A0A067ZUL6_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZUL6, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 234 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
1M34.3Very low32.4Very low232 Ų232159.4 Ų159.4100%1.14382%0.823SS**  0112.90-80.5173.5156.500105.9
2F29.3Very low32.3Very low198 Ų198152.4 Ų152.487%0.86882%0.82SS**  cis-143.4136.438.5-101.9-101.8000110.5
3C28.4Very low32.3Very low117 Ų117146.2 Ų146.279%0.79181%0.814SS**  trans-108.1135.5151.2-162.40000104.9
4C34Very low32.6Very low101 Ų101144.4 Ų144.468%0.68281%0.814SS**  trans174.8110.6144.3-91.90000108.9
5L33.8Very low33Very low135 Ų135147.3 Ų147.371%0.70781%0.814SS**  89.3107.2108.2-66.6169.5000110.8
6G31.6Very low33.7Very low59 Ų59145.2 Ų145.261%0.60881%0.807SS**  88.4134.383.200000107.5
7Y27.7Very low33.9Very low196 Ų196150.2 Ų150.277%0.76981%0.811SS**  cis-162.6150.930.3-56.6-93.8000105
8E30.7Very low34.2Very low192 Ų192150.2 Ų150.290%0.89780%0.804SS**  -170.3141.595-95.1-176.2142.700110.6
9W38.3Very low34.8Very low235 Ų235145.8 Ų145.889%0.8979%0.786SS**  trans-77.5144.3170.9-83.566.3000110.8
10L32.7Very low35.3Very low181 Ų181141.2 Ų141.295%0.94877%0.769SS**  trans-152.5127.7132.8-106.5165.9000110.8
11S35.6Very low35.4Very low107 Ų107143 Ų14375%0.74877%0.765SS**  trans-77.3155.3-176.4-177.90000112.2
12G30.8Very low36Very low76 Ų76136.1 Ų136.178%0.78474%0.736SS**  trans124.3108.216200000111.7
13G32.2Very low36.8Very low72 Ų72132.2 Ų132.274%0.74272%0.723SS**  cis152144.315.300000106.9
14C37.4Very low37.5Very low121 Ų121132.1 Ų132.182%0.81871%0.714SS**  trans79.7105.8168.7-152.70000117.1
15K38.6Very low38Very low187 Ų187129.7 Ų129.781%0.81370%0.696SS**  161.193.9123.9-85.5159.6-174.3172.60111.6
16T43.8Very low38.3Very low114 Ų114128.8 Ų128.870%0.69969%0.691SS**SBendtrans-15425.9146.249.40000112.7
17W37Very low38.8Very low231 Ų231128.8 Ų128.888%0.87569%0.686SS**SBendtrans-85.4-20.1169.8-75.292.6000113
18H39.8Very low39.5Very low149 Ų149125.2 Ų125.269%0.6968%0.68SS**Hα-helixtrans-78.4-28.7-177.6-99.1-79.2000114.4V22H18-V22 WeakPolarHBondContact O-CG2 3.42Å; H18-V22 PolarHBondContact O-N 3.36Å
19S45.4Very low40.1Very low67 Ų67122.1 Ų122.147%0.46967%0.665SS.*Hα-helixtrans-75.6-31.3-178.744.20000112.7I23S19-I23 WeakPolarHBondContact O-CD1 3.35Å; S19-I23 VanDerWaalsContact O-CG1 3.23Å; S19-I23 WeakPolarHBondContact O-CG1 3.26Å; S19-I23 PolarHBondContact O-N 3.06Å
20A45.5Very low40.3Very low53 Ų53118.6 Ų118.644%0.43866%0.658SS.*Hα-helixtrans-73-35.9175.100000112.4N24A20-N24 PolarHBondContact O-N 3.32Å
21W36.3Very low40.7Very low181 Ų181118.3 Ų118.369%0.68665%0.652SS**Hα-helixtrans-67.2-47.3177.6-154.859.5000110.9I23 N24 T25W21-I23 VanDerWaalsContact C-N 3.33Å; W21-I23 PolarHBondContact O-N 2.97Å; W21-N24 PolarHBondContact O-N 3.41Å; W21-N24 VanDerWaalsContact O-N 3.15Å; W21-T25 PolarHBondContact O-N 3.03Å; W21-T25 PolarHBondContact O-OG1 3.03Å
22V46.5Very low41Very low87 Ų87123.8 Ų123.853%0.52766%0.656SS.*Hα-helixtrans-62.7-35.4-179.7173.60000112.9H18 L26H18-V22 WeakPolarHBondContact O-CG2 3.42Å; H18-V22 PolarHBondContact O-N 3.36Å; V22-L26 VanDerWaalsContact O-CB 3.28Å; V22-L26 WeakPolarHBondContact O-CB 3.49Å; V22-L26 PolarHBondContact O-N 3.44Å
23I47.4Very low41.6Very low116 Ų116122.6 Ų122.660%0.59564%0.644SS**Hα-helixtrans-71.2-38.6176.9-65167.9000110.9S19 W21 A27S19-I23 WeakPolarHBondContact O-CD1 3.35Å; S19-I23 VanDerWaalsContact O-CG1 3.23Å; S19-I23 WeakPolarHBondContact O-CG1 3.26Å; S19-I23 PolarHBondContact O-N 3.06Å; W21-I23 VanDerWaalsContact C-N 3.33Å; W21-I23 PolarHBondContact O-N 2.97Å; I23-A27 WeakPolarHBondContact O-CB 3.26Å; I23-A27 PolarHBondContact O-N 3.26Å
24N43.2Very low42.1Very low115 Ų115125.9 Ų125.962%0.61565%0.65SS**Hα-helixtrans-72-36.4175.1-81.1-24000112.4A20 W21 L26 A27 D28A20-N24 PolarHBondContact O-N 3.32Å; W21-N24 PolarHBondContact O-N 3.41Å; W21-N24 VanDerWaalsContact O-N 3.15Å; N24-L26 VanDerWaalsContact C-N 3.33Å; N24-L26 PolarHBondContact O-N 3.46Å; N24-A27 PolarHBondContact O-N 3.09Å; N24-D28 VanDerWaalsContact O-CB 3.29Å; N24-D28 WeakPolarHBondContact O-CB 3.22Å; N24-D28 PolarHBondContact O-N 3.44Å
25T43.4Very low42.7Very low50 Ų50126.3 Ų126.331%0.30764%0.644SS.*Hα-helixtrans-68.6-32.7175-300000111.9W21 H29W21-T25 PolarHBondContact O-N 3.03Å; W21-T25 PolarHBondContact O-OG1 3.03Å; T25-H29 PolarHBondContact O-N 3.4Å; T25-H29 PolarHBondContact O-ND1 3.29Å
26L39.8Very low42.9Very low115 Ų115127.9 Ų127.960%0.60265%0.651SS**Hα-helixtrans-73.6-35.3175.8-166.371.4000112.3V22 N24V22-L26 VanDerWaalsContact O-CB 3.28Å; V22-L26 WeakPolarHBondContact O-CB 3.49Å; V22-L26 PolarHBondContact O-N 3.44Å; N24-L26 VanDerWaalsContact C-N 3.33Å; N24-L26 PolarHBondContact O-N 3.46Å
27A43.1Very low43Very low59 Ų59125 Ų12549%0.48864%0.643SS.*Hα-helixtrans-69.9-35.8173.100000112.2I23 N24 H29 H30I23-A27 WeakPolarHBondContact O-CB 3.26Å; I23-A27 PolarHBondContact O-N 3.26Å; N24-A27 PolarHBondContact O-N 3.09Å; A27-H29 VanDerWaalsContact C-N 3.31Å; A27-H29 PolarHBondContact O-N 3.34Å; A27-H30 PolarHBondContact O-N 2.96Å
28D42.4Very low43.2Very low121 Ų121115.4 Ų115.465%0.64762%0.617SS**Hα-helixtrans-72.3-24.7179.6-154.455.6000112.6N24N24-D28 VanDerWaalsContact O-CB 3.29Å; N24-D28 WeakPolarHBondContact O-CB 3.22Å; N24-D28 PolarHBondContact O-N 3.44Å
29H42.6Very low44Very low127 Ų127112.2 Ų112.259%0.58861%0.611SS**G310 helixtrans-83.3-11.8176-76.719.5000114.7T25 A27 H31T25-H29 PolarHBondContact O-N 3.4Å; T25-H29 PolarHBondContact O-ND1 3.29Å; A27-H29 VanDerWaalsContact C-N 3.31Å; A27-H29 PolarHBondContact O-N 3.34Å; H29-H31 VanDerWaalsContact C-N 3.31Å
30H43.7Very low44.6Very low162 Ų162113.5 Ų113.575%0.7562%0.618SS**G310 helixtrans-86-0.4174.9-93.3-71.6000114.1A27A27-H30 PolarHBondContact O-N 2.96Å
31H39.8Very low45.1Very low174 Ų174120 Ų12081%0.80663%0.631SS**G310 helixtrans-108.44.5177.6-107.4-53000115.4H29 G33H29-H31 VanDerWaalsContact C-N 3.31Å; H31-G33 PolarHBondContact O-N 3.46Å
32R42.4Very low46.3Very low222 Ų222116.2 Ų116.284%0.83862%0.624SS**SBendtrans-80.7109.2170.2-107.9177.7162.3173-4.6109.7T34R32-T34 PolarHBondContact O-N 3.49Å
33G43.3Very low47Very low51 Ų51118.6 Ų118.653%0.52663%0.629SS.*  trans-41.2127-178.100000113.1H31 D35H31-G33 PolarHBondContact O-N 3.46Å; G33-D35 PolarHBondContact O-N 3.23Å
34T43.8Very low47.8Very low141 Ų141117 Ų11787%0.86562%0.624SS**  trans-6774.4151.645.30000108.1R32 F36R32-T34 PolarHBondContact O-N 3.49Å; T34-F36 PolarHBondContact O-N 2.94Å
35D48Very low48.7Very low131 Ų131115.9 Ų115.970%0.70162%0.618SS**  trans-82.433.7174.2-70.3-42.8000111.8G33 G37G33-D35 PolarHBondContact O-N 3.23Å; D35-G37 VanDerWaalsContact C-N 3.25Å; D35-G37 PolarHBondContact O-N 2.89Å
36F43Very low49.6Very low220 Ų220119 Ų11997%0.96563%0.631SS**THydrogen-bonded Turntrans-94.938.1171.1-90.7-80.2000112.3T34T34-F36 PolarHBondContact O-N 2.94Å
37G47.3Very low50.4Low52 Ų52115.7 Ų115.754%0.53662%0.621SS.*THydrogen-bonded Turntrans176.240.9178.400000111.5D35D35-G37 VanDerWaalsContact C-N 3.25Å; D35-G37 PolarHBondContact O-N 2.89Å
38G40.4Very low51.1Low31 Ų31120.4 Ų120.432%0.3263%0.63SS.*  trans-51.6158.8-169.400000114.2P40 W41G38-P40 WeakPolarHBondContact O-CD 3.35Å; G38-W41 PolarHBondContact O-N 2.97Å
39S57.8Low52Low82 Ų82117.3 Ų117.357%0.57362%0.617SS**Hα-helixtrans-29.4-35.9177.5-70.20000118.1W41 L42 H43S39-W41 VanDerWaalsContact C-N 3.35Å; S39-W41 PolarHBondContact O-N 3.39Å; S39-L42 PolarHBondContact O-N 3.38Å; S39-H43 PolarHBondContact O-CD2 3.39Å; S39-H43 VanDerWaalsContact O-CD2 3.25Å; S39-H43 PolarHBondContact O-N 2.87Å
40P57.3Low52.9Low94 Ų94115.2 Ų115.261%0.6161%0.613SS**Hα-helixtrans-56.3-40.9178.8-28.937000114.8G38 H43 V44G38-P40 WeakPolarHBondContact O-CD 3.35Å; P40-H43 PolarHBondContact O-N 2.95Å; P40-V44 VanDerWaalsContact O-CG2 3.29Å; P40-V44 WeakPolarHBondContact O-CG2 3.45Å; P40-V44 PolarHBondContact O-N 3.43Å
