A0A060X0X4_ONCMY Loading...

Brain-specific homeobox protein homolog

AlphaFold DB , UniProt , Accession A0A060X0X4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 228 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
1M43.4Very low51Low229 Ų229153 Ų153100%1.12882%0.823SS**  094.20-64.3175.2-177.600106.3
2N41.7Very low50.5Low154 Ų154153.8 Ų153.882%0.82482%0.821SS**  trans-88.1114-173.8-70.519.6000108.8N4N2-N4 PolarHBondContact O-N 3.47Å
3L57.1Low50.2Low152 Ų152150.5 Ų150.580%0.79681%0.814SS**  trans-82.797.4176.2-71.4157.3000108.6Y5L3-Y5 PolarHBondContact O-N 3Å; L3-Y5 VanDerWaalsContact O-N 3.13Å
4N47.6Very low50.5Low151 Ų151145.6 Ų145.681%0.80780%0.804SS**  trans-73.397.5169.6-74-32.6000109.3N2 T6N2-N4 PolarHBondContact O-N 3.47Å; N4-T6 PolarHBondContact O-N 3.06Å
5Y47Very low50.6Low225 Ų225148.9 Ų148.988%0.88281%0.811SS**  trans-78.892.4164.8-96-92000108.9L3L3-Y5 PolarHBondContact O-N 3Å; L3-Y5 VanDerWaalsContact O-N 3.13Å
6T60.1Low51.1Low129 Ų129151.3 Ų151.379%0.79180%0.804SS**  trans-85.3110165.9-174.30000108.6N4N4-T6 PolarHBondContact O-N 3.06Å
7S54.4Low51.6Low99 Ų99149.2 Ų149.269%0.69280%0.804SS**  trans-72.9138.6174.1-164.80000109.9V9S7-V9 PolarHBondContact O-N 3.39Å
8P53.9Low52.4Low116 Ų116147.1 Ų147.175%0.75380%0.798SS**  trans-75.9112.4177.129.1-29.1000109.5P10P8-P10 WeakPolarHBondContact O-CD 3.26Å
9V54.4Low53.6Low127 Ų127141.4 Ų141.477%0.7777%0.77SS**  trans-61.5124.7169.8179.10000108.8S7 Q11S7-V9 PolarHBondContact O-N 3.39Å; V9-Q11 PolarHBondContact O-N 3.27Å; V9-Q11 VanDerWaalsContact O-N 3.17Å
10P50.1Low54.7Low112 Ų112143.1 Ų143.173%0.72777%0.77SS**  trans-66.3115.5171.4-14.628.4000108.9P8 M12P8-P10 WeakPolarHBondContact O-CD 3.26Å; P10-M12 PolarHBondContact O-N 3.06Å; P10-M12 VanDerWaalsContact O-N 3.1Å
11Q51.5Low55.9Low189 Ų189143.6 Ų143.688%0.88377%0.766SS**  trans-61.6113.3171.4-68.7179.36.300108.8V9V9-Q11 PolarHBondContact O-N 3.27Å; V9-Q11 VanDerWaalsContact O-N 3.17Å
12M44.5Very low57.6Low163 Ų163138.9 Ų138.980%0.80374%0.743SS**  trans-59.5133.4168.3-69.2-98.978.500108.8P10 A14P10-M12 PolarHBondContact O-N 3.06Å; P10-M12 VanDerWaalsContact O-N 3.1Å; M12-A14 PolarHBondContact O-N 3.3Å
13P47.4Very low59.3Low111 Ų111139 Ų13972%0.72174%0.739SS**  trans-65.9114.7175.726.6-31.2000108.5Q15P13-Q15 PolarHBondContact O-N 3.06Å
14A53.8Low60Low82 Ų82134.5 Ų134.568%0.67872%0.716SS**  trans-46.6126.2172.500000109.8M12 R16M12-A14 PolarHBondContact O-N 3.3Å; A14-R16 PolarHBondContact O-N 3.41Å
15Q52.6Low61.4Low194 Ų194132.7 Ų132.791%0.90771%0.705SS**  trans-57.8100.6170.6-70.8-113.4-45.700107.7P13 S17P13-Q15 PolarHBondContact O-N 3.06Å; Q15-S17 PolarHBondContact O-N 2.93Å; Q15-S17 VanDerWaalsContact O-N 3.14Å
16R58.5Low62.6Low188 Ų188128.6 Ų128.671%0.70970%0.698SS**  trans-78.699.7175.8-62.9-170.5-179.4-148.3-4.4106.9A14 T18A14-R16 PolarHBondContact O-N 3.41Å; R16-T18 PolarHBondContact O-N 2.82Å
17S59.2Low63.1Low115 Ų115129.4 Ų129.480%0.80470%0.697SS**  trans-51.3114.1164.5-84.40000107.8Q15 S19Q15-S17 PolarHBondContact O-N 2.93Å; Q15-S17 VanDerWaalsContact O-N 3.14Å; S17-S19 VanDerWaalsContact C-N 3.27Å; S17-S19 PolarHBondContact O-N 3.01Å
18T66.4Low63.9Low111 Ų111130.5 Ų130.568%0.68169%0.691SS**  trans-67.194.2171.755.40000107R16 F20R16-T18 PolarHBondContact O-N 2.82Å; T18-F20 WeakPolarHBondContact O-CD2 3.31Å
19S75.3Confident64.2Low40 Ų40134 Ų13428%0.2869%0.694SS.*  trans-70.4133.6175.1174.30000109.4S17 F21 D24S17-S19 VanDerWaalsContact C-N 3.27Å; S17-S19 PolarHBondContact O-N 3.01Å; S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 VanDerWaalsContact OG-CD2 3.26Å; S19-F21 WeakPolarHBondContact OG-CD2 3.44Å; S19-F21 PolarHBondContact OG-N 3.49Å; S19-D24 WeakPolarHBondContact CB-OD2 3.45Å; S19-D24 PolarHBondContact OG-OD2 3.27Å
20F74.4Confident64.5Low175 Ų175133.7 Ų133.777%0.76869%0.694SS**  trans-95.510.9177.9-68.4-83.7000112.4T18T18-F20 WeakPolarHBondContact O-CD2 3.31Å
21F81Confident64.6Low154 Ų154135.6 Ų135.668%0.67569%0.691SS**  trans-63.6139.2170-73.1-65.2000109.7S19 E23 D24 I25S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 VanDerWaalsContact OG-CD2 3.26Å; S19-F21 WeakPolarHBondContact OG-CD2 3.44Å; S19-F21 PolarHBondContact OG-N 3.49Å; F21-E23 PolarHBondContact O-N 3.11Å; F21-D24 PolarHBondContact O-N 2.74Å; F21-I25 PolarHBondContact O-N 3.01Å
22I79.5Confident64.6Low129 Ų129132.3 Ų132.366%0.66269%0.686SS**Hα-helixtrans-59-36.2-179.2-68159000109.9D24 I25 L26I22-D24 PolarHBondContact O-N 3.22Å; I22-I25 PolarHBondContact O-N 3.35Å; I22-L26 HydrophobicContact CG2-CD1 3.55Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.35Å; I22-L26 WeakPolarHBondContact O-CG 3.35Å; I22-L26 PolarHBondContact O-N 2.96Å
23E75.8Confident64.7Low157 Ų157132.5 Ų132.573%0.73469%0.69SS**Hα-helixtrans-61-42.4176.4-60.6-169-176.500112.1F21 L26 L27F21-E23 PolarHBondContact O-N 3.11Å; E23-L26 PolarHBondContact O-N 3.41Å; E23-L27 WeakPolarHBondContact O-CB 3.47Å; E23-L27 PolarHBondContact O-N 2.86Å
24D73.2Confident65Low58 Ų58138.2 Ų138.231%0.3170%0.697SS.*Hα-helixtrans-64.5-47.2177.3-75.5-49.4000111S19 F21 I22 L26 L27 H28S19-D24 WeakPolarHBondContact CB-OD2 3.45Å; S19-D24 PolarHBondContact OG-OD2 3.27Å; F21-D24 PolarHBondContact O-N 2.74Å; I22-D24 PolarHBondContact O-N 3.22Å; D24-L26 VanDerWaalsContact C-N 3.29Å; D24-L26 PolarHBondContact O-N 3.45Å; D24-L27 PolarHBondContact O-N 3.29Å; D24-H28 PolarHBondContact O-N 3Å; D24-H28 PolarHBondContact O-ND1 2.89Å
25I75.9Confident64.8Low112 Ų112142.3 Ų142.357%0.57470%0.702SS**Hα-helixtrans-60.9-40.9179.9-60.4170.9000111.3F21 I22F21-I25 PolarHBondContact O-N 3.01Å; I22-I25 PolarHBondContact O-N 3.35Å
26L73.4Confident64.6Low140 Ų140138.6 Ų138.673%0.73369%0.692SS**Hα-helixtrans-73.9-30.9-179.8-67.2176.4000112.9I22 E23 D24I22-L26 HydrophobicContact CG2-CD1 3.55Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.35Å; I22-L26 WeakPolarHBondContact O-CG 3.35Å; I22-L26 PolarHBondContact O-N 2.96Å; E23-L26 PolarHBondContact O-N 3.41Å; D24-L26 VanDerWaalsContact C-N 3.29Å; D24-L26 PolarHBondContact O-N 3.45Å
27L70.7Confident63.8Low146 Ų146137.5 Ų137.576%0.76469%0.693SS**Hα-helixtrans-97.5-9.7-173.2-146.872.1000113.6E23 D24 K29E23-L27 WeakPolarHBondContact O-CB 3.47Å; E23-L27 PolarHBondContact O-N 2.86Å; D24-L27 PolarHBondContact O-N 3.29Å; L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.46Å
28H69.9Low63.4Low122 Ų122140.8 Ų140.857%0.56570%0.695SS**  trans-65.490.3168-84.486000109.6D24 P30D24-H28 PolarHBondContact O-N 3Å; D24-H28 PolarHBondContact O-ND1 2.89Å; H28-P30 WeakPolarHBondContact O-CD 3.22Å; H28-P30 VanDerWaalsContact O-N 3.12Å
29K61.2Low62.4Low190 Ų190142.1 Ų142.183%0.82670%0.697SS**PPolyproline II helixtrans-48.2119.4158.5-105.5116.7159.1177.40107L27 K31L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.46Å; K29-K31 PolarHBondContact O-N 3.35Å; K29-K31 VanDerWaalsContact O-N 3.09Å
30P60.7Low61.1Low119 Ų119146.1 Ų146.177%0.77372%0.722SS**PPolyproline II helixtrans-56.4124.7168.524.3-31.3000106.5H28H28-P30 WeakPolarHBondContact O-CD 3.22Å; H28-P30 VanDerWaalsContact O-N 3.12Å
31K52.1Low59.6Low153 Ų153146.9 Ų146.967%0.66573%0.725SS**PPolyproline II helixtrans-52.4132.5171.5-69170.8-177.4168.70106.3K29 L33K29-K31 PolarHBondContact O-N 3.35Å; K29-K31 VanDerWaalsContact O-N 3.09Å; K31-L33 PolarHBondContact O-N 3.42Å
32P50.8Low58.3Low120 Ų120144.4 Ų144.478%0.77973%0.728SS**PPolyproline II helixtrans-52.7124.4171.323.5-32000106.3R34P32-R34 PolarHBondContact O-N 3.46Å
33L47.7Very low56.5Low167 Ų167142.7 Ų142.787%0.87473%0.727SS**  trans-51.5114.2173.6-73.1176.4000105.7K31 E35K31-L33 PolarHBondContact O-N 3.42Å; L33-E35 PolarHBondContact O-N 2.92Å
34R52.6Low55.3Low231 Ų231139.4 Ų139.487%0.87272%0.721SS**  trans-53.4115.1170.9-146.7-167.3-170.5-167.22.9104.6P32 V36P32-R34 PolarHBondContact O-N 3.46Å; R34-V36 PolarHBondContact O-N 3.43Å
