContact O-N 2.97Å; M205-K209 PolarHBondContact O-N 3.14Å; M205-K209 VanDerWaalsContact O-N 3.07Å
206K96.3Very high86.6Confident122 Ų12291.7 Ų91.753%0.5344%0.444SS..Hα-helixtrans-61.6-50.3173.6-177.5177.5178.4-172.40111.4N202 R203 K208 K209 D210N202-K206 PolarHBondContact O-N 3.36Å; R203-K206 PolarHBondContact O-N 2.95Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K206-K209 WeakPolarHBondContact O-CB 3.32Å; K206-K209 PolarHBondContact O-N 3.33Å; K206-D210 WeakPolarHBondContact CG-OD2 3.2Å; K206-D210 PolarHBondContact O-N 2.86Å
207W95.4Very high84.3Confident80 Ų80101.3 Ų101.330%0.30349%0.486SS..Hα-helixtrans-55.7-44.3177-176.682.8000111.9F171 R203 R204 K209 D210 H211F171-W207 HydrophobicContact CE1-CB 4.3Å; F171-W207 HydrophobicContact CE1-CG 4.25Å; F171-W207 HydrophobicContact CZ-CB 4.03Å; F171-W207 HydrophobicContact CZ-CG 4.17Å; R203-W207 WeakPolarHBondContact O-CB 3.35Å; R203-W207 PolarHBondContact O-N 2.94Å; R204-W207 PolarHBondContact O-N 3.32Å; W207-K209 VanDerWaalsContact C-N 3.32Å; W207-K209 PolarHBondContact O-N 3.47Å; W207-D210 PolarHBondContact O-N 3.12Å; W207-H211 AromaticContact CD1-CD2 3.22Å; W207-H211 AromaticContact CD1-NE2 3.3Å; W207-H211 VanDerWaalsContact CD1-NE2 3.3Å; W207-H211 AromaticContact CD2-CD2 3.84Å; W207-H211 AromaticContact CE2-CD2 3.44Å; W207-H211 VanDerWaalsContact CE2-CD2 3.44Å; W207-H211 AromaticContact CE2-CG 3.87Å; W207-H211 AromaticContact CE2-NE2 3.77Å; W207-H211 AromaticContact CG-CD2 3.7Å; W207-H211 HydrophobicContact CZ2-CB 4.46Å; W207-H211 AromaticContact NE1-CD2 3.01Å; W207-H211 PolarHBondContact NE1-CD2 3.39Å; W207-H211 AromaticContact NE1-CE1 3.74Å; W207-H211 AromaticContact NE1-CG 3.81Å; W207-H211 AromaticContact NE1-NE2 2.93Å; W207-H211 PolarHBondContact NE1-NE2 3.49Å; W207-H211 WeakPolarHBondContact O-CB 3.31Å; W207-H211 PolarHBondContact O-CD2 3.3Å; W207-H211 PolarHBondContact O-N 2.92Å
208K94.5Very high81.9Confident103 Ų103103.1 Ų103.145%0.44850%0.5SS..Hα-helixtrans-60-40.8175.7-174.2-17768.6173.10112.1R204 M205 K206 K212R204-K208 WeakPolarHBondContact O-CB 3.41Å; R204-K208 PolarHBondContact O-N 3.45Å; M205-K208 PolarHBondContact O-N 2.97Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K208-K212 HydrophobicContact CG-CD 3.77Å; K208-K212 HydrophobicContact CG-CG 4.43Å; K208-K212 VanDerWaalsContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CG 3.3Å; K208-K212 PolarHBondContact O-N 3.46Å
209K93.6Very high79.7Confident152 Ų152111.2 Ų111.266%0.66153%0.526SS*.Hα-helixtrans-66.6-45.8177.7-175.2178.2178.2179.50111.2M205 K206 W207 H211M205-K209 PolarHBondContact O-N 3.14Å; M205-K209 VanDerWaalsContact O-N 3.07Å; K206-K209 WeakPolarHBondContact O-CB 3.32Å; K206-K209 PolarHBondContact O-N 3.33Å; W207-K209 VanDerWaalsContact C-N 3.32Å; W207-K209 PolarHBondContact O-N 3.47Å; K209-H211 VanDerWaalsContact C-N 3.33Å; K209-H211 PolarHBondContact O-N 3.31Å
210D90.2Very high77.2Confident92 Ų92115 Ų11549%0.49256%0.557SS.*Hα-helixtrans-69.5-30.2-176.5-58.1-15.2000111.9K206 W207K206-D210 WeakPolarHBondContact CG-OD2 3.2Å; K206-D210 PolarHBondContact O-N 2.86Å; W207-D210 PolarHBondContact O-N 3.12Å