41W56.3Low54Low189 Ų189110.8 Ų110.872%0.71660%0.6SS**Hα-helixtrans-72.6-34.5-176.9-112.382000112.6G38 S39 V44 I45G38-W41 PolarHBondContact O-N 2.97Å; S39-W41 VanDerWaalsContact C-N 3.35Å; S39-W41 PolarHBondContact O-N 3.39Å; W41-V44 PolarHBondContact O-N 3.49Å; W41-I45 HydrophobicContact CE3-CD1 3.83Å; W41-I45 HydrophobicContact CE3-CG1 4.17Å; W41-I45 HydrophobicContact CZ3-CD1 4.33Å; W41-I45 VanDerWaalsContact O-CG1 3.24Å; W41-I45 WeakPolarHBondContact O-CG1 3.06Å; W41-I45 PolarHBondContact O-N 3.45Å
42L61.7Low55.7Low102 Ų102108.3 Ų108.353%0.53459%0.585SS.*Hα-helixtrans-69.4-38.1172.6-73.2170.9000111.6S39 V44 I45 I46S39-L42 PolarHBondContact O-N 3.38Å; L42-V44 VanDerWaalsContact C-N 3.31Å; L42-V44 PolarHBondContact O-N 2.9Å; L42-I45 PolarHBondContact O-N 3.47Å; L42-I46 WeakPolarHBondContact O-CB 3.37Å; L42-I46 VanDerWaalsContact O-CG1 3.27Å; L42-I46 WeakPolarHBondContact O-CG1 3.43Å; L42-I46 PolarHBondContact O-N 2.81Å
43H61.3Low57.3Low136 Ų136103.7 Ų103.763%0.6357%0.571SS**Hα-helixtrans-60.4-41.4170.1-88.7-85000111.4S39 P40 I46 A47S39-H43 PolarHBondContact O-CD2 3.39Å; S39-H43 VanDerWaalsContact O-CD2 3.25Å; S39-H43 PolarHBondContact O-N 2.87Å; P40-H43 PolarHBondContact O-N 2.95Å; H43-I46 PolarHBondContact O-N 2.79Å; H43-A47 WeakPolarHBondContact O-CA 3.3Å; H43-A47 WeakPolarHBondContact O-CB 3.45Å; H43-A47 PolarHBondContact O-N 3.45Å
44V63.2Low58.9Low82 Ų82105 Ų10550%0.49757%0.569SS.*Hα-helixtrans-64.3-46.8174.2173.10000111P40 W41 L42 I46 A47 F48P40-V44 VanDerWaalsContact O-CG2 3.29Å; P40-V44 WeakPolarHBondContact O-CG2 3.45Å; P40-V44 PolarHBondContact O-N 3.43Å; W41-V44 PolarHBondContact O-N 3.49Å; L42-V44 VanDerWaalsContact C-N 3.31Å; L42-V44 PolarHBondContact O-N 2.9Å; V44-I46 VanDerWaalsContact C-N 3.28Å; V44-I46 PolarHBondContact O-N 3.18Å; V44-A47 PolarHBondContact O-N 3.31Å; V44-F48 WeakPolarHBondContact O-CB 3.36Å; V44-F48 PolarHBondContact O-N 3.39Å
45I62.7Low60.6Low92 Ų92102.9 Ų102.947%0.47256%0.555SS.*Hα-helixtrans-63.8-29.8179.3-68.3163.7000112.5W41 L42 P49W41-I45 HydrophobicContact CE3-CD1 3.83Å; W41-I45 HydrophobicContact CE3-CG1 4.17Å; W41-I45 HydrophobicContact CZ3-CD1 4.33Å; W41-I45 VanDerWaalsContact O-CG1 3.24Å; W41-I45 WeakPolarHBondContact O-CG1 3.06Å; W41-I45 PolarHBondContact O-N 3.45Å; L42-I45 PolarHBondContact O-N 3.47Å; I45-P49 WeakPolarHBondContact O-CD 3.26Å; I45-P49 WeakPolarHBondContact O-CG 3.18Å
46I61.8Low62.2Low115 Ų115100.1 Ų100.159%0.5954%0.54SS*.Hα-helixtrans-90.6-36.9179-64.4167.3000111.9L42 H43 V44 P49 T50L42-I46 WeakPolarHBondContact O-CB 3.37Å; L42-I46 VanDerWaalsContact O-CG1 3.27Å; L42-I46 WeakPolarHBondContact O-CG1 3.43Å; L42-I46 PolarHBondContact O-N 2.81Å; H43-I46 PolarHBondContact O-N 2.79Å; V44-I46 VanDerWaalsContact C-N 3.28Å; V44-I46 PolarHBondContact O-N 3.18Å; I46-P49 WeakPolarHBondContact O-CD 3.3Å; I46-T50 PolarHBondContact O-OG1 2.99Å
47A57.8Low64Low47 Ų4793.5 Ų93.539%0.38852%0.518SS..Hα-helixtrans-71.5-39.8178.700000111.4H43 V44 T50 S51H43-A47 WeakPolarHBondContact O-CA 3.3Å; H43-A47 WeakPolarHBondContact O-CB 3.45Å; H43-A47 PolarHBondContact O-N 3.45Å; V44-A47 PolarHBondContact O-N 3.31Å; A47-T50 WeakPolarHBondContact O-CA 3.44Å; A47-T50 WeakPolarHBondContact O-CB 3.23Å; A47-T50 PolarHBondContact O-N 3.29Å; A47-S51 WeakPolarHBondContact O-CB 3.42Å; A47-S51 PolarHBondContact O-N 3.29Å; A47-S51 PolarHBondContact O-OG 3.05Å; A47-S51 VanDerWaalsContact O-OG 3.08Å
48F57.8Low65.7Low157 Ų15796.4 Ų96.469%0.68952%0.52SS*.Hα-helixtrans-60.8-44.1-177-157.9-89.6000113.3V44 T50 S51 Y52V44-F48 WeakPolarHBondContact O-CB 3.36Å; V44-F48 PolarHBondContact O-N 3.39Å; F48-T50 VanDerWaalsContact C-N 3.26Å; F48-T50 PolarHBondContact O-N 3.2Å; F48-S51 PolarHBondContact O-N 3.46Å; F48-Y52 PolarHBondContact O-N 2.96Å
49P61.3Low67.8Low56 Ų56103 Ų10336%0.36454%0.535SS..Hα-helixtrans-66.3-24172-23.234.3000114.4I45 I46 Y52 K53I45-P49 WeakPolarHBondContact O-CD 3.26Å; I45-P49 WeakPolarHBondContact O-CG 3.18Å; I46-P49 WeakPolarHBondContact O-CD 3.3Å; P49-Y52 HydrophobicContact CB-CD1 4.48Å; P49-Y52 WeakPolarHBondContact O-CD1 3.32Å; P49-Y52 WeakPolarHBondContact O-CE1 3.46Å; P49-K53 VanDerWaalsContact O-CG 3.29Å; P49-K53 WeakPolarHBondContact O-CG 3.34Å
50T60.4Low69.3Low83 Ų83103 Ų10351%0.50953%0.528SS..Hα-helixtrans-82-44.2179.2-53.70000109.8I46 A47 F48 K53 V54I46-T50 PolarHBondContact O-OG1 2.99Å; A47-T50 WeakPolarHBondContact O-CA 3.44Å; A47-T50 WeakPolarHBondContact O-CB 3.23Å; A47-T50 PolarHBondContact O-N 3.29Å; F48-T50 VanDerWaalsContact C-N 3.26Å; F48-T50 PolarHBondContact O-N 3.2Å; T50-K53 PolarHBondContact O-N 3.42Å; T50-V54 WeakPolarHBondContact O-CG2 3.49Å; T50-V54 PolarHBondContact O-N 3.46Å; T50-V54 VanDerWaalsContact O-N 3.15Å
51S67.5Low70.8Confident69 Ų69102.5 Ų102.548%0.48352%0.523SS..Hα-helixtrans-63.2-44.5175.6-58.80000112.1A47 F48 K53 V54 V55A47-S51 WeakPolarHBondContact O-CB 3.42Å; A47-S51 PolarHBondContact O-N 3.29Å; A47-S51 PolarHBondContact O-OG 3.05Å; A47-S51 VanDerWaalsContact O-OG 3.08Å; F48-S51 PolarHBondContact O-N 3.46Å; S51-K53 VanDerWaalsContact C-N 3.3Å; S51-K53 PolarHBondContact O-N 2.89Å; S51-V54 PolarHBondContact O-N 3.35Å; S51-V54 VanDerWaalsContact O-N 3.16Å; S51-V55 WeakPolarHBondContact O-CG2 3.32Å; S51-V55 PolarHBondContact O-N 3.05Å
52Y75.1Confident72.2Confident122 Ų122101.2 Ų101.248%0.47852%0.519SS..Hα-helixtrans-63.9-35.8178.6109-82000112.1F48 P49 V54 V55 I56F48-Y52 PolarHBondContact O-N 2.96Å; P49-Y52 HydrophobicContact CB-CD1 4.48Å; P49-Y52 WeakPolarHBondContact O-CD1 3.32Å; P49-Y52 WeakPolarHBondContact O-CE1 3.46Å; Y52-V54 VanDerWaalsContact C-N 3.34Å; Y52-V54 PolarHBondContact O-N 3.32Å; Y52-V55 PolarHBondContact O-N 2.9Å; Y52-I56 HydrophobicContact CD2-CD1 3.26Å; Y52-I56 HydrophobicContact CD2-CG1 4.04Å; Y52-I56 HydrophobicContact CE2-CD1 3.24Å; Y52-I56 HydrophobicContact CE2-CG1 4.4Å; Y52-I56 HydrophobicContact CG-CD1 4.49Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.3Å; Y52-I56 WeakPolarHBondContact O-CG1 3.36Å; Y52-I56 PolarHBondContact O-N 2.82Å
53K76.8Confident73.4Confident125 Ų125100.9 Ų100.954%0.54352%0.518SS..Hα-helixtrans-64.6-40.1175.7-77.1178.8-179.3176.10111.7P49 T50 S51 T57P49-K53 VanDerWaalsContact O-CG 3.29Å; P49-K53 WeakPolarHBondContact O-CG 3.34Å; T50-K53 PolarHBondContact O-N 3.42Å; S51-K53 VanDerWaalsContact C-N 3.3Å; S51-K53 PolarHBondContact O-N 2.89Å; K53-T57 VanDerWaalsContact O-CB 3.3Å; K53-T57 WeakPolarHBondContact O-CB 3.22Å; K53-T57 PolarHBondContact O-N 3.38Å; K53-T57 PolarHBondContact O-OG1 3.05Å
54V75.7Confident74.6Confident80 Ų80102.1 Ų102.149%0.48552%0.517SS..Hα-helixtrans-65.6-46.9176.5174.20000110.3T50 S51 Y52 I56 T57 L58T50-V54 WeakPolarHBondContact O-CG2 3.49Å; T50-V54 PolarHBondContact O-N 3.46Å; T50-V54 VanDerWaalsContact O-N 3.15Å; S51-V54 PolarHBondContact O-N 3.35Å; S51-V54 VanDerWaalsContact O-N 3.16Å; Y52-V54 VanDerWaalsContact C-N 3.34Å; Y52-V54 PolarHBondContact O-N 3.32Å; V54-I56 PolarHBondContact O-N 2.91Å; V54-T57 PolarHBondContact O-N 3.41Å; V54-L58 HydrophobicContact CG1-CD1 3.87Å; V54-L58 HydrophobicContact CG1-CG 4.36Å; V54-L58 WeakPolarHBondContact O-CB 3.44Å; V54-L58 VanDerWaalsContact O-CG 3.31Å; V54-L58 WeakPolarHBondContact O-CG 3.41Å; V54-L58 PolarHBondContact O-N 2.85Å
55V79.3Confident75.5Confident95 Ų95102.2 Ų102.258%0.57652%0.517SS*.Hα-helixtrans-61.8-45.6178.61740000111.5S51 Y52 T57 L58 W59S51-V55 WeakPolarHBondContact O-CG2 3.32Å; S51-V55 PolarHBondContact O-N 3.05Å; Y52-V55 PolarHBondContact O-N 2.9Å; V55-T57 VanDerWaalsContact C-N 3.34Å; V55-T57 PolarHBondContact O-N 2.82Å; V55-L58 PolarHBondContact O-N 3.35Å; V55-W59 WeakPolarHBondContact O-CB 3.31Å; V55-W59 PolarHBondContact O-N 3.32Å
56I83.1Confident76.3Confident73 Ų73100 Ų10037%0.37451%0.51SS..Hα-helixtrans-62.2-43176-72.6-178000111.1Y52 V54 W59 I60Y52-I56 HydrophobicContact CD2-CD1 3.26Å; Y52-I56 HydrophobicContact CD2-CG1 4.04Å; Y52-I56 HydrophobicContact CE2-CD1 3.24Å; Y52-I56 HydrophobicContact CE2-CG1 4.4Å; Y52-I56 HydrophobicContact CG-CD1 4.49Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.3Å; Y52-I56 WeakPolarHBondContact O-CG1 3.36Å; Y52-I56 PolarHBondContact O-N 2.82Å; V54-I56 PolarHBondContact O-N 2.91Å; I56-W59 PolarHBondContact O-N 2.93Å; I56-I60 HydrophobicContact CG2-CD1 3.66Å; I56-I60 HydrophobicContact CG2-CG1 4.32Å; I56-I60 WeakPolarHBondContact O-CB 3.44Å; I56-I60 VanDerWaalsContact O-CG1 3.24Å; I56-I60 WeakPolarHBondContact O-CG1 3.29Å; I56-I60 PolarHBondContact O-N 2.78Å