35E49.2Very low54.3Low168 Ų168144.8 Ų144.879%0.78575%0.749SS**  trans-51.3105.8171.9-87.8179.914200107.1L33 F37L33-E35 PolarHBondContact O-N 2.92Å; E35-F37 VanDerWaalsContact C-N 3.31Å; E35-F37 PolarHBondContact O-N 2.91Å; E35-F37 VanDerWaalsContact O-N 3.09Å
36V49.7Very low53.1Low115 Ų115143.6 Ų143.670%0.69776%0.756SS**  trans-76.198.6167.7-176.80000104R34 H38R34-V36 PolarHBondContact O-N 3.43Å; V36-H38 PolarHBondContact O-N 3.19Å
37F41.2Very low52.2Low166 Ų166142 Ų14273%0.72876%0.756SS**  trans-50.1110.2162.6-93.5-96.4000107.6E35 L39E35-F37 VanDerWaalsContact C-N 3.31Å; E35-F37 PolarHBondContact O-N 2.91Å; E35-F37 VanDerWaalsContact O-N 3.09Å; F37-L39 PolarHBondContact O-N 3.02Å
38H50.6Low51.4Low183 Ų183145.5 Ų145.585%0.84776%0.76SS**  trans-69.677.5163.3-74.2-86.2000107.8V36V36-H38 PolarHBondContact O-N 3.19Å
39L45.8Very low50.4Low139 Ų139148.1 Ų148.173%0.72877%0.774SS**  trans-72.6134156.4-74.4166.6000106.8F37 F41F37-L39 PolarHBondContact O-N 3.02Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.04Å
40P48.5Very low50Low124 Ų124144.6 Ų144.681%0.80577%0.77SS**  trans-66.897.1177.328.2-32.3000107.8S42P40-S42 PolarHBondContact O-N 3.1Å
41F41.3Very low49.4Very low191 Ų191146.6 Ų146.684%0.83877%0.774SS**  trans-68.494.3165.9-155.8-95.7000106.1L39 S43L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.04Å; F41-S43 PolarHBondContact O-N 3.31Å
42S54.3Low49.5Very low103 Ų103146.4 Ų146.472%0.7278%0.779SS**  trans-60.389162.1178.20000107.3P40 S44P40-S42 PolarHBondContact O-N 3.1Å; S42-S44 PolarHBondContact O-N 3.21Å
43S41.8Very low49.6Very low92 Ų92149.5 Ų149.564%0.64378%0.784SS**  trans-75.678.3162.8420000107.6F41 L45F41-S43 PolarHBondContact O-N 3.31Å; S43-L45 PolarHBondContact O-N 3.14Å; S43-L45 VanDerWaalsContact O-N 3.08Å
44S51.3Low49.9Very low89 Ų89152.2 Ų152.262%0.62278%0.784SS**  trans-61.2102162.2-172.80000108.5S42 A46S42-S44 PolarHBondContact O-N 3.21Å; S44-A46 VanDerWaalsContact C-N 3.29Å
45L51.8Low50Low170 Ų170144.2 Ų144.289%0.8977%0.773SS**  trans-9924.3161.6-67177.1000110.9S43 S47S43-L45 PolarHBondContact O-N 3.14Å; S43-L45 VanDerWaalsContact O-N 3.08Å; L45-S47 PolarHBondContact O-N 2.89Å
46A51.4Low50.2Low87 Ų87147 Ų14772%0.71978%0.778SS**  trans-93.471.7172.900000109.8S44S44-A46 VanDerWaalsContact C-N 3.29Å
47S53.3Low50.5Low106 Ų106146.2 Ų146.274%0.74178%0.776SS**  trans-166138.5153.8-156.30000109.8L45L45-S47 PolarHBondContact O-N 2.89Å
48R55Low51.3Low221 Ų221146.6 Ų146.683%0.83478%0.784SS**  trans88.962.8176.9-51.9178.1151.5-113.6-7.8115.3
49M48.5Very low52.4Low177 Ų177144.1 Ų144.187%0.87278%0.775SS**  trans-106.3124.1141.9-76.9-72.3105.800108.1L51M49-L51 PolarHBondContact O-N 3.39Å
50P53.1Low53.1Low115 Ų115143.5 Ų143.575%0.74778%0.779SS**  trans-60.6129173.2-18.430.3000110.3L52P50-L52 PolarHBondContact O-N 2.93Å
51L47.6Very low53.7Low162 Ų162143.5 Ų143.585%0.84878%0.777SS**  trans-67.6115.8168.3-157.6-167000107.5M49M49-L51 PolarHBondContact O-N 3.39Å
52L53.7Low54.3Low148 Ų148140.2 Ų140.278%0.77578%0.775SS**  trans-84.6132.1165.2-86.3149.8000108.8P50 Y54P50-L52 PolarHBondContact O-N 2.93Å; L52-Y54 PolarHBondContact O-N 2.97Å
53E53.9Low54.4Low186 Ų186143.1 Ų143.187%0.86978%0.78SS**SBendtrans-6310.7-176.3-171.5164.8-178.300115.4
54Y52.3Low54.7Low223 Ų223146.5 Ų146.588%0.87579%0.79SS**SBendtrans-130.7101.9171.4-106.6-100.2000109.5L52L52-Y54 PolarHBondContact O-N 2.97Å
55G56.5Low54.7Low63 Ų63145.8 Ų145.865%0.64979%0.79SS**  trans-66.7129.8-174.500000113.1
56Y53Low54.4Low226 Ų226143.8 Ų143.889%0.88679%0.787SS**  trans-169114.9140.7-99.9-75.5000107.8
57P56.3Low54.2Low100 Ų100147.8 Ų147.865%0.64979%0.791SS**  trans-74131.1168.419.2-13.7000109.7M59P57-M59 HydrophobicContact CB-CE 3.45Å; P57-M59 VanDerWaalsContact CB-CE 3.45Å; P57-M59 HydrophobicContact CG-CE 3.47Å; P57-M59 VanDerWaalsContact CG-CE 3.47Å; P57-M59 WeakPolarHBondContact O-CE 3.46Å; P57-M59 PolarHBondContact O-N 2.92Å
58L57.7Low54.1Low173 Ų173147.9 Ų147.991%0.90679%0.789SS**  trans-74.4108.3171.5-167.878.2000108.2
59M72.4Confident53.5Low132 Ų132145.1 Ų145.165%0.6579%0.785SS**PPolyproline II helixtrans-77.5129171.8-33.9-81.3101.700108.5P57 T61P57-M59 HydrophobicContact CB-CE 3.45Å; P57-M59 VanDerWaalsContact CB-CE 3.45Å; P57-M59 HydrophobicContact CG-CE 3.47Å; P57-M59 VanDerWaalsContact CG-CE 3.47Å; P57-M59 WeakPolarHBondContact O-CE 3.46Å; P57-M59 PolarHBondContact O-N 2.92Å; M59-T61 PolarHBondContact O-N 3.02Å
60P61.1Low53.5Low125 Ų125145.5 Ų145.581%0.81278%0.784SS**PPolyproline II helixtrans-73.6125.5162.5-7.524000109.1
61T61.4Low53.6Low124 Ų124148.1 Ų148.176%0.76179%0.786SS**PPolyproline II helixtrans-65.8129.7175.938.10000111.7M59M59-T61 PolarHBondContact O-N 3.02Å
62P53.9Low53.8Low123 Ų123148.4 Ų148.480%0.79979%0.787SS**PPolyproline II helixtrans-85.7122.2166.431.4-29.1000109.8
63I56.5Low53.6Low163 Ų163149 Ų14984%0.83679%0.786SS**PPolyproline II helixtrans-102120.6165.5-56.2-179000109.4
64L47.6Very low53.2Low164 Ų164149.1 Ų149.186%0.85978%0.783SS**  trans-40.9128.2169.5-11759.5000114.9
65A52Low53Low74 Ų74143.3 Ų143.361%0.61277%0.773SS**  161.6129.3109.100000112.5
66P46Very low52.3Low128 Ų128147.4 Ų147.483%0.83178%0.78SS**PPolyproline II helixtrans-86.4127.1178.133.5-29.3000111.1
67H46.6Very low52.1Low171 Ų171143.9 Ų143.979%0.79277%0.772SS**PPolyproline II helixtrans-87134.7169.7-72.374.6000109.7
68P51.3Low52Low108 Ų108146.1 Ų146.170%0.70177%0.773SS**PPolyproline II helixtrans-72.4142.5-174.129.3-33.2000112H70P68-H70 PolarHBondContact O-N 2.71Å
69H42.9Very low51.4Low163 Ų163145.7 Ų145.776%0.75577%0.766SS**PPolyproline II helixtrans-61.3118.7178.5-70.6-97.2000112.1
70H48.7Very low50.2Low184 Ų184149.3 Ų149.385%0.85277%0.774SS**  trans-90.5109.8154.8-74.9-76.1000109P68 L72P68-H70 PolarHBondContact O-N 2.71Å; H70-L72 PolarHBondContact O-N 3.39Å
71H53.4Low49.6Very low171 Ų171152.2 Ų152.279%0.79277%0.774SS**  trans-73103.2169.7-59.1-95.5000109
72L52.9Low48.9Very low167 Ų167154.4 Ų154.487%0.87477%0.774SS**  trans-139.686.4159.6-157.260.3000112.3H70H70-L72 PolarHBondContact O-N 3.39Å
73H49.9Very low48.2Very low160 Ų160155.4 Ų155.474%0.74178%0.778SS**  trans-31.4121154-17788.1000114.5
74K45.1Very low47.9Very low189 Ų189153.5 Ų153.582%0.82278%0.779SS**  -170.9114.9127.3-101168.8-177.9-174.80111.4
75P48.6Very low48.1Very low102 Ų102148.9 Ų148.966%0.66277%0.771SS**  trans-77.7122.9166.930.3-29000109.3H77P75-H77 PolarHBondContact O-N 3.35Å
76D41.4Very low48.3Very low149 Ų149153.6 Ų153.680%0.79778%0.782SS**  trans-72129.1171.5-161.3-112.6000109.6H78D76-H78 PolarHBondContact O-CE1 3.35Å; D76-H78 PolarHBondContact O-N 3.08Å
77H49.3Very low48.6Very low152 Ų152157 Ų15770%0.70479%0.787SS**  trans-67.9109.2-162.6-136.4-34.4000110.4P75 Q79P75-H77 PolarHBondContact O-N 3.35Å; H77-Q79 PolarHBondContact O-N 2.87Å
78H53.8Low49.2Very low147 Ų147156.6 Ų156.668%0.68179%0.788SS**  trans-65.491.2162.5-23.4-65.9000107.3D76 Y80D76-H78 PolarHBondContact O-CE1 3.35Å; D76-H78 PolarHBondContact O-N 3.08Å; H78-Y80 WeakPolarHBondContact O-CD2 3.13Å; H78-Y80 WeakPolarHBondContact O-CE2 3.4Å; H78-Y80 PolarHBondContact O-N 3.37Å
79Q45.1Very low49.1Very low164 Ų164157 Ų15777%0.76679%0.79SS**  trans-67.6102.4171.3-83.2-172-27.400108.2H77 F81H77-Q79 PolarHBondContact O-N 2.87Å; Q79-F81 PolarHBondContact O-N 3.5Å; Q79-F81 VanDerWaalsContact O-N 3.1Å
80Y46.8Very low49.7Very low208 Ų208152.5 Ų152.582%0.81679%0.788SS**  trans-44.2111.1165-59.2-85.3000110.5H78 F82H78-Y80 WeakPolarHBondContact O-CD2 3.13Å; H78-Y80 WeakPolarHBondContact O-CE2 3.4Å; H78-Y80 PolarHBondContact O-N 3.37Å; Y80-F82 PolarHBondContact O-N 2.96Å
81F48.1Very low49.7Very low185 Ų185151.2 Ų151.281%0.81179%0.787SS**  trans-68.899.2160.8-93.3-99.3000107.9Q79Q79-F81 PolarHBondContact O-N 3.5Å; Q79-F81 VanDerWaalsContact O-N 3.1Å
82F47Very low49.9Very low171 Ų171152.5 Ų152.575%0.7579%0.79SS**  trans48103.1153.4-57.3-79.8000119.4Y80Y80-F82 PolarHBondContact O-N 2.96Å
83T39.4Very low49.7Very low144 Ų144152.4 Ų152.488%0.88379%0.785SS**  trans-111.1122.1140.470.60000107.7
