A0A087Y405_POEFO Loading...

Enkurin domain containing 1

AlphaFold DB , UniProt , Accession A0A087Y405, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 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
1M38Very low51.9Low234 Ų234133.5 Ų133.5100%1.15383%0.827SS**  0850-63.6-61.5162.800107.2
2C43.3Very low52.8Low129 Ų129135.8 Ų135.887%0.87283%0.827SS**  trans-113.4105.4178.6-70.60000106.5
3E50.2Low53.8Low196 Ų196132.2 Ų132.292%0.91681%0.808SS**  trans-132.9102178.2-72.3-89.6157.200106.6
4G53.5Low54.9Low59 Ų59127.4 Ų127.461%0.60878%0.781SS**  trans-142129.7169.700000107.8S6G4-S6 PolarHBondContact O-N 3.5Å
5P50.5Low55.8Low131 Ų131124.7 Ų124.785%0.85176%0.76SS**  trans-71.8128.7-17127.5-32.1000110.9T7P5-T7 PolarHBondContact O-N 2.72Å
6S48.1Very low56.4Low115 Ų115122 Ų12280%0.80475%0.745SS**  trans-78.3114.8176.5-59.90000110G4 I8G4-S6 PolarHBondContact O-N 3.5Å; S6-I8 VanDerWaalsContact C-N 3.33Å; S6-I8 PolarHBondContact O-N 3.11Å; S6-I8 VanDerWaalsContact O-N 3.09Å
7T53.7Low57.2Low143 Ų143119.6 Ų119.688%0.87774%0.735SS**THydrogen-bonded Turntrans-83.670.5175.548.60000111.3P5P5-T7 PolarHBondContact O-N 2.72Å
8I54.9Low57.7Low163 Ų163120.4 Ų120.484%0.83673%0.733SS**THydrogen-bonded Turntrans-124.6-4.5173.3-97.9170.9000114.7S6 G10S6-I8 VanDerWaalsContact C-N 3.33Å; S6-I8 PolarHBondContact O-N 3.11Å; S6-I8 VanDerWaalsContact O-N 3.09Å; I8-G10 PolarHBondContact O-N 3Å
9S46.2Very low57.9Low120 Ų120118.1 Ų118.184%0.83972%0.716SS**  trans-92.599.9178.7-1620000112
10G64.1Low58.2Low50 Ų50116.2 Ų116.252%0.51571%0.706SS.*PPolyproline II helixtrans-73.4167.1154.400000111I8I8-G10 PolarHBondContact O-N 3Å
11P68.3Low58.5Low128 Ų128117.3 Ų117.383%0.83170%0.703SS**PPolyproline II helixtrans-61.1143.1176.325.6-32.7000110.9
12I63.1Low59.8Low161 Ų161115.2 Ų115.283%0.82668%0.684SS**PPolyproline II helixtrans-57.3123.5175.6-61.2170.4000107.7
13P65.3Low60.8Low89 Ų89114.2 Ų114.258%0.57866%0.663SS**PPolyproline II helixtrans-67.2144.7-178.131.2-36.7000109.9Y23P13-Y23 WeakPolarHBondContact CB-OH 3.43Å
14P70Confident61.4Low65 Ų65111.2 Ų111.242%0.42265%0.646SS.*PPolyproline II helixtrans-64.9151-171.726.7-34.8000111.8L19 Y23P14-L19 HydrophobicContact CB-CD1 4.05Å; P14-L19 HydrophobicContact CG-CD1 4.04Å; P14-Y23 VanDerWaalsContact O-CE2 3.31Å; P14-Y23 WeakPolarHBondContact O-CE2 3.31Å; P14-Y23 PolarHBondContact O-OH 2.77Å
15D68.4Low61.7Low88 Ų88118 Ų11847%0.47165%0.654SS.*PPolyproline II helixtrans-55.3125.1-178.3-169.1-34.8000111S17 L18 L19D15-S17 PolarHBondContact O-N 3.23Å; D15-S17 VanDerWaalsContact O-N 3.11Å; D15-S17 WeakPolarHBondContact OD1-CB 3.45Å; D15-S17 PolarHBondContact OD1-N 3.06Å; D15-S17 PolarHBondContact OD1-OG 3.45Å; D15-S17 PolarHBondContact OD2-OG 3.18Å; D15-L18 HydrophobicContact CB-CD1 4.14Å; D15-L18 HydrophobicContact CB-CG 4.23Å; D15-L18 PolarHBondContact O-N 3.43Å; D15-L19 PolarHBondContact O-N 3.03Å
16P64.9Low62.1Low81 Ų81115.8 Ų115.853%0.52664%0.639SS.*THydrogen-bonded Turntrans-63.1-16.4-177.326.3-36.3000113.9Y23P16-Y23 HydrophobicContact CB-CD2 3.94Å; P16-Y23 HydrophobicContact CB-CE2 4.01Å
17S70.1Confident62.4Low82 Ų82114.7 Ų114.757%0.57364%0.637SS**THydrogen-bonded Turntrans-74.6-26.7173.963.10000113.3D15D15-S17 PolarHBondContact O-N 3.23Å; D15-S17 VanDerWaalsContact O-N 3.11Å; D15-S17 WeakPolarHBondContact OD1-CB 3.45Å; D15-S17 PolarHBondContact OD1-N 3.06Å; D15-S17 PolarHBondContact OD1-OG 3.45Å; D15-S17 PolarHBondContact OD2-OG 3.18Å
18L66.2Low62.7Low133 Ų133113.3 Ų113.370%0.69663%0.634SS**THydrogen-bonded Turntrans-94.2-27.3-174.6-61.5178.9000112.9D15D15-L18 HydrophobicContact CB-CD1 4.14Å; D15-L18 HydrophobicContact CB-CG 4.23Å; D15-L18 PolarHBondContact O-N 3.43Å
19L61.2Low62.6Low77 Ų77108.3 Ų108.340%0.40362%0.617SS.*  trans-133.772.4178.8-67.8173.5000112P14 D15 E21 Y22P14-L19 HydrophobicContact CB-CD1 4.05Å; P14-L19 HydrophobicContact CG-CD1 4.04Å; D15-L19 PolarHBondContact O-N 3.03Å; L19-E21 PolarHBondContact O-N 2.67Å; L19-E21 VanDerWaalsContact O-N 3.1Å; L19-Y22 HydrophobicContact CB-CD2 4.24Å; L19-Y22 HydrophobicContact CD1-CD2 4.24Å; L19-Y22 PolarHBondContact O-N 2.89Å
20P64.2Low62.9Low79 Ų79111 Ų11151%0.51361%0.608SS.*THydrogen-bonded Turntrans-60.4-26.8-177.1-2131.7000113.1Y23 K24P20-Y23 PolarHBondContact O-N 3.47Å; P20-K24 PolarHBondContact O-N 3.1Å
21E64.6Low62.4Low140 Ų140111.8 Ų111.865%0.65462%0.616SS**THydrogen-bonded Turntrans-73.6-30.5-175.3-55-143.2124.900113.7L19 Y23 K24L19-E21 PolarHBondContact O-N 2.67Å; L19-E21 VanDerWaalsContact O-N 3.1Å; E21-Y23 PolarHBondContact O-N 2.85Å; E21-K24 PolarHBondContact O-N 3.46Å; E21-K24 IonicContact OE1-NZ 3.13Å; E21-K24 PolarHBondContact OE1-NZ 3.29Å
22Y64.4Low61.8Low190 Ų190117.3 Ų117.375%0.74562%0.621SS**THydrogen-bonded Turntrans-69.2-23.8177.5-93.1-91.4000112.6L19L19-Y22 HydrophobicContact CB-CD2 4.24Å; L19-Y22 HydrophobicContact CD1-CD2 4.24Å; L19-Y22 PolarHBondContact O-N 2.89Å
23Y65.5Low61Low109 Ų109117.8 Ų117.843%0.42762%0.624SS.*THydrogen-bonded Turntrans-1045.7177.9-61.9-80.7000113.2P13 P14 P16 P20 E21 R25P13-Y23 WeakPolarHBondContact CB-OH 3.43Å; P14-Y23 VanDerWaalsContact O-CE2 3.31Å; P14-Y23 WeakPolarHBondContact O-CE2 3.31Å; P14-Y23 PolarHBondContact O-OH 2.77Å; P16-Y23 HydrophobicContact CB-CD2 3.94Å; P16-Y23 HydrophobicContact CB-CE2 4.01Å; P20-Y23 PolarHBondContact O-N 3.47Å; E21-Y23 PolarHBondContact O-N 2.85Å; Y23-R25 PolarHBondContact O-N 3.04Å
24K62.5Low60.3Low133 Ų133119.9 Ų119.958%0.57863%0.626SS**  trans-64.7110.5174-84.6177.5-174.1171.20109.4P20 E21P20-K24 PolarHBondContact O-N 3.1Å; E21-K24 PolarHBondContact O-N 3.46Å; E21-K24 IonicContact OE1-NZ 3.13Å; E21-K24 PolarHBondContact OE1-NZ 3.29Å
25R60.4Low59Low201 Ų201120.2 Ų120.276%0.75864%0.641SS**  trans-61.5123.8174.6-175.3176.4-68.9171.50109.4Y23 A29Y23-R25 PolarHBondContact O-N 3.04Å; R25-A29 HydrophobicContact CG-CB 3.92Å
26P57.8Low57.7Low84 Ų84124.4 Ų124.455%0.54566%0.658SS.*  trans-61.5141.818021.4-30.4000111S28 A29P26-S28 PolarHBondContact O-N 2.65Å; P26-A29 PolarHBondContact O-N 3.49Å
27A54.6Low56.8Low93 Ų93129.3 Ų129.377%0.76967%0.673SS**G310 helixtrans-57.8-19.9-174.700000114.1A29 R30A27-A29 VanDerWaalsContact C-N 3.28Å; A27-A29 PolarHBondContact O-N 3.13Å; A27-R30 PolarHBondContact O-N 3.26Å
28S60.7Low55.5Low114 Ų114134.6 Ų134.680%0.79769%0.686SS**G310 helixtrans-69-20.8174.253.50000114.1P26P26-S28 PolarHBondContact O-N 2.65Å
29A51.2Low54.3Low58 Ų58131.9 Ų131.948%0.47969%0.69SS.*G310 helixtrans-93.15.117900000113.3R25 P26 A27 G31R25-A29 HydrophobicContact CG-CB 3.92Å; P26-A29 PolarHBondContact O-N 3.49Å; A27-A29 VanDerWaalsContact C-N 3.28Å; A27-A29 PolarHBondContact O-N 3.13Å; A29-G31 PolarHBondContact O-N 3.44Å
30R54.3Low53.5Low177 Ų177133.4 Ų133.467%0.66871%0.707SS**  trans-87.126.7179.2-145.5-179.3-174.4168.34.4113A27 R32 E34A27-R30 PolarHBondContact O-N 3.26Å; R30-R32 PolarHBondContact O-N 2.98Å; R30-E34 IonicContact CZ-OE2 3.38Å; R30-E34 IonicContact NE-OE2 2.9Å; R30-E34 PolarHBondContact NE-OE2 3.29Å; R30-E34 IonicContact NH2-OE2 3.4Å; R30-E34 PolarHBondContact NH2-OE2 3.31Å
31G53.6Low52.5Low66 Ų66136.2 Ų136.268%0.6872%0.717SS**  trans-99.681.5-176.500000112.3A29A29-G31 PolarHBondContact O-N 3.44Å
32R54.1Low51.7Low244 Ų244134.3 Ų134.392%0.92173%0.725SS**SBendtrans178.8-14.3140.3-111.1-176.3170.5-172-3.2117.1R30R30-R32 PolarHBondContact O-N 2.98Å
33L46Very low51Low170 Ų170130.7 Ų130.789%0.8972%0.718SS**SBendtrans-131.63.8-167.9-77.7171000117.6
34E50.5Low50.4Low133 Ų133130.6 Ų130.662%0.62172%0.721SS**SBendtrans-121.8109.1171.5-71.4180169.200109.9R30 H36R30-E34 IonicContact CZ-OE2 3.38Å; R30-E34 IonicContact NE-OE2 2.9Å; R30-E34 PolarHBondContact NE-OE2 3.29Å; R30-E34 IonicContact NH2-OE2 3.4Å; R30-E34 PolarHBondContact NH2-OE2 3.31Å; E34-H36 PolarHBondContact O-N 3.36Å
35G44.3Very low50.1Low73 Ų73133.6 Ų133.675%0.75374%0.743SS**  trans-57.7132.4174.900000110.7Q37G35-Q37 VanDerWaalsContact C-N 3.34Å; G35-Q37 PolarHBondContact O-N 3.26Å
36H39.7Very low50.1Low176 Ų176126.1 Ų126.182%0.81573%0.728SS**  trans-68.889.4176.2-167.8-25.3000109.4E34 K38E34-H36 PolarHBondContact O-N 3.36Å; H36-K38 PolarHBondContact O-N 2.96Å
37Q46.4Very low50.3Low183 Ų183129 Ų12986%0.85575%0.747SS**  trans-77.498163.9-65.8-159.313.300108.3G35G35-Q37 VanDerWaalsContact C-N 3.34Å; G35-Q37 PolarHBondContact O-N 3.26Å
38K43.3Very low50.4Low194 Ų194131.8 Ų131.884%0.84375%0.748SS**  trans165.4107.6145.7-91.2165.5-173.1-171.60109.8H36H36-K38 PolarHBondContact O-N 2.96Å
39G40.8Very low50.3Low75 Ų75130.2 Ų130.277%0.77374%0.742SS**SBendtrans144.787.5170.300000111.2L41G39-L41 PolarHBondContact O-N 3.22Å
40S45Very low51Low110 Ų110129.2 Ų129.277%0.76973%0.731SS**  trans-8.7117.2164.1-1600000113.9
41L42.6Very low51.6Low138 Ų138124.6 Ų124.672%0.72372%0.72SS**  -151113.580.6-78162.6000110.8G39 L43G39-L41 PolarHBondContact O-N 3.22Å; L41-L43 PolarHBondContact O-N 3.15Å
42A47.5Very low52.3Low99 Ų99125.5 Ų125.582%0.81871%0.713SS**  trans-77.269.7162.200000109.7
43L50.8Low53Low114 Ų114119.5 Ų119.560%0.59770%0.703SS**  trans-157.5112.7164.5-63.4176.9000104.4L41L41-L43 PolarHBondContact O-N 3.15Å
44H52.7Low53.7Low107 Ų107117.3 Ų117.350%0.49569%0.692SS.*  -164.6105.156.5-65.187.6000108.8G46H44-G46 VanDerWaalsContact C-N 3.28Å; H44-G46 PolarHBondContact O-N 2.74Å
45L55.2Low54.1Low197 Ų197116.3 Ų116.3100%1.03168%0.683SS**  trans-85.869.5166.3-92.198.5000109.4
46G60.5Low55Low44 Ų44116.8 Ų116.845%0.45467%0.673SS.*SBendtrans-130.7152.3171.800000110.8H44 L48H44-G46 VanDerWaalsContact C-N 3.28Å; H44-G46 PolarHBondContact O-N 2.74Å; G46-L48 PolarHBondContact O-N 3.24Å; G46-L48 VanDerWaalsContact O-N 3.13Å
47P63.3Low55.7Low144 Ų144115.5 Ų115.594%0.93567%0.672SS**SBendtrans-70-3.117929.1-34.7000113.9
48L56.7Low56.3Low151 Ų151110.1 Ų110.179%0.79166%0.655SS**SBendtrans-108.9132.4-178.9-70.5168000110.6G46G46-L48 PolarHBondContact O-N 3.24Å; G46-L48 VanDerWaalsContact O-N 3.13Å
49A57.6Low57Low82 Ų82106.2 Ų106.268%0.67864%0.636SS**PPolyproline II helixtrans-72.4135.9178.900000110.2Y59A49-Y59 VanDerWaalsContact CB-OH 3.32Å; A49-Y59 WeakPolarHBondContact CB-OH 3.47Å
50P66.5Low57.7Low37 Ų37105.7 Ų105.724%0.2462%0.62CS.*PPolyproline II helixtrans-61.1150.6-179.719.8-29.4000113.4Y59P50-Y59 WeakPolarHBondContact CD-OH 3.48Å; P50-Y59 HydrophobicContact CG-CE2 4.04Å; P50-Y59 WeakPolarHBondContact CG-OH 3.4Å; P50-Y59 VanDerWaalsContact N-OH 3.15Å; P50-Y59 WeakPolarHBondContact O-CE2 3.16Å; P50-Y59 VanDerWaalsContact O-CZ 3.22Å; P50-Y59 PolarHBondContact O-OH 3.14Å
51D67.3Low58Low80 Ų80105.7 Ų105.743%0.42863%0.627SS.*PPolyproline II helixtrans-65.3124-177-175.1-14000111.5V53 L54 Y55D51-V53 PolarHBondContact O-N 3.18Å; D51-V53 PolarHBondContact OD1-N 3.34Å; D51-L54 HydrophobicContact CB-CD1 4.39Å; D51-L54 PolarHBondContact O-N 3.44Å; D51-Y55 PolarHBondContact O-N 3.46Å; D51-Y55 VanDerWaalsContact O-N 3.15Å
52P67.4Low58.3Low84 Ų84109.3 Ų109.355%0.54563%0.631SS.*THydrogen-bonded Turntrans-63.7-19.7-179.625.1-35.1000114.4Y59P52-Y59 HydrophobicContact CB-CD2 4.21Å
53V68.8Low58.5Low118 Ų118109 Ų10972%0.71562%0.623SS**THydrogen-bonded Turntrans-78-35178.4-177.60000111.4D51D51-V53 PolarHBondContact O-N 3.18Å; D51-V53 PolarHBondContact OD1-N 3.34Å
54L61.6Low58.6Low125 Ų125109.1 Ų109.165%0.65463%0.63SS**THydrogen-bonded Turntrans-88.8-23.6-177-65.2174.9000112.8D51D51-L54 HydrophobicContact CB-CD1 4.39Å; D51-L54 PolarHBondContact O-N 3.44Å
55Y58.9Low58.8Low112 Ų112109.8 Ų109.844%0.43965%0.647SS.*  trans-13470.5-178.6-66.9-84.9000113.5D51 D57 S58D51-Y55 PolarHBondContact O-N 3.46Å; D51-Y55 VanDerWaalsContact O-N 3.15Å; Y55-D57 VanDerWaalsContact C-N 3.27Å; Y55-D57 PolarHBondContact O-N 2.92Å; Y55-S58 WeakPolarHBondContact CB-OG 3.32Å; Y55-S58 WeakPolarHBondContact O-CB 3.12Å; Y55-S58 PolarHBondContact O-N 3.36Å; Y55-S58 PolarHBondContact O-OG 3.09Å
56P62.8Low58.9Low82 Ų82109.7 Ų109.753%0.53263%0.633SS.*Hα-helixtrans-60.3-33.7-177.1-2233.2000113.9S58 Y59 S60P56-S58 VanDerWaalsContact C-N 3.25Å; P56-S58 PolarHBondContact O-N 3.41Å; P56-Y59 PolarHBondContact O-N 3.13Å; P56-S60 PolarHBondContact O-N 3.38Å
57D54.8Low58.8Low149 Ų149118.6 Ų118.680%0.79765%0.653SS**Hα-helixtrans-71.6-19.9-177.2-66-28000113.3Y55 Y59Y55-D57 VanDerWaalsContact C-N 3.27Å; Y55-D57 PolarHBondContact O-N 2.92Å; D57-Y59 VanDerWaalsContact C-N 3.31Å
58S57.9Low58.8Low71 Ų71115.5 Ų115.550%0.49763%0.633SS.*Hα-helixtrans-76-22.8-179.9-49.10000112.7Y55 P56Y55-S58 WeakPolarHBondContact CB-OG 3.32Å; Y55-S58 WeakPolarHBondContact O-CB 3.12Å; Y55-S58 PolarHBondContact O-N 3.36Å; Y55-S58 PolarHBondContact O-OG 3.09Å; P56-S58 VanDerWaalsContact C-N 3.25Å; P56-S58 PolarHBondContact O-N 3.41Å
59Y57.7Low59.4Low111 Ų111119 Ų11944%0.43564%0.636SS.*Hα-helixtrans-110.9-5-176.4-69.8-82.3000113.1A49 P50 P52 P56 D57 A61A49-Y59 VanDerWaalsContact CB-OH 3.32Å; A49-Y59 WeakPolarHBondContact CB-OH 3.47Å; P50-Y59 WeakPolarHBondContact CD-OH 3.48Å; P50-Y59 HydrophobicContact CG-CE2 4.04Å; P50-Y59 WeakPolarHBondContact CG-OH 3.4Å; P50-Y59 VanDerWaalsContact N-OH 3.15Å; P50-Y59 WeakPolarHBondContact O-CE2 3.16Å; P50-Y59 VanDerWaalsContact O-CZ 3.22Å; P50-Y59 PolarHBondContact O-OH 3.14Å; P52-Y59 HydrophobicContact CB-CD2 4.21Å; P56-Y59 PolarHBondContact O-N 3.13Å; D57-Y59 VanDerWaalsContact C-N 3.31Å; Y59-A61 PolarHBondContact O-N 3.39Å; Y59-A61 VanDerWaalsContact O-N 3.13Å
60S57Low60.4Low65 Ų65117.7 Ų117.746%0.45562%0.619SS.*  trans-74.8103.7176.3-175.10000110.8P56 R62P56-S60 PolarHBondContact O-N 3.38Å; S60-R62 PolarHBondContact O-N 3.1Å; S60-R62 VanDerWaalsContact O-N 3.1Å; S60-R62 PolarHBondContact OG-N 3.33Å; S60-R62 PolarHBondContact OG-O 2.84Å
61A51.2Low61Low109 Ų109117.8 Ų117.890%0.90163%0.627SS**  trans-65.7-5169.200000113.2Y59Y59-A61 PolarHBondContact O-N 3.39Å; Y59-A61 VanDerWaalsContact O-N 3.13Å
62R48Very low61.6Low214 Ų214119.3 Ų119.381%0.80864%0.641SS**SBendtrans-98106.1175.2-62.4-175.4-147.1-128.43.4108.5S60S60-R62 PolarHBondContact O-N 3.1Å; S60-R62 VanDerWaalsContact O-N 3.1Å; S60-R62 PolarHBondContact OG-N 3.33Å; S60-R62 PolarHBondContact OG-O 2.84Å
63S51.1Low62.3Low94 Ų94122.2 Ų122.266%0.65765%0.652SS**  trans-51.5132.9163.555.80000109.4S65S63-S65 PolarHBondContact O-N 3.5Å
64P54.1Low62.9Low115 Ų115118.3 Ų118.375%0.74763%0.632SS**  trans-53.9138.6176.521.4-31.5000109.5R66P64-R66 PolarHBondContact O-N 3.39Å
65S56Low63.8Low121 Ų121115.6 Ų115.685%0.84662%0.621SS**  trans-55.1104.3-173.159.50000109.6S63 R67S63-S65 PolarHBondContact O-N 3.5Å; S65-R67 PolarHBondContact O-N 3.29Å
66R57.2Low65Low196 Ų196117.4 Ų117.474%0.7463%0.628SS**PPolyproline II helixtrans-66.1129.4176.8-72.9-174.3178-1144.6107.1P64P64-R66 PolarHBondContact O-N 3.39Å
67R58.5Low65.8Low230 Ų230118 Ų11887%0.86863%0.625SS**PPolyproline II helixtrans-49.3134.7171.3-67.9-170.3-179.6-147.30.9109S65 R69S65-R67 PolarHBondContact O-N 3.29Å; R67-R69 PolarHBondContact O-N 2.88Å