57T79.9Confident77.1Confident82 Ų8298.8 Ų98.850%0.50350%0.504SS..Hα-helixtrans-64.7-43.3179.6-55.50000110.8K53 V54 V55 I60 V61K53-T57 VanDerWaalsContact O-CB 3.3Å; K53-T57 WeakPolarHBondContact O-CB 3.22Å; K53-T57 PolarHBondContact O-N 3.38Å; K53-T57 PolarHBondContact O-OG1 3.05Å; V54-T57 PolarHBondContact O-N 3.41Å; V55-T57 VanDerWaalsContact C-N 3.34Å; V55-T57 PolarHBondContact O-N 2.82Å; T57-I60 PolarHBondContact O-N 3.47Å; T57-V61 VanDerWaalsContact O-CG2 3.29Å; T57-V61 WeakPolarHBondContact O-CG2 3.44Å; T57-V61 PolarHBondContact O-N 3.44Å
58L82.4Confident78.2Confident112 Ų112101.1 Ų101.159%0.58651%0.51SS*.Hα-helixtrans-62.4-42.1175-72.7171.5000111.6V54 V55 V61 Y62V54-L58 HydrophobicContact CG1-CD1 3.87Å; V54-L58 HydrophobicContact CG1-CG 4.36Å; V54-L58 WeakPolarHBondContact O-CB 3.44Å; V54-L58 VanDerWaalsContact O-CG 3.31Å; V54-L58 WeakPolarHBondContact O-CG 3.41Å; V54-L58 PolarHBondContact O-N 2.85Å; V55-L58 PolarHBondContact O-N 3.35Å; L58-V61 PolarHBondContact O-N 2.9Å; L58-Y62 VanDerWaalsContact O-CB 3.26Å; L58-Y62 WeakPolarHBondContact O-CB 3.21Å; L58-Y62 PolarHBondContact O-N 3.41Å
59W84.7Confident78.9Confident170 Ų170100.9 Ų100.964%0.64451%0.508SS*.Hα-helixtrans-63.7-42.5176.9-173.260.1000112.1V55 I56 Y62 L63V55-W59 WeakPolarHBondContact O-CB 3.31Å; V55-W59 PolarHBondContact O-N 3.32Å; I56-W59 PolarHBondContact O-N 2.93Å; W59-Y62 PolarHBondContact O-N 3.41Å; W59-L63 WeakPolarHBondContact O-CB 3.28Å; W59-L63 PolarHBondContact O-N 2.8Å
60I88.6Confident79.4Confident83 Ų83102.6 Ų102.643%0.42652%0.518SS..Hα-helixtrans-63.1-46175.6-69.6167.2000110.9I56 T57 Y62 L63 W64I56-I60 HydrophobicContact CG2-CD1 3.66Å; I56-I60 HydrophobicContact CG2-CG1 4.32Å; I56-I60 WeakPolarHBondContact O-CB 3.44Å; I56-I60 VanDerWaalsContact O-CG1 3.24Å; I56-I60 WeakPolarHBondContact O-CG1 3.29Å; I56-I60 PolarHBondContact O-N 2.78Å; T57-I60 PolarHBondContact O-N 3.47Å; I60-Y62 VanDerWaalsContact C-N 3.35Å; I60-L63 PolarHBondContact O-N 3.47Å; I60-W64 WeakPolarHBondContact O-CB 3.35Å; I60-W64 PolarHBondContact O-N 3.26Å
61V89.1Confident79.9Confident82 Ų82103 Ų10350%0.49752%0.516SS..Hα-helixtrans-63.3-43.1178.1171.70000110.5T57 L58 W64 V65T57-V61 VanDerWaalsContact O-CG2 3.29Å; T57-V61 WeakPolarHBondContact O-CG2 3.44Å; T57-V61 PolarHBondContact O-N 3.44Å; L58-V61 PolarHBondContact O-N 2.9Å; V61-W64 PolarHBondContact O-N 2.95Å; V61-V65 HydrophobicContact CG1-CG2 4.31Å; V61-V65 VanDerWaalsContact O-CG2 3.32Å; V61-V65 WeakPolarHBondContact O-CG2 3.24Å; V61-V65 PolarHBondContact O-N 3.3Å
62Y86.4Confident79.7Confident162 Ų162105.1 Ų105.164%0.63552%0.517SS*.Hα-helixtrans-62.3-44.2177.1-178.5-100.4000112.3L58 W59 I60 W64 V65 S66L58-Y62 VanDerWaalsContact O-CB 3.26Å; L58-Y62 WeakPolarHBondContact O-CB 3.21Å; L58-Y62 PolarHBondContact O-N 3.41Å; W59-Y62 PolarHBondContact O-N 3.41Å; I60-Y62 VanDerWaalsContact C-N 3.35Å; Y62-W64 VanDerWaalsContact C-N 3.33Å; Y62-W64 PolarHBondContact O-N 2.86Å; Y62-V65 PolarHBondContact O-N 2.87Å; Y62-S66 VanDerWaalsContact O-CB 3.3Å; Y62-S66 WeakPolarHBondContact O-CB 3.49Å; Y62-S66 PolarHBondContact O-N 3.38Å; Y62-S66 PolarHBondContact O-OG 3.37Å
63L87.1Confident78.6Confident96 Ų96109.3 Ų109.350%0.50353%0.532SS..Hα-helixtrans-61.2-43.1175.5-16396.3000111W59 I60 S66 L67W59-L63 WeakPolarHBondContact O-CB 3.28Å; W59-L63 PolarHBondContact O-N 2.8Å; I60-L63 PolarHBondContact O-N 3.47Å; L63-S66 PolarHBondContact O-N 2.84Å; L63-L67 WeakPolarHBondContact O-CB 3.5Å; L63-L67 PolarHBondContact O-N 2.94Å
64W85.3Confident77.6Confident162 Ų162107.2 Ų107.261%0.61453%0.533SS*.Hα-helixtrans-65-46176.9-97.587.9000112.7I60 V61 Y62 S66 L67 L68I60-W64 WeakPolarHBondContact O-CB 3.35Å; I60-W64 PolarHBondContact O-N 3.26Å; V61-W64 PolarHBondContact O-N 2.95Å; Y62-W64 VanDerWaalsContact C-N 3.33Å; Y62-W64 PolarHBondContact O-N 2.86Å; W64-S66 VanDerWaalsContact C-N 3.3Å; W64-S66 PolarHBondContact O-N 3.37Å; W64-L67 PolarHBondContact O-N 3.28Å; W64-L68 HydrophobicContact CE3-CD1 3.85Å; W64-L68 HydrophobicContact CZ3-CD1 4.5Å; W64-L68 VanDerWaalsContact O-CB 3.32Å; W64-L68 WeakPolarHBondContact O-CB 3.3Å; W64-L68 WeakPolarHBondContact O-CD1 3.38Å; W64-L68 PolarHBondContact O-N 2.85Å
65V82.8Confident76.3Confident84 Ų84109.5 Ų109.551%0.50953%0.533SS..Hα-helixtrans-63.5-39.8177.4171.50000110.5V61 Y62 L68 K69V61-V65 HydrophobicContact CG1-CG2 4.31Å; V61-V65 VanDerWaalsContact O-CG2 3.32Å; V61-V65 WeakPolarHBondContact O-CG2 3.24Å; V61-V65 PolarHBondContact O-N 3.3Å; Y62-V65 PolarHBondContact O-N 2.87Å; V65-L68 PolarHBondContact O-N 3.4Å; V65-K69 VanDerWaalsContact O-CB 3.23Å; V65-K69 WeakPolarHBondContact O-CB 3.33Å; V65-K69 PolarHBondContact O-N 2.85Å
66S79.5Confident74.9Confident45 Ų45109.9 Ų109.932%0.31553%0.532SS..Hα-helixtrans-63.6-44.5176.2-59.80000111.5Y62 L63 W64 K69 T70Y62-S66 VanDerWaalsContact O-CB 3.3Å; Y62-S66 WeakPolarHBondContact O-CB 3.49Å; Y62-S66 PolarHBondContact O-N 3.38Å; Y62-S66 PolarHBondContact O-OG 3.37Å; L63-S66 PolarHBondContact O-N 2.84Å; W64-S66 VanDerWaalsContact C-N 3.3Å; W64-S66 PolarHBondContact O-N 3.37Å; S66-K69 PolarHBondContact O-N 2.94Å; S66-T70 WeakPolarHBondContact O-CG2 3.42Å; S66-T70 PolarHBondContact O-N 2.89Å; S66-T70 PolarHBondContact O-OG1 3.36Å
67L79Confident73.4Confident90 Ų90109.5 Ų109.547%0.47155%0.546SS..Hα-helixtrans-67.5-39.4176.3-169.8121.2000112.5L63 W64 K69 T70 I71L63-L67 WeakPolarHBondContact O-CB 3.5Å; L63-L67 PolarHBondContact O-N 2.94Å; W64-L67 PolarHBondContact O-N 3.28Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-T70 WeakPolarHBondContact CA-OG1 3.36Å; L67-T70 PolarHBondContact O-N 2.97Å; L67-T70 PolarHBondContact O-OG1 3.42Å; L67-I71 HydrophobicContact CD2-CD1 3.66Å; L67-I71 HydrophobicContact CG-CD1 4.11Å; L67-I71 WeakPolarHBondContact O-CB 3.4Å; L67-I71 WeakPolarHBondContact O-CD1 3.33Å; L67-I71 WeakPolarHBondContact O-CG1 3.3Å; L67-I71 PolarHBondContact O-N 2.94Å
68L80.4Confident72Confident95 Ų95111.5 Ų111.550%0.49755%0.549SS..Hα-helixtrans-62.6-42.2172.8-94142.9000111W64 V65 I71 F72W64-L68 HydrophobicContact CE3-CD1 3.85Å; W64-L68 HydrophobicContact CZ3-CD1 4.5Å; W64-L68 VanDerWaalsContact O-CB 3.32Å; W64-L68 WeakPolarHBondContact O-CB 3.3Å; W64-L68 WeakPolarHBondContact O-CD1 3.38Å; W64-L68 PolarHBondContact O-N 2.85Å; V65-L68 PolarHBondContact O-N 3.4Å; L68-I71 PolarHBondContact O-N 2.94Å; L68-F72 WeakPolarHBondContact O-CB 3.22Å; L68-F72 PolarHBondContact O-N 2.96Å
69K73.3Confident70.5Confident153 Ų153112 Ų11267%0.66555%0.552SS**Hα-helixtrans-64.6-43.6178.4-169.5174.8171.9109.40110.9V65 S66 L67 F72 W73V65-K69 VanDerWaalsContact O-CB 3.23Å; V65-K69 WeakPolarHBondContact O-CB 3.33Å; V65-K69 PolarHBondContact O-N 2.85Å; S66-K69 PolarHBondContact O-N 2.94Å; L67-K69 VanDerWaalsContact C-N 3.33Å; K69-F72 PolarHBondContact O-N 3.04Å; K69-W73 VanDerWaalsContact O-CB 3.3Å; K69-W73 WeakPolarHBondContact O-CB 3.29Å; K69-W73 PolarHBondContact O-N 3.26Å
70T70.1Confident69Low92 Ų92106.5 Ų106.556%0.56455%0.549SS*.Hα-helixtrans-64.8-40.4176.554.10000112.6S66 L67 S74S66-T70 WeakPolarHBondContact O-CG2 3.42Å; S66-T70 PolarHBondContact O-N 2.89Å; S66-T70 PolarHBondContact O-OG1 3.36Å; L67-T70 WeakPolarHBondContact CA-OG1 3.36Å; L67-T70 PolarHBondContact O-N 2.97Å; L67-T70 PolarHBondContact O-OG1 3.42Å; T70-S74 PolarHBondContact O-N 3.04Å
71I71.5Confident67.3Low90 Ų90106.1 Ų106.146%0.46255%0.553SS.*Hα-helixtrans-66.7-38.1176.1-66.6167.6000111.6L67 L68 S74 R75L67-I71 HydrophobicContact CD2-CD1 3.66Å; L67-I71 HydrophobicContact CG-CD1 4.11Å; L67-I71 WeakPolarHBondContact O-CB 3.4Å; L67-I71 WeakPolarHBondContact O-CD1 3.33Å; L67-I71 WeakPolarHBondContact O-CG1 3.3Å; L67-I71 PolarHBondContact O-N 2.94Å; L68-I71 PolarHBondContact O-N 2.94Å; I71-S74 PolarHBondContact O-OG 3.34Å; I71-S74 VanDerWaalsContact O-OG 3.05Å; I71-R75 PolarHBondContact O-N 3.16Å
72F62.9Low65.7Low115 Ų115105.7 Ų105.750%0.50455%0.551SS.*Hα-helixtrans-76.5-33.8-179.4-136.5-93000112.2L68 K69 R75 N76L68-F72 WeakPolarHBondContact O-CB 3.22Å; L68-F72 PolarHBondContact O-N 2.96Å; K69-F72 PolarHBondContact O-N 3.04Å; F72-R75 PolarHBondContact O-N 2.92Å; F72-N76 PolarHBondContact O-N 3.23Å