84S49.1Very low49.7Very low123 Ų123153.1 Ų153.186%0.8679%0.789SS**  trans-90.9128.3167.6-75.30000108
85G52.7Low49.9Very low67 Ų67150.9 Ų150.969%0.69178%0.781SS**  trans175.1-6174.100000118
86M55.3Low49.9Very low173 Ų173150.9 Ų150.985%0.85278%0.781SS**  trans-127.6105.2174.7-62.9-102.973.100108.9M88M86-M88 PolarHBondContact O-N 3.11Å
87Q52.8Low50.1Low199 Ų199151.9 Ų151.993%0.9378%0.781SS**  trans-63.4114.5168.3-69.7177.956.600107.9
88M59.4Low50.3Low162 Ų162151.2 Ų151.280%0.79878%0.782SS**PPolyproline II helixtrans-101.7135.8167.6-68.1-60.7-70.700108.9M86M86-M88 PolarHBondContact O-N 3.11Å
89P49.8Very low50.4Low116 Ų116150.5 Ų150.575%0.75379%0.79SS**PPolyproline II helixtrans-63.2143.9-173.1-1729.9000112L91P89-L91 PolarHBondContact O-N 2.9Å
90G54.4Low50.9Low70 Ų70146 Ų14672%0.72279%0.787SS**PPolyproline II helixtrans-55.2116.3-177.700000113.4
91L50.4Low51.4Low156 Ų156144.8 Ų144.882%0.81779%0.786SS**  trans-127.660.7156-69.2175.1000107.8P89 Q93P89-L91 PolarHBondContact O-N 2.9Å; L91-Q93 PolarHBondContact O-N 3.13Å
92F55.9Low51.9Low198 Ų198144.4 Ų144.487%0.86879%0.787SS**  trans-71.370.4156.1-82.8-86.2000108.1H94F92-H94 PolarHBondContact O-N 3.4Å
93Q48.8Very low52.6Low165 Ų165141.9 Ų141.977%0.77179%0.789SS**  trans-76107.5156.6-163.396.434.800105.3L91 H95L91-Q93 PolarHBondContact O-N 3.13Å; Q93-H95 PolarHBondContact O-N 2.82Å
94H51.1Low53.9Low176 Ų176146.3 Ų146.382%0.81579%0.789SS**  trans-57.2102.8166.5-81.7-95.8000108.5F92 P96F92-H94 PolarHBondContact O-N 3.4Å; H94-P96 VanDerWaalsContact O-CD 3.31Å; H94-P96 WeakPolarHBondContact O-CD 3.44Å
95H48Very low55Low142 Ų142151.4 Ų151.466%0.65779%0.79SS**  trans-92104.4165.8-165.1-80.9000107.4Q93Q93-H95 PolarHBondContact O-N 2.82Å
96P48.5Very low56.3Low102 Ų102159.4 Ų159.466%0.66280%0.799SS**  trans-67.2153.9160.233.7-30.4000106.9H94H94-P96 VanDerWaalsContact O-CD 3.31Å; H94-P96 WeakPolarHBondContact O-CD 3.44Å
97E47.4Very low57.4Low170 Ų170160.7 Ų160.779%0.79480%0.8SS**  trans85.854.2175.5-55-98.4127.800117.9
98L53.4Low59Low138 Ų138155.5 Ų155.572%0.72379%0.791SS**  trans-132.6106147.6-74.8-179.6000110.7
99P54.5Low60.6Low132 Ų132159.6 Ų159.686%0.85780%0.798SS**  trans-78130.3175.831-29.3000109.3
100G55.8Low62.5Low68 Ų68158.9 Ų158.970%0.70179%0.792SS**  trans121.439.715600000118.5
101K57.1Low64.5Low183 Ų183162.2 Ų162.280%0.79680%0.798SS**  trans-13274.9157.931.3-172171.4-168.80110.5C103K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 3.32Å
102H59.7Low66.7Low177 Ų177156.8 Ų156.882%0.81977%0.767SS**  trans-65.495.8163.6-71.686.5000107.6R104H102-R104 PolarHBondContact O-N 2.92Å
103C61.7Low68.8Low118 Ų118150.2 Ų150.280%0.79775%0.746SS**  trans-48.5109.1157.2-177.80000106.2K101 R105K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 3.32Å; C103-R105 PolarHBondContact O-N 2.97Å
104R65.5Low71.1Confident237 Ų237148.9 Ų148.989%0.89474%0.744SS**  trans-64.490.1176.9-80.2-160.1-163-113.88.5107H102 R106H102-R104 PolarHBondContact O-N 2.92Å; R104-R106 PolarHBondContact O-N 2.98Å
105R72.6Confident73.4Confident231 Ų231144.9 Ų144.987%0.87274%0.736SS**  trans-53.4113.7175.6-163.8172.968.3-164.42107C103 K107C103-R105 PolarHBondContact O-N 2.97Å; R105-K107 PolarHBondContact O-N 3.31Å
106R80.3Confident75.8Confident234 Ų234140 Ų14088%0.88371%0.713SS**PPolyproline II helixtrans-53.7134.5176.4-76.9-172.9-79.1162.4-3.8107.9R104 A108R104-R106 PolarHBondContact O-N 2.98Å; R106-A108 PolarHBondContact O-N 3.03Å
107K79.4Confident78.2Confident201 Ų201138.2 Ų138.287%0.87470%0.698SS**PPolyproline II helixtrans-59.6135.1174.8-113.681.9100.8176.90108.1R105R105-K107 PolarHBondContact O-N 3.31Å
108A86.5Confident80.6Confident90 Ų90134 Ų13474%0.74469%0.688SS**PPolyproline II helixtrans-56.2146.717200000109.5R106R106-A108 PolarHBondContact O-N 3.03Å
109R91Very high82.7Confident248 Ų248128.5 Ų128.594%0.93666%0.664SS**PPolyproline II helixtrans-67.9136.9175.8-68.2-177.5178.7178.7-0.1108.9
110T91.1Very high84.9Confident101 Ų101122.2 Ų122.262%0.6262%0.623SS**PPolyproline II helixtrans-91.8145.2173.348.10000109.9
111V95.4Very high86.9Confident140 Ų140121.3 Ų121.385%0.84860%0.601SS**  trans-114.2136.3173.2-174.90000107.2
112F98.1Very high88.9Confident41 Ų41119.4 Ų119.418%0.1859%0.593CS.*  trans-85146.5176.2-58.1-51.6000110.1Q116 L117 L144 Q148 W152F112-Q116 HydrophobicContact CB-CB 4.24Å; F112-L117 HydrophobicContact CB-CD2 3.88Å; F112-L117 HydrophobicContact CB-CG 4.02Å; F112-L117 HydrophobicContact CD2-CD2 4.09Å; F112-L117 HydrophobicContact CG-CD2 4.47Å; F112-L144 HydrophobicContact CD1-CD1 4.26Å; F112-L144 HydrophobicContact CD1-CD2 3.76Å; F112-L144 HydrophobicContact CE1-CD1 4.19Å; F112-L144 HydrophobicContact CE1-CD2 3.7Å; F112-Q148 HydrophobicContact CE1-CB 4.16Å; F112-Q148 HydrophobicContact CE1-CG 4.25Å; F112-Q148 HydrophobicContact CZ-CB 3.95Å; F112-Q148 HydrophobicContact CZ-CG 4.22Å; F112-W152 AromaticContact CD2-CD1 3.8Å; F112-W152 HydrophobicContact CE2-CB 4.37Å; F112-W152 AromaticContact CE2-CD1 3.67Å; F112-W152 HydrophobicContact CE2-CG 4.38Å
113S98.4Very high90.7Very high60 Ų60114.4 Ų114.442%0.4257%0.566SS.*  trans-69.5160.9172.362.40000111.7S115 Q116 L117S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.43Å; S113-Q116 WeakPolarHBondContact O-CB 3.41Å; S113-Q116 PolarHBondContact O-N 3.15Å; S113-Q116 VanDerWaalsContact O-N 3.11Å; S113-Q116 VanDerWaalsContact OG-CD 3.3Å; S113-Q116 VanDerWaalsContact OG-CG 3.26Å; S113-Q116 WeakPolarHBondContact OG-CG 3.28Å; S113-Q116 PolarHBondContact OG-N 3.43Å; S113-Q116 PolarHBondContact OG-OE1 2.88Å; S113-L117 WeakPolarHBondContact O-CG 3.48Å; S113-L117 PolarHBondContact O-N 3.23Å
114D98.3Very high92.5Very high137 Ų137109 Ų10973%0.73353%0.529SS*.Hα-helixtrans-61.5-38-179.5-63.4-31.4000112.6Q116 L117 S118D114-Q116 VanDerWaalsContact C-N 3.34Å; D114-Q116 PolarHBondContact O-N 2.97Å; D114-L117 PolarHBondContact O-N 2.79Å; D114-S118 WeakPolarHBondContact O-CB 3.29Å; D114-S118 PolarHBondContact O-N 2.62Å
115S98.3Very high94.1Very high93 Ų93103.6 Ų103.665%0.6551%0.514SS*.Hα-helixtrans-60.9-42.6174.61760000111.9S113 S118 G119S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.43Å; S115-S118 PolarHBondContact O-N 2.86Å; S115-G119 PolarHBondContact O-N 3.16Å
116Q98.6Very high95.3Very high38 Ų3898.4 Ų98.418%0.17850%0.502CS..Hα-helixtrans-65.6-43.1176-72169.2-36.600111.7F112 S113 D114 G119 L120 L142F112-Q116 HydrophobicContact CB-CB 4.24Å; S113-Q116 WeakPolarHBondContact O-CB 3.41Å; S113-Q116 PolarHBondContact O-N 3.15Å; S113-Q116 VanDerWaalsContact O-N 3.11Å; S113-Q116 VanDerWaalsContact OG-CD 3.3Å; S113-Q116 VanDerWaalsContact OG-CG 3.26Å; S113-Q116 WeakPolarHBondContact OG-CG 3.28Å; S113-Q116 PolarHBondContact OG-N 3.43Å; S113-Q116 PolarHBondContact OG-OE1 2.88Å; D114-Q116 VanDerWaalsContact C-N 3.34Å; D114-Q116 PolarHBondContact O-N 2.97Å; Q116-G119 PolarHBondContact O-N 3.47Å; Q116-L120 WeakPolarHBondContact O-CB 3.35Å; Q116-L120 WeakPolarHBondContact O-CD1 3.43Å; Q116-L120 VanDerWaalsContact O-CG 3.22Å; Q116-L120 WeakPolarHBondContact O-CG 3.4Å; Q116-L120 PolarHBondContact O-N 3.36Å; Q116-L142 PolarHBondContact NE2-O 3.06Å
117L98.6Very high96.1Very high65 Ų6590 Ų9034%0.3447%0.473SS..Hα-helixtrans-62.6-43.6177.3-68.5175.2000111.7F112 S113 D114 L120 E121F112-L117 HydrophobicContact CB-CD2 3.88Å; F112-L117 HydrophobicContact CB-CG 4.02Å; F112-L117 HydrophobicContact CD2-CD2 4.09Å; F112-L117 HydrophobicContact CG-CD2 4.47Å; S113-L117 WeakPolarHBondContact O-CG 3.48Å; S113-L117 PolarHBondContact O-N 3.23Å; D114-L117 PolarHBondContact O-N 2.79Å; L117-L120 PolarHBondContact O-N 3.26Å; L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.97Å
118S98.6Very high97Very high82 Ų8285.6 Ų85.657%0.57345%0.451SS*.Hα-helixtrans-60.9-46176.7-178.40000111.7D114 S115 L120 E121 K122D114-S118 WeakPolarHBondContact O-CB 3.29Å; D114-S118 PolarHBondContact O-N 2.62Å; S115-S118 PolarHBondContact O-N 2.86Å; S118-L120 PolarHBondContact O-N 3.36Å; S118-E121 PolarHBondContact O-N 3.43Å; S118-K122 WeakPolarHBondContact O-CB 3.44Å; S118-K122 PolarHBondContact O-N 3.26Å