68P64Low67Low80 Ų80113.8 Ų113.852%0.51960%0.602SS.*PPolyproline II helixtrans-57.9127.7-179.523.6-32.3000108.7V70 L78P68-V70 VanDerWaalsContact C-N 3.26Å; P68-V70 HydrophobicContact CB-CG2 4.08Å; P68-V70 PolarHBondContact O-N 3.21Å; P68-L78 HydrophobicContact CG-CD1 4.11Å; P68-L78 HydrophobicContact CG-CD2 3.9Å
69R69.4Low68.1Low225 Ų225115.2 Ų115.285%0.84960%0.601SS**  trans-75.182.1-179.6-63.3-176.9-161.4175.95.3108.6R67R67-R69 PolarHBondContact O-N 2.88Å
70V79.1Confident69.2Low54 Ų54119.8 Ų119.833%0.32762%0.618SS.*  trans-106.7125.1178.9-177.80000108.2P68 A74 L78P68-V70 VanDerWaalsContact C-N 3.26Å; P68-V70 HydrophobicContact CB-CG2 4.08Å; P68-V70 PolarHBondContact O-N 3.21Å; V70-A74 HydrophobicContact CG1-CB 3.6Å; V70-A74 VanDerWaalsContact CG1-O 3.24Å; V70-A74 WeakPolarHBondContact CG1-O 3.24Å; V70-L78 HydrophobicContact CG1-CB 4.44Å; V70-L78 HydrophobicContact CG2-CB 4.32Å; V70-L78 HydrophobicContact CG2-CD1 4.44Å; V70-L78 HydrophobicContact CG2-CD2 4.01Å; V70-L78 HydrophobicContact CG2-CG 4.49Å
71G79.1Confident70Confident39 Ų39119 Ų11940%0.40262%0.62SS.*  trans-68.1160.5175.100000111.9N73 A74G71-N73 PolarHBondContact O-N 2.96Å; G71-N73 VanDerWaalsContact O-N 3.13Å; G71-A74 PolarHBondContact O-N 3.4Å
72P79.1Confident71.2Confident111 Ų111117.7 Ų117.772%0.72160%0.595SS**G310 helixtrans-55.7-35.8-173.917.9-29.6000113.6A74 T75P72-A74 VanDerWaalsContact C-N 3.3Å; P72-A74 PolarHBondContact O-N 2.94Å; P72-T75 WeakPolarHBondContact O-CG2 3.49Å; P72-T75 PolarHBondContact O-OG1 3.01Å
73N81.3Confident72.6Confident146 Ų146114.8 Ų114.878%0.78159%0.589SS**G310 helixtrans-78.9-7.5179.8-62.7-13.7000114.4G71 Y76G71-N73 PolarHBondContact O-N 2.96Å; G71-N73 VanDerWaalsContact O-N 3.13Å; N73-Y76 VanDerWaalsContact O-CD1 3.32Å; N73-Y76 WeakPolarHBondContact O-CD1 3.11Å; N73-Y76 WeakPolarHBondContact O-CE1 3.38Å
74A81.4Confident73.7Confident35 Ų35112.2 Ų112.229%0.28958%0.576SS.*G310 helixtrans-111.75.7-17700000112.9V70 G71 P72 Y76 I77 L78V70-A74 HydrophobicContact CG1-CB 3.6Å; V70-A74 VanDerWaalsContact CG1-O 3.24Å; V70-A74 WeakPolarHBondContact CG1-O 3.24Å; G71-A74 PolarHBondContact O-N 3.4Å; P72-A74 VanDerWaalsContact C-N 3.3Å; P72-A74 PolarHBondContact O-N 2.94Å; A74-Y76 VanDerWaalsContact C-N 3.3Å; A74-Y76 PolarHBondContact O-N 2.98Å; A74-I77 HydrophobicContact CB-CD1 4.46Å; A74-I77 WeakPolarHBondContact O-CB 3.35Å; A74-I77 PolarHBondContact O-N 3.16Å; A74-L78 PolarHBondContact O-N 3.39Å
75T81.6Confident74.7Confident69 Ų69112.6 Ų112.642%0.42358%0.577SS.*Hα-helixtrans-57.4-41.9177.249.10000111.9P72 I77 L78 E79P72-T75 WeakPolarHBondContact O-CG2 3.49Å; P72-T75 PolarHBondContact O-OG1 3.01Å; T75-I77 VanDerWaalsContact C-N 3.25Å; T75-I77 PolarHBondContact O-N 3.13Å; T75-L78 WeakPolarHBondContact O-CB 3.32Å; T75-L78 PolarHBondContact O-N 3.24Å; T75-L78 VanDerWaalsContact O-N 3.16Å; T75-E79 PolarHBondContact O-N 2.83Å
76Y82.6Confident75.3Confident150 Ų150112 Ų11259%0.58857%0.567SS**Hα-helixtrans-60.7-31.1178.581.3-88.2000113.5N73 A74 R80N73-Y76 VanDerWaalsContact O-CD1 3.32Å; N73-Y76 WeakPolarHBondContact O-CD1 3.11Å; N73-Y76 WeakPolarHBondContact O-CE1 3.38Å; A74-Y76 VanDerWaalsContact C-N 3.3Å; A74-Y76 PolarHBondContact O-N 2.98Å; Y76-R80 VanDerWaalsContact O-CB 3.29Å; Y76-R80 WeakPolarHBondContact O-CB 3.5Å; Y76-R80 PolarHBondContact O-N 3.4Å
77I80.8Confident76Confident94 Ų94102.8 Ų102.848%0.48253%0.534SS..Hα-helixtrans-72.7-42.5178.5-57.3175.4000109.9A74 T75 R80 G81A74-I77 HydrophobicContact CB-CD1 4.46Å; A74-I77 WeakPolarHBondContact O-CB 3.35Å; A74-I77 PolarHBondContact O-N 3.16Å; T75-I77 VanDerWaalsContact C-N 3.25Å; T75-I77 PolarHBondContact O-N 3.13Å; I77-R80 PolarHBondContact O-N 2.76Å; I77-G81 PolarHBondContact O-N 3.44Å
78L79.8Confident76.5Confident60 Ų6096 Ų9631%0.31452%0.515SS..Hα-helixtrans-62.6-47176.2-17968000110.7P68 V70 A74 T75 R80 G81 Q82P68-L78 HydrophobicContact CG-CD1 4.11Å; P68-L78 HydrophobicContact CG-CD2 3.9Å; V70-L78 HydrophobicContact CG1-CB 4.44Å; V70-L78 HydrophobicContact CG2-CB 4.32Å; V70-L78 HydrophobicContact CG2-CD1 4.44Å; V70-L78 HydrophobicContact CG2-CD2 4.01Å; V70-L78 HydrophobicContact CG2-CG 4.49Å; A74-L78 PolarHBondContact O-N 3.39Å; T75-L78 WeakPolarHBondContact O-CB 3.32Å; T75-L78 PolarHBondContact O-N 3.24Å; T75-L78 VanDerWaalsContact O-N 3.16Å; L78-R80 VanDerWaalsContact C-N 3.32Å; L78-R80 PolarHBondContact O-N 2.94Å; L78-G81 PolarHBondContact O-N 2.8Å; L78-G81 VanDerWaalsContact O-N 3.16Å; L78-Q82 WeakPolarHBondContact O-CG 3.21Å; L78-Q82 PolarHBondContact O-N 3.42Å
79E80.8Confident76.6Confident102 Ų10296.9 Ų96.948%0.47752%0.515SS..Hα-helixtrans-62-40.5178-73.2-169.3-169.600112.4T75 G81 Q82 K83T75-E79 PolarHBondContact O-N 2.83Å; E79-G81 VanDerWaalsContact C-N 3.29Å; E79-G81 PolarHBondContact O-N 3.18Å; E79-Q82 PolarHBondContact O-N 2.88Å; E79-K83 WeakPolarHBondContact O-CG 3.45Å; E79-K83 PolarHBondContact O-N 2.92Å; E79-K83 IonicContact OE2-NZ 2.97Å
80R81.3Confident76.5Confident207 Ų20792.5 Ų92.578%0.78151%0.507SS*.Hα-helixtrans-62.5-36.4175.1-175.8-179.7179-169.90.8112.2Y76 I77 L78Y76-R80 VanDerWaalsContact O-CB 3.29Å; Y76-R80 WeakPolarHBondContact O-CB 3.5Å; Y76-R80 PolarHBondContact O-N 3.4Å; I77-R80 PolarHBondContact O-N 2.76Å; L78-R80 VanDerWaalsContact C-N 3.32Å; L78-R80 PolarHBondContact O-N 2.94Å
81G73.9Confident75.8Confident49 Ų4997.5 Ų97.551%0.50552%0.52SS..Hα-helixtrans-75.4-26.4177.200000114I77 L78 E79I77-G81 PolarHBondContact O-N 3.44Å; L78-G81 PolarHBondContact O-N 2.8Å; L78-G81 VanDerWaalsContact O-N 3.16Å; E79-G81 VanDerWaalsContact C-N 3.29Å; E79-G81 PolarHBondContact O-N 3.18Å
82Q76.6Confident75Confident80 Ų80100.5 Ų100.537%0.37453%0.527SS..Hα-helixtrans-83.7-24.6177-72.1-177.5-1.600113.4L78 E79L78-Q82 WeakPolarHBondContact O-CG 3.21Å; L78-Q82 PolarHBondContact O-N 3.42Å; E79-Q82 PolarHBondContact O-N 2.88Å
83K77.4Confident74Confident154 Ų154103.1 Ų103.167%0.6754%0.535SS*.SBendtrans-88.2115.6179-72.1174.3179.6168.90110.5E79E79-K83 WeakPolarHBondContact O-CG 3.45Å; E79-K83 PolarHBondContact O-N 2.92Å; E79-K83 IonicContact OE2-NZ 2.97Å
84G74.7Confident72.9Confident39 Ų3999.6 Ų99.640%0.40253%0.533SS..SBendtrans128.4172.3173.600000113V86 G87 D88G84-V86 PolarHBondContact O-N 3.25Å; G84-V86 VanDerWaalsContact O-N 3.08Å; G84-G87 CarbonylContact O-C 3.58Å; G84-G87 WeakPolarHBondContact O-CA 3.25Å; G84-G87 PolarHBondContact O-N 3.01Å; G84-D88 PolarHBondContact O-N 3.29Å
85V74.9Confident71.3Confident124 Ų124104.3 Ų104.375%0.75255%0.552SS**Hα-helixtrans-52.2-38.9-172.9-178.20000113.1L89V85-L89 WeakPolarHBondContact O-CB 3.43Å; V85-L89 PolarHBondContact O-N 3.28Å
86V67Low69.6Low107 Ų107105.9 Ų105.965%0.64857%0.566SS**Hα-helixtrans-71.7-37.9177.3179.40000111.6G84 L89 L90G84-V86 PolarHBondContact O-N 3.25Å; G84-V86 VanDerWaalsContact O-N 3.08Å; V86-L89 WeakPolarHBondContact O-CB 3.25Å; V86-L89 PolarHBondContact O-N 3.08Å; V86-L90 HydrophobicContact CG1-CD1 4.25Å; V86-L90 VanDerWaalsContact O-CG 3.25Å; V86-L90 WeakPolarHBondContact O-CG 3.26Å; V86-L90 PolarHBondContact O-N 3.22Å; V86-L90 VanDerWaalsContact O-N 3.11Å
87G72Confident68.1Low4 Ų4104.8 Ų104.84%0.04157%0.569CS.*Hα-helixtrans-67.1-39.1175.100000112.3G84 L90 R91G84-G87 CarbonylContact O-C 3.58Å; G84-G87 WeakPolarHBondContact O-CA 3.25Å; G84-G87 PolarHBondContact O-N 3.01Å; G87-L90 PolarHBondContact O-N 3.23Å; G87-R91 WeakPolarHBondContact O-CG 3.41Å; G87-R91 PolarHBondContact O-N 2.88Å
88D70.4Confident66.6Low88 Ų88105.6 Ų105.647%0.47158%0.579SS.*Hα-helixtrans-65.9-39173.8-66-30.5000111.3G84 L90 R91 L92G84-D88 PolarHBondContact O-N 3.29Å; D88-L90 VanDerWaalsContact C-N 3.29Å; D88-L90 PolarHBondContact O-N 3Å; D88-R91 PolarHBondContact O-N 2.94Å; D88-L92 PolarHBondContact O-N 3.05Å
89L66.5Low65.2Low97 Ų97107.9 Ų107.951%0.50860%0.597SS.*Hα-helixtrans-61.6-37.4174.2-151.994.4000112.4V85 V86 I97V85-L89 WeakPolarHBondContact O-CB 3.43Å; V85-L89 PolarHBondContact O-N 3.28Å; V86-L89 WeakPolarHBondContact O-CB 3.25Å; V86-L89 PolarHBondContact O-N 3.08Å; L89-I97 HydrophobicContact CD2-CD1 3.96Å
90L66.8Low63.9Low134 Ų134109 Ų10970%0.70261%0.611SS**Hα-helixtrans-79.3-20.2179.1-68170.5000113.2V86 G87 D88 L92V86-L90 HydrophobicContact CG1-CD1 4.25Å; V86-L90 VanDerWaalsContact O-CG 3.25Å; V86-L90 WeakPolarHBondContact O-CG 3.26Å; V86-L90 PolarHBondContact O-N 3.22Å; V86-L90 VanDerWaalsContact O-N 3.11Å; G87-L90 PolarHBondContact O-N 3.23Å; D88-L90 VanDerWaalsContact C-N 3.29Å; D88-L90 PolarHBondContact O-N 3Å; L90-L92 VanDerWaalsContact C-N 3.33Å
91R64.9Low62.6Low159 Ų159104.4 Ų104.460%0.661%0.608SS**Hα-helixtrans-78.9-13.6173.9-84.5176.8149.9-169.7-6.3113.7G87 D88 D93G87-R91 WeakPolarHBondContact O-CG 3.41Å; G87-R91 PolarHBondContact O-N 2.88Å; D88-R91 PolarHBondContact O-N 2.94Å; R91-D93 PolarHBondContact O-N 2.92Å
92L62.2Low62.1Low102 Ų102111.2 Ų111.253%0.53462%0.623SS.*  trans-71.181.6173.8-64.1175.6000109D88 L90 G94 L95D88-L92 PolarHBondContact O-N 3.05Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L92-G94 PolarHBondContact O-N 3.22Å; L92-L95 HydrophobicContact CD1-CD1 4.41Å
93D56.4Low61.4Low166 Ų166116.5 Ų116.589%0.88865%0.648SS**THydrogen-bonded Turntrans-52.2104168.4-79.1-31.3000108.8R91R91-D93 PolarHBondContact O-N 2.92Å
94G58.3Low60.7Low72 Ų72118.4 Ų118.474%0.74266%0.656SS**THydrogen-bonded Turntrans121.6-5.3165.500000117.6L92 S96L92-G94 PolarHBondContact O-N 3.22Å; G94-S96 PolarHBondContact O-N 3.43Å
95L48.4Very low60.3Low133 Ų133125.3 Ų125.370%0.69668%0.678SS**  trans-96.991.3173.8-62.3-179.4000110.4L92 I97L92-L95 HydrophobicContact CD1-CD1 4.41Å; L95-I97 VanDerWaalsContact C-N 3.28Å; L95-I97 PolarHBondContact O-N 3.05Å
96S47Very low60.1Low103 Ų103129.3 Ų129.372%0.7269%0.685SS**  trans-65.990.6167.560.50000109.1G94 T98G94-S96 PolarHBondContact O-N 3.43Å; S96-T98 PolarHBondContact O-N 3.16Å
97I50.6Low60.6Low127 Ų127130.4 Ų130.465%0.65169%0.692SS**  trans-6594.8156.6-59.9168.6000104.2L89 L95 P99L89-I97 HydrophobicContact CD2-CD1 3.96Å; L95-I97 VanDerWaalsContact C-N 3.28Å; L95-I97 PolarHBondContact O-N 3.05Å; I97-P99 WeakPolarHBondContact O-CD 3.1Å; I97-P99 VanDerWaalsContact O-N 3.14Å
98T48.1Very low61Low110 Ų110135.6 Ų135.668%0.67572%0.715SS**  trans-66.1108.1166.347.20000105.9S96 V100S96-T98 PolarHBondContact O-N 3.16Å; T98-V100 PolarHBondContact O-N 3.03Å
99P50.2Low61.8Low108 Ų108135.1 Ų135.170%0.70171%0.712SS**  trans-61.8120.417027.6-31.6000105.9I97 P101I97-P99 WeakPolarHBondContact O-CD 3.1Å; I97-P99 VanDerWaalsContact O-N 3.14Å; P99-P101 VanDerWaalsContact O-CD 3.29Å; P99-P101 WeakPolarHBondContact O-CD 3.47Å
100V55.3Low62.9Low126 Ų126137 Ų13776%0.76472%0.717SS**  trans-52.6116.9168.71750000105.9T98 K102T98-V100 PolarHBondContact O-N 3.03Å; V100-K102 PolarHBondContact O-N 3.41Å
101P54Low64Low110 Ų110134.5 Ų134.571%0.71471%0.71SS**  trans-64.5112.1-177.524.4-30.8000106.6P99 Q103P99-P101 VanDerWaalsContact O-CD 3.29Å; P99-P101 WeakPolarHBondContact O-CD 3.47Å; P101-Q103 PolarHBondContact O-N 3.43Å
102K61.9Low65.3Low193 Ų193132.7 Ų132.784%0.83971%0.707SS**  trans-49.9119164.3-67.5-176.6179.2-178.10105.7V100 K104V100-K102 PolarHBondContact O-N 3.41Å; K102-K104 PolarHBondContact O-N 2.8Å
103Q61.6Low66.7Low190 Ų190130 Ų13089%0.88869%0.693SS**  trans-53.5107.8175.4-81.3-176.3-11.900106.7P101 Q105P101-Q103 PolarHBondContact O-N 3.43Å; Q103-Q105 PolarHBondContact O-N 3.02Å; Q103-Q105 VanDerWaalsContact O-N 3.16Å
104K63.7Low68.5Low195 Ų195126.7 Ų126.785%0.84868%0.676SS**  trans-56.8125.6172.7-68.9-178179.2-179.80105.4K102 K106K102-K104 PolarHBondContact O-N 2.8Å; K104-K106 PolarHBondContact O-N 3.21Å
105Q65.3Low70.3Confident184 Ų184126.9 Ų126.986%0.8666%0.662SS**  trans-50122.1170.9-73.5-178-14.600107.1Q103 V107Q103-Q105 PolarHBondContact O-N 3.02Å; Q103-Q105 VanDerWaalsContact O-N 3.16Å; Q105-V107 PolarHBondContact O-N 3.33Å
106K71.9Confident72.5Confident207 Ų207128.9 Ų128.990%0.966%0.66SS**  trans-58.8109.7177.2-108.1175.5176.8174.10106.6K104 H108K104-K106 PolarHBondContact O-N 3.21Å; K106-H108 PolarHBondContact O-N 3.42Å
107V77.3Confident74.9Confident130 Ų130131.8 Ų131.879%0.78866%0.655SS**  trans-60.9122.9172.3-179.90000106.5Q105 D109Q105-V107 PolarHBondContact O-N 3.33Å; V107-D109 PolarHBondContact O-N 2.8Å
108H81.3Confident77Confident113 Ų113130.5 Ų130.552%0.52365%0.649SS.*  trans-73.7126.6-175.5-159.210.4000109.7K106 F110 D113K106-H108 PolarHBondContact O-N 3.42Å; H108-F110 VanDerWaalsContact C-N 3.27Å; H108-F110 HydrophobicContact CB-CE1 4.49Å; H108-F110 HydrophobicContact CB-CE2 4.17Å; H108-F110 HydrophobicContact CB-CZ 4.11Å; H108-F110 VanDerWaalsContact O-CD2 3.24Å; H108-F110 WeakPolarHBondContact O-CD2 3.39Å; H108-F110 PolarHBondContact O-N 2.93Å; H108-D113 IonicContact CD2-OD2 2.76Å; H108-D113 IonicContact CE1-OD2 2.83Å; H108-D113 PolarHBondContact CE1-OD2 3.01Å; H108-D113 IonicContact CG-OD2 3.28Å; H108-D113 IonicContact ND1-OD2 3.69Å; H108-D113 PolarHBondContact ND1-OD2 3.32Å; H108-D113 IonicContact NE2-OD2 2.77Å; H108-D113 PolarHBondContact NE2-OD2 3.14Å
109D85.9Confident79.3Confident78 Ų78133.4 Ų133.442%0.41765%0.648SS.*  trans-75.276178.1-74.4-14.2000111.1V107 S111 K112 D113V107-D109 PolarHBondContact O-N 2.8Å; D109-S111 PolarHBondContact O-N 2.92Å; D109-K112 HydrophobicContact CB-CB 4.19Å; D109-K112 HydrophobicContact CB-CD 3.98Å; D109-K112 HydrophobicContact CB-CG 4.17Å; D109-K112 PolarHBondContact O-N 3.27Å; D109-K112 WeakPolarHBondContact OD2-CE 3.27Å; D109-K112 IonicContact OD2-NZ 2.85Å; D109-K112 PolarHBondContact OD2-NZ 2.9Å; D109-D113 PolarHBondContact O-N 2.89Å
110F90.1Very high81.5Confident136 Ų136134.5 Ų134.560%0.59664%0.644SS**Hα-helixtrans-56-26.8179.3-65.5-74.3000113.4H108 D113 N114H108-F110 VanDerWaalsContact C-N 3.27Å; H108-F110 HydrophobicContact CB-CE1 4.49Å; H108-F110 HydrophobicContact CB-CE2 4.17Å; H108-F110 HydrophobicContact CB-CZ 4.11Å; H108-F110 VanDerWaalsContact O-CD2 3.24Å; H108-F110 WeakPolarHBondContact O-CD2 3.39Å; H108-F110 PolarHBondContact O-N 2.93Å; F110-D113 PolarHBondContact O-N 3.22Å; F110-N114 WeakPolarHBondContact O-CB 3.33Å; F110-N114 PolarHBondContact O-N 3.21Å; F110-N114 PolarHBondContact O-ND2 3.47Å; F110-N114 VanDerWaalsContact O-ND2 3.12Å
111S88.7Confident83.5Confident82 Ų82132.6 Ų132.657%0.57363%0.628SS**Hα-helixtrans-62.1-41.9174.358.30000112.2D109 V115D109-S111 PolarHBondContact O-N 2.92Å; S111-V115 VanDerWaalsContact O-CG2 3.25Å; S111-V115 WeakPolarHBondContact O-CG2 3.28Å; S111-V115 PolarHBondContact O-N 3.41Å; S111-V115 VanDerWaalsContact O-N 3.14Å
112K93.2Very high85.4Confident122 Ų122132.9 Ų132.953%0.5362%0.62SS.*Hα-helixtrans-72.1-40.1178.4-70.4178-175.9154.10111.4D109 V115 R116D109-K112 HydrophobicContact CB-CB 4.19Å; D109-K112 HydrophobicContact CB-CD 3.98Å; D109-K112 HydrophobicContact CB-CG 4.17Å; D109-K112 PolarHBondContact O-N 3.27Å; D109-K112 WeakPolarHBondContact OD2-CE 3.27Å; D109-K112 IonicContact OD2-NZ 2.85Å; D109-K112 PolarHBondContact OD2-NZ 2.9Å; K112-V115 PolarHBondContact O-N 3.02Å; K112-R116 WeakPolarHBondContact O-CG 3.35Å; K112-R116 PolarHBondContact O-N 3.29Å