73W53.2Low64.4Low210 Ų210101.8 Ų101.880%0.79554%0.541SS*.Hα-helixtrans-70.5-37.1175.7-136.239000112K69 R75 N76 G77K69-W73 VanDerWaalsContact O-CB 3.3Å; K69-W73 WeakPolarHBondContact O-CB 3.29Å; K69-W73 PolarHBondContact O-N 3.26Å; W73-R75 PolarHBondContact O-N 3.46Å; W73-N76 PolarHBondContact O-N 2.95Å; W73-G77 PolarHBondContact O-N 2.87Å
74S54.6Low63Low81 Ų81101.9 Ų101.957%0.56655%0.546SS*.Hα-helixtrans-66-22.917377.60000113.1T70 I71T70-S74 PolarHBondContact O-N 3.04Å; I71-S74 PolarHBondContact O-OG 3.34Å; I71-S74 VanDerWaalsContact O-OG 3.05Å
75R50Low61.6Low127 Ų127101 Ų10148%0.47955%0.548SS..Hα-helixtrans-86.4-40.1176.6-162.4133.483.7-175.96.8113.2I71 F72 W73 G77I71-R75 PolarHBondContact O-N 3.16Å; F72-R75 PolarHBondContact O-N 2.92Å; W73-R75 PolarHBondContact O-N 3.46Å; R75-G77 VanDerWaalsContact C-N 3.34Å; R75-G77 PolarHBondContact O-N 3.49Å
76N49.7Very low60.4Low104 Ų104102.3 Ų102.356%0.55655%0.549SS*.Hα-helixtrans-77.5-15.8-176.8-73.41.2000114.2F72 W73F72-N76 PolarHBondContact O-N 3.23Å; W73-N76 PolarHBondContact O-N 2.95Å
77G50.8Low59.6Low65 Ų65108.4 Ų108.467%0.6757%0.565SS**THydrogen-bonded Turntrans-83.2-7.4177.100000115.5W73 R75W73-G77 PolarHBondContact O-N 2.87Å; R75-G77 VanDerWaalsContact C-N 3.34Å; R75-G77 PolarHBondContact O-N 3.49Å
78H50.8Low58.6Low124 Ų124106.8 Ų106.857%0.57457%0.565SS**SBendtrans-105.4-3.3-169.8-94.7-37000116.3T82H78-T82 PolarHBondContact O-OG1 3.39Å
79D50.7Low57.5Low122 Ų122109.7 Ų109.765%0.65257%0.569SS**THydrogen-bonded Turntrans-88.1-9.9-170.5-73.7-17.3000114.7
80G53.3Low56.8Low55 Ų55110 Ų11057%0.56757%0.566SS**THydrogen-bonded Turntrans-92.3-39176.300000114.6
81S52.8Low56.2Low74 Ų74109.5 Ų109.552%0.51757%0.566SS.*Hα-helixtrans-82.9-26.7-172.51780000113.4Q85S81-Q85 WeakPolarHBondContact O-CG 3.36Å; S81-Q85 PolarHBondContact O-N 3.36Å
82T55.7Low55.6Low74 Ų74110.2 Ų110.245%0.45457%0.571SS.*Hα-helixtrans-75.2-36-178460000111.8H78 Q86H78-T82 PolarHBondContact O-OG1 3.39Å; T82-Q86 WeakPolarHBondContact O-CB 3.05Å; T82-Q86 PolarHBondContact O-N 2.85Å
83D59Low55.3Low79 Ų79111 Ų11142%0.42257%0.571SS.*Hα-helixtrans-66.6-41.8176.4-168.764.2000112Q86 R87D83-Q86 PolarHBondContact O-N 3.15Å; D83-R87 WeakPolarHBondContact O-CB 3.49Å; D83-R87 PolarHBondContact O-N 2.65Å; D83-R87 IonicContact OD2-CZ 3.49Å; D83-R87 IonicContact OD2-NE 2.79Å; D83-R87 IonicContact OD2-NH2 3.47Å; D83-R87 PolarHBondContact OD2-NH2 3.48Å
84V57.9Low55.5Low99 Ų99110.7 Ų110.760%0.657%0.569SS**Hα-helixtrans-66.4-45179.4-178.90000111.2R87 A88V84-R87 PolarHBondContact O-N 3.49Å; V84-A88 WeakPolarHBondContact O-CB 3Å; V84-A88 PolarHBondContact O-N 2.9Å
85Q55.1Low55.5Low144 Ų144116.4 Ų116.467%0.67358%0.579SS**Hα-helixtrans-67.9-36.4176.3-71.4-145.6-26.400112.5S81 A88 W89S81-Q85 WeakPolarHBondContact O-CG 3.36Å; S81-Q85 PolarHBondContact O-N 3.36Å; Q85-A88 PolarHBondContact O-N 3.45Å; Q85-W89 WeakPolarHBondContact O-CB 3.11Å; Q85-W89 PolarHBondContact O-N 3.08Å
86Q57.9Low55.5Low111 Ų111115 Ų11552%0.51958%0.577SS.*Hα-helixtrans-71.3-32.2177.1-166.9143.3-45.400112.2T82 D83 R90T82-Q86 WeakPolarHBondContact O-CB 3.05Å; T82-Q86 PolarHBondContact O-N 2.85Å; D83-Q86 PolarHBondContact O-N 3.15Å; Q86-R90 WeakPolarHBondContact O-CB 3.29Å; Q86-R90 WeakPolarHBondContact O-CG 3.47Å; Q86-R90 PolarHBondContact O-N 2.91Å
87R62.4Low55.6Low172 Ų172115.3 Ų115.365%0.64958%0.575SS**Hα-helixtrans-71-42.8173.3-165.3177.1-64.6-168.81.6111.7D83 V84 R90 S91D83-R87 WeakPolarHBondContact O-CB 3.49Å; D83-R87 PolarHBondContact O-N 2.65Å; D83-R87 IonicContact OD2-CZ 3.49Å; D83-R87 IonicContact OD2-NE 2.79Å; D83-R87 IonicContact OD2-NH2 3.47Å; D83-R87 PolarHBondContact OD2-NH2 3.48Å; V84-R87 PolarHBondContact O-N 3.49Å; R87-R90 PolarHBondContact O-N 3.33Å; R87-S91 PolarHBondContact O-N 2.98Å; R87-S91 VanDerWaalsContact O-N 3.09Å
88A58.8Low55.8Low57 Ų57115.2 Ų115.247%0.47158%0.575SS.*Hα-helixtrans-63.3-40.8172.500000112V84 Q85 S91 N92V84-A88 WeakPolarHBondContact O-CB 3Å; V84-A88 PolarHBondContact O-N 2.9Å; Q85-A88 PolarHBondContact O-N 3.45Å; A88-S91 PolarHBondContact O-N 2.87Å; A88-N92 PolarHBondContact O-N 3.49Å
89W57.5Low55.6Low155 Ų155116.2 Ų116.259%0.58758%0.584SS**Hα-helixtrans-66.9-40.3177.1-169.582.7000112.8Q85 S91 N92 R93Q85-W89 WeakPolarHBondContact O-CB 3.11Å; Q85-W89 PolarHBondContact O-N 3.08Å; W89-S91 VanDerWaalsContact C-N 3.31Å; W89-S91 PolarHBondContact O-N 2.84Å; W89-N92 PolarHBondContact O-N 2.91Å; W89-R93 WeakPolarHBondContact O-CB 3.46Å; W89-R93 PolarHBondContact O-N 2.97Å
90R57.5Low55.5Low160 Ų160118.8 Ų118.860%0.60458%0.584SS**Hα-helixtrans-64-34.7173.7-80.7-177-179.8159.1-0112.6Q86 R87 R94Q86-R90 WeakPolarHBondContact O-CB 3.29Å; Q86-R90 WeakPolarHBondContact O-CG 3.47Å; Q86-R90 PolarHBondContact O-N 2.91Å; R87-R90 PolarHBondContact O-N 3.33Å; R90-R94 PolarHBondContact O-N 3.34Å
91S58Low55.2Low81 Ų81121.2 Ų121.257%0.56659%0.593SS**Hα-helixtrans-69-45.8175.9-177.90000112.1R87 A88 W89 R93 R94 R95R87-S91 PolarHBondContact O-N 2.98Å; R87-S91 VanDerWaalsContact O-N 3.09Å; A88-S91 PolarHBondContact O-N 2.87Å; W89-S91 VanDerWaalsContact C-N 3.31Å; W89-S91 PolarHBondContact O-N 2.84Å; S91-R93 VanDerWaalsContact C-N 3.32Å; S91-R93 PolarHBondContact O-N 2.92Å; S91-R94 PolarHBondContact O-N 3.39Å; S91-R95 PolarHBondContact O-N 2.97Å
92N58.9Low55Low105 Ų105124.9 Ų124.956%0.56161%0.605SS**Hα-helixtrans-68.2-29.6177.3-102.5-27.1000113.3A88 W89 R95 Q96A88-N92 PolarHBondContact O-N 3.49Å; W89-N92 PolarHBondContact O-N 2.91Å; N92-R95 PolarHBondContact O-N 3Å; N92-Q96 PolarHBondContact O-N 3.49Å
93R56.3Low54.4Low132 Ų132126.3 Ų126.350%0.49862%0.617SS.*Hα-helixtrans-67.1-42177-169.5167.6-175166.24.4112.6W89 S91 R95 Q96 E97W89-R93 WeakPolarHBondContact O-CB 3.46Å; W89-R93 PolarHBondContact O-N 2.97Å; S91-R93 VanDerWaalsContact C-N 3.32Å; S91-R93 PolarHBondContact O-N 2.92Å; R93-R95 VanDerWaalsContact C-N 3.33Å; R93-R95 PolarHBondContact O-N 3.35Å; R93-Q96 PolarHBondContact O-N 2.82Å; R93-E97 WeakPolarHBondContact CG-OE1 3.37Å; R93-E97 IonicContact NE-OE1 3.87Å; R93-E97 PolarHBondContact NE-OE1 3.25Å; R93-E97 WeakPolarHBondContact O-CG 3.26Å; R93-E97 PolarHBondContact O-N 2.93Å
94R58.2Low53.9Low204 Ų204131.2 Ų131.277%0.7764%0.639SS**Hα-helixtrans-64.8-35.5174.5-70.2-168.8-169.8-173.23.3112.6R90 S91R90-R94 PolarHBondContact O-N 3.34Å; S91-R94 PolarHBondContact O-N 3.39Å
95R53.9Low52.9Low201 Ų201134.5 Ų134.576%0.75865%0.648SS**Hα-helixtrans-68.2-35173.9-106.1-171.2-177.1-175.11.5113.2S91 N92 R93S91-R95 PolarHBondContact O-N 2.97Å; N92-R95 PolarHBondContact O-N 3Å; R93-R95 VanDerWaalsContact C-N 3.33Å; R93-R95 PolarHBondContact O-N 3.35Å
96Q49.8Very low52.7Low96 Ų96134 Ų13445%0.44966%0.655SS.*Hα-helixtrans-80.2-24.2176.3-76.1-146.3-4.100113.9N92 R93 G98 L99 R100N92-Q96 PolarHBondContact O-N 3.49Å; R93-Q96 PolarHBondContact O-N 2.82Å; Q96-G98 PolarHBondContact O-N 3.29Å; Q96-L99 PolarHBondContact O-N 3Å; Q96-R100 VanDerWaalsContact O-CB 3.26Å; Q96-R100 WeakPolarHBondContact O-CB 3.4Å; Q96-R100 VanDerWaalsContact O-CG 3.26Å; Q96-R100 WeakPolarHBondContact O-CG 3.37Å; Q96-R100 PolarHBondContact O-N 3.42Å
97E52.3Low51.7Low111 Ų111138.2 Ų138.252%0.51967%0.671SS.*Hα-helixtrans-64.9-25.8175.1-79.7163.8-177.400112.5R93R93-E97 WeakPolarHBondContact CG-OE1 3.37Å; R93-E97 IonicContact NE-OE1 3.87Å; R93-E97 PolarHBondContact NE-OE1 3.25Å; R93-E97 WeakPolarHBondContact O-CG 3.26Å; R93-E97 PolarHBondContact O-N 2.93Å
98G54.7Low50.9Low64 Ų64140.1 Ų140.166%0.6668%0.684SS**THydrogen-bonded Turntrans-75.1-17.1169.800000115.3Q96Q96-G98 PolarHBondContact O-N 3.29Å
99L47.5Very low50.1Low145 Ų145149 Ų14976%0.75971%0.706SS**THydrogen-bonded Turntrans-109.4-10-179.4-80.9165.4000113.6Q96Q96-L99 PolarHBondContact O-N 3Å
100R47.3Very low49.2Very low175 Ų175148 Ų14866%0.6672%0.716SS**THydrogen-bonded Turntrans-96.99.1-172.5-82.9-178179.1-147.61115.3Q96 I102Q96-R100 VanDerWaalsContact O-CB 3.26Å; Q96-R100 WeakPolarHBondContact O-CB 3.4Å; Q96-R100 VanDerWaalsContact O-CG 3.26Å; Q96-R100 WeakPolarHBondContact O-CG 3.37Å; Q96-R100 PolarHBondContact O-N 3.42Å; R100-I102 PolarHBondContact O-N 3Å