119G98.5Very high97.6Very high22 Ų2288.7 Ų88.723%0.22745%0.445CS..Hα-helixtrans-62.6-40.8176.600000113.5S115 Q116 R123S115-G119 PolarHBondContact O-N 3.16Å; Q116-G119 PolarHBondContact O-N 3.47Å; G119-R123 PolarHBondContact O-N 3.17Å
120L98.8Very high97.9Very high0 Ų078.1 Ų78.10%041%0.406CS..Hα-helixtrans-64.6-43.2175.7-71.9165.8000111.8Q116 L117 S118 F124 L138 L142 L144 V149 W152 F153Q116-L120 WeakPolarHBondContact O-CB 3.35Å; Q116-L120 WeakPolarHBondContact O-CD1 3.43Å; Q116-L120 VanDerWaalsContact O-CG 3.22Å; Q116-L120 WeakPolarHBondContact O-CG 3.4Å; Q116-L120 PolarHBondContact O-N 3.36Å; L117-L120 PolarHBondContact O-N 3.26Å; S118-L120 PolarHBondContact O-N 3.36Å; L120-F124 WeakPolarHBondContact O-CB 3.35Å; L120-F124 PolarHBondContact O-N 2.96Å; L120-L138 HydrophobicContact CD2-CD2 4.02Å; L120-L142 HydrophobicContact CD2-CD1 3.85Å; L120-L142 HydrophobicContact CG-CD1 3.69Å; L120-L144 HydrophobicContact CD1-CD1 4.09Å; L120-V149 HydrophobicContact CD2-CG1 4.31Å; L120-V149 HydrophobicContact CD2-CG2 4.43Å; L120-W152 HydrophobicContact CB-CD2 3.92Å; L120-W152 HydrophobicContact CB-CE3 3.84Å; L120-W152 HydrophobicContact CB-CH2 3.65Å; L120-W152 HydrophobicContact CB-CZ2 3.69Å; L120-W152 HydrophobicContact CB-CZ3 3.72Å; L120-W152 HydrophobicContact CD1-CB 4.42Å; L120-W152 HydrophobicContact CD1-CD2 3.78Å; L120-W152 HydrophobicContact CD1-CE3 4.39Å; L120-W152 HydrophobicContact CD1-CG 3.76Å; L120-W152 HydrophobicContact CD2-CD2 4.38Å; L120-W152 HydrophobicContact CD2-CE3 4.22Å; L120-W152 HydrophobicContact CG-CD2 4.24Å; L120-W152 HydrophobicContact CG-CE3 4.37Å; L120-F153 HydrophobicContact CD2-CE2 4Å
121E98.7Very high98.3Very high50 Ų5075.8 Ų75.823%0.23439%0.394CS..Hα-helixtrans-66.8-46179.2-164.266.3-143.800111.4L117 S118 R123 F124 E125 W152 R156L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.97Å; S118-E121 PolarHBondContact O-N 3.43Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 2.68Å; E121-F124 WeakPolarHBondContact O-CA 3.49Å; E121-F124 WeakPolarHBondContact O-CB 3.36Å; E121-F124 PolarHBondContact O-N 2.91Å; E121-E125 WeakPolarHBondContact O-CG 3.46Å; E121-E125 PolarHBondContact O-N 2.81Å; E121-W152 HydrophobicContact CB-CH2 4.43Å; E121-W152 WeakPolarHBondContact OE2-CH2 3.36Å; E121-R156 VanDerWaalsContact CD-NE 3.29Å; E121-R156 IonicContact OE1-CZ 3.85Å; E121-R156 IonicContact OE1-NE 2.91Å; E121-R156 PolarHBondContact OE1-NE 2.86Å; E121-R156 IonicContact OE1-NH2 3.97Å; E121-R156 PolarHBondContact OE1-NH2 3.32Å; E121-R156 WeakPolarHBondContact OE2-CD 3.47Å; E121-R156 IonicContact OE2-CZ 2.97Å; E121-R156 IonicContact OE2-NE 2.68Å; E121-R156 PolarHBondContact OE2-NE 3.07Å; E121-R156 IonicContact OE2-NH2 3.17Å
122K98.6Very high98.4Very high143 Ų14373.3 Ų73.362%0.62238%0.38SS*.Hα-helixtrans-55.2-45.5176.3-177178-178.1178.20112S118 F124S118-K122 WeakPolarHBondContact O-CB 3.44Å; S118-K122 PolarHBondContact O-N 3.26Å; K122-F124 VanDerWaalsContact C-N 3.33Å
123R98.5Very high98.5Very high71 Ų7175.6 Ų75.627%0.26840%0.398SS..Hα-helixtrans-68.5-34.4176.8-173.162.1178.6-157.53.5111.8G119 E121 I126 Q127 L130 E134 L138 F153G119-R123 PolarHBondContact O-N 3.17Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 2.68Å; R123-I126 PolarHBondContact O-N 2.79Å; R123-Q127 PolarHBondContact O-N 3.37Å; R123-L130 HydrophobicContact CG-CD2 4.09Å; R123-E134 IonicContact NH2-OE1 2.81Å; R123-E134 PolarHBondContact NH2-OE1 3.32Å; R123-L138 HydrophobicContact CB-CD1 4.31Å; R123-L138 HydrophobicContact CB-CD2 4.14Å; R123-L138 HydrophobicContact CG-CD2 4.02Å; R123-F153 HydrophobicContact CB-CZ 4.42Å; R123-F153 HydrophobicContact CG-CZ 4.31Å
124F98.8Very high98.5Very high4 Ų474.6 Ų74.62%0.01839%0.387CS..Hα-helixtrans-66.8-36.8179.8-176.9-96.4000113.5L120 E121 K122 I126 Q127 R128 W152 F153 R156 R157 H160L120-F124 WeakPolarHBondContact O-CB 3.35Å; L120-F124 PolarHBondContact O-N 2.96Å; E121-F124 WeakPolarHBondContact O-CA 3.49Å; E121-F124 WeakPolarHBondContact O-CB 3.36Å; E121-F124 PolarHBondContact O-N 2.91Å; K122-F124 VanDerWaalsContact C-N 3.33Å; F124-I126 VanDerWaalsContact C-N 3.31Å; F124-Q127 CarbonylContact O-C 3.37Å; F124-Q127 PolarHBondContact O-N 3.45Å; F124-R128 HydrophobicContact CE1-CG 4.13Å; F124-R128 HydrophobicContact CE2-CB 4.03Å; F124-R128 HydrophobicContact CE2-CG 4.08Å; F124-R128 HydrophobicContact CZ-CB 4.21Å; F124-R128 HydrophobicContact CZ-CG 3.82Å; F124-W152 HydrophobicContact CB-CH2 4.36Å; F124-W152 HydrophobicContact CB-CZ3 4.1Å; F124-W152 HydrophobicContact CD2-CZ3 4.48Å; F124-W152 HydrophobicContact CG-CZ3 4.43Å; F124-F153 HydrophobicContact CB-CE1 4.22Å; F124-F153 HydrophobicContact CB-CZ 4.32Å; F124-F153 AromaticContact CD2-CD1 3.85Å; F124-F153 HydrophobicContact CD2-CD1 3.85Å; F124-F153 AromaticContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CE2-CD1 4.49Å; F124-R156 HydrophobicContact CD1-CG 3.66Å; F124-R156 HydrophobicContact CD2-CB 4.26Å; F124-R156 HydrophobicContact CD2-CG 3.69Å; F124-R156 HydrophobicContact CE1-CG 3.65Å; F124-R156 HydrophobicContact CE2-CB 4.14Å; F124-R156 HydrophobicContact CE2-CG 3.69Å; F124-R156 HydrophobicContact CG-CG 3.68Å; F124-R156 HydrophobicContact CZ-CB 4.43Å; F124-R156 HydrophobicContact CZ-CG 3.67Å; F124-R157 HydrophobicContact CE2-CG 3.72Å; F124-R157 HydrophobicContact CZ-CG 4.11Å; F124-H160 HydrophobicContact CE1-CB 4.43Å; F124-H160 HydrophobicContact CZ-CB 4.32Å
125E98.4Very high98.5Very high124 Ų12470.3 Ų70.358%0.57936%0.361SS*.Hα-helixtrans-59.2-44.9175.7-73170.3-179.700111.3E121 R128E121-E125 WeakPolarHBondContact O-CG 3.46Å; E121-E125 PolarHBondContact O-N 2.81Å; E125-R128 PolarHBondContact O-NH1 2.9Å
126I98.2Very high98.5Very high122 Ų12268.8 Ų68.863%0.62635%0.348SS*.Hα-helixtrans-69.5-47.7177-57.9165000110.3R123 F124R123-I126 PolarHBondContact O-N 2.79Å; F124-I126 VanDerWaalsContact C-N 3.31Å
127Q98.3Very high98.5Very high57 Ų5773 Ų7327%0.26637%0.367SS..  trans-143.1111.8-172.2-167.4175.7-56.600112.4R123 F124 Y129 L130 E134 F153R123-Q127 PolarHBondContact O-N 3.37Å; F124-Q127 CarbonylContact O-C 3.37Å; F124-Q127 PolarHBondContact O-N 3.45Å; Q127-Y129 VanDerWaalsContact C-N 3.3Å; Q127-Y129 VanDerWaalsContact CG-O 3.27Å; Q127-Y129 WeakPolarHBondContact CG-O 3.25Å; Q127-Y129 PolarHBondContact NE2-O 3.41Å; Q127-Y129 PolarHBondContact O-N 3.34Å; Q127-L130 HydrophobicContact CG-CD2 4.48Å; Q127-E134 PolarHBondContact NE2-OE1 3.18Å; Q127-E134 PolarHBondContact NE2-OE2 2.99Å; Q127-E134 PolarHBondContact OE1-OE1 3.24Å; Q127-E134 VanDerWaalsContact OE1-OE1 3.06Å; Q127-F153 WeakPolarHBondContact O-CE1 3.44Å
128R98.1Very high98.5Very high110 Ų11071 Ų7142%0.41536%0.357SS..SBendtrans-75.6-15.8-175-69.6167.4166.776-5.1114.1F124 E125 R157 H160F124-R128 HydrophobicContact CE1-CG 4.13Å; F124-R128 HydrophobicContact CE2-CB 4.03Å; F124-R128 HydrophobicContact CE2-CG 4.08Å; F124-R128 HydrophobicContact CZ-CB 4.21Å; F124-R128 HydrophobicContact CZ-CG 3.82Å; E125-R128 PolarHBondContact O-NH1 2.9Å; R128-R157 WeakPolarHBondContact O-CD 3.38Å; R128-H160 PolarHBondContact NE-CE1 3.09Å
129Y98.5Very high98.5Very high155 Ų15567.3 Ų67.361%0.60833%0.331SS*.SBendtrans-136.3121.2-177.5-64.6-104.2000109.6Q127 R157Q127-Y129 VanDerWaalsContact C-N 3.3Å; Q127-Y129 VanDerWaalsContact CG-O 3.27Å; Q127-Y129 WeakPolarHBondContact CG-O 3.25Å; Q127-Y129 PolarHBondContact NE2-O 3.41Å; Q127-Y129 PolarHBondContact O-N 3.34Å; Y129-R157 VanDerWaalsContact CD1-NH1 3.27Å