211H84.7Confident74.8Confident124 Ų124121.4 Ų121.457%0.57459%0.592SS**THydrogen-bonded Turntrans-101.44.9-176.3-73.1-87.6000115.6W207 K209W207-H211 AromaticContact CD1-CD2 3.22Å; W207-H211 AromaticContact CD1-NE2 3.3Å; W207-H211 VanDerWaalsContact CD1-NE2 3.3Å; W207-H211 AromaticContact CD2-CD2 3.84Å; W207-H211 AromaticContact CE2-CD2 3.44Å; W207-H211 VanDerWaalsContact CE2-CD2 3.44Å; W207-H211 AromaticContact CE2-CG 3.87Å; W207-H211 AromaticContact CE2-NE2 3.77Å; W207-H211 AromaticContact CG-CD2 3.7Å; W207-H211 HydrophobicContact CZ2-CB 4.46Å; W207-H211 AromaticContact NE1-CD2 3.01Å; W207-H211 PolarHBondContact NE1-CD2 3.39Å; W207-H211 AromaticContact NE1-CE1 3.74Å; W207-H211 AromaticContact NE1-CG 3.81Å; W207-H211 AromaticContact NE1-NE2 2.93Å; W207-H211 PolarHBondContact NE1-NE2 3.49Å; W207-H211 WeakPolarHBondContact O-CB 3.31Å; W207-H211 PolarHBondContact O-CD2 3.3Å; W207-H211 PolarHBondContact O-N 2.92Å; K209-H211 VanDerWaalsContact C-N 3.33Å; K209-H211 PolarHBondContact O-N 3.31Å
212K67.8Low72.4Confident162 Ų162122.1 Ų122.170%0.70461%0.606SS**SBendtrans-118.721.4-178.2-71.9-168.7160.2-79.90115.6K208K208-K212 HydrophobicContact CG-CD 3.77Å; K208-K212 HydrophobicContact CG-CG 4.43Å; K208-K212 VanDerWaalsContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CG 3.3Å; K208-K212 PolarHBondContact O-N 3.46Å
213L57.4Low69.8Low120 Ų120123.7 Ų123.763%0.62862%0.615SS**  trans-123.9108.6170-77.3145.3000109.6N215L213-N215 VanDerWaalsContact C-N 3.3Å; L213-N215 HydrophobicContact CB-CB 4.47Å; L213-N215 HydrophobicContact CD2-CB 3.96Å; L213-N215 PolarHBondContact O-N 2.77Å
214P63.8Low67.3Low134 Ų134126.9 Ų126.987%0.8764%0.643SS**  trans-8087.5142.632.2-23.3000106.2
215N41.1Very low64.7Low116 Ų116130.9 Ų130.962%0.6267%0.669SS**  trans-140.292.5170.3-157.829.7000111.6L213L213-N215 VanDerWaalsContact C-N 3.3Å; L213-N215 HydrophobicContact CB-CB 4.47Å; L213-N215 HydrophobicContact CD2-CB 3.96Å; L213-N215 PolarHBondContact O-N 2.77Å
216T51.1Low61.9Low114 Ų114133.7 Ų133.770%0.69969%0.686SS**  trans51.6118.7131.6700000119.4
217K49.2Very low59.5Low202 Ų202133.5 Ų133.588%0.87870%0.695SS**  trans68.175.2143.4-153.1177.7-173.4-177.20117.4
218I49.7Very low56.8Low161 Ų161136.9 Ų136.983%0.82672%0.719SS**  trans-125.492.7135.3-49.1179.3000108.3S220I218-S220 PolarHBondContact O-N 3.05Å
219R52.2Low54.2Low230 Ų230136.4 Ų136.487%0.86873%0.729SS**  trans28.172.9139.4-160.9170.1-175.9-175.1-0.6115.4N221R219-N221 PolarHBondContact O-N 2.7Å
220S44.7Very low51.6Low110 Ų110138.2 Ų138.277%0.76974%0.74SS**  trans-8993.9154.1-43.80000106.9I218 S222I218-S220 PolarHBondContact O-N 3.05Å; S220-S222 PolarHBondContact O-N 2.93Å
221N49.5Very low49.1Very low142 Ų142139.6 Ų139.676%0.75976%0.756SS**  trans-70.580.3164.1-17178.6000107.5R219R219-N221 PolarHBondContact O-N 2.7Å
222S46.3Very low47.1Very low96 Ų96139.3 Ų139.367%0.67177%0.769SS**  trans-117.194.1165.1-67.40000106.3S220 S224S220-S222 PolarHBondContact O-N 2.93Å; S222-S224 VanDerWaalsContact C-N 3.34Å; S222-S224 PolarHBondContact O-N 3.04Å