101S47Very low48.5Very low107 Ų107145.4 Ų145.475%0.74872%0.723SS**THydrogen-bonded Turntrans-71.2-8172.457.30000113.4
102I48.4Very low47.9Very low150 Ų150147 Ų14777%0.76973%0.734SS**SBendtrans-122.390.9176.2-50172.8000108.6R100R100-I102 PolarHBondContact O-N 3Å
103C44.3Very low47.2Very low105 Ų105151.8 Ų151.871%0.70975%0.75SS**  trans14889.3153-174.20000109.9
104M47.5Very low46.5Very low181 Ų181156.7 Ų156.789%0.89277%0.768SS**  trans-80.1117.5153.7-77.6-144.184.200107.9
105H37Very low45.8Very low169 Ų169149.7 Ų149.778%0.78276%0.76SS**  trans-141.4133.5150.5-99-73.6000111.5K107H105-K107 PolarHBondContact O-N 2.92Å
106T50.6Low46Very low134 Ų134146.6 Ų146.682%0.82276%0.758SS**  trans-48.6117.1-177.940.80000113.8
107K37Very low46.4Very low199 Ų199151.5 Ų151.587%0.86578%0.778SS**  trans-128.7101.1156.1-92.1-176.51771760110H105 R109H105-K107 PolarHBondContact O-N 2.92Å; K107-R109 PolarHBondContact O-N 3.42Å
108K46.5Very low46.9Very low212 Ų212151.8 Ų151.892%0.92278%0.782SS**  trans-49.9116163.3-82.4-179.7174.3176.50108.2
109R41.6Very low47.5Very low243 Ų243150.1 Ų150.192%0.91777%0.765SS**  trans-88113.4166.6-73.8-169.7179-163.7-1.2108.3K107 S111K107-R109 PolarHBondContact O-N 3.42Å; R109-S111 PolarHBondContact O-N 3.4Å
110V38.7Very low48.6Very low134 Ų134148 Ų14881%0.81275%0.753SS**  trans-53.2131.2165.1174.50000108.3S112V110-S112 PolarHBondContact O-N 2.93Å
111S42Very low49.7Very low106 Ų106147.8 Ų147.874%0.74176%0.758SS**  trans-50.4115.4-17750.30000111.8R109 F113R109-S111 PolarHBondContact O-N 3.4Å; S111-F113 PolarHBondContact O-N 3.26Å
112S47Very low51.1Low113 Ų113146.9 Ų146.979%0.7974%0.744SS**  trans-61.5128.316853.20000109.8V110 R114V110-S112 PolarHBondContact O-N 2.93Å; S112-R114 PolarHBondContact O-N 2.94Å
113F42.6Very low52.4Low206 Ų206143.5 Ų143.590%0.90473%0.73SS**  trans-36.8127.6172.2-92-105.6000112.7S111 G115S111-F113 PolarHBondContact O-N 3.26Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.18Å
114R42.2Very low54Low235 Ų235142 Ų14289%0.88772%0.715SS**  trans-7081.7174.7-167.6179.7-162.6-1226.9109S112 N116S112-R114 PolarHBondContact O-N 2.94Å; R114-N116 PolarHBondContact O-N 3.43Å
115G44.2Very low55.8Low57 Ų57137.4 Ų137.459%0.58870%0.697SS**  trans-60.3121.3172.200000109.9F113 K117F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.18Å; G115-K117 VanDerWaalsContact C-N 3.28Å; G115-K117 PolarHBondContact O-N 3.27Å
116N57.8Low57.8Low136 Ų136134.6 Ų134.673%0.72769%0.687SS**  trans-62.690170.3-93.1-0.8000109R114 I118R114-N116 PolarHBondContact O-N 3.43Å; N116-I118 PolarHBondContact O-N 3.01Å
117K59.1Low59.5Low200 Ų200136.3 Ų136.387%0.8768%0.678SS**  trans-74.979166.6-66-179.1-177.8-179.10107.4G115 G119G115-K117 VanDerWaalsContact C-N 3.28Å; G115-K117 PolarHBondContact O-N 3.27Å; K117-G119 PolarHBondContact O-N 3.2Å
118I60.8Low61.8Low116 Ų116135 Ų13560%0.59567%0.668SS**  trans-65.5104.2167.7-64.4169.3000105.4N116 D122 V123N116-I118 PolarHBondContact O-N 3.01Å; I118-D122 HydrophobicContact CG2-CB 3.99Å; I118-V123 HydrophobicContact CG2-CG2 3.7Å
119G68.3Low63.7Low29 Ų29129.2 Ų129.230%0.29964%0.644SS.*  trans-65.8150.9-178.900000109.6K117 K121 D122 V123K117-G119 PolarHBondContact O-N 3.2Å; G119-K121 PolarHBondContact O-N 2.86Å; G119-D122 PolarHBondContact N-OD2 3.32Å; G119-D122 WeakPolarHBondContact O-CB 3.06Å; G119-D122 PolarHBondContact O-N 3.32Å; G119-V123 PolarHBondContact O-N 3.31Å
120L70.3Confident65.9Low100 Ų100121.1 Ų121.152%0.52462%0.622SS.*Hα-helixtrans-51.1-32169.9178.962000111.4V123 I124L120-V123 PolarHBondContact O-N 3.18Å; L120-I124 HydrophobicContact CD1-CD1 4.18Å; L120-I124 HydrophobicContact CD1-CG1 4.43Å; L120-I124 HydrophobicContact CG-CD1 3.85Å; L120-I124 WeakPolarHBondContact O-CD1 2.84Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-I124 PolarHBondContact O-N 2.91Å
121K71.9Confident68Low172 Ų172118 Ų11875%0.74860%0.598SS**Hα-helixtrans-60.1-41.6173.7-67.1-178.4178.4179.80112.6G119 I124 T125G119-K121 PolarHBondContact O-N 2.86Å; K121-I124 PolarHBondContact O-N 3.35Å; K121-T125 PolarHBondContact O-N 3.46Å; K121-T125 PolarHBondContact O-OG1 3.3Å
122D74.8Confident70.3Confident87 Ų87117 Ų11747%0.46559%0.588SS.*Hα-helixtrans-70.4-35.8-179.4-57.2-35.6000111.9I118 G119 T125 L126I118-D122 HydrophobicContact CG2-CB 3.99Å; G119-D122 PolarHBondContact N-OD2 3.32Å; G119-D122 WeakPolarHBondContact O-CB 3.06Å; G119-D122 PolarHBondContact O-N 3.32Å; D122-T125 VanDerWaalsContact CA-OG1 3.28Å; D122-T125 WeakPolarHBondContact CA-OG1 3.44Å; D122-T125 PolarHBondContact O-OG1 3.36Å; D122-L126 WeakPolarHBondContact O-CB 3.27Å; D122-L126 PolarHBondContact O-N 3.49Å
123V76.2Confident72.2Confident79 Ų79117.4 Ų117.448%0.47958%0.575SS.*Hα-helixtrans-68.2-41.2174.5-177.70000110.8I118 G119 L120 L126 R127I118-V123 HydrophobicContact CG2-CG2 3.7Å; G119-V123 PolarHBondContact O-N 3.31Å; L120-V123 PolarHBondContact O-N 3.18Å; V123-L126 PolarHBondContact O-N 2.77Å; V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 PolarHBondContact O-N 2.93Å
124I79.1Confident74.5Confident74 Ų74111 Ų11138%0.37955%0.553SS.*Hα-helixtrans-67.5-42.2178.8-67.8166.1000111L120 K121 R127 R128L120-I124 HydrophobicContact CD1-CD1 4.18Å; L120-I124 HydrophobicContact CD1-CG1 4.43Å; L120-I124 HydrophobicContact CG-CD1 3.85Å; L120-I124 WeakPolarHBondContact O-CD1 2.84Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-I124 PolarHBondContact O-N 2.91Å; K121-I124 PolarHBondContact O-N 3.35Å; I124-R127 PolarHBondContact O-N 2.91Å; I124-R128 WeakPolarHBondContact O-CG 3.41Å; I124-R128 PolarHBondContact O-N 3.17Å
125T84.4Confident76.5Confident84 Ų84107.3 Ų107.352%0.51554%0.539SS..Hα-helixtrans-66-42.5176.243.20000111.4K121 D122 R127 R128 H129K121-T125 PolarHBondContact O-N 3.46Å; K121-T125 PolarHBondContact O-OG1 3.3Å; D122-T125 VanDerWaalsContact CA-OG1 3.28Å; D122-T125 WeakPolarHBondContact CA-OG1 3.44Å; D122-T125 PolarHBondContact O-OG1 3.36Å; T125-R127 PolarHBondContact O-N 3.43Å; T125-R128 PolarHBondContact O-N 3.25Å; T125-H129 WeakPolarHBondContact O-CB 3.01Å; T125-H129 PolarHBondContact O-N 2.99Å
126L79.4Confident78.4Confident111 Ų111106.9 Ų106.958%0.58153%0.53SS*.Hα-helixtrans-61.8-43.9175.7-173.965.7000111.6D122 V123 H129 V130D122-L126 WeakPolarHBondContact O-CB 3.27Å; D122-L126 PolarHBondContact O-N 3.49Å; V123-L126 PolarHBondContact O-N 2.77Å; L126-H129 PolarHBondContact O-N 3.45Å; L126-V130 WeakPolarHBondContact O-CG2 3.34Å; L126-V130 PolarHBondContact O-N 3Å
127R86.8Confident79.7Confident169 Ų169108 Ų10864%0.63853%0.528SS*.Hα-helixtrans-59.4-49.2175.3-178.2-176.7166.9-159-5.4111.6V123 I124 T125 H129 V130 E131V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 PolarHBondContact O-N 2.93Å; I124-R127 PolarHBondContact O-N 2.91Å; T125-R127 PolarHBondContact O-N 3.43Å; R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.32Å; R127-V130 PolarHBondContact O-N 3.47Å; R127-E131 IonicContact CZ-OE1 3.59Å; R127-E131 VanDerWaalsContact CZ-OE1 3.25Å; R127-E131 IonicContact NE-OE1 3.54Å; R127-E131 PolarHBondContact NE-OE1 3.06Å; R127-E131 IonicContact NH2-OE1 3.01Å; R127-E131 PolarHBondContact NH2-OE1 2.93Å; R127-E131 WeakPolarHBondContact O-CG 3.35Å; R127-E131 PolarHBondContact O-N 2.88Å
128R85.3Confident80.8Confident172 Ų172103.4 Ų103.465%0.64951%0.512SS*.Hα-helixtrans-59.4-41.6177.6-75.4178.8177.2-176.40.2111.6I124 T125 E131 T132I124-R128 WeakPolarHBondContact O-CG 3.41Å; I124-R128 PolarHBondContact O-N 3.17Å; T125-R128 PolarHBondContact O-N 3.25Å; R128-E131 PolarHBondContact O-N 3.08Å; R128-T132 WeakPolarHBondContact O-CG2 3.21Å; R128-T132 PolarHBondContact O-N 3.25Å; R128-T132 PolarHBondContact O-OG1 3.39Å
129H85.2Confident81.7Confident90 Ų90106.6 Ų106.642%0.41752%0.517SS..Hα-helixtrans-66.4-38.2178.1171.2-101.8000113T125 L126 R127 T132 K133T125-H129 WeakPolarHBondContact O-CB 3.01Å; T125-H129 PolarHBondContact O-N 2.99Å; L126-H129 PolarHBondContact O-N 3.45Å; R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.32Å; H129-T132 PolarHBondContact O-OG1 3.37Å; H129-K133 VanDerWaalsContact CE1-CE 3.41Å; H129-K133 WeakPolarHBondContact CE1-CE 3.31Å; H129-K133 PolarHBondContact CE1-NZ 3.36Å; H129-K133 VanDerWaalsContact CE1-NZ 3.32Å; H129-K133 WeakPolarHBondContact NE2-CE 3.4Å; H129-K133 PolarHBondContact NE2-NZ 2.9Å; H129-K133 PolarHBondContact O-N 3.48Å