130L98.4Very high98.5Very high25 Ų2571.2 Ų71.213%0.13135%0.351CS..  trans-96.4135.8177.8-59.1-179.9000111R123 Q127 E134 R135 L138 V149 F153R123-L130 HydrophobicContact CG-CD2 4.09Å; Q127-L130 HydrophobicContact CG-CD2 4.48Å; L130-E134 HydrophobicContact CB-CB 4.4Å; L130-E134 HydrophobicContact CD2-CB 4.3Å; L130-R135 HydrophobicContact CB-CB 4.49Å; L130-L138 HydrophobicContact CD1-CD2 3.72Å; L130-V149 HydrophobicContact CD1-CG1 4.07Å; L130-F153 HydrophobicContact CD1-CD1 4.18Å; L130-F153 HydrophobicContact CD1-CD2 4.02Å; L130-F153 HydrophobicContact CD1-CE1 3.76Å; L130-F153 HydrophobicContact CD1-CE2 3.59Å; L130-F153 HydrophobicContact CD1-CG 4.31Å; L130-F153 HydrophobicContact CD1-CZ 3.46Å; L130-F153 VanDerWaalsContact CD1-CZ 3.46Å; L130-F153 HydrophobicContact CD2-CE1 4.07Å; L130-F153 HydrophobicContact CD2-CZ 4.23Å; L130-F153 HydrophobicContact CG-CD1 3.97Å; L130-F153 HydrophobicContact CG-CE1 3.59Å; L130-F153 HydrophobicContact CG-CE2 4.35Å; L130-F153 HydrophobicContact CG-CZ 3.82Å
131S98.5Very high98.5Very high52 Ų5274.9 Ų74.936%0.36438%0.381SS..  trans-67.7170.4162.969.90000110.7P133 E134 R135S131-P133 WeakPolarHBondContact OG-CD 3.42Å; S131-P133 WeakPolarHBondContact OG-CG 3.27Å; S131-E134 VanDerWaalsContact CB-OE2 3.25Å; S131-E134 WeakPolarHBondContact CB-OE2 3.49Å; S131-E134 PolarHBondContact N-OE2 2.82Å; S131-E134 VanDerWaalsContact OG-CD 3.26Å; S131-E134 VanDerWaalsContact OG-CG 3.27Å; S131-E134 WeakPolarHBondContact OG-CG 3.48Å; S131-E134 PolarHBondContact OG-OE2 3.15Å; S131-R135 WeakPolarHBondContact O-CB 3.42Å; S131-R135 PolarHBondContact O-N 3.32Å; S131-R135 VanDerWaalsContact O-N 3.15Å
132T98.4Very high98.5Very high88 Ų8873.8 Ų73.854%0.5438%0.377SS..Hα-helixtrans-58-51.9177.1-55.50000113.1E134 R135 V136T132-E134 PolarHBondContact O-N 2.8Å; T132-R135 WeakPolarHBondContact O-CB 3.43Å; T132-R135 PolarHBondContact O-N 2.9Å; T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.48Å
133P98.4Very high98.5Very high89 Ų8972.1 Ų72.158%0.57838%0.383SS*.Hα-helixtrans-62.1-42-178.522.9-33.7000113S131 R135 V136 E137S131-P133 WeakPolarHBondContact OG-CD 3.42Å; S131-P133 WeakPolarHBondContact OG-CG 3.27Å; P133-R135 VanDerWaalsContact C-N 3.26Å; P133-R135 PolarHBondContact O-N 3.43Å; P133-V136 WeakPolarHBondContact O-CB 3.48Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.1Å; P133-E137 PolarHBondContact O-N 3.48Å
134E98.6Very high98.5Very high39 Ų3969.7 Ų69.718%0.18238%0.375CS..Hα-helixtrans-65.1-32.1179.3-61.8171.2106.600112.6R123 Q127 L130 S131 T132 L138R123-E134 IonicContact NH2-OE1 2.81Å; R123-E134 PolarHBondContact NH2-OE1 3.32Å; Q127-E134 PolarHBondContact NE2-OE1 3.18Å; Q127-E134 PolarHBondContact NE2-OE2 2.99Å; Q127-E134 PolarHBondContact OE1-OE1 3.24Å; Q127-E134 VanDerWaalsContact OE1-OE1 3.06Å; L130-E134 HydrophobicContact CB-CB 4.4Å; L130-E134 HydrophobicContact CD2-CB 4.3Å; S131-E134 VanDerWaalsContact CB-OE2 3.25Å; S131-E134 WeakPolarHBondContact CB-OE2 3.49Å; S131-E134 PolarHBondContact N-OE2 2.82Å; S131-E134 VanDerWaalsContact OG-CD 3.26Å; S131-E134 VanDerWaalsContact OG-CG 3.27Å; S131-E134 WeakPolarHBondContact OG-CG 3.48Å; S131-E134 PolarHBondContact OG-OE2 3.15Å; T132-E134 PolarHBondContact O-N 2.8Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 PolarHBondContact O-N 3.15Å
135R98.8Very high98.4Very high48 Ų4872.1 Ų72.118%0.18139%0.392CS..Hα-helixtrans-66.3-40.9174.3-170.4-166.9-56.1142.710.4111.4L130 S131 T132 P133 E137 A139 E146 V149L130-R135 HydrophobicContact CB-CB 4.49Å; S131-R135 WeakPolarHBondContact O-CB 3.42Å; S131-R135 PolarHBondContact O-N 3.32Å; S131-R135 VanDerWaalsContact O-N 3.15Å; T132-R135 WeakPolarHBondContact O-CB 3.43Å; T132-R135 PolarHBondContact O-N 2.9Å; P133-R135 VanDerWaalsContact C-N 3.26Å; P133-R135 PolarHBondContact O-N 3.43Å; R135-E137 VanDerWaalsContact C-N 3.34Å; R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 3.41Å; R135-E146 WeakPolarHBondContact CD-O 3.46Å; R135-E146 HydrophobicContact CG-CB 4.34Å; R135-E146 HydrophobicContact CG-CG 4.48Å; R135-V149 HydrophobicContact CG-CB 4.05Å; R135-V149 HydrophobicContact CG-CG1 3.87Å
136V98.8Very high98.5Very high61 Ų6170 Ų7037%0.3738%0.383SS..Hα-helixtrans-62.7-44.8177.2175.10000110.1T132 P133 A139 T140 E146T132-V136 WeakPolarHBondContact O-CG2 3.35Å; T132-V136 PolarHBondContact O-N 3.48Å; P133-V136 WeakPolarHBondContact O-CB 3.48Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.1Å; V136-A139 PolarHBondContact O-N 3.09Å; V136-T140 PolarHBondContact O-N 3.25Å; V136-T140 PolarHBondContact O-OG1 3.35Å; V136-E146 VanDerWaalsContact CG2-CD 3.49Å; V136-E146 HydrophobicContact CG2-CG 4.08Å
137E98.6Very high98.4Very high127 Ų12768.9 Ų68.959%0.59338%0.382SS*.Hα-helixtrans-59.3-51.7177.2-172-170.7160.300111.5P133 R135 A139 T140 A141P133-E137 PolarHBondContact O-N 3.48Å; R135-E137 VanDerWaalsContact C-N 3.34Å; E137-A139 VanDerWaalsContact C-N 3.35Å; E137-A139 PolarHBondContact O-N 3.44Å; E137-T140 PolarHBondContact O-N 3.22Å; E137-A141 PolarHBondContact O-N 3.24Å
138L98.6Very high98.4Very high22 Ų2268.9 Ų68.912%0.11538%0.381CS..Hα-helixtrans-65.2-38.2-179.6-173.862.8000112.6L120 R123 L130 E134 T140 A141 L142 V149 F153L120-L138 HydrophobicContact CD2-CD2 4.02Å; R123-L138 HydrophobicContact CB-CD1 4.31Å; R123-L138 HydrophobicContact CB-CD2 4.14Å; R123-L138 HydrophobicContact CG-CD2 4.02Å; L130-L138 HydrophobicContact CD1-CD2 3.72Å; E134-L138 WeakPolarHBondContact O-CB 3.38Å; E134-L138 PolarHBondContact O-N 3.15Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.37Å; L138-A141 PolarHBondContact O-N 3.07Å; L138-L142 HydrophobicContact CD1-CD1 3.73Å; L138-L142 HydrophobicContact CD1-CG 4.08Å; L138-L142 HydrophobicContact CG-CD1 4.06Å; L138-L142 PolarHBondContact O-N 3.1Å; L138-V149 HydrophobicContact CD2-CG1 3.91Å; L138-V149 HydrophobicContact CG-CG1 4.48Å; L138-F153 HydrophobicContact CD2-CE2 3.67Å; L138-F153 HydrophobicContact CD2-CZ 4Å
139A98.7Very high98.5Very high5 Ų563.6 Ų63.64%0.04136%0.362CS..Hα-helixtrans-59.7-44.6175.400000111R135 V136 E137 S143 L144 E146 V149R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 3.41Å; V136-A139 PolarHBondContact O-N 3.09Å; E137-A139 VanDerWaalsContact C-N 3.35Å; E137-A139 PolarHBondContact O-N 3.44Å; A139-S143 PolarHBondContact O-N 3.25Å; A139-L144 CarbonylContact C-O 3.49Å; A139-L144 WeakPolarHBondContact CB-O 3.27Å; A139-L144 PolarHBondContact O-N 3.48Å; A139-L144 VanDerWaalsContact O-O 3.12Å; A139-E146 HydrophobicContact CB-CG 4.24Å; A139-V149 HydrophobicContact CB-CG2 3.96Å
140T98.6Very high98.5Very high103 Ų10361.6 Ų61.663%0.63236%0.356SS*.Hα-helixtrans-64.6-47.8177.2-53.10000111V136 E137 L138 L142 S143V136-T140 PolarHBondContact O-N 3.25Å; V136-T140 PolarHBondContact O-OG1 3.35Å; E137-T140 PolarHBondContact O-N 3.22Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.37Å; T140-L142 VanDerWaalsContact C-N 3.3Å; T140-L142 PolarHBondContact O-N 3.01Å; T140-S143 PolarHBondContact O-N 3.48Å
141A98.4Very high98.5Very high77 Ų7763.9 Ų63.964%0.63637%0.371SS*.Hα-helixtrans-60.4-35.8-179.100000113.4E137 L138E137-A141 PolarHBondContact O-N 3.24Å; L138-A141 PolarHBondContact O-N 3.07Å
142L98.3Very high98.5Very high28 Ų2863 Ų6315%0.14736%0.36CS..THydrogen-bonded Turntrans-100.14.5-177.4-59.3-179000114Q116 L120 L138 T140 L144Q116-L142 PolarHBondContact NE2-O 3.06Å; L120-L142 HydrophobicContact CD2-CD1 3.85Å; L120-L142 HydrophobicContact CG-CD1 3.69Å; L138-L142 HydrophobicContact CD1-CD1 3.73Å; L138-L142 HydrophobicContact CD1-CG 4.08Å; L138-L142 HydrophobicContact CG-CD1 4.06Å; L138-L142 PolarHBondContact O-N 3.1Å; T140-L142 VanDerWaalsContact C-N 3.3Å; T140-L142 PolarHBondContact O-N 3.01Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 HydrophobicContact CB-CD1 4.2Å; L142-L144 HydrophobicContact CB-CG 4.2Å; L142-L144 PolarHBondContact O-N 2.82Å
143S98.4Very high98.5Very high107 Ų10759.2 Ų59.275%0.74834%0.336SS*.THydrogen-bonded Turntrans52.645.8-174.9-59.90000113A139 T140A139-S143 PolarHBondContact O-N 3.25Å; T140-S143 PolarHBondContact O-N 3.48Å