113D92.3Very high87.1Confident45 Ų45131.5 Ų131.524%0.24161%0.61CS.*Hα-helixtrans-70.3-36.8178.9-62.1-42.6000112.1H108 D109 F110 V115 R116 R117H108-D113 IonicContact CD2-OD2 2.76Å; H108-D113 IonicContact CE1-OD2 2.83Å; H108-D113 PolarHBondContact CE1-OD2 3.01Å; H108-D113 IonicContact CG-OD2 3.28Å; H108-D113 IonicContact ND1-OD2 3.69Å; H108-D113 PolarHBondContact ND1-OD2 3.32Å; H108-D113 IonicContact NE2-OD2 2.77Å; H108-D113 PolarHBondContact NE2-OD2 3.14Å; D109-D113 PolarHBondContact O-N 2.89Å; F110-D113 PolarHBondContact O-N 3.22Å; D113-V115 VanDerWaalsContact C-N 3.32Å; D113-V115 PolarHBondContact O-N 3.44Å; D113-R116 PolarHBondContact O-N 2.79Å; D113-R117 VanDerWaalsContact O-CB 3.22Å; D113-R117 WeakPolarHBondContact O-CB 3.31Å; D113-R117 PolarHBondContact O-N 3.26Å
114N93.4Very high88.7Confident97 Ų97130.3 Ų130.352%0.51960%0.597SS.*Hα-helixtrans-61.9-40.8171.7-73.2-21.6000111.6F110 R117 L118F110-N114 WeakPolarHBondContact O-CB 3.33Å; F110-N114 PolarHBondContact O-N 3.21Å; F110-N114 PolarHBondContact O-ND2 3.47Å; F110-N114 VanDerWaalsContact O-ND2 3.12Å; N114-R117 PolarHBondContact O-N 3.37Å; N114-L118 VanDerWaalsContact O-CB 3.29Å; N114-L118 WeakPolarHBondContact O-CB 3.46Å; N114-L118 PolarHBondContact O-N 2.92Å
115V96.7Very high90.1Very high75 Ų75124.2 Ų124.246%0.45558%0.578SS.*Hα-helixtrans-65.8-42.3175170.60000111.3S111 K112 D113 L118 R119S111-V115 VanDerWaalsContact O-CG2 3.25Å; S111-V115 WeakPolarHBondContact O-CG2 3.28Å; S111-V115 PolarHBondContact O-N 3.41Å; S111-V115 VanDerWaalsContact O-N 3.14Å; K112-V115 PolarHBondContact O-N 3.02Å; D113-V115 VanDerWaalsContact C-N 3.32Å; D113-V115 PolarHBondContact O-N 3.44Å; V115-L118 PolarHBondContact O-N 2.99Å; V115-R119 WeakPolarHBondContact O-CG 3.1Å; V115-R119 PolarHBondContact O-N 3.39Å
116R94.8Very high91.5Very high176 Ų176123 Ų12366%0.66457%0.57SS**Hα-helixtrans-61.5-48.1175.6-74.9174.8176.9-168.4-2.7111.2K112 D113 L118 R119 E120K112-R116 WeakPolarHBondContact O-CG 3.35Å; K112-R116 PolarHBondContact O-N 3.29Å; D113-R116 PolarHBondContact O-N 2.79Å; R116-L118 VanDerWaalsContact C-N 3.34Å; R116-L118 PolarHBondContact O-N 3.45Å; R116-R119 PolarHBondContact O-N 3.48Å; R116-E120 WeakPolarHBondContact O-CB 3.29Å; R116-E120 PolarHBondContact O-N 3.31Å
117R96.3Very high92.6Very high164 Ų164117.9 Ų117.962%0.61955%0.549SS*.Hα-helixtrans-60.3-42.4176.8-172.6-179.7-178.5-151.10.4111.7D113 N114 E120 I121D113-R117 VanDerWaalsContact O-CB 3.22Å; D113-R117 WeakPolarHBondContact O-CB 3.31Å; D113-R117 PolarHBondContact O-N 3.26Å; N114-R117 PolarHBondContact O-N 3.37Å; R117-E120 PolarHBondContact O-N 2.9Å; R117-I121 HydrophobicContact CG-CD1 4.1Å; R117-I121 VanDerWaalsContact O-CG1 3.25Å; R117-I121 WeakPolarHBondContact O-CG1 3.29Å; R117-I121 PolarHBondContact O-N 2.93Å
118L95.8Very high93Very high99 Ų99115.8 Ų115.852%0.51853%0.531SS..Hα-helixtrans-63.7-43.2177-170.271000111.4N114 V115 R116 E120 I121 Q122N114-L118 VanDerWaalsContact O-CB 3.29Å; N114-L118 WeakPolarHBondContact O-CB 3.46Å; N114-L118 PolarHBondContact O-N 2.92Å; V115-L118 PolarHBondContact O-N 2.99Å; R116-L118 VanDerWaalsContact C-N 3.34Å; R116-L118 PolarHBondContact O-N 3.45Å; L118-E120 VanDerWaalsContact C-N 3.32Å; L118-E120 PolarHBondContact O-N 3.48Å; L118-I121 PolarHBondContact O-N 2.85Å; L118-Q122 WeakPolarHBondContact O-CB 3.42Å; L118-Q122 VanDerWaalsContact O-CG 3.3Å; L118-Q122 WeakPolarHBondContact O-CG 3.4Å; L118-Q122 PolarHBondContact O-N 3.49Å
119R96.6Very high93.1Very high172 Ų172116.2 Ų116.265%0.64953%0.533SS*.Hα-helixtrans-64.3-37.5175.8-73.4-179.5-177.3-137.91.5112.3V115 R116 Q122 R123V115-R119 WeakPolarHBondContact O-CG 3.1Å; V115-R119 PolarHBondContact O-N 3.39Å; R116-R119 PolarHBondContact O-N 3.48Å; R119-Q122 PolarHBondContact O-N 2.85Å; R119-R123 WeakPolarHBondContact O-CB 3.43Å; R119-R123 PolarHBondContact O-N 3.06Å
120E96.5Very high93.2Very high131 Ų131114.4 Ų114.461%0.61253%0.529SS*.Hα-helixtrans-67.1-43.3176-172.8173.6-159.800111.6R116 R117 L118 Q122 R123 R124R116-E120 WeakPolarHBondContact O-CB 3.29Å; R116-E120 PolarHBondContact O-N 3.31Å; R117-E120 PolarHBondContact O-N 2.9Å; L118-E120 VanDerWaalsContact C-N 3.32Å; L118-E120 PolarHBondContact O-N 3.48Å; E120-Q122 PolarHBondContact O-N 3.49Å; E120-R123 WeakPolarHBondContact O-CB 3.45Å; E120-R123 PolarHBondContact O-N 2.93Å; E120-R124 WeakPolarHBondContact O-CB 3.35Å; E120-R124 PolarHBondContact O-N 3.01Å
121I95.4Very high92.9Very high85 Ų85114 Ų11444%0.43653%0.529SS..Hα-helixtrans-59.6-47.5173.1-69.5164.9000110.4R117 L118 R123 R124 C125R117-I121 HydrophobicContact CG-CD1 4.1Å; R117-I121 VanDerWaalsContact O-CG1 3.25Å; R117-I121 WeakPolarHBondContact O-CG1 3.29Å; R117-I121 PolarHBondContact O-N 2.93Å; L118-I121 PolarHBondContact O-N 2.85Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.14Å; I121-R124 PolarHBondContact O-N 3.4Å; I121-C125 WeakPolarHBondContact O-CB 3.49Å; I121-C125 PolarHBondContact O-N 3.39Å; I121-C125 PolarHBondContact O-SG 2.9Å; I121-C125 VanDerWaalsContact O-SG 3.34Å
122Q95.4Very high92.4Very high116 Ų116118.1 Ų118.154%0.54253%0.532SS..Hα-helixtrans-59.5-42.6177.4-75.1174.5-20.600112L118 R119 E120 K126L118-Q122 WeakPolarHBondContact O-CB 3.42Å; L118-Q122 VanDerWaalsContact O-CG 3.3Å; L118-Q122 WeakPolarHBondContact O-CG 3.4Å; L118-Q122 PolarHBondContact O-N 3.49Å; R119-Q122 PolarHBondContact O-N 2.85Å; E120-Q122 PolarHBondContact O-N 3.49Å; Q122-K126 WeakPolarHBondContact O-CB 3.37Å; Q122-K126 PolarHBondContact O-N 3.25Å
123R96.4Very high91.5Very high165 Ų165118.2 Ų118.262%0.62354%0.537SS*.Hα-helixtrans-60.6-51175.6-174-169.7-58.8179.30.5111R119 E120 I121 C125 K126 E127R119-R123 WeakPolarHBondContact O-CB 3.43Å; R119-R123 PolarHBondContact O-N 3.06Å; E120-R123 WeakPolarHBondContact O-CB 3.45Å; E120-R123 PolarHBondContact O-N 2.93Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.14Å; R123-C125 VanDerWaalsContact C-N 3.34Å; R123-C125 PolarHBondContact O-N 3.04Å; R123-K126 WeakPolarHBondContact O-CB 3.02Å; R123-K126 PolarHBondContact O-N 3.12Å; R123-K126 VanDerWaalsContact O-N 3.11Å; R123-E127 WeakPolarHBondContact CD-OE1 3.29Å; R123-E127 HydrophobicContact CG-CG 4.49Å; R123-E127 VanDerWaalsContact CG-OE1 3.31Å; R123-E127 WeakPolarHBondContact CG-OE1 3.19Å; R123-E127 WeakPolarHBondContact O-CG 3.24Å; R123-E127 PolarHBondContact O-N 2.88Å
124R96Very high90.6Very high164 Ų164124.1 Ų124.162%0.61956%0.563SS**Hα-helixtrans-61.4-41-179.4-172.2-179.6-179.8-173.80.8112.2E120 I121 K126 E127 Q128E120-R124 WeakPolarHBondContact O-CB 3.35Å; E120-R124 PolarHBondContact O-N 3.01Å; I121-R124 PolarHBondContact O-N 3.4Å; R124-K126 VanDerWaalsContact C-N 3.33Å; R124-E127 PolarHBondContact O-N 3.25Å; R124-Q128 WeakPolarHBondContact O-CB 3.22Å; R124-Q128 VanDerWaalsContact O-CG 3.3Å; R124-Q128 WeakPolarHBondContact O-CG 3.3Å; R124-Q128 PolarHBondContact O-N 3.5Å
125C93.6Very high89.8Confident68 Ų68123.4 Ų123.446%0.45957%0.571SS.*Hα-helixtrans-63.4-40.9175.1-71.80000111.6I121 R123 Q128 E129I121-C125 WeakPolarHBondContact O-CB 3.49Å; I121-C125 PolarHBondContact O-N 3.39Å; I121-C125 PolarHBondContact O-SG 2.9Å; I121-C125 VanDerWaalsContact O-SG 3.34Å; R123-C125 VanDerWaalsContact C-N 3.34Å; R123-C125 PolarHBondContact O-N 3.04Å; C125-Q128 PolarHBondContact O-N 3.08Å; C125-E129 WeakPolarHBondContact O-CB 3.49Å; C125-E129 PolarHBondContact O-N 2.87Å
126K94.5Very high88.4Confident159 Ų159121.2 Ų121.269%0.69156%0.563SS**Hα-helixtrans-66.3-39.8176.5-170.3179.6-178.8-177.80112.2Q122 R123 R124 E129 A130Q122-K126 WeakPolarHBondContact O-CB 3.37Å; Q122-K126 PolarHBondContact O-N 3.25Å; R123-K126 WeakPolarHBondContact O-CB 3.02Å; R123-K126 PolarHBondContact O-N 3.12Å; R123-K126 VanDerWaalsContact O-N 3.11Å; R124-K126 VanDerWaalsContact C-N 3.33Å; K126-E129 PolarHBondContact O-N 3.11Å; K126-A130 WeakPolarHBondContact O-CB 3.23Å; K126-A130 PolarHBondContact O-N 2.99Å
127E93.6Very high87.1Confident99 Ų99119.3 Ų119.346%0.46357%0.574SS.*Hα-helixtrans-63.5-47.5174-74.3166.6-176.300111R123 R124 E129 A130 E131R123-E127 WeakPolarHBondContact CD-OE1 3.29Å; R123-E127 HydrophobicContact CG-CG 4.49Å; R123-E127 VanDerWaalsContact CG-OE1 3.31Å; R123-E127 WeakPolarHBondContact CG-OE1 3.19Å; R123-E127 WeakPolarHBondContact O-CG 3.24Å; R123-E127 PolarHBondContact O-N 2.88Å; R124-E127 PolarHBondContact O-N 3.25Å; E127-E129 VanDerWaalsContact C-N 3.29Å; E127-E129 PolarHBondContact O-N 3.08Å; E127-A130 WeakPolarHBondContact O-CB 3.36Å; E127-A130 PolarHBondContact O-N 2.84Å; E127-A130 VanDerWaalsContact O-N 3.15Å; E127-E131 WeakPolarHBondContact O-CG 3.4Å; E127-E131 PolarHBondContact O-N 3.07Å
128Q87.3Confident85.6Confident86 Ų86115.5 Ų115.540%0.40257%0.568SS.*Hα-helixtrans-60.9-38.2175.1-75.1179.20.500112.4R124 C125 R132R124-Q128 WeakPolarHBondContact O-CB 3.22Å; R124-Q128 VanDerWaalsContact O-CG 3.3Å; R124-Q128 WeakPolarHBondContact O-CG 3.3Å; R124-Q128 PolarHBondContact O-N 3.5Å; C125-Q128 PolarHBondContact O-N 3.08Å; Q128-R132 WeakPolarHBondContact O-CB 3.31Å; Q128-R132 WeakPolarHBondContact O-CG 3.48Å; Q128-R132 PolarHBondContact O-N 3.4Å
129E82.8Confident84.2Confident121 Ų121115.3 Ų115.357%0.56557%0.573SS**Hα-helixtrans-67.3-41.1175.4-169.5172.2-165.700111.4C125 K126 E127 R132 I133C125-E129 WeakPolarHBondContact O-CB 3.49Å; C125-E129 PolarHBondContact O-N 2.87Å; K126-E129 PolarHBondContact O-N 3.11Å; E127-E129 VanDerWaalsContact C-N 3.29Å; E127-E129 PolarHBondContact O-N 3.08Å; E129-R132 PolarHBondContact O-N 3.15Å; E129-I133 HydrophobicContact CG-CD1 4.19Å; E129-I133 WeakPolarHBondContact O-CD1 3.4Å; E129-I133 WeakPolarHBondContact O-CG1 3.45Å; E129-I133 PolarHBondContact O-N 3.37Å
130A87.1Confident82.4Confident40 Ų40114.5 Ų114.533%0.33159%0.587SS.*Hα-helixtrans-62.3-45.5173.300000111.7K126 E127 R132 I133 H134K126-A130 WeakPolarHBondContact O-CB 3.23Å; K126-A130 PolarHBondContact O-N 2.99Å; E127-A130 WeakPolarHBondContact O-CB 3.36Å; E127-A130 PolarHBondContact O-N 2.84Å; E127-A130 VanDerWaalsContact O-N 3.15Å; A130-R132 VanDerWaalsContact C-N 3.31Å; A130-R132 PolarHBondContact O-N 3.16Å; A130-I133 PolarHBondContact O-N 3.02Å; A130-H134 WeakPolarHBondContact O-CB 3.31Å; A130-H134 PolarHBondContact O-CD2 2.72Å; A130-H134 PolarHBondContact O-N 3.35Å
131E85.3Confident80.7Confident129 Ų129117.6 Ų117.660%0.60360%0.598SS**Hα-helixtrans-58.9-41.1173.4-73.6174.7179.400111.6E127 H134 A135E127-E131 WeakPolarHBondContact O-CG 3.4Å; E127-E131 PolarHBondContact O-N 3.07Å; E131-H134 CarbonylContact O-C 3.56Å; E131-H134 PolarHBondContact O-N 3.07Å; E131-A135 VanDerWaalsContact O-CB 3.22Å; E131-A135 WeakPolarHBondContact O-CB 3.43Å; E131-A135 PolarHBondContact O-N 2.98Å
132R77.9Confident79.3Confident167 Ų167116.8 Ų116.863%0.6360%0.604SS**Hα-helixtrans-67.6-35.9175.7-74.4178.175.4-163.21.7112.8Q128 E129 A130 A135Q128-R132 WeakPolarHBondContact O-CB 3.31Å; Q128-R132 WeakPolarHBondContact O-CG 3.48Å; Q128-R132 PolarHBondContact O-N 3.4Å; E129-R132 PolarHBondContact O-N 3.15Å; A130-R132 VanDerWaalsContact C-N 3.31Å; A130-R132 PolarHBondContact O-N 3.16Å; R132-A135 PolarHBondContact O-N 3.21Å
133I74.6Confident77.8Confident125 Ų125118.1 Ų118.164%0.64161%0.614SS**Hα-helixtrans-67.4-42173.4-68.1162.4000109.8E129 A130 G136E129-I133 HydrophobicContact CG-CD1 4.19Å; E129-I133 WeakPolarHBondContact O-CD1 3.4Å; E129-I133 WeakPolarHBondContact O-CG1 3.45Å; E129-I133 PolarHBondContact O-N 3.37Å; A130-I133 PolarHBondContact O-N 3.02Å; I133-G136 PolarHBondContact O-N 2.89Å
134H73.3Confident76Confident169 Ų169121.5 Ų121.578%0.78263%0.627SS**Hα-helixtrans-67-32.8174.9-74.3-60.5000113A130 E131 G136A130-H134 WeakPolarHBondContact O-CB 3.31Å; A130-H134 PolarHBondContact O-CD2 2.72Å; A130-H134 PolarHBondContact O-N 3.35Å; E131-H134 CarbonylContact O-C 3.56Å; E131-H134 PolarHBondContact O-N 3.07Å; H134-G136 PolarHBondContact O-N 3.15Å
135A76.8Confident74.5Confident82 Ų82118.8 Ų118.868%0.67863%0.629SS**THydrogen-bonded Turntrans-74.9-1.2177.700000114.2E131 R132E131-A135 VanDerWaalsContact O-CB 3.22Å; E131-A135 WeakPolarHBondContact O-CB 3.43Å; E131-A135 PolarHBondContact O-N 2.98Å; R132-A135 PolarHBondContact O-N 3.21Å
136G67.1Low73.6Confident29 Ų29118.1 Ų118.130%0.29963%0.625SS.*  trans83.1171.5177.700000114.3I133 H134 V138I133-G136 PolarHBondContact O-N 2.89Å; H134-G136 PolarHBondContact O-N 3.15Å; G136-V138 PolarHBondContact O-N 3.28Å
137P67.9Low72.8Confident136 Ų136115.3 Ų115.388%0.88363%0.626SS**  trans-69.6102.6-171.227-32.9000111.6
138V64.3Low72.1Confident83 Ų83118.5 Ų118.550%0.50364%0.638SS.*  trans-68.8122.1168.1-179.60000108.4G136 V140 A142G136-V138 PolarHBondContact O-N 3.28Å; V138-V140 PolarHBondContact O-N 3.28Å; V138-A142 HydrophobicContact CG1-CB 4.49Å
139P66.5Low71.3Confident96 Ų96121.2 Ų121.262%0.62365%0.646SS**  trans-61133.5-179.223.2-32000110.4K141 A142P139-K141 PolarHBondContact O-N 3.29Å; P139-A142 PolarHBondContact O-N 3.08Å; P139-A142 VanDerWaalsContact O-N 3.1Å
140V58.5Low71Confident154 Ų154122.3 Ų122.393%0.93365%0.65SS**THydrogen-bonded Turntrans-58.7-8.3-174-177.80000113.5V138V138-V140 PolarHBondContact O-N 3.28Å
141K61Low70.5Confident196 Ų196127.5 Ų127.585%0.85267%0.673SS**THydrogen-bonded Turntrans-121.848.8176.2-67.1-179.6172.8176.20112.3P139 L143P139-K141 PolarHBondContact O-N 3.29Å; K141-L143 PolarHBondContact O-N 2.98Å
142A64.5Low70.4Confident69 Ų69126.2 Ų126.257%0.5767%0.673SS**  trans-69102.4164.300000108.2V138 P139 W144V138-A142 HydrophobicContact CG1-CB 4.49Å; P139-A142 PolarHBondContact O-N 3.08Å; P139-A142 VanDerWaalsContact O-N 3.1Å; A142-W144 PolarHBondContact O-N 3.11Å
143L65.5Low70.2Confident143 Ų143123 Ų12375%0.74968%0.675SS**  trans-54131.4160.1-65.7169.9000106.5K141 T145K141-L143 PolarHBondContact O-N 2.98Å; L143-T145 WeakPolarHBondContact O-CG2 3.44Å; L143-T145 PolarHBondContact O-N 2.98Å
144W57.4Low70.4Confident237 Ų237120.1 Ų120.190%0.89867%0.665SS**  trans-50102.117847.2-73.2000109.7A142A142-W144 PolarHBondContact O-N 3.11Å
145T66.1Low70.6Confident106 Ų106122.5 Ų122.565%0.6567%0.667SS**  trans-85.5121.8174.751.90000107.3L143L143-T145 WeakPolarHBondContact O-CG2 3.44Å; L143-T145 PolarHBondContact O-N 2.98Å
146S74.4Confident70.3Confident55 Ų55122.8 Ų122.839%0.38566%0.661SS.*  trans-66.7146.9171.2630000109.3K148 Y149S146-K148 PolarHBondContact O-N 3.19Å; S146-Y149 PolarHBondContact O-N 3.01Å; S146-Y149 VanDerWaalsContact OG-CD2 3.27Å; S146-Y149 WeakPolarHBondContact OG-CD2 3.46Å
147S77Confident70.6Confident100 Ų100126.8 Ų126.870%0.69967%0.673SS**G310 helixtrans-50.7-28.2-179.9173.80000113Y149 Q150S147-Y149 PolarHBondContact O-N 2.81Å; S147-Y149 VanDerWaalsContact O-N 3.1Å; S147-Q150 PolarHBondContact O-N 3.41Å
148K79.5Confident70.6Confident165 Ų165122.7 Ų122.772%0.71765%0.65SS**G310 helixtrans-55.1-26.3176-164.8175.5-164.5179.80114.5S146S146-K148 PolarHBondContact O-N 3.19Å