130V88.3Confident82.1Confident74 Ų74112.7 Ų112.745%0.44854%0.535SS..Hα-helixtrans-68.6-43.3174.31730000110.6L126 R127 T132 K133 V134L126-V130 WeakPolarHBondContact O-CG2 3.34Å; L126-V130 PolarHBondContact O-N 3Å; R127-V130 PolarHBondContact O-N 3.47Å; V130-T132 PolarHBondContact O-N 3.5Å; V130-K133 PolarHBondContact O-N 2.88Å; V130-V134 HydrophobicContact CG1-CG2 4.32Å; V130-V134 WeakPolarHBondContact O-CG2 3.48Å; V130-V134 PolarHBondContact O-N 2.89Å
131E82.9Confident82.2Confident67 Ų67117 Ų11731%0.31354%0.544SS..Hα-helixtrans-60.7-41.6178.2-76.2-177.8-174.500112.2R127 R128 V134 R135R127-E131 IonicContact CZ-OE1 3.59Å; R127-E131 VanDerWaalsContact CZ-OE1 3.25Å; R127-E131 IonicContact NE-OE1 3.54Å; R127-E131 PolarHBondContact NE-OE1 3.06Å; R127-E131 IonicContact NH2-OE1 3.01Å; R127-E131 PolarHBondContact NH2-OE1 2.93Å; R127-E131 WeakPolarHBondContact O-CG 3.35Å; R127-E131 PolarHBondContact O-N 2.88Å; R128-E131 PolarHBondContact O-N 3.08Å; E131-V134 PolarHBondContact O-N 3.08Å; E131-R135 WeakPolarHBondContact O-CB 3.44Å; E131-R135 VanDerWaalsContact O-CG 3.26Å; E131-R135 WeakPolarHBondContact O-CG 3.35Å; E131-R135 PolarHBondContact O-N 3.3Å
132T89Confident82.1Confident86 Ų86115.8 Ų115.853%0.52854%0.539SS..Hα-helixtrans-66.6-41.4176.555.20000111.9R128 H129 V130 V134 R135 A136R128-T132 WeakPolarHBondContact O-CG2 3.21Å; R128-T132 PolarHBondContact O-N 3.25Å; R128-T132 PolarHBondContact O-OG1 3.39Å; H129-T132 PolarHBondContact O-OG1 3.37Å; V130-T132 PolarHBondContact O-N 3.5Å; T132-V134 PolarHBondContact O-N 3.45Å; T132-R135 PolarHBondContact O-N 3.36Å; T132-A136 WeakPolarHBondContact O-CB 3.38Å; T132-A136 PolarHBondContact O-N 3.47Å
133K88.7Confident81.8Confident122 Ų122115.6 Ų115.653%0.5354%0.541SS..Hα-helixtrans-61.5-42.3174.7-80.7-171.9173.3179.40112.5H129 V130 A136 K137H129-K133 VanDerWaalsContact CE1-CE 3.41Å; H129-K133 WeakPolarHBondContact CE1-CE 3.31Å; H129-K133 PolarHBondContact CE1-NZ 3.36Å; H129-K133 VanDerWaalsContact CE1-NZ 3.32Å; H129-K133 WeakPolarHBondContact NE2-CE 3.4Å; H129-K133 PolarHBondContact NE2-NZ 2.9Å; H129-K133 PolarHBondContact O-N 3.48Å; V130-K133 PolarHBondContact O-N 2.88Å; K133-A136 PolarHBondContact O-N 3.18Å; K133-K137 WeakPolarHBondContact O-CG 3.46Å; K133-K137 PolarHBondContact O-N 3.4Å
134V90.3Very high81Confident71 Ų71115.3 Ų115.343%0.4354%0.539SS..Hα-helixtrans-66.3-46.2177.2171.80000110.6V130 E131 T132 A136 K137 I138V130-V134 HydrophobicContact CG1-CG2 4.32Å; V130-V134 WeakPolarHBondContact O-CG2 3.48Å; V130-V134 PolarHBondContact O-N 2.89Å; E131-V134 PolarHBondContact O-N 3.08Å; T132-V134 PolarHBondContact O-N 3.45Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.89Å; V134-K137 PolarHBondContact O-N 3.42Å; V134-I138 HydrophobicContact CG1-CD1 3.78Å; V134-I138 HydrophobicContact CG1-CG1 4.39Å; V134-I138 WeakPolarHBondContact O-CG1 3.3Å; V134-I138 PolarHBondContact O-N 2.87Å
135R84.3Confident80Confident158 Ų158116 Ų11660%0.59655%0.547SS*.Hα-helixtrans-59.6-41.3176.1-73.5175.6-176.2-161.62.6112.1E131 T132 I138 R139E131-R135 WeakPolarHBondContact O-CB 3.44Å; E131-R135 VanDerWaalsContact O-CG 3.26Å; E131-R135 WeakPolarHBondContact O-CG 3.35Å; E131-R135 PolarHBondContact O-N 3.3Å; T132-R135 PolarHBondContact O-N 3.36Å; R135-I138 PolarHBondContact O-N 2.84Å; R135-R139 WeakPolarHBondContact O-CB 3.4Å; R135-R139 WeakPolarHBondContact O-CG 3.35Å; R135-R139 PolarHBondContact O-N 3.06Å
136A84.8Confident78.7Confident48 Ų48119.8 Ų119.840%0.39756%0.557SS.*Hα-helixtrans-63.8-42.4175.900000111.8T132 K133 V134 R139 K140T132-A136 WeakPolarHBondContact O-CB 3.38Å; T132-A136 PolarHBondContact O-N 3.47Å; K133-A136 PolarHBondContact O-N 3.18Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.89Å; A136-R139 PolarHBondContact O-N 2.88Å; A136-K140 WeakPolarHBondContact O-CB 3.46Å; A136-K140 WeakPolarHBondContact O-CG 3.37Å; A136-K140 PolarHBondContact O-N 3.41Å
137K83.8Confident77.7Confident159 Ų159120.1 Ų120.169%0.69156%0.557SS**Hα-helixtrans-63.1-42.5174.2-77.2-178.6177-175.90112.2K133 V134 K140 R141K133-K137 WeakPolarHBondContact O-CG 3.46Å; K133-K137 PolarHBondContact O-N 3.4Å; V134-K137 PolarHBondContact O-N 3.42Å; K137-K140 PolarHBondContact O-N 3.36Å; K137-R141 WeakPolarHBondContact O-CB 3.39Å; K137-R141 PolarHBondContact O-N 2.78Å
138I82.9Confident76.1Confident103 Ų103117.9 Ų117.953%0.52856%0.558SS.*Hα-helixtrans-63.5-45.5176.6-67.5167.9000110.7V134 R135 R141 K142V134-I138 HydrophobicContact CG1-CD1 3.78Å; V134-I138 HydrophobicContact CG1-CG1 4.39Å; V134-I138 WeakPolarHBondContact O-CG1 3.3Å; V134-I138 PolarHBondContact O-N 2.87Å; R135-I138 PolarHBondContact O-N 2.84Å; I138-R141 PolarHBondContact O-N 3.25Å; I138-K142 WeakPolarHBondContact O-CB 3.36Å; I138-K142 PolarHBondContact O-N 2.81Å
139R79.6Confident74.7Confident184 Ų184117.5 Ų117.569%0.69456%0.563SS**Hα-helixtrans-61.4-47.5176.2-75179.2-179.9-179-1.1111.6R135 A136 R141 K142 V143R135-R139 WeakPolarHBondContact O-CB 3.4Å; R135-R139 WeakPolarHBondContact O-CG 3.35Å; R135-R139 PolarHBondContact O-N 3.06Å; A136-R139 PolarHBondContact O-N 2.88Å; R139-R141 PolarHBondContact O-N 2.91Å; R139-K142 PolarHBondContact O-N 2.99Å; R139-V143 WeakPolarHBondContact O-CB 3.41Å; R139-V143 VanDerWaalsContact O-CG2 3.28Å; R139-V143 WeakPolarHBondContact O-CG2 3.46Å; R139-V143 PolarHBondContact O-N 2.85Å
140K76.8Confident73.3Confident156 Ų156121.1 Ų121.168%0.67858%0.58SS**Hα-helixtrans-57.4-47.6175.1-76.9-173.3177.8-1700111.4A136 K137 K142 V143 T144A136-K140 WeakPolarHBondContact O-CB 3.46Å; A136-K140 WeakPolarHBondContact O-CG 3.37Å; A136-K140 PolarHBondContact O-N 3.41Å; K137-K140 PolarHBondContact O-N 3.36Å; K140-K142 PolarHBondContact O-N 3.03Å; K140-V143 PolarHBondContact O-N 3.19Å; K140-T144 WeakPolarHBondContact O-CG2 3.33Å; K140-T144 PolarHBondContact O-N 3.37Å; K140-T144 PolarHBondContact O-OG1 2.91Å; K140-T144 VanDerWaalsContact O-OG1 3.1Å
141R72.1Confident71.8Confident191 Ų191123.9 Ų123.972%0.72159%0.593SS**Hα-helixtrans-60.3-44.8177.1-167.2177.4-176.3-161.41111.9K137 I138 R139 T144 T145K137-R141 WeakPolarHBondContact O-CB 3.39Å; K137-R141 PolarHBondContact O-N 2.78Å; I138-R141 PolarHBondContact O-N 3.25Å; R139-R141 PolarHBondContact O-N 2.91Å; R141-T144 WeakPolarHBondContact CA-OG1 3.18Å; R141-T144 PolarHBondContact O-N 3.37Å; R141-T144 PolarHBondContact O-OG1 3.45Å; R141-T145 WeakPolarHBondContact O-CB 3.41Å; R141-T145 PolarHBondContact O-N 2.85Å; R141-T145 PolarHBondContact O-OG1 2.78Å
142K70.1Confident70.5Confident146 Ų146129.9 Ų129.964%0.63562%0.618SS**Hα-helixtrans-64.8-39.1178-168.6174.2-176.8177.30112.2I138 R139 K140 T145 K146I138-K142 WeakPolarHBondContact O-CB 3.36Å; I138-K142 PolarHBondContact O-N 2.81Å; R139-K142 PolarHBondContact O-N 2.99Å; K140-K142 PolarHBondContact O-N 3.03Å; K142-T145 PolarHBondContact O-N 3.47Å; K142-K146 PolarHBondContact O-N 3.35Å
143V67.1Low69Low83 Ų83130.3 Ų130.350%0.50362%0.616SS.*Hα-helixtrans-65.1-46.9174.2169.70000110.4R139 K140 T145 K146 I147R139-V143 WeakPolarHBondContact O-CB 3.41Å; R139-V143 VanDerWaalsContact O-CG2 3.28Å; R139-V143 WeakPolarHBondContact O-CG2 3.46Å; R139-V143 PolarHBondContact O-N 2.85Å; K140-V143 PolarHBondContact O-N 3.19Å; V143-T145 VanDerWaalsContact C-N 3.33Å; V143-T145 PolarHBondContact O-N 3.4Å; V143-K146 PolarHBondContact O-N 3.1Å; V143-I147 HydrophobicContact CG1-CD1 3.67Å; V143-I147 HydrophobicContact CG1-CG1 4.41Å; V143-I147 VanDerWaalsContact O-CG1 3.29Å; V143-I147 WeakPolarHBondContact O-CG1 3.47Å; V143-I147 PolarHBondContact O-N 2.88Å
144T59.6Low67.5Low73 Ų73130.8 Ų130.845%0.44862%0.624SS.*Hα-helixtrans-65.1-35176.653.80000112.7K140 R141 I147 N148K140-T144 WeakPolarHBondContact O-CG2 3.33Å; K140-T144 PolarHBondContact O-N 3.37Å; K140-T144 PolarHBondContact O-OG1 2.91Å; K140-T144 VanDerWaalsContact O-OG1 3.1Å; R141-T144 WeakPolarHBondContact CA-OG1 3.18Å; R141-T144 PolarHBondContact O-N 3.37Å; R141-T144 PolarHBondContact O-OG1 3.45Å; T144-I147 PolarHBondContact O-N 3.29Å; T144-N148 WeakPolarHBondContact O-CB 3.24Å; T144-N148 PolarHBondContact O-N 3.29Å; T144-N148 VanDerWaalsContact O-N 3.11Å; T144-N148 PolarHBondContact O-ND2 3.46Å