144L98.1Very high98.5Very high21 Ų2159.1 Ų59.111%0.1133%0.328CS..  trans-117.3162176.9-65.7179.4000110.3F112 L120 A139 L142 Q148 V149F112-L144 HydrophobicContact CD1-CD1 4.26Å; F112-L144 HydrophobicContact CD1-CD2 3.76Å; F112-L144 HydrophobicContact CE1-CD1 4.19Å; F112-L144 HydrophobicContact CE1-CD2 3.7Å; L120-L144 HydrophobicContact CD1-CD1 4.09Å; A139-L144 CarbonylContact C-O 3.49Å; A139-L144 WeakPolarHBondContact CB-O 3.27Å; A139-L144 PolarHBondContact O-N 3.48Å; A139-L144 VanDerWaalsContact O-O 3.12Å; L142-L144 VanDerWaalsContact C-N 3.3Å; L142-L144 HydrophobicContact CB-CD1 4.2Å; L142-L144 HydrophobicContact CB-CG 4.2Å; L142-L144 PolarHBondContact O-N 2.82Å; L144-Q148 HydrophobicContact CB-CB 4.49Å; L144-V149 HydrophobicContact CB-CG2 4.13Å; L144-V149 HydrophobicContact CD1-CG2 4.44Å
145S98.4Very high98.5Very high54 Ų5462 Ų6238%0.37834%0.344SS..  trans-78.9150.3167.765.30000111.3T147 Q148 V149S145-T147 PolarHBondContact O-N 3.2Å; S145-T147 VanDerWaalsContact O-N 3.13Å; S145-Q148 WeakPolarHBondContact O-CB 3.33Å; S145-Q148 PolarHBondContact O-N 3.26Å; S145-Q148 VanDerWaalsContact OG-CG 3.28Å; S145-Q148 WeakPolarHBondContact OG-CG 3.48Å; S145-Q148 PolarHBondContact OG-N 3.27Å; S145-Q148 PolarHBondContact OG-OE1 3.35Å; S145-V149 PolarHBondContact O-N 3.12Å; S145-V149 VanDerWaalsContact O-N 3.08Å
146E98.5Very high98.5Very high81 Ų8161.5 Ų61.538%0.37934%0.343SS..Hα-helixtrans-52.3-37.5173-72.3-178.2-111.200112.5R135 V136 A139 Q148 V149 K150R135-E146 WeakPolarHBondContact CD-O 3.46Å; R135-E146 HydrophobicContact CG-CB 4.34Å; R135-E146 HydrophobicContact CG-CG 4.48Å; V136-E146 VanDerWaalsContact CG2-CD 3.49Å; V136-E146 HydrophobicContact CG2-CG 4.08Å; A139-E146 HydrophobicContact CB-CG 4.24Å; E146-Q148 VanDerWaalsContact C-N 3.35Å; E146-Q148 PolarHBondContact O-N 3.48Å; E146-V149 PolarHBondContact O-N 3.07Å; E146-K150 VanDerWaalsContact O-CB 3.29Å; E146-K150 WeakPolarHBondContact O-CB 3.33Å; E146-K150 PolarHBondContact O-N 3.07Å
147T98.1Very high98.5Very high98 Ų9861.5 Ų61.560%0.60134%0.336SS*.Hα-helixtrans-64.6-41178.4-62.50000111.2S145 K150 T151S145-T147 PolarHBondContact O-N 3.2Å; S145-T147 VanDerWaalsContact O-N 3.13Å; T147-K150 PolarHBondContact O-N 3.11Å; T147-T151 WeakPolarHBondContact O-CB 3.47Å; T147-T151 PolarHBondContact O-N 3.25Å; T147-T151 PolarHBondContact O-OG1 3.29Å; T147-T151 VanDerWaalsContact O-OG1 3.11Å
148Q98.3Very high98.5Very high56 Ų5660 Ų6026%0.26233%0.33SS..Hα-helixtrans-63-45.4175.5-75.9164.5-59.400111.4F112 L144 S145 E146 T151 W152F112-Q148 HydrophobicContact CE1-CB 4.16Å; F112-Q148 HydrophobicContact CE1-CG 4.25Å; F112-Q148 HydrophobicContact CZ-CB 3.95Å; F112-Q148 HydrophobicContact CZ-CG 4.22Å; L144-Q148 HydrophobicContact CB-CB 4.49Å; S145-Q148 WeakPolarHBondContact O-CB 3.33Å; S145-Q148 PolarHBondContact O-N 3.26Å; S145-Q148 VanDerWaalsContact OG-CG 3.28Å; S145-Q148 WeakPolarHBondContact OG-CG 3.48Å; S145-Q148 PolarHBondContact OG-N 3.27Å; S145-Q148 PolarHBondContact OG-OE1 3.35Å; E146-Q148 VanDerWaalsContact C-N 3.35Å; E146-Q148 PolarHBondContact O-N 3.48Å; Q148-T151 PolarHBondContact O-N 3.18Å; Q148-W152 WeakPolarHBondContact O-CB 3.5Å; Q148-W152 PolarHBondContact O-N 2.94Å
149V98.6Very high98.4Very high0 Ų065 Ų650%035%0.351CS..Hα-helixtrans-60.8-47.3176.3178.70000110.5L120 L130 R135 L138 A139 L144 S145 E146 T151 W152 F153L120-V149 HydrophobicContact CD2-CG1 4.31Å; L120-V149 HydrophobicContact CD2-CG2 4.43Å; L130-V149 HydrophobicContact CD1-CG1 4.07Å; R135-V149 HydrophobicContact CG-CB 4.05Å; R135-V149 HydrophobicContact CG-CG1 3.87Å; L138-V149 HydrophobicContact CD2-CG1 3.91Å; L138-V149 HydrophobicContact CG-CG1 4.48Å; A139-V149 HydrophobicContact CB-CG2 3.96Å; L144-V149 HydrophobicContact CB-CG2 4.13Å; L144-V149 HydrophobicContact CD1-CG2 4.44Å; S145-V149 PolarHBondContact O-N 3.12Å; S145-V149 VanDerWaalsContact O-N 3.08Å; E146-V149 PolarHBondContact O-N 3.07Å; V149-T151 PolarHBondContact O-N 3.46Å; V149-W152 PolarHBondContact O-N 3.25Å; V149-F153 HydrophobicContact CG1-CD2 3.84Å; V149-F153 HydrophobicContact CG1-CE2 3.99Å; V149-F153 WeakPolarHBondContact O-CD2 3.46Å; V149-F153 PolarHBondContact O-N 3.46Å
150K98.4Very high98.3Very high113 Ų11367.5 Ų67.549%0.49136%0.362SS..Hα-helixtrans-56.5-49.7176.7-179.9-178.5176.1-179.70111.9E146 T147 F153 Q154E146-K150 VanDerWaalsContact O-CB 3.29Å; E146-K150 WeakPolarHBondContact O-CB 3.33Å; E146-K150 PolarHBondContact O-N 3.07Å; T147-K150 PolarHBondContact O-N 3.11Å; K150-F153 PolarHBondContact O-N 3.34Å; K150-Q154 WeakPolarHBondContact O-CB 3.19Å; K150-Q154 PolarHBondContact O-N 3.36Å
151T98.4Very high98.3Very high72 Ų7268.4 Ų68.444%0.44236%0.357SS..Hα-helixtrans-64.4-41.2179.6-64.90000111.4T147 Q148 V149 Q154 N155T147-T151 WeakPolarHBondContact O-CB 3.47Å; T147-T151 PolarHBondContact O-N 3.25Å; T147-T151 PolarHBondContact O-OG1 3.29Å; T147-T151 VanDerWaalsContact O-OG1 3.11Å; Q148-T151 PolarHBondContact O-N 3.18Å; V149-T151 PolarHBondContact O-N 3.46Å; T151-Q154 WeakPolarHBondContact O-CB 3.35Å; T151-Q154 PolarHBondContact O-N 2.91Å; T151-N155 WeakPolarHBondContact O-CB 3.4Å; T151-N155 VanDerWaalsContact O-CG 3.23Å; T151-N155 PolarHBondContact O-N 3.34Å; T151-N155 PolarHBondContact O-ND2 3.36Å
152W98.5Very high98.1Very high33 Ų3372.6 Ų72.613%0.12536%0.36CS..Hα-helixtrans-62.8-47.7177-170.699.3000111.4F112 L120 E121 F124 Q148 V149 Q154 N155 R156F112-W152 AromaticContact CD2-CD1 3.8Å; F112-W152 HydrophobicContact CE2-CB 4.37Å; F112-W152 AromaticContact CE2-CD1 3.67Å; F112-W152 HydrophobicContact CE2-CG 4.38Å; L120-W152 HydrophobicContact CB-CD2 3.92Å; L120-W152 HydrophobicContact CB-CE3 3.84Å; L120-W152 HydrophobicContact CB-CH2 3.65Å; L120-W152 HydrophobicContact CB-CZ2 3.69Å; L120-W152 HydrophobicContact CB-CZ3 3.72Å; L120-W152 HydrophobicContact CD1-CB 4.42Å; L120-W152 HydrophobicContact CD1-CD2 3.78Å; L120-W152 HydrophobicContact CD1-CE3 4.39Å; L120-W152 HydrophobicContact CD1-CG 3.76Å; L120-W152 HydrophobicContact CD2-CD2 4.38Å; L120-W152 HydrophobicContact CD2-CE3 4.22Å; L120-W152 HydrophobicContact CG-CD2 4.24Å; L120-W152 HydrophobicContact CG-CE3 4.37Å; E121-W152 HydrophobicContact CB-CH2 4.43Å; E121-W152 WeakPolarHBondContact OE2-CH2 3.36Å; F124-W152 HydrophobicContact CB-CH2 4.36Å; F124-W152 HydrophobicContact CB-CZ3 4.1Å; F124-W152 HydrophobicContact CD2-CZ3 4.48Å; F124-W152 HydrophobicContact CG-CZ3 4.43Å; Q148-W152 WeakPolarHBondContact O-CB 3.5Å; Q148-W152 PolarHBondContact O-N 2.94Å; V149-W152 PolarHBondContact O-N 3.25Å; W152-Q154 VanDerWaalsContact C-N 3.32Å; W152-Q154 PolarHBondContact O-N 2.97Å; W152-N155 PolarHBondContact O-N 3.19Å; W152-N155 VanDerWaalsContact O-N 3.15Å; W152-R156 HydrophobicContact CD2-CB 4.48Å; W152-R156 HydrophobicContact CE3-CB 3.97Å; W152-R156 HydrophobicContact CH2-CB 4.03Å; W152-R156 HydrophobicContact CH2-CG 3.72Å; W152-R156 HydrophobicContact CZ2-CG 4.45Å; W152-R156 HydrophobicContact CZ3-CB 3.72Å; W152-R156 HydrophobicContact CZ3-CG 3.76Å; W152-R156 WeakPolarHBondContact O-CB 3.48Å; W152-R156 PolarHBondContact O-N 3.35Å
153F98.8Very high97.9Very high9 Ų975.2 Ų75.24%0.03937%0.372CS..Hα-helixtrans-62.8-35.9176.8-91.6-103.7000112.7L120 R123 F124 Q127 L130 L138 V149 K150 R157L120-F153 HydrophobicContact CD2-CE2 4Å; R123-F153 HydrophobicContact CB-CZ 4.42Å; R123-F153 HydrophobicContact CG-CZ 4.31Å; F124-F153 HydrophobicContact CB-CE1 4.22Å; F124-F153 HydrophobicContact CB-CZ 4.32Å; F124-F153 AromaticContact CD2-CD1 3.85Å; F124-F153 HydrophobicContact CD2-CD1 3.85Å; F124-F153 AromaticContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CD2-CE1 3.8Å; F124-F153 HydrophobicContact CE2-CD1 4.49Å; Q127-F153 WeakPolarHBondContact O-CE1 3.44Å; L130-F153 HydrophobicContact CD1-CD1 4.18Å; L130-F153 HydrophobicContact CD1-CD2 4.02Å; L130-F153 HydrophobicContact CD1-CE1 3.76Å; L130-F153 HydrophobicContact CD1-CE2 3.59Å; L130-F153 HydrophobicContact CD1-CG 4.31Å; L130-F153 HydrophobicContact CD1-CZ 3.46Å; L130-F153 VanDerWaalsContact CD1-CZ 3.46Å; L130-F153 HydrophobicContact CD2-CE1 4.07Å; L130-F153 HydrophobicContact CD2-CZ 4.23Å; L130-F153 HydrophobicContact CG-CD1 3.97Å; L130-F153 HydrophobicContact CG-CE1 3.59Å; L130-F153 HydrophobicContact CG-CE2 4.35Å; L130-F153 HydrophobicContact CG-CZ 3.82Å; L138-F153 HydrophobicContact CD2-CE2 3.67Å; L138-F153 HydrophobicContact CD2-CZ 4Å; V149-F153 HydrophobicContact CG1-CD2 3.84Å; V149-F153 HydrophobicContact CG1-CE2 3.99Å; V149-F153 WeakPolarHBondContact O-CD2 3.46Å; V149-F153 PolarHBondContact O-N 3.46Å; K150-F153 PolarHBondContact O-N 3.34Å; F153-R157 WeakPolarHBondContact O-CG 3.07Å; F153-R157 PolarHBondContact O-N 3.4Å; F153-R157 VanDerWaalsContact O-N 3.09Å; F153-R157 PolarHBondContact O-NE 2.65Å