149Y70.2Confident70.8Confident144 Ų144125.5 Ų125.557%0.56566%0.658SS**G310 helixtrans-117.98.5-174.2-57.6-72.6000114S146 S147 N151 V152S146-Y149 PolarHBondContact O-N 3.01Å; S146-Y149 VanDerWaalsContact OG-CD2 3.27Å; S146-Y149 WeakPolarHBondContact OG-CD2 3.46Å; S147-Y149 PolarHBondContact O-N 2.81Å; S147-Y149 VanDerWaalsContact O-N 3.1Å; Y149-N151 VanDerWaalsContact C-N 3.29Å; Y149-N151 PolarHBondContact O-N 2.83Å; Y149-V152 HydrophobicContact CD1-CG2 4.29Å
150Q76Confident70.5Confident143 Ų143125.9 Ų125.967%0.66865%0.654SS**THydrogen-bonded Turntrans-67.7-29.4-176.6-168.81596.700113.1S147S147-Q150 PolarHBondContact O-N 3.41Å
151N77.4Confident70.8Confident150 Ų150126.1 Ų126.180%0.80265%0.645SS**THydrogen-bonded Turntrans-109.616.7-176.5-59.7-32.6000113.3Y149 P153Y149-N151 VanDerWaalsContact C-N 3.29Å; Y149-N151 PolarHBondContact O-N 2.83Å; N151-P153 WeakPolarHBondContact O-CD 3.46Å
152V81.6Confident70.7Confident101 Ų101123 Ų12361%0.61264%0.642SS**  trans-91103.9178.5-178.30000108.3Y149Y149-V152 HydrophobicContact CD1-CG2 4.29Å
153P75.2Confident70.6Confident101 Ų101123.4 Ų123.466%0.65664%0.641SS**  trans-65.3144.4179.428.2-35000110.2N151 R155N151-P153 WeakPolarHBondContact O-CD 3.46Å; P153-R155 PolarHBondContact O-N 3.33Å
154S78.9Confident70Confident63 Ų63123.2 Ų123.244%0.44164%0.639SS.*  trans-61.5125.4174.8175.90000109.7V156 M157 A158S154-V156 PolarHBondContact O-N 3.28Å; S154-V156 VanDerWaalsContact O-N 3.13Å; S154-V156 PolarHBondContact OG-N 2.89Å; S154-M157 PolarHBondContact O-N 2.86Å; S154-A158 PolarHBondContact O-N 3.15Å
155R77.9Confident70.1Confident219 Ų219116.5 Ų116.583%0.82663%0.626SS**Hα-helixtrans-58.2-26174.2-69.9-174.6176.5-171.8-2.3112.4P153 Q159P153-R155 PolarHBondContact O-N 3.33Å; R155-Q159 WeakPolarHBondContact O-CG 3.43Å; R155-Q159 PolarHBondContact O-N 3.36Å
156V69.8Low69.4Low89 Ų89117.4 Ų117.454%0.53963%0.634SS.*Hα-helixtrans-69.5-38.5175.2-178.40000111.1S154 Q159 L160S154-V156 PolarHBondContact O-N 3.28Å; S154-V156 VanDerWaalsContact O-N 3.13Å; S154-V156 PolarHBondContact OG-N 2.89Å; V156-Q159 PolarHBondContact O-N 3.41Å; V156-L160 HydrophobicContact CG1-CD1 4.45Å; V156-L160 WeakPolarHBondContact O-CG 3.44Å; V156-L160 PolarHBondContact O-N 3.4Å
157M73.1Confident68.2Low112 Ų112121.2 Ų121.255%0.55265%0.654SS**Hα-helixtrans-68.7-40.2176-74.1-69.1157.600111.5S154 Q159 L160 E161S154-M157 PolarHBondContact O-N 2.86Å; M157-Q159 VanDerWaalsContact C-N 3.25Å; M157-Q159 PolarHBondContact O-N 3.11Å; M157-L160 PolarHBondContact O-N 3.44Å; M157-L160 VanDerWaalsContact O-N 3.11Å; M157-L160 HydrophobicContact SD-CD1 4.36Å; M157-E161 PolarHBondContact O-N 2.89Å
158A68.7Low67Low50 Ų50125.4 Ų125.441%0.41366%0.66SS.*Hα-helixtrans-61.2-32.6175.400000113S154 V162S154-A158 PolarHBondContact O-N 3.15Å; A158-V162 VanDerWaalsContact O-CG2 3.29Å; A158-V162 WeakPolarHBondContact O-CG2 3.5Å; A158-V162 PolarHBondContact O-N 2.9Å
159Q67.6Low65.8Low142 Ų142123.8 Ų123.866%0.66467%0.666SS**Hα-helixtrans-76-28.6175.8-74.8-179.7-15.600113.3R155 V156 M157 S163R155-Q159 WeakPolarHBondContact O-CG 3.43Å; R155-Q159 PolarHBondContact O-N 3.36Å; V156-Q159 PolarHBondContact O-N 3.41Å; M157-Q159 VanDerWaalsContact C-N 3.25Å; M157-Q159 PolarHBondContact O-N 3.11Å; Q159-S163 PolarHBondContact O-OG 3.36Å
160L60.8Low65.1Low104 Ų104125.3 Ų125.355%0.54568%0.679SS.*Hα-helixtrans-76.1-33.6176.5-70.2170.6000112.4V156 M157V156-L160 HydrophobicContact CG1-CD1 4.45Å; V156-L160 WeakPolarHBondContact O-CG 3.44Å; V156-L160 PolarHBondContact O-N 3.4Å; M157-L160 PolarHBondContact O-N 3.44Å; M157-L160 VanDerWaalsContact O-N 3.11Å; M157-L160 HydrophobicContact SD-CD1 4.36Å
161E64.3Low63.9Low160 Ų160122.8 Ų122.875%0.74868%0.676SS**Hα-helixtrans-72.6-30.6176.6-72.2-179.2176.600113.1M157 S163M157-E161 PolarHBondContact O-N 2.89Å; E161-S163 VanDerWaalsContact C-N 3.34Å
162V59.3Low63Low131 Ų131124.4 Ų124.479%0.79468%0.679SS**SBendtrans-82.5-9.9-177.8175.50000113A158A158-V162 VanDerWaalsContact O-CG2 3.29Å; A158-V162 WeakPolarHBondContact O-CG2 3.5Å; A158-V162 PolarHBondContact O-N 2.9Å
163S62.5Low62.1Low77 Ų77125.9 Ų125.954%0.53869%0.688SS.*  trans-127.674.2-178.958.40000112.9Q159 E161 P165Q159-S163 PolarHBondContact O-OG 3.36Å; E161-S163 VanDerWaalsContact C-N 3.34Å; S163-P165 VanDerWaalsContact C-CD 3.47Å
164I52.6Low61.2Low138 Ų138129 Ų12971%0.70869%0.691SS**  trans-121.578.9160.1-46.3174.7000109.7
165P60.4Low59.9Low96 Ų96134.3 Ų134.362%0.62371%0.714SS**  trans-70.2145.3151.930.5-29.6000109S163 V167S163-P165 VanDerWaalsContact C-CD 3.47Å; P165-V167 PolarHBondContact O-N 3.41Å
166P50.6Low59.1Low126 Ų126134.1 Ų134.182%0.81872%0.719SS**  trans-61125.4-176.424.4-33.1000111.1K168P166-K168 PolarHBondContact O-N 2.89Å
167V49.7Very low58.2Low134 Ų134133.6 Ų133.681%0.81272%0.724SS**  trans-64.3110.8-178.9176.50000110.1P165P165-V167 PolarHBondContact O-N 3.41Å
168K50.8Low56.8Low188 Ų188137.3 Ų137.382%0.81774%0.74SS**  trans-75.7133.9155.5-73.8-178.3178.7177.40108.2P166 Q170P166-K168 PolarHBondContact O-N 2.89Å; K168-Q170 VanDerWaalsContact C-N 3.32Å; K168-Q170 PolarHBondContact O-N 3.25Å
169P55.1Low55.7Low131 Ų131140 Ų14085%0.85176%0.756SS**SBendtrans-84.878.1-175.135.3-32.5000109.2
170Q56.1Low54.5Low176 Ų176142.7 Ų142.782%0.82277%0.765SS**  trans-148.6109.2167.2-161.715913.800108K168K168-Q170 VanDerWaalsContact C-N 3.32Å; K168-Q170 PolarHBondContact O-N 3.25Å
171C49.8Very low53.7Low91 Ų91141.6 Ų141.662%0.61578%0.778SS**  trans152.161.6155.8-77.10000109.6F174C171-F174 HydrophobicContact CB-CD2 4.18Å; C171-F174 HydrophobicContact CB-CE2 3.49Å; C171-F174 VanDerWaalsContact CB-CE2 3.49Å; C171-F174 HydrophobicContact CB-CZ 4.31Å; C171-F174 WeakPolarHBondContact SG-CE2 3.36Å
172Q57.9Low52.6Low184 Ų184137.7 Ų137.786%0.8678%0.781SS**  trans-70.7143149.6-66-174.318.100106.8
173T62.9Low51.7Low132 Ų132137.3 Ų137.381%0.8178%0.784SS**  trans8661.3177.961.30000118.8
174F56.6Low50.6Low165 Ų165138.7 Ų138.772%0.72479%0.794SS**  trans-130.194.3147.3-49.4-66.3000108.8C171C171-F174 HydrophobicContact CB-CD2 4.18Å; C171-F174 HydrophobicContact CB-CE2 3.49Å; C171-F174 VanDerWaalsContact CB-CE2 3.49Å; C171-F174 HydrophobicContact CB-CZ 4.31Å; C171-F174 WeakPolarHBondContact SG-CE2 3.36Å
175L52.6Low50.2Low176 Ų176136.4 Ų136.492%0.92180%0.796SS**  trans177.370.7149.9-91.8-179.1000108
176K61.2Low49.7Very low215 Ų215137.6 Ų137.694%0.93580%0.804SS**  trans-148.666.5155.3-161.2125.3-179.3178.20110
177A49.6Very low50.3Low77 Ų77137.1 Ų137.164%0.63680%0.8SS**  trans-122.5120.3162.600000106.5
178H44.6Very low49.7Very low191 Ų191142.3 Ų142.388%0.88481%0.806SS**  trans143.5127.3157.4-65.1-42.6000109.4
179S44.6Very low49.6Very low106 Ų106137.8 Ų137.874%0.74180%0.795SS**  trans87.888-165.2-173.90000112
180K43.7Very low48.4Very low199 Ų199136.6 Ų136.687%0.86579%0.79SS**  -144.1154.560.8-64.6-77.1-179.5168.20112.6
181G43.3Very low48.3Very low80 Ų80133.3 Ų133.383%0.82578%0.784SS**  trans-88.2173.3-177.500000116.2
182G40.3Very low47.7Very low78 Ų78134.6 Ų134.680%0.80479%0.789SS**  trans93.8111.2152.100000119
183S41.4Very low46.7Very low123 Ų123129.3 Ų129.386%0.8678%0.777SS**  trans68117143.9-161.90000122.8
184S38.7Very low45.4Very low106 Ų106131.2 Ų131.274%0.74177%0.774SS**  trans51.6101.1136.8-173.70000122.4
185A44.1Very low44.4Very low91 Ų91131.6 Ų131.675%0.75278%0.778SS**  34.6163.9126.300000123.5
186P50.7Low43.6Very low120 Ų120133.9 Ų133.978%0.77977%0.774SS**  -134.9-152.9-62.846.4-27.2000112
187P62.2Low42.8Very low116 Ų116129.5 Ų129.575%0.75377%0.768SS**  -134.8171.1-111.837.9-15.6000117.9
188R36.9Very low42.2Very low244 Ų244129.2 Ų129.292%0.92177%0.765SS**  trans172.1168.9141.2-113.9-162.3165.4-167.5-1.6114.6
189P49.5Very low41.8Very low93 Ų93125.4 Ų125.460%0.60476%0.76SS**  -133.7162.8-115.741.8-21.6000118.8
190S30.9Very low41.2Very low106 Ų106125.5 Ų125.574%0.74176%0.761SS**  trans70.5165.614381.10000120.1
191P53.6Low41Very low107 Ų107121.3 Ų121.370%0.69576%0.757SS**  cis-140.1-172.7-1625.20.8000115.5
192V37.3Very low40.7Very low118 Ų118122.2 Ų122.272%0.71575%0.75SS**  trans81.5102.7153.6-157.90000117.4
193A36.3Very low41.1Very low73 Ų73124.1 Ų124.160%0.60375%0.751SS**  65.8134.189.400000113.2
194F34.6Very low41.2Very low172 Ų172126.4 Ų126.475%0.75475%0.746SS**  cis-16115538.4-89.8-83.2000111.5
195Q36.1Very low41.6Very low172 Ų172128 Ų12880%0.80475%0.75SS**  trans67.6127.7141-67.6176.549.900122.7
196R35.5Very low42Very low224 Ų224130.4 Ų130.485%0.84575%0.75SS**  trans-76156162.8-143.1-172.3-167.9157.13.5109.5
197P45.5Very low42.2Very low124 Ų124129.6 Ų129.681%0.80574%0.739SS**  -141.9136.885.126.7-5.5000112.9
198A35.8Very low41.9Very low70 Ų70130.3 Ų130.358%0.57974%0.736SS**  72.6116.310600000115.9
199S36.6Very low42.4Very low111 Ų111125 Ų12578%0.77672%0.724SS**  trans73.7128.2148.434.60000121.9
200S31.6Very low42.8Very low108 Ų108125.1 Ų125.176%0.75572%0.722SS**  trans93.6128.7140.3730000119.8
201S40.8Very low43.9Very low112 Ų112128.8 Ų128.878%0.78373%0.727SS**  trans53.1109.1155.661.10000118.5
202S37.4Very low44.1Very low98 Ų98126.4 Ų126.469%0.68572%0.723SS**  -170.3125.5124.2-163.60000109.7K204S202-K204 PolarHBondContact O-N 2.87Å
203S48.4Very low45.4Very low118 Ų118127.7 Ų127.783%0.82572%0.72SS**  trans-46.8100161.1440000111.6
204K42.9Very low47.1Very low172 Ų172128.7 Ų128.775%0.74872%0.719SS**  trans-137113155-67.2-170.7-178.5178.40107.8S202 L206S202-K204 PolarHBondContact O-N 2.87Å; K204-L206 VanDerWaalsContact C-N 3.33Å; K204-L206 PolarHBondContact O-N 3.5Å
205V47.8Very low49Very low138 Ų138123.4 Ų123.484%0.83670%0.701SS**  trans-56.499.9168.1177.20000106.3D207V205-D207 PolarHBondContact O-N 2.89Å
206L51.8Low51.3Low143 Ų143118.4 Ų118.475%0.74968%0.68SS**  trans-77.4102.7167.3-71.5172.3000105.8K204 L208K204-L206 VanDerWaalsContact C-N 3.33Å; K204-L206 PolarHBondContact O-N 3.5Å; L206-L208 VanDerWaalsContact C-N 3.26Å; L206-L208 PolarHBondContact O-N 2.89Å
207D54.6Low53.7Low103 Ų103113.2 Ų113.255%0.55166%0.664SS**  trans-61.495.5164.7-115.2-7.3000107.4V205 M209 T214V205-D207 PolarHBondContact O-N 2.89Å; D207-M209 VanDerWaalsContact C-N 3.34Å; D207-M209 PolarHBondContact O-N 3.34Å; D207-T214 VanDerWaalsContact OD2-CG2 3.26Å; D207-T214 WeakPolarHBondContact OD2-CG2 3.3Å
208L55.5Low55.7Low131 Ų131112.9 Ų112.969%0.68666%0.659SS**  trans-73.691.9175.8-79157.8000107.6L206 V210L206-L208 VanDerWaalsContact C-N 3.26Å; L206-L208 PolarHBondContact O-N 2.89Å; L208-V210 PolarHBondContact O-N 2.88Å
209M47Very low58.2Low133 Ų133115.9 Ų115.966%0.65566%0.659SS**  trans-62118.8175.4-68.1179.9102.100110.2D207D207-M209 VanDerWaalsContact C-N 3.34Å; D207-M209 PolarHBondContact O-N 3.34Å
210V57.8Low60.7Low94 Ų94116.4 Ų116.457%0.5765%0.649SS**BIsolated β-bridgetrans-116.3111.6165.4179.50000106.5L208L208-V210 PolarHBondContact O-N 2.88Å
211Q56Low63.5Low183 Ų183116.6 Ų116.686%0.85564%0.642SS**THydrogen-bonded Turntrans58.248.8178.8-60.2-172-6.300115.8H213Q211-H213 PolarHBondContact O-N 3.36Å; Q211-H213 PolarHBondContact O-ND1 2.92Å
212G57.6Low65.8Low58 Ų58113.7 Ų113.760%0.59862%0.624SS**THydrogen-bonded Turntrans72.41.116300000117
213H62.9Low68.3Low144 Ų144117.7 Ų117.767%0.66762%0.624SS**BIsolated β-bridgetrans-123.9132.9174-62.380.1000109.8Q211 V215Q211-H213 PolarHBondContact O-N 3.36Å; Q211-H213 PolarHBondContact O-ND1 2.92Å; H213-V215 PolarHBondContact O-N 3Å; H213-V215 VanDerWaalsContact O-N 3.08Å
214T73.2Confident70.2Confident94 Ų94114 Ų11458%0.57760%0.601SS**  trans-68.6101.4173.744.60000109.3D207 D216D207-T214 VanDerWaalsContact OD2-CG2 3.26Å; D207-T214 WeakPolarHBondContact OD2-CG2 3.3Å; T214-D216 PolarHBondContact O-N 2.82Å
215V75.1Confident72.2Confident61 Ų61108.4 Ų108.437%0.3759%0.587SS.*  trans-84.9113.2177.2-178.70000109H213 F217H213-V215 PolarHBondContact O-N 3Å; H213-V215 VanDerWaalsContact O-N 3.08Å; V215-F217 HydrophobicContact CB-CZ 4.35Å; V215-F217 HydrophobicContact CG1-CD1 4.41Å; V215-F217 HydrophobicContact CG1-CE1 4.31Å; V215-F217 VanDerWaalsContact O-CD2 3.23Å; V215-F217 WeakPolarHBondContact O-CD2 3.36Å; V215-F217 PolarHBondContact O-N 3.28Å
216D84.1Confident73.9Confident67 Ų67112.7 Ų112.736%0.35859%0.588SS.*  trans-70.992.2171.1-175.6-21.2000109.5T214 V218 K219 H220T214-D216 PolarHBondContact O-N 2.82Å; D216-V218 PolarHBondContact O-N 3.2Å; D216-V218 WeakPolarHBondContact OD1-CB 3.22Å; D216-V218 PolarHBondContact OD1-N 3.21Å; D216-V218 VanDerWaalsContact OD1-N 3.08Å; D216-K219 HydrophobicContact CB-CB 4.23Å; D216-K219 HydrophobicContact CB-CD 4.33Å; D216-K219 HydrophobicContact CB-CG 4.45Å; D216-K219 PolarHBondContact O-N 3.16Å; D216-K219 PolarHBondContact OD1-N 3.22Å; D216-K219 WeakPolarHBondContact OD2-CD 3.44Å; D216-K219 WeakPolarHBondContact OD2-CE 3.45Å; D216-K219 VanDerWaalsContact OD2-CG 3.28Å; D216-K219 WeakPolarHBondContact OD2-CG 3.46Å; D216-K219 IonicContact OD2-NZ 2.67Å; D216-K219 PolarHBondContact OD2-NZ 3.04Å; D216-H220 WeakPolarHBondContact O-CB 3.43Å; D216-H220 PolarHBondContact O-N 3.05Å
217F84.4Confident75.4Confident116 Ų116114.2 Ų114.251%0.50959%0.589SS.*Hα-helixtrans-60.2-26.8-179.7-67.5-76.2000112.6V215 N221V215-F217 HydrophobicContact CB-CZ 4.35Å; V215-F217 HydrophobicContact CG1-CD1 4.41Å; V215-F217 HydrophobicContact CG1-CE1 4.31Å; V215-F217 VanDerWaalsContact O-CD2 3.23Å; V215-F217 WeakPolarHBondContact O-CD2 3.36Å; V215-F217 PolarHBondContact O-N 3.28Å; F217-N221 WeakPolarHBondContact O-CB 3.41Å; F217-N221 PolarHBondContact O-N 2.76Å
218V88Confident76.7Confident117 Ų117114.1 Ų114.171%0.70959%0.592SS**Hα-helixtrans-68.5-48.3177.9-176.70000109.6D216 A222D216-V218 PolarHBondContact O-N 3.2Å; D216-V218 WeakPolarHBondContact OD1-CB 3.22Å; D216-V218 PolarHBondContact OD1-N 3.21Å; D216-V218 VanDerWaalsContact OD1-N 3.08Å; V218-A222 VanDerWaalsContact O-CB 3.27Å; V218-A222 WeakPolarHBondContact O-CB 3.37Å; V218-A222 PolarHBondContact O-N 3.19Å
219K89.1Confident77.8Confident133 Ų133113.9 Ų113.958%0.57860%0.596SS**Hα-helixtrans-66.8-39.4175.5-72.8178.8-168.4133.10112.5D216 R223D216-K219 HydrophobicContact CB-CB 4.23Å; D216-K219 HydrophobicContact CB-CD 4.33Å; D216-K219 HydrophobicContact CB-CG 4.45Å; D216-K219 PolarHBondContact O-N 3.16Å; D216-K219 PolarHBondContact OD1-N 3.22Å; D216-K219 WeakPolarHBondContact OD2-CD 3.44Å; D216-K219 WeakPolarHBondContact OD2-CE 3.45Å; D216-K219 VanDerWaalsContact OD2-CG 3.28Å; D216-K219 WeakPolarHBondContact OD2-CG 3.46Å; D216-K219 IonicContact OD2-NZ 2.67Å; D216-K219 PolarHBondContact OD2-NZ 3.04Å; K219-R223 WeakPolarHBondContact O-CB 3.16Å; K219-R223 VanDerWaalsContact O-CG 3.31Å; K219-R223 WeakPolarHBondContact O-CG 3.25Å; K219-R223 PolarHBondContact O-N 3.22Å
220H88.8Confident79.1Confident122 Ų122115.8 Ų115.857%0.56561%0.608SS**Hα-helixtrans-62.7-47.1177.6-178.468.6000111.5D216 R223 A224D216-H220 WeakPolarHBondContact O-CB 3.43Å; D216-H220 PolarHBondContact O-N 3.05Å; H220-R223 PolarHBondContact O-N 3.15Å; H220-A224 WeakPolarHBondContact O-CB 3.27Å; H220-A224 PolarHBondContact O-N 2.89Å