145T58.9Low65.7Low90 Ų90130.1 Ų130.155%0.55263%0.632SS**Hα-helixtrans-68.2-37174.4-58.60000111.6R141 K142 V143R141-T145 WeakPolarHBondContact O-CB 3.41Å; R141-T145 PolarHBondContact O-N 2.85Å; R141-T145 PolarHBondContact O-OG1 2.78Å; K142-T145 PolarHBondContact O-N 3.47Å; V143-T145 VanDerWaalsContact C-N 3.33Å; V143-T145 PolarHBondContact O-N 3.4Å
146K56.4Low64.3Low163 Ų163131.5 Ų131.571%0.70964%0.642SS**Hα-helixtrans-68.2-40.7174.1-90.4-167.2167.1-1660112.5K142 V143 N148 H149K142-K146 PolarHBondContact O-N 3.35Å; V143-K146 PolarHBondContact O-N 3.1Å; K146-N148 VanDerWaalsContact C-N 3.27Å; K146-N148 PolarHBondContact O-N 2.87Å; K146-H149 PolarHBondContact O-N 3.25Å
147I58.2Low62.8Low117 Ų117139.5 Ų139.560%0.666%0.662SS**Hα-helixtrans-65.3-32.8178.3-67.2167.3000111V143 T144 H149V143-I147 HydrophobicContact CG1-CD1 3.67Å; V143-I147 HydrophobicContact CG1-CG1 4.41Å; V143-I147 VanDerWaalsContact O-CG1 3.29Å; V143-I147 WeakPolarHBondContact O-CG1 3.47Å; V143-I147 PolarHBondContact O-N 2.88Å; T144-I147 PolarHBondContact O-N 3.29Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.45Å
148N54.4Low61.4Low123 Ų123137.5 Ų137.566%0.65865%0.653SS**THydrogen-bonded Turntrans-786.4178.9-76.5-23.6000115.7T144 K146T144-N148 WeakPolarHBondContact O-CB 3.24Å; T144-N148 PolarHBondContact O-N 3.29Å; T144-N148 VanDerWaalsContact O-N 3.11Å; T144-N148 PolarHBondContact O-ND2 3.46Å; K146-N148 VanDerWaalsContact C-N 3.27Å; K146-N148 PolarHBondContact O-N 2.87Å
149H56Low60.3Low163 Ų163136.3 Ų136.376%0.75565%0.651SS**THydrogen-bonded Turntrans-97.54.6176.4-154.6-59.8000113.5K146 I147K146-H149 PolarHBondContact O-N 3.25Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.45Å
150H55.9Low59.7Low167 Ų167129.6 Ų129.677%0.77364%0.635SS**  trans-105.49.9179.8-100.8-72.5000116.3K152H150-K152 PolarHBondContact O-N 3.19Å
151D55.3Low59.5Low132 Ų132130.9 Ų130.971%0.70664%0.636SS**  trans-72.8100.1162-77.8-14.1000108.2I153D151-I153 WeakPolarHBondContact O-CG1 3.44Å; D151-I153 PolarHBondContact O-N 2.96Å
152K55.3Low59.6Low193 Ų193128.7 Ų128.784%0.83963%0.631SS**  trans-56.293.9159.2-83.4179.8177.2177.80106.8H150 N154H150-K152 PolarHBondContact O-N 3.19Å; K152-N154 PolarHBondContact O-N 3.32Å
153I58Low59.8Low94 Ų94127.6 Ų127.648%0.48263%0.628SS.*  trans-67.691.5174.7-67155.5000105.9D151 G155 K158D151-I153 WeakPolarHBondContact O-CG1 3.44Å; D151-I153 PolarHBondContact O-N 2.96Å; I153-G155 PolarHBondContact O-N 2.84Å; I153-K158 HydrophobicContact CG2-CD 3.36Å; I153-K158 HydrophobicContact CG2-CG 3.57Å
154N57.3Low60.7Low132 Ų132130.4 Ų130.471%0.70663%0.634SS**  trans-52.1112.4163.4-85.8-15.7000107.5K152 K156 R157K152-N154 PolarHBondContact O-N 3.32Å; N154-K156 PolarHBondContact O-N 3.26Å; N154-R157 PolarHBondContact O-N 3.35Å; N154-R157 VanDerWaalsContact O-N 3.1Å
155G53.6Low62.1Low58 Ų58131.9 Ų131.960%0.59864%0.637SS**Hα-helixtrans-53.6-18.6-168.600000115.1I153 T159I153-G155 PolarHBondContact O-N 2.84Å; G155-T159 PolarHBondContact O-OG1 2.92Å
156K53.6Low63.2Low186 Ų186133.8 Ų133.881%0.80964%0.638SS**Hα-helixtrans-70.9-30.1178.7-64.2-175.2178.2-177.80114.7N154 T159N154-K156 PolarHBondContact O-N 3.26Å; K156-T159 PolarHBondContact O-OG1 3.49Å
157R54.1Low64.7Low217 Ų217131.9 Ų131.982%0.81963%0.631SS**Hα-helixtrans-80.9-27.9-176.1-156.5175.9-1721743.1112.9N154 R161N154-R157 PolarHBondContact O-N 3.35Å; N154-R157 VanDerWaalsContact O-N 3.1Å; R157-R161 WeakPolarHBondContact O-CB 3.43Å; R157-R161 PolarHBondContact O-N 2.99Å; R157-R161 VanDerWaalsContact O-N 3.11Å
158K53.9Low66.3Low116 Ų116135.1 Ų135.150%0.50464%0.636SS.*Hα-helixtrans-69.4-37.6176.7-84.8-173.5178.71660112.2I153 K162I153-K158 HydrophobicContact CG2-CD 3.36Å; I153-K158 HydrophobicContact CG2-CG 3.57Å; K158-K162 VanDerWaalsContact O-CB 3.3Å; K158-K162 WeakPolarHBondContact O-CB 3.33Å; K158-K162 WeakPolarHBondContact O-CG 3.46Å; K158-K162 PolarHBondContact O-N 3.37Å
159T59.3Low67.9Low78 Ų78132 Ų13248%0.47963%0.627SS.*Hα-helixtrans-65.9-46.4176.111.20000111.3G155 K156 R161 K162 Q163G155-T159 PolarHBondContact O-OG1 2.92Å; K156-T159 PolarHBondContact O-OG1 3.49Å; T159-R161 PolarHBondContact O-N 3.5Å; T159-K162 PolarHBondContact O-N 2.96Å; T159-Q163 WeakPolarHBondContact O-CB 3.39Å; T159-Q163 WeakPolarHBondContact O-CG 3.28Å; T159-Q163 PolarHBondContact O-N 3.42Å
160A67.8Low69.5Low44 Ų44128.4 Ų128.436%0.36461%0.611SS.*Hα-helixtrans-62.9-41176.900000112.9K164A160-K164 WeakPolarHBondContact O-CB 3.32Å; A160-K164 WeakPolarHBondContact O-CG 3.34Å; A160-K164 PolarHBondContact O-N 3.48Å
161R72.8Confident71.2Confident183 Ų183125.2 Ų125.269%0.69160%0.596SS**Hα-helixtrans-69.3-39.7176.7-167.8177.6177.4173.80.1112R157 T159 K164 M165R157-R161 WeakPolarHBondContact O-CB 3.43Å; R157-R161 PolarHBondContact O-N 2.99Å; R157-R161 VanDerWaalsContact O-N 3.11Å; T159-R161 PolarHBondContact O-N 3.5Å; R161-K164 PolarHBondContact O-N 2.87Å; R161-M165 HydrophobicContact CG-CE 4.25Å; R161-M165 WeakPolarHBondContact O-CG 3.47Å; R161-M165 PolarHBondContact O-N 3.35Å
162K74.3Confident72.9Confident145 Ų145124.2 Ų124.263%0.6359%0.59SS**Hα-helixtrans-63.9-44.2174-83.9-173.8173-172.60111.8K158 T159 K164 M165 F166K158-K162 VanDerWaalsContact O-CB 3.3Å; K158-K162 WeakPolarHBondContact O-CB 3.33Å; K158-K162 WeakPolarHBondContact O-CG 3.46Å; K158-K162 PolarHBondContact O-N 3.37Å; T159-K162 PolarHBondContact O-N 2.96Å; K162-K164 PolarHBondContact O-N 3.31Å; K162-M165 HydrophobicContact CG-CE 4.25Å; K162-M165 PolarHBondContact O-N 3.11Å; K162-F166 WeakPolarHBondContact O-CB 3.31Å; K162-F166 PolarHBondContact O-N 2.91Å
163Q73.9Confident74.3Confident123 Ų123123.3 Ų123.358%0.57558%0.582SS**Hα-helixtrans-60.8-43.9175.3-77.3173.9-19.400111.5T159 M165 F166 Q167T159-Q163 WeakPolarHBondContact O-CB 3.39Å; T159-Q163 WeakPolarHBondContact O-CG 3.28Å; T159-Q163 PolarHBondContact O-N 3.42Å; Q163-M165 VanDerWaalsContact C-N 3.35Å; Q163-M165 PolarHBondContact O-N 3.24Å; Q163-F166 PolarHBondContact O-N 3.45Å; Q163-Q167 WeakPolarHBondContact O-CB 3.46Å; Q163-Q167 WeakPolarHBondContact O-CG 3.29Å; Q163-Q167 PolarHBondContact O-N 3.19Å
164K86.6Confident75.7Confident142 Ų142127 Ų12762%0.61759%0.59SS**Hα-helixtrans-62.1-38.9174.2-75.7-179178.7-173.10113A160 R161 K162 R168A160-K164 WeakPolarHBondContact O-CB 3.32Å; A160-K164 WeakPolarHBondContact O-CG 3.34Å; A160-K164 PolarHBondContact O-N 3.48Å; R161-K164 PolarHBondContact O-N 2.87Å; K162-K164 PolarHBondContact O-N 3.31Å; K164-R168 WeakPolarHBondContact O-CB 3.45Å; K164-R168 WeakPolarHBondContact O-CG 3.44Å; K164-R168 PolarHBondContact O-N 2.96Å
165M87.4Confident77Confident103 Ų103128 Ų12851%0.50758%0.583SS.*Hα-helixtrans-68.5-38.9175.2-72.9-174.9-6300111.9R161 K162 Q163 R168 A169R161-M165 HydrophobicContact CG-CE 4.25Å; R161-M165 WeakPolarHBondContact O-CG 3.47Å; R161-M165 PolarHBondContact O-N 3.35Å; K162-M165 HydrophobicContact CG-CE 4.25Å; K162-M165 PolarHBondContact O-N 3.11Å; Q163-M165 VanDerWaalsContact C-N 3.35Å; Q163-M165 PolarHBondContact O-N 3.24Å; M165-R168 PolarHBondContact O-N 2.95Å; M165-A169 WeakPolarHBondContact O-CB 3.17Å; M165-A169 PolarHBondContact O-N 3.48Å
166F83.4Confident78.4Confident131 Ų131128.1 Ų128.158%0.57558%0.579SS**Hα-helixtrans-65.7-44.6176.4-173.3-104.2000112K162 Q163 R168 A169 Q170K162-F166 WeakPolarHBondContact O-CB 3.31Å; K162-F166 PolarHBondContact O-N 2.91Å; Q163-F166 PolarHBondContact O-N 3.45Å; F166-R168 PolarHBondContact O-N 3.27Å; F166-A169 PolarHBondContact O-N 3.05Å; F166-Q170 HydrophobicContact CD1-CG 4.48Å; F166-Q170 HydrophobicContact CE1-CG 4.23Å; F166-Q170 HydrophobicContact CZ-CG 4.45Å; F166-Q170 WeakPolarHBondContact O-CG 3.01Å; F166-Q170 PolarHBondContact O-N 3.39Å
167Q87.7Confident79.6Confident123 Ų123123.2 Ų123.258%0.57556%0.559SS**Hα-helixtrans-59.6-45.3173.3-75175.2-13.700111.6Q163 A169 Q170 E171Q163-Q167 WeakPolarHBondContact O-CB 3.46Å; Q163-Q167 WeakPolarHBondContact O-CG 3.29Å; Q163-Q167 PolarHBondContact O-N 3.19Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 3.25Å; Q167-Q170 PolarHBondContact O-N 3.16Å; Q167-E171 PolarHBondContact O-N 2.96Å