154Q98.7Very high97.6Very high87 Ų8775.2 Ų75.241%0.40736%0.363SS..Hα-helixtrans-60.6-52.1171.8-169.182.940.500110.7K150 T151 W152 R156 R157 M158K150-Q154 WeakPolarHBondContact O-CB 3.19Å; K150-Q154 PolarHBondContact O-N 3.36Å; T151-Q154 WeakPolarHBondContact O-CB 3.35Å; T151-Q154 PolarHBondContact O-N 2.91Å; W152-Q154 VanDerWaalsContact C-N 3.32Å; W152-Q154 PolarHBondContact O-N 2.97Å; Q154-R156 VanDerWaalsContact C-N 3.34Å; Q154-R156 PolarHBondContact O-N 3.24Å; Q154-R157 PolarHBondContact O-N 3.21Å; Q154-M158 WeakPolarHBondContact O-CG 2.91Å; Q154-M158 PolarHBondContact O-N 2.5Å; Q154-M158 VanDerWaalsContact O-N 3.15Å
155N98.4Very high97.3Very high100 Ų10082.8 Ų82.854%0.53539%0.39SS..Hα-helixtrans-63.1-41.1-179.3-68.9-18.7000111.7T151 W152 M158 K159T151-N155 WeakPolarHBondContact O-CB 3.4Å; T151-N155 VanDerWaalsContact O-CG 3.23Å; T151-N155 PolarHBondContact O-N 3.34Å; T151-N155 PolarHBondContact O-ND2 3.36Å; W152-N155 PolarHBondContact O-N 3.19Å; W152-N155 VanDerWaalsContact O-N 3.15Å; N155-M158 PolarHBondContact O-N 3.3Å; N155-K159 PolarHBondContact O-N 3.34Å
156R98.6Very high96.7Very high38 Ų3887 Ų8714%0.14340%0.402CS..Hα-helixtrans-63.1-44179.8-175.164.6-171.399.6-4.1112E121 F124 W152 Q154 M158 K159 H160E121-R156 VanDerWaalsContact CD-NE 3.29Å; E121-R156 IonicContact OE1-CZ 3.85Å; E121-R156 IonicContact OE1-NE 2.91Å; E121-R156 PolarHBondContact OE1-NE 2.86Å; E121-R156 IonicContact OE1-NH2 3.97Å; E121-R156 PolarHBondContact OE1-NH2 3.32Å; E121-R156 WeakPolarHBondContact OE2-CD 3.47Å; E121-R156 IonicContact OE2-CZ 2.97Å; E121-R156 IonicContact OE2-NE 2.68Å; E121-R156 PolarHBondContact OE2-NE 3.07Å; E121-R156 IonicContact OE2-NH2 3.17Å; F124-R156 HydrophobicContact CD1-CG 3.66Å; F124-R156 HydrophobicContact CD2-CB 4.26Å; F124-R156 HydrophobicContact CD2-CG 3.69Å; F124-R156 HydrophobicContact CE1-CG 3.65Å; F124-R156 HydrophobicContact CE2-CB 4.14Å; F124-R156 HydrophobicContact CE2-CG 3.69Å; F124-R156 HydrophobicContact CG-CG 3.68Å; F124-R156 HydrophobicContact CZ-CB 4.43Å; F124-R156 HydrophobicContact CZ-CG 3.67Å; W152-R156 HydrophobicContact CD2-CB 4.48Å; W152-R156 HydrophobicContact CE3-CB 3.97Å; W152-R156 HydrophobicContact CH2-CB 4.03Å; W152-R156 HydrophobicContact CH2-CG 3.72Å; W152-R156 HydrophobicContact CZ2-CG 4.45Å; W152-R156 HydrophobicContact CZ3-CB 3.72Å; W152-R156 HydrophobicContact CZ3-CG 3.76Å; W152-R156 WeakPolarHBondContact O-CB 3.48Å; W152-R156 PolarHBondContact O-N 3.35Å; Q154-R156 VanDerWaalsContact C-N 3.34Å; Q154-R156 PolarHBondContact O-N 3.24Å; R156-M158 PolarHBondContact O-N 3.38Å; R156-K159 PolarHBondContact O-N 3.44Å; R156-H160 WeakPolarHBondContact O-CB 3.34Å; R156-H160 PolarHBondContact O-N 2.93Å
157R98.6Very high95.9Very high60 Ų6086.9 Ų86.923%0.22641%0.407CS..Hα-helixtrans-60.6-42.2173.5-74.4-178.2-70.8154.8-0.5112.2F124 R128 Y129 F153 Q154 K159 H160 K161F124-R157 HydrophobicContact CE2-CG 3.72Å; F124-R157 HydrophobicContact CZ-CG 4.11Å; R128-R157 WeakPolarHBondContact O-CD 3.38Å; Y129-R157 VanDerWaalsContact CD1-NH1 3.27Å; F153-R157 WeakPolarHBondContact O-CG 3.07Å; F153-R157 PolarHBondContact O-N 3.4Å; F153-R157 VanDerWaalsContact O-N 3.09Å; F153-R157 PolarHBondContact O-NE 2.65Å; Q154-R157 PolarHBondContact O-N 3.21Å; R157-K159 VanDerWaalsContact C-N 3.34Å; R157-K159 PolarHBondContact O-N 3.44Å; R157-H160 PolarHBondContact O-N 2.8Å; R157-K161 WeakPolarHBondContact O-CB 3.26Å; R157-K161 PolarHBondContact O-N 2.87Å
158M98.4Very high94.7Very high97 Ų9788.7 Ų88.748%0.47841%0.408SS..Hα-helixtrans-62.5-42.3177.2-66-57.4-70.400111.9Q154 N155 R156 K162Q154-M158 WeakPolarHBondContact O-CG 2.91Å; Q154-M158 PolarHBondContact O-N 2.5Å; Q154-M158 VanDerWaalsContact O-N 3.15Å; N155-M158 PolarHBondContact O-N 3.3Å; R156-M158 PolarHBondContact O-N 3.38Å; M158-K162 PolarHBondContact O-N 3.04Å; M158-K162 VanDerWaalsContact O-N 3.07Å
159K97.7Very high93.3Very high127 Ų12791.6 Ų91.655%0.55243%0.426SS*.Hα-helixtrans-62.3-47.2174.3-174.6-177.9178.2-172.80111.5N155 R156 R157 K161 K162 Q163N155-K159 PolarHBondContact O-N 3.34Å; R156-K159 PolarHBondContact O-N 3.44Å; R157-K159 VanDerWaalsContact C-N 3.34Å; R157-K159 PolarHBondContact O-N 3.44Å; K159-K161 PolarHBondContact O-N 3.04Å; K159-K162 WeakPolarHBondContact O-CB 3.45Å; K159-K162 PolarHBondContact O-N 3.14Å; K159-K162 VanDerWaalsContact O-N 3.12Å; K159-Q163 WeakPolarHBondContact O-CG 2.94Å; K159-Q163 PolarHBondContact O-N 2.83Å
160H97.1Very high91.5Very high57 Ų5796.9 Ų96.926%0.26445%0.454SS..Hα-helixtrans-59.6-45.8179-177.9-137.9000111.7F124 R128 R156 R157 K162 Q163 L164F124-H160 HydrophobicContact CE1-CB 4.43Å; F124-H160 HydrophobicContact CZ-CB 4.32Å; R128-H160 PolarHBondContact NE-CE1 3.09Å; R156-H160 WeakPolarHBondContact O-CB 3.34Å; R156-H160 PolarHBondContact O-N 2.93Å; R157-H160 PolarHBondContact O-N 2.8Å; H160-K162 VanDerWaalsContact C-N 3.3Å; H160-K162 PolarHBondContact O-N 2.88Å; H160-Q163 WeakPolarHBondContact O-CB 3.4Å; H160-Q163 PolarHBondContact O-N 2.97Å; H160-L164 PolarHBondContact O-N 2.85Å
161K96.9Very high89.5Confident122 Ų12299 Ų9953%0.5347%0.466SS..Hα-helixtrans-58.9-40.3174.2-175.9176.666.8176.10112.3R157 K159 R165R157-K161 WeakPolarHBondContact O-CB 3.26Å; R157-K161 PolarHBondContact O-N 2.87Å; K159-K161 PolarHBondContact O-N 3.04Å; K161-R165 WeakPolarHBondContact O-CG 3.45Å; K161-R165 PolarHBondContact O-N 2.82Å
162K95.8Very high87.5Confident164 Ų164104 Ų10471%0.71348%0.481SS*.Hα-helixtrans-67-39.2177.7-174.7176.6-179.8-178.10111.9M158 K159 H160 R165 K166M158-K162 PolarHBondContact O-N 3.04Å; M158-K162 VanDerWaalsContact O-N 3.07Å; K159-K162 WeakPolarHBondContact O-CB 3.45Å; K159-K162 PolarHBondContact O-N 3.14Å; K159-K162 VanDerWaalsContact O-N 3.12Å; H160-K162 VanDerWaalsContact C-N 3.3Å; H160-K162 PolarHBondContact O-N 2.88Å; K162-R165 PolarHBondContact O-N 2.91Å; K162-K166 PolarHBondContact O-N 2.96Å
163Q94.1Very high85Confident83 Ų83109.1 Ų109.139%0.38851%0.511SS..Hα-helixtrans-62.1-46.5177-72.5168.8-30.300111.1K159 H160 R165 K166 T167K159-Q163 WeakPolarHBondContact O-CG 2.94Å; K159-Q163 PolarHBondContact O-N 2.83Å; H160-Q163 WeakPolarHBondContact O-CB 3.4Å; H160-Q163 PolarHBondContact O-N 2.97Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.21Å; Q163-K166 PolarHBondContact O-N 3.06Å; Q163-K166 VanDerWaalsContact O-N 3.11Å; Q163-T167 PolarHBondContact O-N 3.5Å; Q163-T167 PolarHBondContact O-OG1 3.09Å
164L92Very high82.8Confident108 Ų108114 Ų11457%0.56554%0.544SS*.Hα-helixtrans-61.7-35.5-179-166.364.6000113.3H160H160-L164 PolarHBondContact O-N 2.85Å
165R90.3Very high80.3Confident180 Ų180116.7 Ų116.768%0.67956%0.561SS**Hα-helixtrans-69.1-38.3175.6-67.3-178.772.7-157.92.4112.5K161 K162 Q163 Q168K161-R165 WeakPolarHBondContact O-CG 3.45Å; K161-R165 PolarHBondContact O-N 2.82Å; K162-R165 PolarHBondContact O-N 2.91Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.21Å; R165-Q168 PolarHBondContact O-N 3.1Å
166K86.8Confident78.1Confident142 Ų142119.6 Ų119.662%0.61758%0.576SS**Hα-helixtrans-65.3-41.1-179.8-175.7171.8175.5178.70111.3K162 Q163 Q168 D169 D170K162-K166 PolarHBondContact O-N 2.96Å; Q163-K166 PolarHBondContact O-N 3.06Å; Q163-K166 VanDerWaalsContact O-N 3.11Å; K166-Q168 VanDerWaalsContact C-N 3.25Å; K166-Q168 PolarHBondContact O-N 3.32Å; K166-D169 PolarHBondContact O-N 2.88Å; K166-D170 PolarHBondContact O-N 3.17Å
167T80.8Confident76.1Confident79 Ų79125.8 Ų125.849%0.48561%0.611SS.*Hα-helixtrans-63.8-28.7178.7-50.50000113.1Q163Q163-T167 PolarHBondContact O-N 3.5Å; Q163-T167 PolarHBondContact O-OG1 3.09Å