221N89.8Confident79.8Confident112 Ų112120.9 Ų120.960%0.59962%0.617SS**Hα-helixtrans-69.3-38.3179.9-154.8-23.3000111.6F217 R223 A224 A225F217-N221 WeakPolarHBondContact O-CB 3.41Å; F217-N221 PolarHBondContact O-N 2.76Å; N221-R223 VanDerWaalsContact C-N 3.34Å; N221-R223 PolarHBondContact O-N 3.03Å; N221-A224 PolarHBondContact O-N 3.48Å; N221-A225 WeakPolarHBondContact O-CB 3.39Å; N221-A225 PolarHBondContact O-N 3.47Å
222A90.1Very high80.6Confident51 Ų51118.2 Ų118.242%0.42160%0.599SS.*Hα-helixtrans-60.8-41.3172.800000112.6V218 R226V218-A222 VanDerWaalsContact O-CB 3.27Å; V218-A222 WeakPolarHBondContact O-CB 3.37Å; V218-A222 PolarHBondContact O-N 3.19Å; A222-R226 WeakPolarHBondContact O-CG 3.22Å; A222-R226 PolarHBondContact O-N 3.26Å; A222-R226 VanDerWaalsContact O-N 3.14Å
223R89.6Confident81.7Confident181 Ų181118.3 Ų118.368%0.68359%0.59SS**Hα-helixtrans-68.8-38.1174.6-73177178.5-161.3-0.1112K219 H220 N221 K227K219-R223 WeakPolarHBondContact O-CB 3.16Å; K219-R223 VanDerWaalsContact O-CG 3.31Å; K219-R223 WeakPolarHBondContact O-CG 3.25Å; K219-R223 PolarHBondContact O-N 3.22Å; H220-R223 PolarHBondContact O-N 3.15Å; N221-R223 VanDerWaalsContact C-N 3.34Å; N221-R223 PolarHBondContact O-N 3.03Å; R223-K227 WeakPolarHBondContact O-CG 3.39Å; R223-K227 PolarHBondContact O-N 3.35Å
224A87.4Confident82.1Confident41 Ų41118 Ų11834%0.33959%0.589SS.*Hα-helixtrans-64.4-49.1175.700000111.1H220 N221 R226 K227 T228H220-A224 WeakPolarHBondContact O-CB 3.27Å; H220-A224 PolarHBondContact O-N 2.89Å; N221-A224 PolarHBondContact O-N 3.48Å; A224-R226 VanDerWaalsContact C-N 3.33Å; A224-R226 PolarHBondContact O-N 3.17Å; A224-K227 PolarHBondContact O-N 2.79Å; A224-T228 VanDerWaalsContact O-CG2 3.31Å; A224-T228 WeakPolarHBondContact O-CG2 3.43Å; A224-T228 PolarHBondContact O-N 3.27Å
225A85.3Confident82Confident54 Ų54117 Ų11745%0.44659%0.586SS.*Hα-helixtrans-57.7-42.317800000112.4N221 K227 T228N221-A225 WeakPolarHBondContact O-CB 3.39Å; N221-A225 PolarHBondContact O-N 3.47Å; A225-K227 VanDerWaalsContact C-N 3.26Å; A225-K227 PolarHBondContact O-N 2.97Å; A225-T228 PolarHBondContact O-N 3.1Å; A225-T228 PolarHBondContact O-OG1 2.83Å
226R83.5Confident81.6Confident228 Ų228117.8 Ų117.886%0.8659%0.588SS**Hα-helixtrans-63.8-28175.1-75-178.9178.5-136.61.2113.8A222 A224A222-R226 WeakPolarHBondContact O-CG 3.22Å; A222-R226 PolarHBondContact O-N 3.26Å; A222-R226 VanDerWaalsContact O-N 3.14Å; A224-R226 VanDerWaalsContact C-N 3.33Å; A224-R226 PolarHBondContact O-N 3.17Å
227K84.5Confident80.9Confident176 Ų176117.1 Ų117.177%0.76559%0.586SS**Hα-helixtrans-85.8-17.5177.4-71.1178.9179.6-172.70112.9R223 A224 A225 T229R223-K227 WeakPolarHBondContact O-CG 3.39Å; R223-K227 PolarHBondContact O-N 3.35Å; A224-K227 PolarHBondContact O-N 2.79Å; A225-K227 VanDerWaalsContact C-N 3.26Å; A225-K227 PolarHBondContact O-N 2.97Å; K227-T229 PolarHBondContact O-N 3.06Å
228T80.4Confident80Confident101 Ų101116.1 Ų116.162%0.6259%0.586SS**  trans-71.5117.1176.866.40000110.1A224 A225A224-T228 VanDerWaalsContact O-CG2 3.31Å; A224-T228 WeakPolarHBondContact O-CG2 3.43Å; A224-T228 PolarHBondContact O-N 3.27Å; A225-T228 PolarHBondContact O-N 3.1Å; A225-T228 PolarHBondContact O-OG1 2.83Å
229T78.6Confident79Confident125 Ų125115.6 Ų115.677%0.76758%0.579SS**  trans-89.1132.417051.70000109K227 R231K227-T229 PolarHBondContact O-N 3.06Å; T229-R231 PolarHBondContact O-N 3.49Å
230L75.1Confident77.8Confident174 Ų174118.4 Ų118.491%0.91159%0.586SS**  trans-65.7107.9176.2-70.3173.6000109R232L230-R232 PolarHBondContact O-N 3.25Å; L230-R232 VanDerWaalsContact O-N 3.15Å
231R72.6Confident77Confident200 Ų200118.1 Ų118.176%0.75559%0.588SS**  trans-72.9107176.9-123.1-72.8166.8177.7-3.3108.9T229T229-R231 PolarHBondContact O-N 3.49Å
232R73.1Confident75.9Confident128 Ų128120.6 Ų120.648%0.48359%0.594SS.*  trans-61.4138.4170.9-162.2175.4-169.9-140.90.7109.4L230 Q234 L236L230-R232 PolarHBondContact O-N 3.25Å; L230-R232 VanDerWaalsContact O-N 3.15Å; R232-Q234 PolarHBondContact O-N 3.2Å; R232-L236 HydrophobicContact CG-CB 4.5Å
233S79.3Confident74.7Confident59 Ų59123.4 Ų123.441%0.41361%0.608SS.*  trans-59.5136.2178.757.30000110.5S235 L236S233-S235 PolarHBondContact O-N 2.99Å; S233-S235 VanDerWaalsContact O-N 3.16Å; S233-S235 PolarHBondContact OG-OG 2.91Å; S233-L236 PolarHBondContact O-N 2.97Å; S233-L236 VanDerWaalsContact O-N 3.15Å
234Q71.6Confident73.5Confident138 Ų138120.1 Ų120.165%0.64561%0.607SS**Hα-helixtrans-59-29.1-178.5-69.3-177.6-3.300112.2R232 L236 T237 N238R232-Q234 PolarHBondContact O-N 3.2Å; Q234-L236 PolarHBondContact O-N 3.02Å; Q234-T237 PolarHBondContact O-N 3.05Å; Q234-N238 WeakPolarHBondContact O-CB 3.42Å; Q234-N238 PolarHBondContact O-N 3.09Å; Q234-N238 PolarHBondContact O-ND2 2.85Å
235S71.8Confident72.4Confident73 Ų73124 Ų12451%0.5163%0.629SS.*Hα-helixtrans-59.9-38.5176.952.70000113.8S233 L239S233-S235 PolarHBondContact O-N 2.99Å; S233-S235 VanDerWaalsContact O-N 3.16Å; S233-S235 PolarHBondContact OG-OG 2.91Å; S235-L239 PolarHBondContact O-N 3.01Å
236L67.3Low71.6Confident77 Ų77126 Ų12640%0.40364%0.64SS.*Hα-helixtrans-76.8-25.3177.5-75.5-175000113.3R232 S233 Q234 L239R232-L236 HydrophobicContact CG-CB 4.5Å; S233-L236 PolarHBondContact O-N 2.97Å; S233-L236 VanDerWaalsContact O-N 3.15Å; Q234-L236 PolarHBondContact O-N 3.02Å; L236-L239 HydrophobicContact CD2-CD1 4.33Å
237T68.1Low71.1Confident53 Ų53119.1 Ų119.133%0.32563%0.632SS.*Hα-helixtrans-73.9-44.9172.2-43.80000110Q234 L239 R240 D241Q234-T237 PolarHBondContact O-N 3.05Å; T237-L239 VanDerWaalsContact C-N 3.29Å; T237-L239 PolarHBondContact O-N 2.8Å; T237-R240 PolarHBondContact O-N 2.94Å; T237-D241 PolarHBondContact O-N 3.39Å
238N67.1Low70.8Confident96 Ų96115.2 Ų115.251%0.51362%0.623SS.*Hα-helixtrans-60.3-33.4178.3-69.4-32.2000113.7Q234 R240 K242Q234-N238 WeakPolarHBondContact O-CB 3.42Å; Q234-N238 PolarHBondContact O-N 3.09Å; Q234-N238 PolarHBondContact O-ND2 2.85Å; N238-R240 VanDerWaalsContact C-N 3.33Å; N238-K242 PolarHBondContact O-N 2.92Å; N238-K242 VanDerWaalsContact O-N 3.15Å
239L65.1Low70.9Confident105 Ų105120 Ų12055%0.5563%0.634SS.*Hα-helixtrans-69.8-26.5174.5-85.5157.9000113.6S235 L236 T237 V244S235-L239 PolarHBondContact O-N 3.01Å; L236-L239 HydrophobicContact CD2-CD1 4.33Å; T237-L239 VanDerWaalsContact C-N 3.29Å; T237-L239 PolarHBondContact O-N 2.8Å; L239-V244 HydrophobicContact CD2-CG2 4.44Å
240R65.4Low71.2Confident193 Ų193118.1 Ų118.173%0.72864%0.641SS**Hα-helixtrans-80-37175.7-77.6-149.4172.7-165.7-0.3112.2T237 N238T237-R240 PolarHBondContact O-N 2.94Å; N238-R240 VanDerWaalsContact C-N 3.33Å
241D70.5Confident71.7Confident116 Ų116116.7 Ų116.762%0.6263%0.629SS**Hα-helixtrans-81.2-21.4-176.3-59-29000112.6T237T237-D241 PolarHBondContact O-N 3.39Å
242K67.7Low72.5Confident164 Ų164110.3 Ų110.371%0.71361%0.612SS**SBendtrans-13293.9177.4-63.9-178-175.9-177.80110.1N238 V244N238-K242 PolarHBondContact O-N 2.92Å; N238-K242 VanDerWaalsContact O-N 3.15Å; K242-V244 PolarHBondContact O-N 3.42Å
243P64.8Low73.4Confident110 Ų110107.1 Ų107.171%0.71461%0.608SS**  trans-58.4125.7167.923.1-29.6000108.1
244V64.2Low73.9Confident111 Ų111111.4 Ų111.467%0.67362%0.622SS**  trans-52.8129.81721790000106.7L239 K242 S246L239-V244 HydrophobicContact CD2-CG2 4.44Å; K242-V244 PolarHBondContact O-N 3.42Å; V244-S246 VanDerWaalsContact C-N 3.28Å; V244-S246 PolarHBondContact O-N 3.39Å
245P65.4Low75Confident122 Ų122111.8 Ų111.879%0.79262%0.618SS**  trans-62.497.3179.324-31000107.8A247P245-A247 PolarHBondContact O-N 2.96Å
246S68.3Low76.1Confident98 Ų98111.6 Ų111.669%0.68561%0.611SS**  trans-61.5112.3169169.70000105.2V244 V248V244-S246 VanDerWaalsContact C-N 3.28Å; V244-S246 PolarHBondContact O-N 3.39Å; S246-V248 PolarHBondContact O-N 3.42Å; S246-V248 VanDerWaalsContact O-N 3.11Å
247A72.1Confident77.4Confident82 Ų82112.3 Ų112.368%0.67861%0.612SS**  trans-44.8124.8173.100000108.6P245 K249P245-A247 PolarHBondContact O-N 2.96Å; A247-K249 PolarHBondContact O-N 2.85Å
248V77.6Confident78.8Confident95 Ų95114.9 Ų114.958%0.57662%0.621SS**  trans-60.2112.5-177.1178.70000107.1S246 G250 Q251S246-V248 PolarHBondContact O-N 3.42Å; S246-V248 VanDerWaalsContact O-N 3.11Å; V248-G250 PolarHBondContact O-N 3.32Å; V248-Q251 HydrophobicContact CB-CB 4.44Å; V248-Q251 HydrophobicContact CB-CG 4.3Å; V248-Q251 HydrophobicContact CG1-CG 4.13Å; V248-Q251 PolarHBondContact O-N 2.99Å; V248-Q251 VanDerWaalsContact O-N 3.08Å
249K82.3Confident80.2Confident200 Ų200116.4 Ų116.487%0.8762%0.619SS**THydrogen-bonded Turntrans-57.7130.4-179.2-72-178.8179.3179.40108.7A247A247-K249 PolarHBondContact O-N 2.85Å
250G84.9Confident81.7Confident87 Ų87117 Ų11790%0.89762%0.617SS**THydrogen-bonded Turntrans94.1-10.3-178.600000115V248V248-G250 PolarHBondContact O-N 3.32Å
251Q87.6Confident83.2Confident144 Ų144113.6 Ų113.667%0.67361%0.608SS**PPolyproline II helixtrans-90.8139.4169.9-71.4-165.1-5.300111.8V248 P253V248-Q251 HydrophobicContact CB-CB 4.44Å; V248-Q251 HydrophobicContact CB-CG 4.3Å; V248-Q251 HydrophobicContact CG1-CG 4.13Å; V248-Q251 PolarHBondContact O-N 2.99Å; V248-Q251 VanDerWaalsContact O-N 3.08Å; Q251-P253 WeakPolarHBondContact O-CD 3.5Å
252V88.8Confident84.5Confident66 Ų66112.8 Ų112.840%0.460%0.6SS.*PPolyproline II helixtrans-73.5127.2174.5176.30000108.1L256 E257V252-L256 HydrophobicContact CG1-CB 3.64Å; V252-L256 HydrophobicContact CG1-CD1 4.08Å; V252-L256 HydrophobicContact CG1-CG 4.47Å; V252-E257 HydrophobicContact CB-CG 4.42Å; V252-E257 HydrophobicContact CG1-CG 3.99Å
253P92.1Very high85.8Confident60 Ų60112.7 Ų112.739%0.3960%0.596SS.*PPolyproline II helixtrans-55.2139.8173.8-30.135.7000113Q251 Y255 L256Q251-P253 WeakPolarHBondContact O-CD 3.5Å; P253-Y255 HydrophobicContact CB-CD1 3.46Å; P253-Y255 VanDerWaalsContact CB-CD1 3.46Å; P253-Y255 HydrophobicContact CB-CE1 3.25Å; P253-Y255 HydrophobicContact CG-CE1 3.9Å; P253-Y255 PolarHBondContact O-N 3.26Å; P253-Y255 VanDerWaalsContact O-N 3.09Å; P253-L256 WeakPolarHBondContact O-CB 3.29Å; P253-L256 PolarHBondContact O-N 2.88Å
254Q90.1Very high87.3Confident150 Ų150113.6 Ų113.670%0.70159%0.59SS**Hα-helixtrans-50-40.8-176.7-70.6176.7-1300113.3L256 E257 E258Q254-L256 PolarHBondContact O-N 3.49Å; Q254-E257 WeakPolarHBondContact O-CB 3.43Å; Q254-E257 PolarHBondContact O-N 3.47Å; Q254-E258 WeakPolarHBondContact O-CG 3.34Å; Q254-E258 PolarHBondContact O-N 2.93Å
255Y94Very high88.8Confident146 Ų146115 Ų11557%0.57359%0.587SS**Hα-helixtrans-61.3-29.5-179.777.4-93000113.4P253 R259P253-Y255 HydrophobicContact CB-CD1 3.46Å; P253-Y255 VanDerWaalsContact CB-CD1 3.46Å; P253-Y255 HydrophobicContact CB-CE1 3.25Å; P253-Y255 HydrophobicContact CG-CE1 3.9Å; P253-Y255 PolarHBondContact O-N 3.26Å; P253-Y255 VanDerWaalsContact O-N 3.09Å; Y255-R259 VanDerWaalsContact O-CB 3.27Å; Y255-R259 WeakPolarHBondContact O-CB 3.49Å; Y255-R259 PolarHBondContact O-N 3.24Å
256L95.5Very high90.1Very high68 Ų68113.8 Ų113.836%0.35657%0.571SS.*Hα-helixtrans-76-35176.2-68.7178.9000111.3V252 P253 Q254 R259 K260V252-L256 HydrophobicContact CG1-CB 3.64Å; V252-L256 HydrophobicContact CG1-CD1 4.08Å; V252-L256 HydrophobicContact CG1-CG 4.47Å; P253-L256 WeakPolarHBondContact O-CB 3.29Å; P253-L256 PolarHBondContact O-N 2.88Å; Q254-L256 PolarHBondContact O-N 3.49Å; L256-R259 PolarHBondContact O-N 3.25Å; L256-K260 WeakPolarHBondContact O-CG 3.35Å; L256-K260 PolarHBondContact O-N 2.96Å
257E94.4Very high91.2Very high93 Ų93113.1 Ų113.144%0.43556%0.557SS.*Hα-helixtrans-66.8-44.9174-57.7-173.4162.900110.9V252 Q254 R259 K260 K261V252-E257 HydrophobicContact CB-CG 4.42Å; V252-E257 HydrophobicContact CG1-CG 3.99Å; Q254-E257 WeakPolarHBondContact O-CB 3.43Å; Q254-E257 PolarHBondContact O-N 3.47Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.23Å; E257-K260 PolarHBondContact O-N 2.94Å; E257-K261 WeakPolarHBondContact O-CG 3.35Å; E257-K261 PolarHBondContact O-N 3.45Å
258E96.1Very high92.2Very high107 Ų107114 Ų11450%0.555%0.547SS..Hα-helixtrans-59.4-42.5173.5-70.5172.6-176.900111.4Q254 K260 K261 Q262Q254-E258 WeakPolarHBondContact O-CG 3.34Å; Q254-E258 PolarHBondContact O-N 2.93Å; E258-K260 PolarHBondContact O-N 2.81Å; E258-K261 WeakPolarHBondContact O-CB 3.42Å; E258-K261 PolarHBondContact O-N 3.44Å; E258-Q262 WeakPolarHBondContact O-CG 3.18Å; E258-Q262 PolarHBondContact O-N 3.17Å
259R97.9Very high92.8Very high127 Ų127115 Ų11548%0.47955%0.546SS..Hα-helixtrans-61.8-42.9175.7-176.6120.8-70.7171.3-3.2112.4Y255 L256 E257 K261 Q262 W263Y255-R259 VanDerWaalsContact O-CB 3.27Å; Y255-R259 WeakPolarHBondContact O-CB 3.49Å; Y255-R259 PolarHBondContact O-N 3.24Å; L256-R259 PolarHBondContact O-N 3.25Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.23Å; R259-K261 VanDerWaalsContact C-N 3.33Å; R259-K261 PolarHBondContact O-N 3.18Å; R259-Q262 VanDerWaalsContact NH2-OE1 3.16Å; R259-Q262 WeakPolarHBondContact O-CB 3.49Å; R259-Q262 PolarHBondContact O-N 2.87Å; R259-W263 HydrophobicContact CG-CD2 4.3Å; R259-W263 HydrophobicContact CG-CH2 4.27Å; R259-W263 HydrophobicContact CG-CZ2 4.04Å; R259-W263 HydrophobicContact CG-CZ3 4.5Å; R259-W263 PolarHBondContact O-N 3.46Å
260K96.9Very high93.1Very high118 Ų118111.9 Ų111.951%0.51353%0.528SS..Hα-helixtrans-61.6-42.6175.3-74.6176.4-179.7-178.40111.5L256 E257 E258 Q262 W263 Q264L256-K260 WeakPolarHBondContact O-CG 3.35Å; L256-K260 PolarHBondContact O-N 2.96Å; E257-K260 PolarHBondContact O-N 2.94Å; E258-K260 PolarHBondContact O-N 2.81Å; K260-Q262 VanDerWaalsContact C-N 3.33Å; K260-Q262 PolarHBondContact O-N 3.45Å; K260-W263 PolarHBondContact O-N 2.83Å; K260-Q264 WeakPolarHBondContact O-CG 3.22Å; K260-Q264 PolarHBondContact O-N 3.24Å
261K96.8Very high93Very high121 Ų121114.4 Ų114.453%0.52652%0.515SS..Hα-helixtrans-62.5-40.3175.4-69.1171.8-176.7173.10111.6E257 E258 R259 Q264 K265E257-K261 WeakPolarHBondContact O-CG 3.35Å; E257-K261 PolarHBondContact O-N 3.45Å; E258-K261 WeakPolarHBondContact O-CB 3.42Å; E258-K261 PolarHBondContact O-N 3.44Å; R259-K261 VanDerWaalsContact C-N 3.33Å; R259-K261 PolarHBondContact O-N 3.18Å; K261-Q264 PolarHBondContact O-N 3.46Å; K261-K265 WeakPolarHBondContact O-CG 3.38Å; K261-K265 PolarHBondContact O-N 3.29Å
262Q96.8Very high92.7Very high99 Ų99116.2 Ų116.246%0.46352%0.515SS..Hα-helixtrans-59.6-49.1174.4-73.9171.3-4.700111.2E258 R259 K260 Q264 K265 E266E258-Q262 WeakPolarHBondContact O-CG 3.18Å; E258-Q262 PolarHBondContact O-N 3.17Å; R259-Q262 VanDerWaalsContact NH2-OE1 3.16Å; R259-Q262 WeakPolarHBondContact O-CB 3.49Å; R259-Q262 PolarHBondContact O-N 2.87Å; K260-Q262 VanDerWaalsContact C-N 3.33Å; K260-Q262 PolarHBondContact O-N 3.45Å; Q262-Q264 VanDerWaalsContact C-N 3.33Å; Q262-Q264 PolarHBondContact O-N 3.02Å; Q262-K265 PolarHBondContact O-N 2.84Å; Q262-E266 WeakPolarHBondContact O-CB 3.32Å; Q262-E266 PolarHBondContact O-N 3.44Å
263W96.1Very high92.3Very high162 Ų162119.4 Ų119.461%0.61453%0.53SS*.Hα-helixtrans-62.4-38.8177.7-72.4-26000113.3R259 K260 E266 E267R259-W263 HydrophobicContact CG-CD2 4.3Å; R259-W263 HydrophobicContact CG-CH2 4.27Å; R259-W263 HydrophobicContact CG-CZ2 4.04Å; R259-W263 HydrophobicContact CG-CZ3 4.5Å; R259-W263 PolarHBondContact O-N 3.46Å; K260-W263 PolarHBondContact O-N 2.83Å; W263-E266 PolarHBondContact O-N 3.49Å; W263-E267 VanDerWaalsContact O-CB 3.29Å; W263-E267 WeakPolarHBondContact O-CB 3.42Å; W263-E267 PolarHBondContact O-N 2.87Å