223N44.5Very low45.6Very low136 Ų136135 Ų13573%0.72777%0.77SS**  trans-54.3102.1160.1-106.316.8000107.7
224S46.1Very low44.8Very low108 Ų108138.1 Ų138.176%0.75579%0.786SS**  trans-124.687.6159.2-67.30000106.4S222 N226S222-S224 VanDerWaalsContact C-N 3.34Å; S222-S224 PolarHBondContact O-N 3.04Å; S224-N226 PolarHBondContact O-N 3.39Å
225N42.9Very low43.8Very low146 Ų146135.8 Ų135.878%0.78178%0.779SS**  trans-55.6116.1163.1-72.6-16.9000107.6
226N39.5Very low43.6Very low157 Ų157138.8 Ų138.884%0.8479%0.794SS**  trans-143.7115.9149.8-148.9-5.8000110.9S224S224-N226 PolarHBondContact O-N 3.39Å
227T45.8Very low42.8Very low118 Ų118136.8 Ų136.872%0.72480%0.795SS**  trans-80.6124.9179.144.60000110.5
228N37.9Very low42.5Very low152 Ų152133 Ų13381%0.81379%0.794SS**  trans-169103.7144.5-122.35.3000107.9
229S39.8Very low42.2Very low92 Ų92131.3 Ų131.364%0.64380%0.797SS**  62.696.975.4-51.10000113
230Q39.2Very low41.9Very low190 Ų190128.8 Ų128.889%0.88880%0.795SS**  trans38.9124.7132.3-58.7176.45.900118.9
231S37.9Very low42.1Very low121 Ų121131.6 Ų131.685%0.84680%0.801SS**  179.2143.9106.758.20000113
232S43.5Very low41.8Very low119 Ų119135.9 Ų135.983%0.83281%0.807SS**  trans-64.1167.8179.2-320000114
233G36.3Very low42.3Very low71 Ų71137.9 Ų137.973%0.73282%0.815SS**  trans-74.5-170.2-171.500000116.6
234L39.6Very low42.5Very low185 Ų185137.3 Ų137.397%0.96982%0.822SS**  trans176.2147.4139.9-91.6174.6000109.7
235A42.1Very low42.8Very low86 Ų86135.6 Ų135.671%0.71182%0.821SS**  trans-81.3149.7177.100000112.3
236L37.6Very low44.3Very low179 Ų179134.6 Ų134.694%0.93782%0.823SS**  trans175.7148.2131.3-12581.2000111.3
237G35.4Very low45.7Very low71 Ų71132.6 Ų132.673%0.73282%0.818SS**  trans108.393.2133.500000118.6
238S41.2Very low46.6Very low123 Ų123133.2 Ų133.286%0.8682%0.824SS**  trans-28.8143.6154.5-400000116.9
239S44Very low47.9Very low125 Ų125131.4 Ų131.487%0.87482%0.823SS**  -168.2148.3120.8-145.60000113
240Q47.1Very low48.7Very low177 Ų177139 Ų13983%0.82786%0.856SS**  trans-71.4149.1-172-60164.4-1.200112.1
241N47.1Very low49.1Very low169 Ų169136.5 Ų136.590%0.90485%0.854SS**  trans-154.9122.8133.1-121.9-16.2000112.2
242R44.3Very low49.7Very low232 Ų232137.3 Ų137.388%0.87586%0.855SS**  trans-89.2131.4171.9-67.4173.5168.7-125.7-0.7107.8
243T55.7Low50.1Low139 Ų139138.3 Ų138.385%0.85386%0.856SS**  trans-149.4116.3146.553.70000109.9
244S48.8Very low50.9Low124 Ų124142.3 Ų142.387%0.86786%0.863SS**  trans-66.8132.6171.943.40000112.7
245G53.6Low51.6Low72 Ų72139.6 Ų139.674%0.74286%0.857SS**  trans-109.2141.6163.400000110.8
246P74.6Confident52.2Low125 Ų125143.2 Ų143.281%0.81287%0.866SS**PPolyproline II helixtrans-83.9165.9-17835-33000112.7
247P68.2Low53.3Low114 Ų114140.6 Ų140.674%0.7486%0.861SS**PPolyproline II helixtrans-84.1164-17035.1-35.3000113.6
248P65.6Low54.6Low131 Ų131146 Ų14685%0.85187%0.871SS**PPolyproline II helixtrans-78.3147.7179.532.3-33.6000112.2
249S63.3Low55.8Low114 Ų114147.9 Ų147.980%0.79787%0.872SS**  trans-112.8136.2168.3-64.20000110.3
250L56.8Low56.8Low253 Ų253150 Ų150100%1.32587%0.872SS**  trans79.80171.1-56.5176000117.4

Retrieved 250 of 250 residues in 859.8 ms (Link to these results)