168Q74.6Confident73.6Confident135 Ų135130.5 Ų130.563%0.63164%0.64SS**Hα-helixtrans-73-30.9175.6-76-171.3-2.400113.6R165 K166R165-Q168 PolarHBondContact O-N 3.1Å; K166-Q168 VanDerWaalsContact C-N 3.25Å; K166-Q168 PolarHBondContact O-N 3.32Å
169D67Low71.2Confident117 Ų117137.5 Ų137.563%0.62666%0.661SS**Hα-helixtrans-74.7-32.4179.3-67.3-31.9000111.3K166K166-D169 PolarHBondContact O-N 2.88Å
170D61.3Low68.7Low112 Ų112136.9 Ų136.960%0.59967%0.673SS**Hα-helixtrans-74.8-22.9179.6-66-32.7000113K166 K172K166-D170 PolarHBondContact O-N 3.17Å; D170-K172 VanDerWaalsContact C-N 3.33Å; D170-K172 PolarHBondContact O-N 2.86Å
171Q57.5Low66.3Low157 Ų157143.2 Ų143.273%0.73471%0.705SS**THydrogen-bonded Turntrans-80.5-4.1178.5-76-171.43.300114.9
172K56Low63.6Low177 Ų177146.9 Ų146.977%0.7772%0.724SS**THydrogen-bonded Turntrans-90.1-1.3178.6-94.5-176.3177.5-179.10115.4D170D170-K172 VanDerWaalsContact C-N 3.33Å; D170-K172 PolarHBondContact O-N 2.86Å
173N46.8Very low60.6Low140 Ų140146.7 Ų146.775%0.74973%0.731SS**  trans-130.682.6176.6-73.3-37.7000111.7N175N173-N175 VanDerWaalsContact C-N 3.32Å; N173-N175 PolarHBondContact O-N 2.97Å
174P51.6Low58Low112 Ų112148 Ų14873%0.72775%0.749SS**  trans-85.212.717733.3-33.2000115
175N46.7Very low55.4Low144 Ų144147.9 Ų147.977%0.7776%0.757SS**SBendtrans-110.87.3-165.4-80.4-15.8000118.3N173N173-N175 VanDerWaalsContact C-N 3.32Å; N173-N175 PolarHBondContact O-N 2.97Å
176D51.6Low53Low160 Ų160148.7 Ų148.786%0.85677%0.769SS**  trans-137.755.1179.6-75-54.3000113.6
177I57.6Low50.8Low169 Ų169147.8 Ų147.887%0.86778%0.78SS**  trans-127.663165.1-41.2-177.8000110.2
178D44.8Very low48.9Very low158 Ų158152.1 Ų152.185%0.84580%0.795SS**  trans-143.871.9158.9-171.324.7000110.2
179R48.5Very low47.5Very low244 Ų244152.5 Ų152.592%0.92180%0.801SS**SBendtrans-164.234.7162.7-135.4-177.6-178.2-166-0.3118.6
180S44.3Very low45.9Very low114 Ų114154.4 Ų154.480%0.79781%0.811SS**SBendtrans-158.365.1173.552.30000113.9
181M46.4Very low45.1Very low191 Ų191156.4 Ų156.494%0.94182%0.817SS**  trans-155.148.8156.6-146.8130.516600113
182E40.7Very low44.3Very low198 Ų198158.1 Ų158.193%0.92582%0.822SS**  trans-12390.8162.6-79.4-170.4161.200108.7
183N33.1Very low43.4Very low161 Ų161156.5 Ų156.586%0.86182%0.822SS**  trans-174.992.8143.2-156.164.4000110
184S38.7Very low42.9Very low109 Ų109155.7 Ų155.776%0.76282%0.822SS**  trans-172.694139.4-163.70000110.6
185S38.2Very low42.4Very low106 Ų106157.2 Ų157.274%0.74182%0.824SS**  trans35.6109.3136.8-51.20000120.4
186E39.3Very low42.4Very low198 Ų198157.5 Ų157.593%0.92583%0.825SS**  trans-2.9130.3141.2-57.6179.513000119.2
187S41.4Very low42.3Very low123 Ų123156.4 Ų156.486%0.8682%0.824SS**  -152.5108.913046.90000110.9
188E41.3Very low41.7Very low169 Ų169155 Ų15579%0.7982%0.818SS**  trans-44.6152.1154.7-88.9-171.3126.700112.4
189L43.8Very low41.6Very low144 Ų144152.1 Ų152.175%0.75481%0.811SS**  cis-163.515110.7-88.1146.4000106.3
190N33.9Very low41.5Very low156 Ų156144.1 Ų144.183%0.83480%0.804SS**  -176.7134.5117.6-15010.3000112.5
191E43.9Very low41.8Very low154 Ų154146.3 Ų146.372%0.7281%0.805SS**  trans-62.1148.3-179.6-69.3166.863.400114.9
192K41.1Very low41.9Very low193 Ų193144.2 Ų144.284%0.83980%0.798SS**  -177.8134.1104.1-98.3170.8179.8176.60113.7
193N36.8Very low42.6Very low144 Ų144140.8 Ų140.877%0.7779%0.793SS**  trans-20.6140.7165.1-66.8-45.8000118.2
194T38.2Very low43.4Very low122 Ų122139.3 Ų139.375%0.74879%0.785SS**  -169.7122.8107.7430000110.8
195D40.3Very low43.5Very low145 Ų145139.6 Ų139.678%0.77579%0.787SS**  trans54.4101135.1-47.9-44.3000121.3
196D47.3Very low43.8Very low149 Ų149143.9 Ų143.980%0.79779%0.788SS**  18.8105.4124.7-143.7-49000118.1
197V47.8Very low44.4Very low138 Ų138142 Ų14284%0.83678%0.782SS**  trans-149.9108.1136.2-173.10000110
198N46.3Very low45Very low138 Ų138144.5 Ų144.574%0.73878%0.784SS**  trans-54.8125158172.329000112.3
199S41.4Very low45.6Very low99 Ų99144.6 Ų144.669%0.69279%0.785SS**  trans-169.9113.2143.3-81.10000110.6
200G47.1Very low46Very low76 Ų76146 Ų14678%0.78479%0.787SS**  trans-65.1138.6165.900000111
201I49.8Very low46.5Very low160 Ų160145.5 Ų145.582%0.82179%0.785SS**  trans-135.2113.2167.9-61.9-179.6000107.6
202D49.7Very low47.1Very low146 Ų146146.1 Ų146.178%0.78179%0.787SS**  trans-53.3142.5166.8-110.9-62.6000111.9D204D202-D204 PolarHBondContact O-N 3.08Å
203P55Low47.8Very low126 Ų126143.7 Ų143.782%0.81878%0.784SS**SBendtrans-94.869174.537.4-29.4000110.3
204D49.8Very low48.9Very low130 Ų130144 Ų14470%0.69579%0.785SS**  trans-159.294.5164.1-147.78.5000112D202D202-D204 PolarHBondContact O-N 3.08Å
205S40.9Very low49.9Very low115 Ų115144 Ų14480%0.80479%0.785SS**  trans-159.880.1160.9-159.70000109.8
206Y44.3Very low50.6Low196 Ų196144.2 Ų144.277%0.76979%0.786SS**  trans-83.4106.5158.774.2-77.1000106.9
207M52.2Low50.9Low160 Ų160144.8 Ų144.879%0.78879%0.788SS**  trans-135.787.1161.1-74.5-66.8179.300105.6E209M207-E209 PolarHBondContact O-N 3.35Å
208L53.9Low51.2Low175 Ų175145.8 Ų145.892%0.91678%0.783SS**  trans-79.7101158.4-82.7170.7000105.4E210L208-E210 PolarHBondContact O-N 3.24Å
209E54.4Low51.4Low171 Ų171146 Ų14680%0.79978%0.784SS**  trans-63121.5160.7-69.9-145.6158.800108.2M207 N211M207-E209 PolarHBondContact O-N 3.35Å; E209-N211 PolarHBondContact O-N 3.41Å
210E52.7Low52.1Low173 Ų173148.4 Ų148.481%0.80879%0.789SS**  trans-62.6118.6165.1-74.7174.2138.200107.5L208 E212L208-E210 PolarHBondContact O-N 3.24Å; E210-E212 PolarHBondContact O-N 2.84Å
211N44.5Very low52.3Low146 Ų146152.1 Ų152.178%0.78179%0.79SS**  trans-74.7100.7163.8-69.4-90.4000106.2E209 D213E209-N211 PolarHBondContact O-N 3.41Å; N211-D213 VanDerWaalsContact C-N 3.35Å; N211-D213 PolarHBondContact O-N 3.34Å
212E55Low52.2Low166 Ų166149.5 Ų149.578%0.77679%0.785SS**  trans-79.983.6165-63.1-173.7143.100108.3E210 D214E210-E212 PolarHBondContact O-N 2.84Å; E212-D214 PolarHBondContact O-N 3.22Å
213D55.9Low52.7Low143 Ų143148.1 Ų148.177%0.76579%0.786SS**  trans-90.689.9161.3-73.7-50.1000108.1N211 V215N211-D213 VanDerWaalsContact C-N 3.35Å; N211-D213 PolarHBondContact O-N 3.34Å; D213-V215 PolarHBondContact O-N 3.13Å; D213-V215 VanDerWaalsContact O-N 3.16Å
214D60Low53Low149 Ų149147.2 Ų147.280%0.79778%0.78SS**  trans-56.8107.2160.8-89-48000109.1E212E212-D214 PolarHBondContact O-N 3.22Å
215V59.7Low53.3Low124 Ų124149.4 Ų149.475%0.75279%0.787SS**  trans-92.894.3161.9-83.50000108.7D213 I217D213-V215 PolarHBondContact O-N 3.13Å; D213-V215 VanDerWaalsContact O-N 3.16Å; V215-I217 PolarHBondContact O-N 3.31Å; V215-I217 VanDerWaalsContact O-N 3.14Å
216D54.8Low54Low148 Ų148155 Ų15579%0.79179%0.79SS**  trans-54110.6159.2-90-34.3000109.1
217I54.8Low54.6Low162 Ų162150.7 Ų150.783%0.83179%0.788SS**  trans-109.477.3160-61.9172.1000105.8V215V215-I217 PolarHBondContact O-N 3.31Å; V215-I217 VanDerWaalsContact O-N 3.14Å
218E53.2Low54.5Low158 Ų158155 Ų15574%0.73881%0.813SS**  trans-92.8155.2155-68.3-139.5137.100110
219D50.8Low54.5Low143 Ų143154 Ų15477%0.76581%0.808SS**  trans94.784.3164-60.3-47.1000119.8
220D55.5Low54.6Low149 Ų149153.1 Ų153.180%0.79781%0.809SS**  61.3157.4107.7-130-27000121.1
221I52.2Low54.7Low154 Ų154152 Ų15279%0.7981%0.809SS**  trans85.6116.3171.8-66153.6000114.2
222C48Very low55.3Low106 Ų106152.4 Ų152.472%0.71681%0.81SS**  cis-162.9132.532-159.50000109.8
223S58.3Low55.3Low117 Ų117151.5 Ų151.582%0.81881%0.813SS**  trans-70.4143.3150.7-730000108.7
224P61.2Low55.2Low107 Ų107152.1 Ų152.170%0.69582%0.816SS**  -137.7146.4120.833.2-19.4000114.3
225E57.9Low54.9Low176 Ų176152.3 Ų152.382%0.82282%0.817SS**  trans70.8107.1147.4-85.7-168.5116.500121.2
226R55.5Low54.5Low232 Ų232154.5 Ų154.588%0.87582%0.822SS**  -29.4136.2129.9-66.5175.5176.9-134.4-2.3112.3
227S56Low54.5Low105 Ų105155 Ų15573%0.73483%0.825SS**  trans-158.7112.2134-86.80000110.3
228L50.6Low54.5Low251 Ų251154.4 Ų154.4100%1.31482%0.824SS**  trans48.60151.8-68.4158.9000119.6

Retrieved 228 of 228 residues in 289.2 ms (Link to these results)