264Q95.8Very high91.7Very high130 Ų130119 Ų11961%0.60753%0.532SS*.Hα-helixtrans-62.3-45.5175.5-75.2175.2-14.800111.7K260 K261 Q262 E267 E268K260-Q264 WeakPolarHBondContact O-CG 3.22Å; K260-Q264 PolarHBondContact O-N 3.24Å; K261-Q264 PolarHBondContact O-N 3.46Å; Q262-Q264 VanDerWaalsContact C-N 3.33Å; Q262-Q264 PolarHBondContact O-N 3.02Å; Q264-E267 PolarHBondContact O-N 2.68Å; Q264-E268 WeakPolarHBondContact O-CB 3.44Å; Q264-E268 PolarHBondContact O-N 3.38Å
265K95.3Very high90.9Very high139 Ų139117.2 Ų117.260%0.60453%0.533SS*.Hα-helixtrans-61.2-46.6175.8-72.7179.2179.1-172.10111.7K261 Q262 E267 E268 E269K261-K265 WeakPolarHBondContact O-CG 3.38Å; K261-K265 PolarHBondContact O-N 3.29Å; Q262-K265 PolarHBondContact O-N 2.84Å; K265-E267 VanDerWaalsContact C-N 3.34Å; K265-E267 PolarHBondContact O-N 3.07Å; K265-E268 PolarHBondContact O-N 3.23Å; K265-E269 WeakPolarHBondContact O-CG 3.48Å; K265-E269 PolarHBondContact O-N 3.13Å
266E93.8Very high89.9Confident98 Ų98114.6 Ų114.646%0.45853%0.529SS..Hα-helixtrans-64.7-38.9179.4-165.8-162.513800111.8Q262 W263 E269 R270Q262-E266 WeakPolarHBondContact O-CB 3.32Å; Q262-E266 PolarHBondContact O-N 3.44Å; W263-E266 PolarHBondContact O-N 3.49Å; E266-E269 PolarHBondContact O-N 3.32Å; E266-R270 WeakPolarHBondContact O-CB 3.43Å; E266-R270 PolarHBondContact O-N 3.38Å; E266-R270 IonicContact OE1-NH2 2.76Å; E266-R270 PolarHBondContact OE1-NH2 3.32Å
267E91.6Very high88.9Confident84 Ų84117.7 Ų117.739%0.39355%0.553SS.*Hα-helixtrans-67.8-36.5175.7-169.6-179.1167.200111.9W263 Q264 K265 R270 K271W263-E267 VanDerWaalsContact O-CB 3.29Å; W263-E267 WeakPolarHBondContact O-CB 3.42Å; W263-E267 PolarHBondContact O-N 2.87Å; Q264-E267 PolarHBondContact O-N 2.68Å; K265-E267 VanDerWaalsContact C-N 3.34Å; K265-E267 PolarHBondContact O-N 3.07Å; E267-R270 PolarHBondContact O-N 3.11Å; E267-K271 HydrophobicContact CG-CD 4.5Å; E267-K271 WeakPolarHBondContact O-CB 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.32Å; E267-K271 WeakPolarHBondContact O-CG 3.14Å; E267-K271 PolarHBondContact O-N 3.38Å; E267-K271 WeakPolarHBondContact OE1-CE 3.27Å; E267-K271 IonicContact OE1-NZ 3.2Å; E267-K271 PolarHBondContact OE1-NZ 3.14Å
268E92.1Very high88.1Confident99 Ų99122.7 Ų122.746%0.46357%0.568SS.*Hα-helixtrans-66.3-46.4173.8-168.5-177.6171.200111.4Q264 K265 R270 K271 R272Q264-E268 WeakPolarHBondContact O-CB 3.44Å; Q264-E268 PolarHBondContact O-N 3.38Å; K265-E268 PolarHBondContact O-N 3.23Å; E268-R270 VanDerWaalsContact C-N 3.31Å; E268-R270 PolarHBondContact O-N 2.97Å; E268-K271 PolarHBondContact O-N 2.94Å; E268-R272 VanDerWaalsContact O-CG 3.3Å; E268-R272 WeakPolarHBondContact O-CG 3.3Å; E268-R272 PolarHBondContact O-N 3.26Å; E268-R272 IonicContact OE1-CZ 3.78Å; E268-R272 IonicContact OE1-NE 3.23Å; E268-R272 PolarHBondContact OE1-NE 3.18Å; E268-R272 IonicContact OE1-NH2 3.37Å; E268-R272 PolarHBondContact OE1-NH2 2.97Å
269E90.3Very high87.5Confident117 Ų117119.6 Ų119.655%0.54756%0.557SS.*Hα-helixtrans-59.7-42.6173.4-74.6176.8-176.700111.3K265 E266 K271 R272 N273K265-E269 WeakPolarHBondContact O-CG 3.48Å; K265-E269 PolarHBondContact O-N 3.13Å; E266-E269 PolarHBondContact O-N 3.32Å; E269-K271 VanDerWaalsContact C-N 3.34Å; E269-K271 PolarHBondContact O-N 2.97Å; E269-R272 PolarHBondContact O-N 3.48Å; E269-N273 VanDerWaalsContact O-CB 3.28Å; E269-N273 WeakPolarHBondContact O-CB 3.43Å; E269-N273 PolarHBondContact O-N 2.91Å; E269-N273 PolarHBondContact O-ND2 3.4Å
270R88.2Confident87Confident134 Ų134116.1 Ų116.151%0.50655%0.55SS.*Hα-helixtrans-62.5-39.9175.1-166.9-170-50.8121.85.6111.8E266 E267 E268 A274E266-R270 WeakPolarHBondContact O-CB 3.43Å; E266-R270 PolarHBondContact O-N 3.38Å; E266-R270 IonicContact OE1-NH2 2.76Å; E266-R270 PolarHBondContact OE1-NH2 3.32Å; E267-R270 PolarHBondContact O-N 3.11Å; E268-R270 VanDerWaalsContact C-N 3.31Å; E268-R270 PolarHBondContact O-N 2.97Å; R270-A274 WeakPolarHBondContact O-CA 3.33Å; R270-A274 WeakPolarHBondContact O-CB 3.47Å; R270-A274 PolarHBondContact O-N 3.1Å
271K82.5Confident86.4Confident140 Ų140116.4 Ų116.461%0.60956%0.564SS**Hα-helixtrans-69.4-38175.9-78.2173.8-175.2162.10112.2E267 E268 E269 A274E267-K271 HydrophobicContact CG-CD 4.5Å; E267-K271 WeakPolarHBondContact O-CB 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.32Å; E267-K271 WeakPolarHBondContact O-CG 3.14Å; E267-K271 PolarHBondContact O-N 3.38Å; E267-K271 WeakPolarHBondContact OE1-CE 3.27Å; E267-K271 IonicContact OE1-NZ 3.2Å; E267-K271 PolarHBondContact OE1-NZ 3.14Å; E268-K271 PolarHBondContact O-N 2.94Å; E269-K271 VanDerWaalsContact C-N 3.34Å; E269-K271 PolarHBondContact O-N 2.97Å; K271-A274 PolarHBondContact O-N 3.48Å
272R82.8Confident85.9Confident183 Ų183113.3 Ų113.369%0.69157%0.566SS**Hα-helixtrans-65.9-40.7174.8-72174.9-176.2-159.42.6111.9E268 E269E268-R272 VanDerWaalsContact O-CG 3.3Å; E268-R272 WeakPolarHBondContact O-CG 3.3Å; E268-R272 PolarHBondContact O-N 3.26Å; E268-R272 IonicContact OE1-CZ 3.78Å; E268-R272 IonicContact OE1-NE 3.23Å; E268-R272 PolarHBondContact OE1-NE 3.18Å; E268-R272 IonicContact OE1-NH2 3.37Å; E268-R272 PolarHBondContact OE1-NH2 2.97Å; E269-R272 PolarHBondContact O-N 3.48Å
273N79.8Confident85.6Confident133 Ų133111.9 Ų111.971%0.71156%0.56SS**Hα-helixtrans-84.4-14.6179.6-65.6-22.6000113E269 P275E269-N273 VanDerWaalsContact O-CB 3.28Å; E269-N273 WeakPolarHBondContact O-CB 3.43Å; E269-N273 PolarHBondContact O-N 2.91Å; E269-N273 PolarHBondContact O-ND2 3.4Å; N273-P275 WeakPolarHBondContact O-CD 3.34Å
274A78.4Confident85.3Confident52 Ų52110 Ų11043%0.4356%0.559SS.*SBendtrans-64.2119.7177.200000108R270 K271 D276R270-A274 WeakPolarHBondContact O-CA 3.33Å; R270-A274 WeakPolarHBondContact O-CB 3.47Å; R270-A274 PolarHBondContact O-N 3.1Å; K271-A274 PolarHBondContact O-N 3.48Å; A274-D276 PolarHBondContact O-N 3.27Å
275P73.8Confident85.1Confident112 Ų112108.2 Ų108.273%0.72755%0.552SS**PPolyproline II helixtrans-61.2137.517525.8-32.8000108.7N273N273-P275 WeakPolarHBondContact O-CD 3.34Å
276D72.6Confident84.9Confident91 Ų91102.9 Ų102.949%0.48753%0.53SS..PPolyproline II helixtrans-54.1127.2-179.1-102.2-11.2000109.7A274 R278 V279A274-D276 PolarHBondContact O-N 3.27Å; D276-R278 PolarHBondContact O-N 2.86Å; D276-V279 HydrophobicContact CB-CG2 3.64Å; D276-V279 WeakPolarHBondContact O-CB 3.28Å; D276-V279 PolarHBondContact O-N 3.29Å
277P75.3Confident85Confident132 Ų132101.2 Ų101.286%0.85753%0.527SS*.THydrogen-bonded Turntrans-65.6-8.7-176.426-35000113.4
278R77.7Confident85.2Confident199 Ų199101.4 Ų101.475%0.75153%0.531SS*.THydrogen-bonded Turntrans-85-19.3173.8-69.5-172.6178.5-134.61.9113.2D276 P280D276-R278 PolarHBondContact O-N 2.86Å; R278-P280 WeakPolarHBondContact O-CD 3.47Å
279V83Confident85.3Confident42 Ų4298.6 Ų98.626%0.25553%0.529SS..SBendtrans-78.7119.3-177.8-175.50000108.4D276 H283 Y348D276-V279 HydrophobicContact CB-CG2 3.64Å; D276-V279 WeakPolarHBondContact O-CB 3.28Å; D276-V279 PolarHBondContact O-N 3.29Å; V279-H283 VanDerWaalsContact CG1-O 3.28Å; V279-H283 WeakPolarHBondContact CG1-O 3.28Å; V279-Y348 HydrophobicContact CB-CE1 4.35Å; V279-Y348 HydrophobicContact CG1-CD1 4.18Å; V279-Y348 HydrophobicContact CG1-CE1 4.3Å; V279-Y348 HydrophobicContact CG2-CD1 4.41Å; V279-Y348 HydrophobicContact CG2-CE1 3.71Å
280P87Confident85.6Confident53 Ų5397.9 Ų97.934%0.34453%0.526SS..PPolyproline II helixtrans-61.4143.8175.1-22.234.5000111.1R278 G282 H283R278-P280 WeakPolarHBondContact O-CD 3.47Å; P280-G282 PolarHBondContact O-N 3.48Å; P280-H283 HydrophobicContact CB-CB 4.32Å; P280-H283 WeakPolarHBondContact O-CB 3.29Å; P280-H283 PolarHBondContact O-N 3.22Å; P280-H283 VanDerWaalsContact O-N 3.14Å
281P85.4Confident86Confident125 Ų12592.6 Ų92.681%0.81251%0.505SS*.THydrogen-bonded Turntrans-54.6139.8175.5-24.433.2000112H283P281-H283 PolarHBondContact O-N 3.29Å; P281-H283 PolarHBondContact O-ND1 3Å
282G86.8Confident86.6Confident55 Ų5590.3 Ų90.357%0.56750%0.497SS*.THydrogen-bonded Turntrans70.510.9-178.800000114.9P280 V351P280-G282 PolarHBondContact O-N 3.48Å; G282-V351 PolarHBondContact O-N 2.93Å
283H89.9Confident87.3Confident70 Ų7087.8 Ų87.832%0.32449%0.493SS..EExtended strand (participates in β ladder)trans-116.1150.4174.2-61.963.7000110.4V279 P280 P281 V349V279-H283 VanDerWaalsContact CG1-O 3.28Å; V279-H283 WeakPolarHBondContact CG1-O 3.28Å; P280-H283 HydrophobicContact CB-CB 4.32Å; P280-H283 WeakPolarHBondContact O-CB 3.29Å; P280-H283 PolarHBondContact O-N 3.22Å; P280-H283 VanDerWaalsContact O-N 3.14Å; P281-H283 PolarHBondContact O-N 3.29Å; P281-H283 PolarHBondContact O-ND1 3Å; H283-V349 CarbonylContact C-O 3.54Å; H283-V349 VanDerWaalsContact CA-O 3.26Å; H283-V349 WeakPolarHBondContact CA-O 3.26Å
284M89.8Confident88.1Confident121 Ų12184.1 Ų84.160%0.59648%0.475SS*.EExtended strand (participates in β ladder)trans-120.2144.6175.6-175.3169.363.400109.3L286 Y348 V349 V351M284-L286 PolarHBondContact O-N 3.02Å; M284-Y348 CarbonylContact O-C 3.57Å; M284-Y348 WeakPolarHBondContact O-CA 3.42Å; M284-V349 PolarHBondContact N-O 3.01Å; M284-V349 PolarHBondContact O-N 2.84Å; M284-V351 HydrophobicContact CB-CG2 3.72Å
285M90.5Very high89Confident94 Ų9482.7 Ų82.746%0.46346%0.46SS..EExtended strand (participates in β ladder)trans-70.7126.2173.7-168.9177.275.600109.3Y348M285-Y348 HydrophobicContact CB-CD1 3.99Å; M285-Y348 HydrophobicContact CB-CE1 3.84Å; M285-Y348 HydrophobicContact CG-CD1 4.32Å; M285-Y348 HydrophobicContact CG-CE1 3.96Å
286L92.9Very high90.2Very high27 Ų2783.4 Ų83.414%0.14145%0.452CS..PPolyproline II helixtrans-71.1128.5175-169.768000109.4M284 E290 R291 F342 V347 V349M284-L286 PolarHBondContact O-N 3.02Å; L286-E290 HydrophobicContact CD1-CB 4.13Å; L286-E290 VanDerWaalsContact CD1-OE2 3.3Å; L286-E290 WeakPolarHBondContact CD1-OE2 3.31Å; L286-E290 HydrophobicContact CG-CB 4.27Å; L286-R291 HydrophobicContact CD2-CB 4Å; L286-R291 HydrophobicContact CG-CB 4.4Å; L286-F342 HydrophobicContact CD2-CD1 4.18Å; L286-F342 HydrophobicContact CD2-CE1 3.62Å; L286-V347 HydrophobicContact CB-CB 4.3Å; L286-V347 HydrophobicContact CD2-CG1 4.47Å; L286-V347 PolarHBondContact N-O 3Å; L286-V349 HydrophobicContact CB-CG2 4.12Å; L286-V349 HydrophobicContact CD1-CG2 4.2Å; L286-V349 HydrophobicContact CD2-CG2 4.34Å; L286-V349 HydrophobicContact CG-CG2 4.47Å
287P95.4Very high91.4Very high62 Ų6282.3 Ų82.340%0.40345%0.452SS..PPolyproline II helixtrans-57147175.2-24.434.3000112.5G289 E290 R291P287-G289 VanDerWaalsContact C-N 3.28Å; P287-G289 PolarHBondContact O-N 3.33Å; P287-E290 HydrophobicContact CB-CG 4.48Å; P287-E290 PolarHBondContact O-N 3.43Å; P287-R291 WeakPolarHBondContact O-CB 3.34Å; P287-R291 PolarHBondContact O-N 3Å
288D94.1Very high92.5Very high88 Ų8877.6 Ų77.647%0.47142%0.419SS..Hα-helixtrans-62.5-32.3-176.7-84.1-47.6000113.9R291 Q292D288-R291 IonicContact OD1-CZ 3.93Å; D288-R291 IonicContact OD1-NE 3.01Å; D288-R291 PolarHBondContact OD1-NE 3.19Å; D288-R291 IonicContact OD1-NH2 3.9Å; D288-R291 PolarHBondContact OD1-NH2 2.86Å; D288-Q292 WeakPolarHBondContact O-CB 3.44Å; D288-Q292 WeakPolarHBondContact O-CG 3.47Å; D288-Q292 PolarHBondContact O-N 3.44Å
289G95.4Very high93.5Very high40 Ų4073.5 Ų73.541%0.41241%0.407SS..Hα-helixtrans-61.9-56.9175.600000111.5P287 R291 Q292 E293P287-G289 VanDerWaalsContact C-N 3.28Å; P287-G289 PolarHBondContact O-N 3.33Å; G289-R291 VanDerWaalsContact C-N 3.28Å; G289-R291 PolarHBondContact O-N 2.99Å; G289-Q292 PolarHBondContact O-N 3.27Å; G289-Q292 VanDerWaalsContact O-N 3.11Å; G289-E293 WeakPolarHBondContact O-CG 3.42Å; G289-E293 PolarHBondContact O-N 3.11Å
290E95.8Very high94.2Very high103 Ų10376.8 Ų76.848%0.48142%0.423SS..Hα-helixtrans-59.5-39.1178.2-63.7176.7-167.700111.9L286 P287 E293 T294L286-E290 HydrophobicContact CD1-CB 4.13Å; L286-E290 VanDerWaalsContact CD1-OE2 3.3Å; L286-E290 WeakPolarHBondContact CD1-OE2 3.31Å; L286-E290 HydrophobicContact CG-CB 4.27Å; P287-E290 HydrophobicContact CB-CG 4.48Å; P287-E290 PolarHBondContact O-N 3.43Å; E290-E293 PolarHBondContact O-N 2.84Å; E290-T294 PolarHBondContact O-N 3.39Å; E290-T294 PolarHBondContact O-OG1 3.48Å
291R96.2Very high94.8Very high22 Ų2276.9 Ų76.98%0.08342%0.422CS..Hα-helixtrans-61.3-44.2174.9-176.8-175.665.583.5-3.8112.2L286 P287 D288 G289 T294 L295 F342 R344 V347L286-R291 HydrophobicContact CD2-CB 4Å; L286-R291 HydrophobicContact CG-CB 4.4Å; P287-R291 WeakPolarHBondContact O-CB 3.34Å; P287-R291 PolarHBondContact O-N 3Å; D288-R291 IonicContact OD1-CZ 3.93Å; D288-R291 IonicContact OD1-NE 3.01Å; D288-R291 PolarHBondContact OD1-NE 3.19Å; D288-R291 IonicContact OD1-NH2 3.9Å; D288-R291 PolarHBondContact OD1-NH2 2.86Å; G289-R291 VanDerWaalsContact C-N 3.28Å; G289-R291 PolarHBondContact O-N 2.99Å; R291-T294 WeakPolarHBondContact CA-OG1 3.29Å; R291-T294 PolarHBondContact O-OG1 3.42Å; R291-L295 VanDerWaalsContact O-CB 3.28Å; R291-L295 WeakPolarHBondContact O-CB 3.43Å; R291-L295 PolarHBondContact O-N 2.89Å; R291-F342 HydrophobicContact CG-CD1 4.24Å; R291-F342 PolarHBondContact NH1-O 3.19Å; R291-R344 WeakPolarHBondContact CD-O 3.24Å; R291-R344 PolarHBondContact NH1-O 3.09Å; R291-V347 HydrophobicContact CG-CG2 4.07Å
292Q96.9Very high95.4Very high93 Ų9373.4 Ų73.444%0.43540%0.395SS..Hα-helixtrans-70.7-36.8179.6-74175.718.700111.9D288 G289 L295 K296D288-Q292 WeakPolarHBondContact O-CB 3.44Å; D288-Q292 WeakPolarHBondContact O-CG 3.47Å; D288-Q292 PolarHBondContact O-N 3.44Å; G289-Q292 PolarHBondContact O-N 3.27Å; G289-Q292 VanDerWaalsContact O-N 3.11Å; Q292-L295 PolarHBondContact O-N 3.38Å; Q292-K296 VanDerWaalsContact O-CG 3.27Å; Q292-K296 WeakPolarHBondContact O-CG 3.41Å; Q292-K296 PolarHBondContact O-N 2.88Å
293E97.4Very high95.9Very high130 Ų13072.2 Ų72.261%0.60738%0.384SS*.Hα-helixtrans-63.6-49.1175.6-72.4173-170.700111.6G289 E290 L295 K296 S297G289-E293 WeakPolarHBondContact O-CG 3.42Å; G289-E293 PolarHBondContact O-N 3.11Å; E290-E293 PolarHBondContact O-N 2.84Å; E293-L295 VanDerWaalsContact C-N 3.35Å; E293-L295 PolarHBondContact O-N 3.31Å; E293-K296 PolarHBondContact O-N 2.96Å; E293-S297 PolarHBondContact O-N 3.39Å
294T96.8Very high96.3Very high55 Ų5572.6 Ų72.634%0.33739%0.394SS..Hα-helixtrans-60-43.5174.240.70000111.8E290 R291 K296 S297 L298E290-T294 PolarHBondContact O-N 3.39Å; E290-T294 PolarHBondContact O-OG1 3.48Å; R291-T294 WeakPolarHBondContact CA-OG1 3.29Å; R291-T294 PolarHBondContact O-OG1 3.42Å; T294-K296 VanDerWaalsContact C-N 3.33Å; T294-K296 PolarHBondContact O-N 3.29Å; T294-S297 PolarHBondContact O-N 2.99Å; T294-L298 WeakPolarHBondContact O-CB 3.47Å; T294-L298 VanDerWaalsContact O-CG 3.3Å; T294-L298 WeakPolarHBondContact O-CG 3.46Å; T294-L298 PolarHBondContact O-N 3.4Å
295L97.4Very high96.6Very high22 Ų2268 Ų6812%0.11537%0.372CS..Hα-helixtrans-60.5-40175.7-177.663.8000112.7R291 Q292 E293 K299 I339 F342R291-L295 VanDerWaalsContact O-CB 3.28Å; R291-L295 WeakPolarHBondContact O-CB 3.43Å; R291-L295 PolarHBondContact O-N 2.89Å; Q292-L295 PolarHBondContact O-N 3.38Å; E293-L295 VanDerWaalsContact C-N 3.35Å; E293-L295 PolarHBondContact O-N 3.31Å; L295-K299 WeakPolarHBondContact O-CG 3.12Å; L295-K299 PolarHBondContact O-N 3.45Å; L295-K299 VanDerWaalsContact O-N 3.09Å; L295-I339 HydrophobicContact CD1-CG2 4.02Å; L295-F342 HydrophobicContact CB-CB 4.26Å; L295-F342 HydrophobicContact CD1-CB 4.08Å
296K98.1Very high97Very high127 Ų12765.8 Ų65.855%0.55236%0.363SS*.Hα-helixtrans-63.8-50.1175.3-74.1169.4-176.6176.60110.7Q292 E293 T294 L298 K299 D300Q292-K296 VanDerWaalsContact O-CG 3.27Å; Q292-K296 WeakPolarHBondContact O-CG 3.41Å; Q292-K296 PolarHBondContact O-N 2.88Å; E293-K296 PolarHBondContact O-N 2.96Å; T294-K296 VanDerWaalsContact C-N 3.33Å; T294-K296 PolarHBondContact O-N 3.29Å; K296-L298 VanDerWaalsContact C-N 3.29Å; K296-L298 PolarHBondContact O-N 3.2Å; K296-K299 WeakPolarHBondContact O-CB 3.22Å; K296-K299 PolarHBondContact O-N 3.22Å; K296-D300 VanDerWaalsContact O-CG 3.26Å; K296-D300 PolarHBondContact O-N 2.9Å
297S98.2Very high97.2Very high69 Ų6968.2 Ų68.248%0.48338%0.382SS..Hα-helixtrans-56.5-41.7177.1-178.80000112.6E293 T294 K299 D300 T301E293-S297 PolarHBondContact O-N 3.39Å; T294-S297 PolarHBondContact O-N 2.99Å; S297-K299 PolarHBondContact O-N 2.85Å; S297-D300 PolarHBondContact O-N 2.87Å; S297-T301 WeakPolarHBondContact O-CG2 3.41Å; S297-T301 PolarHBondContact O-N 2.8Å; S297-T301 PolarHBondContact O-OG1 2.67Å
298L98.1Very high97.3Very high32 Ų3268.3 Ų68.317%0.16838%0.377CS..Hα-helixtrans-65-37175.5-71.1171.5000112.8T294 K296 T301 H302 I335 A338 I339 F342T294-L298 WeakPolarHBondContact O-CB 3.47Å; T294-L298 VanDerWaalsContact O-CG 3.3Å; T294-L298 WeakPolarHBondContact O-CG 3.46Å; T294-L298 PolarHBondContact O-N 3.4Å; K296-L298 VanDerWaalsContact C-N 3.29Å; K296-L298 PolarHBondContact O-N 3.2Å; L298-T301 VanDerWaalsContact CA-OG1 3.31Å; L298-T301 WeakPolarHBondContact CA-OG1 3.41Å; L298-T301 PolarHBondContact O-OG1 3.48Å; L298-H302 VanDerWaalsContact O-CB 3.23Å; L298-H302 WeakPolarHBondContact O-CB 3.43Å; L298-H302 PolarHBondContact O-N 3.39Å; L298-I335 HydrophobicContact CB-CG2 4.49Å; L298-I335 HydrophobicContact CD2-CG2 4.37Å; L298-I335 WeakPolarHBondContact O-CG2 3.4Å; L298-A338 HydrophobicContact CD1-CB 3.74Å; L298-A338 HydrophobicContact CD2-CB 4Å; L298-I339 HydrophobicContact CB-CD1 4.34Å; L298-I339 HydrophobicContact CB-CG1 3.66Å; L298-I339 HydrophobicContact CD1-CG1 4.44Å; L298-F342 HydrophobicContact CD1-CB 4.43Å; L298-F342 HydrophobicContact CD1-CD2 3.51Å; L298-F342 HydrophobicContact CD1-CE2 4.1Å; L298-F342 HydrophobicContact CD1-CG 4.2Å
299K98.1Very high97.3Very high113 Ų11365.8 Ų65.849%0.49136%0.364SS..Hα-helixtrans-69.3-39.9175.7-74.2175.1177.6-176.30112.4L295 K296 S297 H302 G303 I339L295-K299 WeakPolarHBondContact O-CG 3.12Å; L295-K299 PolarHBondContact O-N 3.45Å; L295-K299 VanDerWaalsContact O-N 3.09Å; K296-K299 WeakPolarHBondContact O-CB 3.22Å; K296-K299 PolarHBondContact O-N 3.22Å; S297-K299 PolarHBondContact O-N 2.85Å; K299-H302 PolarHBondContact O-N 3.01Å; K299-G303 PolarHBondContact O-N 3.21Å; K299-I339 HydrophobicContact CG-CD1 4.34Å
300D98.3Very high97.2Very high111 Ų11170.1 Ų70.159%0.59438%0.377SS*.Hα-helixtrans-66.4-43.8178.8-62.1-25.2000111K296 S297 G303 S304K296-D300 VanDerWaalsContact O-CG 3.26Å; K296-D300 PolarHBondContact O-N 2.9Å; S297-D300 PolarHBondContact O-N 2.87Å; D300-G303 PolarHBondContact O-N 3.38Å; D300-S304 PolarHBondContact O-N 3.04Å; D300-S304 PolarHBondContact O-OG 3.15Å
301T98.3Very high97.2Very high55 Ų5569.4 Ų69.434%0.33738%0.383SS..Hα-helixtrans-64.8-42.6174.150.90000112S297 L298 G303 S304 L305S297-T301 WeakPolarHBondContact O-CG2 3.41Å; S297-T301 PolarHBondContact O-N 2.8Å; S297-T301 PolarHBondContact O-OG1 2.67Å; L298-T301 VanDerWaalsContact CA-OG1 3.31Å; L298-T301 WeakPolarHBondContact CA-OG1 3.41Å; L298-T301 PolarHBondContact O-OG1 3.48Å; T301-G303 PolarHBondContact O-N 2.97Å; T301-S304 WeakPolarHBondContact O-CB 3.48Å; T301-S304 PolarHBondContact O-N 3.11Å; T301-L305 WeakPolarHBondContact O-CG 3.46Å; T301-L305 PolarHBondContact O-N 3.37Å
302H98.2Very high97Very high52 Ų5269.6 Ų69.624%0.24139%0.386CS..Hα-helixtrans-55.4-50.6172.3172.6-85.1000111.6L298 K299 S304 L305 V306 I335 E336 I339L298-H302 VanDerWaalsContact O-CB 3.23Å; L298-H302 WeakPolarHBondContact O-CB 3.43Å; L298-H302 PolarHBondContact O-N 3.39Å; K299-H302 PolarHBondContact O-N 3.01Å; H302-S304 VanDerWaalsContact C-N 3.26Å; H302-S304 PolarHBondContact O-N 3Å; H302-L305 PolarHBondContact O-N 3.47Å; H302-V306 WeakPolarHBondContact O-CG2 3.32Å; H302-V306 PolarHBondContact O-N 2.83Å; H302-I335 HydrophobicContact CB-CG2 3.86Å; H302-E336 IonicContact NE2-OE1 2.69Å; H302-I339 HydrophobicContact CB-CD1 3.98Å
303G98.1Very high96.7Very high31 Ų3169 Ų6932%0.3239%0.39SS..Hα-helixtrans-60.2-36.217800000113K299 D300 T301 S307K299-G303 PolarHBondContact O-N 3.21Å; D300-G303 PolarHBondContact O-N 3.38Å; T301-G303 PolarHBondContact O-N 2.97Å; G303-S307 WeakPolarHBondContact O-CB 3.28Å; G303-S307 PolarHBondContact O-N 2.78Å; G303-S307 PolarHBondContact O-OG 2.72Å
304S97.9Very high96Very high77 Ų7771 Ų7154%0.53840%0.404SS..Hα-helixtrans-66.4-45.8175.9-56.10000112D300 T301 H302 S307 E308D300-S304 PolarHBondContact O-N 3.04Å; D300-S304 PolarHBondContact O-OG 3.15Å; T301-S304 WeakPolarHBondContact O-CB 3.48Å; T301-S304 PolarHBondContact O-N 3.11Å; H302-S304 VanDerWaalsContact C-N 3.26Å; H302-S304 PolarHBondContact O-N 3Å; S304-S307 WeakPolarHBondContact O-CB 3.36Å; S304-S307 PolarHBondContact O-N 3.41Å; S304-E308 PolarHBondContact O-N 2.95Å
305L97.6Very high95.3Very high25 Ų2578.7 Ų78.713%0.13143%0.427CS..Hα-helixtrans-66.3-39.2177.3-70-174.8000112.6T301 H302 S307 E308 L309 L328 K331 L332 I335T301-L305 WeakPolarHBondContact O-CG 3.46Å; T301-L305 PolarHBondContact O-N 3.37Å; H302-L305 PolarHBondContact O-N 3.47Å; L305-S307 VanDerWaalsContact C-N 3.32Å; L305-E308 PolarHBondContact O-N 2.97Å; L305-L309 WeakPolarHBondContact O-CB 3.47Å; L305-L309 PolarHBondContact O-N 3.34Å; L305-L328 HydrophobicContact CD2-CD2 3.89Å; L305-K331 HydrophobicContact CD1-CB 3.86Å; L305-L332 HydrophobicContact CB-CD2 3.77Å; L305-L332 HydrophobicContact CB-CG 4.07Å; L305-L332 HydrophobicContact CD1-CD2 4.28Å; L305-L332 HydrophobicContact CD1-CG 4.31Å; L305-I335 HydrophobicContact CD1-CD1 3.49Å; L305-I335 VanDerWaalsContact CD1-CD1 3.49Å; L305-I335 HydrophobicContact CG-CD1 4.47Å
306V97.7Very high93.8Very high48 Ų4879.1 Ų79.129%0.29143%0.431SS..Hα-helixtrans-61.7-44.2173.6171.50000110.1H302 E308 L309 L310 L332H302-V306 WeakPolarHBondContact O-CG2 3.32Å; H302-V306 PolarHBondContact O-N 2.83Å; V306-E308 VanDerWaalsContact C-N 3.31Å; V306-E308 PolarHBondContact O-N 3.43Å; V306-L309 PolarHBondContact O-N 3.27Å; V306-L310 HydrophobicContact CG1-CD1 3.88Å; V306-L310 HydrophobicContact CG1-CG 4.3Å; V306-L310 WeakPolarHBondContact O-CB 3.3Å; V306-L310 VanDerWaalsContact O-CG 3.24Å; V306-L310 WeakPolarHBondContact O-CG 3.49Å; V306-L310 PolarHBondContact O-N 3.45Å; V306-L332 HydrophobicContact CG2-CD1 4.41Å; V306-L332 HydrophobicContact CG2-CD2 3.8Å
307S97.7Very high92.6Very high77 Ų7780.1 Ų80.154%0.53844%0.443SS..Hα-helixtrans-61.3-41.1176.7-57.60000111.7G303 S304 L305 L310 S311G303-S307 WeakPolarHBondContact O-CB 3.28Å; G303-S307 PolarHBondContact O-N 2.78Å; G303-S307 PolarHBondContact O-OG 2.72Å; S304-S307 WeakPolarHBondContact O-CB 3.36Å; S304-S307 PolarHBondContact O-N 3.41Å; L305-S307 VanDerWaalsContact C-N 3.32Å; S307-L310 PolarHBondContact O-N 3.45Å; S307-S311 PolarHBondContact O-N 2.94Å; S307-S311 VanDerWaalsContact O-N 3.09Å
308E96.3Very high92.3Very high64 Ų6478.7 Ų78.730%0.29944%0.439SS..Hα-helixtrans-63.8-45174.9-170.3-178167.400111.7S304 L305 V306 L310 S311 L312 R324 L328S304-E308 PolarHBondContact O-N 2.95Å; L305-E308 PolarHBondContact O-N 2.97Å; V306-E308 VanDerWaalsContact C-N 3.31Å; V306-E308 PolarHBondContact O-N 3.43Å; E308-L310 VanDerWaalsContact C-N 3.33Å; E308-L310 PolarHBondContact O-N 2.98Å; E308-S311 WeakPolarHBondContact O-CB 3.5Å; E308-S311 PolarHBondContact O-N 2.96Å; E308-S311 VanDerWaalsContact O-N 3.11Å; E308-S311 PolarHBondContact O-OG 3.33Å; E308-L312 PolarHBondContact O-N 3.11Å; E308-R324 IonicContact OE1-CZ 2.8Å; E308-R324 IonicContact OE1-NE 3.39Å; E308-R324 PolarHBondContact OE1-NE 3Å; E308-R324 IonicContact OE1-NH2 2.68Å; E308-R324 PolarHBondContact OE1-NH2 2.92Å; E308-L328 HydrophobicContact CB-CD1 4.4Å; E308-L328 HydrophobicContact CG-CD1 3.98Å; E308-L328 HydrophobicContact CG-CD2 4.33Å
309L94.8Very high91.9Very high36 Ų3683.6 Ų83.619%0.18846%0.464CS..Hα-helixtrans-62.4-41178.6-175.9133.6000111.9L305 V306 S311 L312 L328 D329 L332L305-L309 WeakPolarHBondContact O-CB 3.47Å; L305-L309 PolarHBondContact O-N 3.34Å; V306-L309 PolarHBondContact O-N 3.27Å; L309-S311 VanDerWaalsContact C-N 3.25Å; L309-S311 PolarHBondContact O-N 3.09Å; L309-L312 WeakPolarHBondContact O-CB 3.37Å; L309-L312 PolarHBondContact O-N 2.97Å; L309-L328 HydrophobicContact CB-CD1 4.17Å; L309-L328 HydrophobicContact CD1-CB 4.06Å; L309-D329 WeakPolarHBondContact CD1-OD1 3.49Å; L309-L332 HydrophobicContact CD1-CD1 4.08Å
310L94.3Very high91.6Very high131 Ų13182.6 Ų82.669%0.68647%0.472SS*.Hα-helixtrans-69-22.5175.9-67.9174.7000113V306 S307 E308 L312V306-L310 HydrophobicContact CG1-CD1 3.88Å; V306-L310 HydrophobicContact CG1-CG 4.3Å; V306-L310 WeakPolarHBondContact O-CB 3.3Å; V306-L310 VanDerWaalsContact O-CG 3.24Å; V306-L310 WeakPolarHBondContact O-CG 3.49Å; V306-L310 PolarHBondContact O-N 3.45Å; S307-L310 PolarHBondContact O-N 3.45Å; E308-L310 VanDerWaalsContact C-N 3.33Å; E308-L310 PolarHBondContact O-N 2.98Å; L310-L312 VanDerWaalsContact C-N 3.3Å
311S94.2Very high91.3Very high87 Ų8779.3 Ų79.361%0.60846%0.455SS*.Hα-helixtrans-77.6-12.7175.578.70000113.9S307 E308 L309S307-S311 PolarHBondContact O-N 2.94Å; S307-S311 VanDerWaalsContact O-N 3.09Å; E308-S311 WeakPolarHBondContact O-CB 3.5Å; E308-S311 PolarHBondContact O-N 2.96Å; E308-S311 VanDerWaalsContact O-N 3.11Å; E308-S311 PolarHBondContact O-OG 3.33Å; L309-S311 VanDerWaalsContact C-N 3.25Å; L309-S311 PolarHBondContact O-N 3.09Å
312L92.5Very high91Very high26 Ų2684.2 Ų84.214%0.13647%0.468CS..SBendtrans-70145.3179.6-64.6-178.2000111.8E308 L309 L310 L314 R325 L328E308-L312 PolarHBondContact O-N 3.11Å; L309-L312 WeakPolarHBondContact O-CB 3.37Å; L309-L312 PolarHBondContact O-N 2.97Å; L310-L312 VanDerWaalsContact C-N 3.3Å; L312-L314 PolarHBondContact O-N 2.97Å; L312-R325 HydrophobicContact CD1-CB 3.9Å; L312-R325 HydrophobicContact CD1-CG 4.37Å; L312-L328 HydrophobicContact CD1-CD1 3.94Å; L312-L328 HydrophobicContact CG-CD1 4.5Å
313P91.9Very high90.8Very high80 Ų8085.3 Ų85.352%0.51948%0.478SS..  trans-58.9135.5177-22.732.2000113R315P313-R315 PolarHBondContact O-N 3.49Å
314L82.6Confident90.6Very high172 Ų17289.5 Ų89.590%0.90148%0.484SS*.SBendtrans-62.8-37.9-178.5-70.7167.5000113.4L312L312-L314 PolarHBondContact O-N 2.97Å
315R81.8Confident90.5Very high218 Ų21891.5 Ų91.582%0.82348%0.48SS*.SBendtrans-98.3116.6174.6-66.1-179.778.4145.51.7108.4P313P313-R315 PolarHBondContact O-N 3.49Å
316S65.3Low90.4Very high31 Ų3192.7 Ų92.722%0.21749%0.493CS..  trans-127.472.4-169.847.40000111.7G318S316-G318 VanDerWaalsContact C-N 3.31Å
317D73.5Confident90.3Very high148 Ų14895.8 Ų95.879%0.79151%0.505SS*.  trans-78.6-18.8178.3-60.2-31.7000112.1
318G90.6Very high90.3Very high38 Ų3892.4 Ų92.439%0.39248%0.48SS..SBendtrans-81.5130.2178.200000113.6S316 S320 V321 R322S316-G318 VanDerWaalsContact C-N 3.31Å; G318-S320 PolarHBondContact O-N 2.94Å; G318-V321 PolarHBondContact O-N 3.29Å; G318-V321 VanDerWaalsContact O-N 3.11Å; G318-R322 PolarHBondContact O-N 3.3Å
319L91.6Very high90.3Very high135 Ų13592.9 Ų92.971%0.70749%0.485SS*.Hα-helixtrans-52.5-38.2177.1-71.2171.3000113.1V321 R322 T323L319-V321 PolarHBondContact O-N 3.31Å; L319-R322 PolarHBondContact O-N 3.04Å; L319-T323 WeakPolarHBondContact O-CG2 3.28Å; L319-T323 PolarHBondContact O-N 2.97Å; L319-T323 PolarHBondContact O-OG1 3.02Å
320S90.7Very high90.4Very high93 Ų9394.4 Ų94.465%0.6550%0.498SS*.Hα-helixtrans-61.2-39.7179.1178.80000113.5G318 T323 R324G318-S320 PolarHBondContact O-N 2.94Å; S320-T323 WeakPolarHBondContact CA-OG1 3.3Å; S320-T323 PolarHBondContact O-OG1 3.35Å; S320-R324 WeakPolarHBondContact O-CB 3.27Å; S320-R324 PolarHBondContact O-N 2.84Å
321V92.2Very high90.6Very high41 Ų4193.1 Ų93.125%0.24849%0.487CS..Hα-helixtrans-71.3-37.8177.9-178.60000110.1G318 L319 R325G318-V321 PolarHBondContact O-N 3.29Å; G318-V321 VanDerWaalsContact O-N 3.11Å; L319-V321 PolarHBondContact O-N 3.31Å; V321-R325 WeakPolarHBondContact O-CB 3.39Å; V321-R325 PolarHBondContact O-N 3.44Å
322R92.3Very high90.8Very high158 Ų15889.8 Ų89.860%0.59646%0.462SS*.Hα-helixtrans-66-42.6177.1-61.7179.677-175.84.9111.9G318 L319 R325 A326G318-R322 PolarHBondContact O-N 3.3Å; L319-R322 PolarHBondContact O-N 3.04Å; R322-R325 PolarHBondContact O-N 3.5Å; R322-A326 WeakPolarHBondContact O-CB 3.37Å; R322-A326 PolarHBondContact O-N 3.45Å
323T94.1Very high91Very high75 Ų7591.3 Ų91.346%0.4648%0.475SS..Hα-helixtrans-67.1-44.6176.652.90000111.6L319 S320 R325 A326 Q327L319-T323 WeakPolarHBondContact O-CG2 3.28Å; L319-T323 PolarHBondContact O-N 2.97Å; L319-T323 PolarHBondContact O-OG1 3.02Å; S320-T323 WeakPolarHBondContact CA-OG1 3.3Å; S320-T323 PolarHBondContact O-OG1 3.35Å; T323-R325 VanDerWaalsContact C-N 3.34Å; T323-R325 PolarHBondContact O-N 2.91Å; T323-A326 PolarHBondContact O-N 3.1Å; T323-Q327 VanDerWaalsContact O-CG 3.3Å; T323-Q327 WeakPolarHBondContact O-CG 3.34Å; T323-Q327 PolarHBondContact O-N 2.9Å
324R94.4Very high91.3Very high120 Ų12093.6 Ų93.645%0.45348%0.479SS..Hα-helixtrans-59.8-43.5175.7-174.6175.4-179.8-178.31.2111.7E308 S320 Q327 L328E308-R324 IonicContact OE1-CZ 2.8Å; E308-R324 IonicContact OE1-NE 3.39Å; E308-R324 PolarHBondContact OE1-NE 3Å; E308-R324 IonicContact OE1-NH2 2.68Å; E308-R324 PolarHBondContact OE1-NH2 2.92Å; S320-R324 WeakPolarHBondContact O-CB 3.27Å; S320-R324 PolarHBondContact O-N 2.84Å; R324-Q327 WeakPolarHBondContact O-CB 3.21Å; R324-Q327 PolarHBondContact O-N 3.29Å; R324-L328 WeakPolarHBondContact O-CG 3.41Å; R324-L328 PolarHBondContact O-N 3.29Å
325R94.4Very high92Very high119 Ų11986.7 Ų86.745%0.44944%0.443SS..Hα-helixtrans-59.3-50175.4-176.8173.5179.6162.42.6111.8L312 V321 R322 T323 Q327 L328 D329L312-R325 HydrophobicContact CD1-CB 3.9Å; L312-R325 HydrophobicContact CD1-CG 4.37Å; V321-R325 WeakPolarHBondContact O-CB 3.39Å; V321-R325 PolarHBondContact O-N 3.44Å; R322-R325 PolarHBondContact O-N 3.5Å; T323-R325 VanDerWaalsContact C-N 3.34Å; T323-R325 PolarHBondContact O-N 2.91Å; R325-Q327 VanDerWaalsContact C-N 3.27Å; R325-Q327 PolarHBondContact O-N 2.98Å; R325-L328 PolarHBondContact O-N 2.93Å; R325-L328 VanDerWaalsContact O-N 3.1Å; R325-D329 PolarHBondContact O-N 3.42Å
326A95.1Very high92.8Very high49 Ų4981.3 Ų81.341%0.40543%0.427SS..Hα-helixtrans-59.6-37.4177.800000112.6R322 T323 D329 C330R322-A326 WeakPolarHBondContact O-CB 3.37Å; R322-A326 PolarHBondContact O-N 3.45Å; T323-A326 PolarHBondContact O-N 3.1Å; A326-D329 PolarHBondContact O-N 2.92Å; A326-C330 PolarHBondContact O-N 2.89Å; A326-C330 PolarHBondContact O-SG 3.01Å
327Q96.6Very high94.3Very high114 Ų11486.2 Ų86.253%0.53345%0.446SS..Hα-helixtrans-64.9-41.3174.6-72.5171.4-1.700112.5T323 R324 R325 C330 K331T323-Q327 VanDerWaalsContact O-CG 3.3Å; T323-Q327 WeakPolarHBondContact O-CG 3.34Å; T323-Q327 PolarHBondContact O-N 2.9Å; R324-Q327 WeakPolarHBondContact O-CB 3.21Å; R324-Q327 PolarHBondContact O-N 3.29Å; R325-Q327 VanDerWaalsContact C-N 3.27Å; R325-Q327 PolarHBondContact O-N 2.98Å; Q327-C330 PolarHBondContact O-N 3.4Å; Q327-K331 WeakPolarHBondContact O-CG 3.5Å; Q327-K331 PolarHBondContact O-N 3.49Å
328L96.9Very high95.5Very high5 Ų580.3 Ų80.33%0.02642%0.418CS..Hα-helixtrans-65.2-43175.3-69.4174.9000111.4L305 E308 L309 L312 R324 R325 C330 K331 L332L305-L328 HydrophobicContact CD2-CD2 3.89Å; E308-L328 HydrophobicContact CB-CD1 4.4Å; E308-L328 HydrophobicContact CG-CD1 3.98Å; E308-L328 HydrophobicContact CG-CD2 4.33Å; L309-L328 HydrophobicContact CB-CD1 4.17Å; L309-L328 HydrophobicContact CD1-CB 4.06Å; L312-L328 HydrophobicContact CD1-CD1 3.94Å; L312-L328 HydrophobicContact CG-CD1 4.5Å; R324-L328 WeakPolarHBondContact O-CG 3.41Å; R324-L328 PolarHBondContact O-N 3.29Å; R325-L328 PolarHBondContact O-N 2.93Å; R325-L328 VanDerWaalsContact O-N 3.1Å; L328-C330 PolarHBondContact O-N 3.31Å; L328-K331 PolarHBondContact O-N 2.96Å; L328-L332 WeakPolarHBondContact O-CB 3.3Å; L328-L332 WeakPolarHBondContact O-CG 3.32Å; L328-L332 PolarHBondContact O-N 3.4Å
329D96.1Very high95.8Very high74 Ų7480 Ų8040%0.39641%0.407SS..Hα-helixtrans-61-43.1176.3-70.2-36.3000111.6L309 R325 A326 L332 S333L309-D329 WeakPolarHBondContact CD1-OD1 3.49Å; R325-D329 PolarHBondContact O-N 3.42Å; A326-D329 PolarHBondContact O-N 2.92Å; D329-L332 PolarHBondContact O-N 3.38Å; D329-S333 PolarHBondContact O-N 2.94Å
330C97.8Very high96.1Very high69 Ų6980.3 Ų80.347%0.46640%0.403SS..Hα-helixtrans-61.9-49.9175.8-66.40000111.3A326 Q327 L328 L332 S333 E334A326-C330 PolarHBondContact O-N 2.89Å; A326-C330 PolarHBondContact O-SG 3.01Å; Q327-C330 PolarHBondContact O-N 3.4Å; L328-C330 PolarHBondContact O-N 3.31Å; C330-L332 VanDerWaalsContact C-N 3.3Å; C330-L332 PolarHBondContact O-N 2.94Å; C330-S333 PolarHBondContact O-N 3.2Å; C330-S333 VanDerWaalsContact O-N 3.15Å; C330-S333 PolarHBondContact O-OG 3.3Å; C330-E334 WeakPolarHBondContact O-CG 3.35Å; C330-E334 PolarHBondContact O-N 3.44Å
331K97.9Very high96.3Very high104 Ų10479.9 Ų79.945%0.45239%0.392SS..Hα-helixtrans-61.2-38.3177.8-72.3176.1-179.5-179.60112.4L305 Q327 L328 E334 I335L305-K331 HydrophobicContact CD1-CB 3.86Å; Q327-K331 WeakPolarHBondContact O-CG 3.5Å; Q327-K331 PolarHBondContact O-N 3.49Å; L328-K331 PolarHBondContact O-N 2.96Å; K331-E334 PolarHBondContact O-N 3.11Å; K331-I335 WeakPolarHBondContact O-CG1 3.15Å; K331-I335 PolarHBondContact O-N 3.01Å
332L97.9Very high96.5Very high16 Ų1680 Ų808%0.08439%0.389CS..Hα-helixtrans-61.2-46.2174.7-83.7168.9000110.8L305 V306 L309 L328 D329 C330 E334 I335 E336L305-L332 HydrophobicContact CB-CD2 3.77Å; L305-L332 HydrophobicContact CB-CG 4.07Å; L305-L332 HydrophobicContact CD1-CD2 4.28Å; L305-L332 HydrophobicContact CD1-CG 4.31Å; V306-L332 HydrophobicContact CG2-CD1 4.41Å; V306-L332 HydrophobicContact CG2-CD2 3.8Å; L309-L332 HydrophobicContact CD1-CD1 4.08Å; L328-L332 WeakPolarHBondContact O-CB 3.3Å; L328-L332 WeakPolarHBondContact O-CG 3.32Å; L328-L332 PolarHBondContact O-N 3.4Å; D329-L332 PolarHBondContact O-N 3.38Å; C330-L332 VanDerWaalsContact C-N 3.3Å; C330-L332 PolarHBondContact O-N 2.94Å; L332-E334 VanDerWaalsContact C-N 3.34Å; L332-E334 PolarHBondContact O-N 3.18Å; L332-I335 PolarHBondContact O-N 2.94Å; L332-E336 WeakPolarHBondContact O-CB 3.38Å; L332-E336 VanDerWaalsContact O-CG 3.32Å; L332-E336 WeakPolarHBondContact O-CG 3.39Å; L332-E336 PolarHBondContact O-N 2.94Å
333S97.9Very high96.6Very high59 Ų5975.5 Ų75.541%0.41338%0.382SS..Hα-helixtrans-61.1-40.6177.469.90000112.8D329 C330 E336 E337D329-S333 PolarHBondContact O-N 2.94Å; C330-S333 PolarHBondContact O-N 3.2Å; C330-S333 VanDerWaalsContact O-N 3.15Å; C330-S333 PolarHBondContact O-OG 3.3Å; S333-E336 PolarHBondContact O-N 2.88Å; S333-E337 WeakPolarHBondContact O-CG 3.31Å; S333-E337 PolarHBondContact O-N 3.23Å
334E97.9Very high96.7Very high128 Ų12879 Ų7960%0.59839%0.387SS*.Hα-helixtrans-61.9-44.1175.1-69.1170.5-168.600111.8C330 K331 L332 E337 A338C330-E334 WeakPolarHBondContact O-CG 3.35Å; C330-E334 PolarHBondContact O-N 3.44Å; K331-E334 PolarHBondContact O-N 3.11Å; L332-E334 VanDerWaalsContact C-N 3.34Å; L332-E334 PolarHBondContact O-N 3.18Å; E334-E337 PolarHBondContact O-N 3.2Å; E334-A338 PolarHBondContact O-N 3.49Å
335I98.1Very high96.5Very high27 Ų2779.6 Ų79.614%0.13840%0.399CS..Hα-helixtrans-69-39.6178.5-68.7-179.1000111.3L298 H302 L305 K331 L332 E337 A338 I339L298-I335 HydrophobicContact CB-CG2 4.49Å; L298-I335 HydrophobicContact CD2-CG2 4.37Å; L298-I335 WeakPolarHBondContact O-CG2 3.4Å; H302-I335 HydrophobicContact CB-CG2 3.86Å; L305-I335 HydrophobicContact CD1-CD1 3.49Å; L305-I335 VanDerWaalsContact CD1-CD1 3.49Å; L305-I335 HydrophobicContact CG-CD1 4.47Å; K331-I335 WeakPolarHBondContact O-CG1 3.15Å; K331-I335 PolarHBondContact O-N 3.01Å; L332-I335 PolarHBondContact O-N 2.94Å; I335-E337 VanDerWaalsContact C-N 3.33Å; I335-E337 PolarHBondContact O-N 3.46Å; I335-A338 CarbonylContact O-C 3.59Å; I335-A338 WeakPolarHBondContact O-CB 3.23Å; I335-A338 PolarHBondContact O-N 3.44Å; I335-I339 HydrophobicContact CG2-CD1 3.78Å; I335-I339 HydrophobicContact CG2-CG1 4.19Å; I335-I339 WeakPolarHBondContact O-CB 3.36Å; I335-I339 VanDerWaalsContact O-CG1 3.28Å; I335-I339 WeakPolarHBondContact O-CG1 3.42Å; I335-I339 PolarHBondContact O-N 3.47Å
336E97.4Very high96.4Very high105 Ų10580.5 Ų80.549%0.49140%0.402SS..Hα-helixtrans-62.9-40.5176.4-75.5177.8177.100111.7H302 L332 S333 I339 K340H302-E336 IonicContact NE2-OE1 2.69Å; L332-E336 WeakPolarHBondContact O-CB 3.38Å; L332-E336 VanDerWaalsContact O-CG 3.32Å; L332-E336 WeakPolarHBondContact O-CG 3.39Å; L332-E336 PolarHBondContact O-N 2.94Å; S333-E336 PolarHBondContact O-N 2.88Å; E336-I339 PolarHBondContact O-N 3.42Å; E336-K340 VanDerWaalsContact O-CB 3.29Å; E336-K340 WeakPolarHBondContact O-CB 3.38Å; E336-K340 PolarHBondContact O-N 2.62Å
337E97.8Very high96.3Very high134 Ų13478.5 Ų78.563%0.62639%0.385SS*.Hα-helixtrans-62.2-43.8171.8-74.1-170170.900111.6S333 E334 I335 K340 I341S333-E337 WeakPolarHBondContact O-CG 3.31Å; S333-E337 PolarHBondContact O-N 3.23Å; E334-E337 PolarHBondContact O-N 3.2Å; I335-E337 VanDerWaalsContact C-N 3.33Å; I335-E337 PolarHBondContact O-N 3.46Å; E337-K340 WeakPolarHBondContact O-CB 3.44Å; E337-K340 PolarHBondContact O-N 3.11Å; E337-I341 VanDerWaalsContact O-CG1 3.31Å; E337-I341 WeakPolarHBondContact O-CG1 3.43Å; E337-I341 PolarHBondContact O-N 3.27Å
338A97Very high96.1Very high24 Ų2476 Ų7620%0.19837%0.372CS..Hα-helixtrans-61-48.8174.900000111.5L298 E334 I335 K340 I341 F342L298-A338 HydrophobicContact CD1-CB 3.74Å; L298-A338 HydrophobicContact CD2-CB 4Å; E334-A338 PolarHBondContact O-N 3.49Å; I335-A338 CarbonylContact O-C 3.59Å; I335-A338 WeakPolarHBondContact O-CB 3.23Å; I335-A338 PolarHBondContact O-N 3.44Å; A338-K340 VanDerWaalsContact C-N 3.25Å; A338-K340 PolarHBondContact O-N 2.86Å; A338-I341 WeakPolarHBondContact O-CA 3.44Å; A338-I341 WeakPolarHBondContact O-CB 3.45Å; A338-I341 PolarHBondContact O-N 3.29Å; A338-F342 WeakPolarHBondContact O-CD2 3.34Å; A338-F342 PolarHBondContact O-N 3.23Å
339I97.3Very high95.8Very high31 Ų3179 Ų7916%0.15939%0.39CS..Hα-helixtrans-56.8-41.8176-70.2170.3000110.4L295 L298 K299 H302 I335 E336 I341 F342 S343L295-I339 HydrophobicContact CD1-CG2 4.02Å; L298-I339 HydrophobicContact CB-CD1 4.34Å; L298-I339 HydrophobicContact CB-CG1 3.66Å; L298-I339 HydrophobicContact CD1-CG1 4.44Å; K299-I339 HydrophobicContact CG-CD1 4.34Å; H302-I339 HydrophobicContact CB-CD1 3.98Å; I335-I339 HydrophobicContact CG2-CD1 3.78Å; I335-I339 HydrophobicContact CG2-CG1 4.19Å; I335-I339 WeakPolarHBondContact O-CB 3.36Å; I335-I339 VanDerWaalsContact O-CG1 3.28Å; I335-I339 WeakPolarHBondContact O-CG1 3.42Å; I335-I339 PolarHBondContact O-N 3.47Å; E336-I339 PolarHBondContact O-N 3.42Å; I339-I341 VanDerWaalsContact C-N 3.28Å; I339-I341 PolarHBondContact O-N 3.43Å; I339-F342 PolarHBondContact O-N 3.28Å; I339-S343 WeakPolarHBondContact O-CB 3.46Å; I339-S343 PolarHBondContact O-N 2.92Å; I339-S343 PolarHBondContact O-OG 3.41Å
340K97.6Very high95.7Very high142 Ų14282 Ų8262%0.61740%0.4SS*.Hα-helixtrans-63.3-32.4176-176.4-179.3-179.8-179.70112.8E336 E337 A338 S343E336-K340 VanDerWaalsContact O-CB 3.29Å; E336-K340 WeakPolarHBondContact O-CB 3.38Å; E336-K340 PolarHBondContact O-N 2.62Å; E337-K340 WeakPolarHBondContact O-CB 3.44Å; E337-K340 PolarHBondContact O-N 3.11Å; A338-K340 VanDerWaalsContact C-N 3.25Å; A338-K340 PolarHBondContact O-N 2.86Å; K340-S343 WeakPolarHBondContact CA-OG 3.44Å; K340-S343 PolarHBondContact O-OG 3.25Å
341I95.8Very high95.2Very high83 Ų8382 Ų8243%0.42640%0.397SS..Hα-helixtrans-73.2-50.7174.3-66.1162.5000110.2E337 A338 I339 S343 R344 V347E337-I341 VanDerWaalsContact O-CG1 3.31Å; E337-I341 WeakPolarHBondContact O-CG1 3.43Å; E337-I341 PolarHBondContact O-N 3.27Å; A338-I341 WeakPolarHBondContact O-CA 3.44Å; A338-I341 WeakPolarHBondContact O-CB 3.45Å; A338-I341 PolarHBondContact O-N 3.29Å; I339-I341 VanDerWaalsContact C-N 3.28Å; I339-I341 PolarHBondContact O-N 3.43Å; I341-S343 VanDerWaalsContact C-N 3.34Å; I341-S343 PolarHBondContact O-N 2.93Å; I341-R344 WeakPolarHBondContact O-CB 3.49Å; I341-R344 WeakPolarHBondContact O-CG 3.45Å; I341-R344 PolarHBondContact O-N 2.93Å; I341-V347 HydrophobicContact CG2-CG1 4.26Å; I341-V347 WeakPolarHBondContact O-CG2 3.46Å
342F96.2Very high94.1Very high43 Ų4384.1 Ų84.119%0.18941%0.413CS..Hα-helixtrans-76.3-17.8-175-73.6-80.6000114.6L286 R291 L295 L298 A338 I339 R344 V347L286-F342 HydrophobicContact CD2-CD1 4.18Å; L286-F342 HydrophobicContact CD2-CE1 3.62Å; R291-F342 HydrophobicContact CG-CD1 4.24Å; R291-F342 PolarHBondContact NH1-O 3.19Å; L295-F342 HydrophobicContact CB-CB 4.26Å; L295-F342 HydrophobicContact CD1-CB 4.08Å; L298-F342 HydrophobicContact CD1-CB 4.43Å; L298-F342 HydrophobicContact CD1-CD2 3.51Å; L298-F342 HydrophobicContact CD1-CE2 4.1Å; L298-F342 HydrophobicContact CD1-CG 4.2Å; A338-F342 WeakPolarHBondContact O-CD2 3.34Å; A338-F342 PolarHBondContact O-N 3.23Å; I339-F342 PolarHBondContact O-N 3.28Å; F342-R344 PolarHBondContact O-N 3.47Å; F342-V347 HydrophobicContact CD1-CG1 4.31Å; F342-V347 HydrophobicContact CD1-CG2 4.36Å; F342-V347 HydrophobicContact CE1-CG1 4.14Å
343S95.4Very high92.2Very high64 Ų6492 Ų9245%0.44847%0.469SS..THydrogen-bonded Turntrans-69.7-16.5171.756.60000113.5I339 K340 I341I339-S343 WeakPolarHBondContact O-CB 3.46Å; I339-S343 PolarHBondContact O-N 2.92Å; I339-S343 PolarHBondContact O-OG 3.41Å; K340-S343 WeakPolarHBondContact CA-OG 3.44Å; K340-S343 PolarHBondContact O-OG 3.25Å; I341-S343 VanDerWaalsContact C-N 3.34Å; I341-S343 PolarHBondContact O-N 2.93Å
344R94.3Very high91.9Very high150 Ų15093.6 Ų93.657%0.56647%0.472SS*.SBendtrans-70.8148.6174.4-60.9177.5-179.2-178.10110.5R291 I341 F342 R346R291-R344 WeakPolarHBondContact CD-O 3.24Å; R291-R344 PolarHBondContact NH1-O 3.09Å; I341-R344 WeakPolarHBondContact O-CB 3.49Å; I341-R344 WeakPolarHBondContact O-CG 3.45Å; I341-R344 PolarHBondContact O-N 2.93Å; F342-R344 PolarHBondContact O-N 3.47Å; R344-R346 VanDerWaalsContact C-N 3.26Å; R344-R346 PolarHBondContact O-N 2.76Å
345D92.1Very high91.6Very high131 Ų13191.8 Ų91.870%0.70147%0.466SS*.SBendtrans-62.4-34.4178.4-65.4-9.5000112.7
346R90.7Very high91.2Very high138 Ų13895.4 Ų95.452%0.52148%0.484SS..  trans-123.4120.5-178.6-57.6-176.1-172-159.8-1.4110R344R344-R346 VanDerWaalsContact C-N 3.26Å; R344-R346 PolarHBondContact O-N 2.76Å
347V93.6Very high90.9Very high8 Ų894.8 Ų94.85%0.04848%0.483CS..  trans-118.7132.9176.8-179.20000107.9L286 R291 I341 F342 V349L286-V347 HydrophobicContact CB-CB 4.3Å; L286-V347 HydrophobicContact CD2-CG1 4.47Å; L286-V347 PolarHBondContact N-O 3Å; R291-V347 HydrophobicContact CG-CG2 4.07Å; I341-V347 HydrophobicContact CG2-CG1 4.26Å; I341-V347 WeakPolarHBondContact O-CG2 3.46Å; F342-V347 HydrophobicContact CD1-CG1 4.31Å; F342-V347 HydrophobicContact CD1-CG2 4.36Å; F342-V347 HydrophobicContact CE1-CG1 4.14Å; V347-V349 HydrophobicContact CG1-CG2 4.44Å
348Y92.1Very high90.4Very high61 Ų6192.4 Ų92.424%0.23947%0.474CS..EExtended strand (participates in β ladder)trans-111.9126.8177.8-60.2-69.6000108.7V279 M284 M285V279-Y348 HydrophobicContact CB-CE1 4.35Å; V279-Y348 HydrophobicContact CG1-CD1 4.18Å; V279-Y348 HydrophobicContact CG1-CE1 4.3Å; V279-Y348 HydrophobicContact CG2-CD1 4.41Å; V279-Y348 HydrophobicContact CG2-CE1 3.71Å; M284-Y348 CarbonylContact O-C 3.57Å; M284-Y348 WeakPolarHBondContact O-CA 3.42Å; M285-Y348 HydrophobicContact CB-CD1 3.99Å; M285-Y348 HydrophobicContact CB-CE1 3.84Å; M285-Y348 HydrophobicContact CG-CD1 4.32Å; M285-Y348 HydrophobicContact CG-CE1 3.96Å
349V91.9Very high90Very high67 Ų6796.9 Ų96.941%0.40649%0.493SS..EExtended strand (participates in β ladder)trans-109.8137.9179.6-179.10000108.2H283 M284 L286 V347H283-V349 CarbonylContact C-O 3.54Å; H283-V349 VanDerWaalsContact CA-O 3.26Å; H283-V349 WeakPolarHBondContact CA-O 3.26Å; M284-V349 PolarHBondContact N-O 3.01Å; M284-V349 PolarHBondContact O-N 2.84Å; L286-V349 HydrophobicContact CB-CG2 4.12Å; L286-V349 HydrophobicContact CD1-CG2 4.2Å; L286-V349 HydrophobicContact CD2-CG2 4.34Å; L286-V349 HydrophobicContact CG-CG2 4.47Å; V347-V349 HydrophobicContact CG1-CG2 4.44Å
350K92.3Very high89.5Confident139 Ų139101.6 Ų101.660%0.60452%0.517SS*.EExtended strand (participates in β ladder)trans-68.2131.4175.9-171.7-177.1176.2-167.70108.7D352K350-D352 PolarHBondContact O-N 2.69Å
351V88.1Confident88.8Confident69 Ų6998.5 Ų98.542%0.41851%0.509SS..  trans-83.5113.3176.7-164.20000107.3G282 M284 S353G282-V351 PolarHBondContact O-N 2.93Å; M284-V351 HydrophobicContact CB-CG2 3.72Å; V351-S353 PolarHBondContact O-N 3.23Å; V351-S353 VanDerWaalsContact O-N 3.11Å
352D75.4Confident88.3Confident148 Ų14899.8 Ų99.879%0.79152%0.516SS*.  trans-69.8106.8172.9-65.5-32.8000107.6K350K350-D352 PolarHBondContact O-N 2.69Å
353S57.2Low87.5Confident180 Ų180105 Ų105100%1.25955%0.546SS*.  trans-970176.7-57.20000111.2V351V351-S353 PolarHBondContact O-N 3.23Å; V351-S353 VanDerWaalsContact O-N 3.11Å

Retrieved 353 of 353 residues in 513.8 ms (Link to these results)