168R91Very high80.9Confident184 Ų184116.7 Ų116.769%0.69454%0.54SS*.Hα-helixtrans-62.4-39.2175.4-78.2-178.5179.6-169.6-1.3112.9K164 M165 F166 E171 L172K164-R168 WeakPolarHBondContact O-CB 3.45Å; K164-R168 WeakPolarHBondContact O-CG 3.44Å; K164-R168 PolarHBondContact O-N 2.96Å; M165-R168 PolarHBondContact O-N 2.95Å; F166-R168 PolarHBondContact O-N 3.27Å; R168-E171 PolarHBondContact O-N 3.44Å; R168-L172 WeakPolarHBondContact O-CG 3.44Å; R168-L172 PolarHBondContact O-N 3.33Å
169A88.3Confident81.8Confident57 Ų57118 Ų11847%0.47154%0.543SS..Hα-helixtrans-65.6-40.2176.200000111.7M165 F166 Q167 L172 R173M165-A169 WeakPolarHBondContact O-CB 3.17Å; M165-A169 PolarHBondContact O-N 3.48Å; F166-A169 PolarHBondContact O-N 3.05Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 3.25Å; A169-L172 PolarHBondContact O-N 3.42Å; A169-R173 WeakPolarHBondContact O-CB 3.46Å; A169-R173 PolarHBondContact O-N 2.79Å
170Q89.9Confident82.3Confident89 Ų89119.8 Ų119.842%0.41655%0.546SS..Hα-helixtrans-64.4-39.9173.7-74.1-175.1-27.300112.2F166 Q167 R173 R174F166-Q170 HydrophobicContact CD1-CG 4.48Å; F166-Q170 HydrophobicContact CE1-CG 4.23Å; F166-Q170 HydrophobicContact CZ-CG 4.45Å; F166-Q170 WeakPolarHBondContact O-CG 3.01Å; F166-Q170 PolarHBondContact O-N 3.39Å; Q167-Q170 PolarHBondContact O-N 3.16Å; Q170-R173 WeakPolarHBondContact O-CB 3.43Å; Q170-R173 PolarHBondContact O-N 2.73Å; Q170-R174 WeakPolarHBondContact O-CG 3.44Å; Q170-R174 PolarHBondContact O-N 3.23Å
171E91.4Very high82.3Confident99 Ų99122.4 Ų122.446%0.46355%0.549SS..Hα-helixtrans-67.9-40.7177.5-169.9169.5170.200112.3Q167 R168 R173 R174 R175Q167-E171 PolarHBondContact O-N 2.96Å; R168-E171 PolarHBondContact O-N 3.44Å; E171-R173 VanDerWaalsContact C-N 3.3Å; E171-R173 PolarHBondContact O-N 3.32Å; E171-R174 PolarHBondContact O-N 3.46Å; E171-R175 WeakPolarHBondContact O-CG 3.46Å; E171-R175 PolarHBondContact O-N 2.95Å; E171-R175 IonicContact OE1-CZ 2.87Å; E171-R175 IonicContact OE1-NE 3.88Å; E171-R175 IonicContact OE1-NH2 2.84Å; E171-R175 PolarHBondContact OE1-NH2 3.4Å
172L91Very high82Confident112 Ų112119.2 Ų119.259%0.58655%0.553SS**Hα-helixtrans-61.2-39.8172.3-74.2172.5000111.9R168 A169 R175 A176R168-L172 WeakPolarHBondContact O-CG 3.44Å; R168-L172 PolarHBondContact O-N 3.33Å; A169-L172 PolarHBondContact O-N 3.42Å; L172-R175 PolarHBondContact O-N 3.48Å; L172-A176 WeakPolarHBondContact O-CB 3.29Å; L172-A176 PolarHBondContact O-N 2.76Å
173R85.8Confident81.8Confident174 Ų174118.7 Ų118.766%0.65755%0.551SS**Hα-helixtrans-61.9-46.6174.7-178.3178.6172.4166.63.2111.6A169 Q170 E171 R175 A176 E177A169-R173 WeakPolarHBondContact O-CB 3.46Å; A169-R173 PolarHBondContact O-N 2.79Å; Q170-R173 WeakPolarHBondContact O-CB 3.43Å; Q170-R173 PolarHBondContact O-N 2.73Å; E171-R173 VanDerWaalsContact C-N 3.3Å; E171-R173 PolarHBondContact O-N 3.32Å; R173-R175 PolarHBondContact O-N 2.87Å; R173-A176 PolarHBondContact O-N 3.43Å; R173-E177 WeakPolarHBondContact CG-OE1 3.3Å; R173-E177 IonicContact CZ-OE1 3.54Å; R173-E177 IonicContact NE-OE1 3.75Å; R173-E177 PolarHBondContact NE-OE1 2.64Å; R173-E177 IonicContact NH2-OE1 2.72Å; R173-E177 WeakPolarHBondContact O-CG 3.49Å; R173-E177 PolarHBondContact O-N 3.42Å
174R85.8Confident81.4Confident172 Ų172114.3 Ų114.365%0.64953%0.531SS*.Hα-helixtrans-59.8-44.2175.9-72.5-179.9-178.2178.70.3111.7Q170 E171 A176 E177 D178Q170-R174 WeakPolarHBondContact O-CG 3.44Å; Q170-R174 PolarHBondContact O-N 3.23Å; E171-R174 PolarHBondContact O-N 3.46Å; R174-A176 VanDerWaalsContact C-N 3.33Å; R174-A176 PolarHBondContact O-N 3.37Å; R174-E177 PolarHBondContact O-N 3.32Å; R174-D178 WeakPolarHBondContact O-CB 3.48Å; R174-D178 VanDerWaalsContact O-CG 3.28Å; R174-D178 PolarHBondContact O-N 3.11Å
175R86.1Confident80.6Confident151 Ų151110.9 Ų110.957%0.5752%0.523SS*.Hα-helixtrans-62.6-37.8176-71.6-178-169.6170.23.8113E171 L172 R173 Y179E171-R175 WeakPolarHBondContact O-CG 3.46Å; E171-R175 PolarHBondContact O-N 2.95Å; E171-R175 IonicContact OE1-CZ 2.87Å; E171-R175 IonicContact OE1-NE 3.88Å; E171-R175 IonicContact OE1-NH2 2.84Å; E171-R175 PolarHBondContact OE1-NH2 3.4Å; L172-R175 PolarHBondContact O-N 3.48Å; R173-R175 PolarHBondContact O-N 2.87Å; R175-Y179 VanDerWaalsContact O-CB 3.29Å; R175-Y179 WeakPolarHBondContact O-CB 3.45Å; R175-Y179 PolarHBondContact O-N 3.47Å
176A82Confident79.6Confident61 Ų61111 Ų11150%0.50453%0.532SS..Hα-helixtrans-67.9-41.7175.700000111.8L172 R173 R174 Y179 H180L172-A176 WeakPolarHBondContact O-CB 3.29Å; L172-A176 PolarHBondContact O-N 2.76Å; R173-A176 PolarHBondContact O-N 3.43Å; R174-A176 VanDerWaalsContact C-N 3.33Å; R174-A176 PolarHBondContact O-N 3.37Å; A176-Y179 PolarHBondContact O-N 3.33Å; A176-H180 WeakPolarHBondContact O-CB 3.29Å; A176-H180 PolarHBondContact O-N 2.96Å
177E78.6Confident78.7Confident84 Ų84109.1 Ų109.139%0.39354%0.535SS..Hα-helixtrans-62.7-42.3174.4-72.4172.9-165.400111.2R173 R174 H180 K181R173-E177 WeakPolarHBondContact CG-OE1 3.3Å; R173-E177 IonicContact CZ-OE1 3.54Å; R173-E177 IonicContact NE-OE1 3.75Å; R173-E177 PolarHBondContact NE-OE1 2.64Å; R173-E177 IonicContact NH2-OE1 2.72Å; R173-E177 WeakPolarHBondContact O-CG 3.49Å; R173-E177 PolarHBondContact O-N 3.42Å; R174-E177 PolarHBondContact O-N 3.32Å; E177-H180 PolarHBondContact O-N 3.33Å; E177-K181 VanDerWaalsContact O-CG 3.3Å; E177-K181 WeakPolarHBondContact O-CG 3.41Å; E177-K181 PolarHBondContact O-N 3.21Å
178D82.6Confident77.6Confident80 Ų80104.9 Ų104.943%0.42852%0.521SS..Hα-helixtrans-68.9-39.1177.2-68.7-22.3000111.9R174 H180 K181 C182R174-D178 WeakPolarHBondContact O-CB 3.48Å; R174-D178 VanDerWaalsContact O-CG 3.28Å; R174-D178 PolarHBondContact O-N 3.11Å; D178-H180 VanDerWaalsContact C-N 3.33Å; D178-H180 PolarHBondContact O-N 2.83Å; D178-K181 WeakPolarHBondContact O-CB 3.43Å; D178-K181 PolarHBondContact O-N 2.91Å; D178-K181 IonicContact OD1-NZ 3.25Å; D178-C182 WeakPolarHBondContact O-CB 3.42Å; D178-C182 PolarHBondContact O-N 2.84Å; D178-C182 PolarHBondContact O-SG 2.79Å
179Y72.6Confident76.3Confident143 Ų143100.4 Ų100.456%0.56150%0.504SS*.Hα-helixtrans-60.3-42.3172-176.5-101.7000112.1R175 A176 K181 C182 K183R175-Y179 VanDerWaalsContact O-CB 3.29Å; R175-Y179 WeakPolarHBondContact O-CB 3.45Å; R175-Y179 PolarHBondContact O-N 3.47Å; A176-Y179 PolarHBondContact O-N 3.33Å; Y179-K181 VanDerWaalsContact C-N 3.35Å; Y179-C182 PolarHBondContact O-N 3.47Å; Y179-K183 HydrophobicContact CD1-CD 4.18Å; Y179-K183 HydrophobicContact CE1-CD 3.5Å; Y179-K183 HydrophobicContact CE1-CG 4.3Å; Y179-K183 HydrophobicContact CE2-CD 4.36Å; Y179-K183 WeakPolarHBondContact O-CB 3.35Å; Y179-K183 PolarHBondContact O-N 3.12Å; Y179-K183 WeakPolarHBondContact OH-CE 3.47Å; Y179-K183 PolarHBondContact OH-NZ 3.33Å
180H69.4Low75.3Confident116 Ų116104.9 Ų104.954%0.53751%0.513SS..Hα-helixtrans-65.8-38.3175.7-170.172.7000111.8A176 E177 D178 I184A176-H180 WeakPolarHBondContact O-CB 3.29Å; A176-H180 PolarHBondContact O-N 2.96Å; E177-H180 PolarHBondContact O-N 3.33Å; D178-H180 VanDerWaalsContact C-N 3.33Å; D178-H180 PolarHBondContact O-N 2.83Å; H180-I184 WeakPolarHBondContact CE1-CD1 3.48Å; H180-I184 WeakPolarHBondContact NE2-CD1 3.48Å; H180-I184 PolarHBondContact O-N 3.48Å; H180-I184 VanDerWaalsContact O-N 3.16Å
181K67.3Low74.2Confident99 Ų99103.6 Ų103.643%0.4352%0.517SS..Hα-helixtrans-63.4-44.4172.6-71.7171.8-170.5165.30111.5E177 D178 Y179 K183 I184 R189E177-K181 VanDerWaalsContact O-CG 3.3Å; E177-K181 WeakPolarHBondContact O-CG 3.41Å; E177-K181 PolarHBondContact O-N 3.21Å; D178-K181 WeakPolarHBondContact O-CB 3.43Å; D178-K181 PolarHBondContact O-N 2.91Å; D178-K181 IonicContact OD1-NZ 3.25Å; Y179-K181 VanDerWaalsContact C-N 3.35Å; K181-K183 VanDerWaalsContact C-N 3.34Å; K181-K183 PolarHBondContact O-N 2.87Å; K181-I184 VanDerWaalsContact O-O 3.13Å; K181-R189 VanDerWaalsContact C-NH2 3.25Å; K181-R189 PolarHBondContact O-NH2 3.46Å
182C67.7Low72.9Confident115 Ų115103 Ų10378%0.77752%0.517SS*.Hα-helixtrans-71.3-28.3-178.8-66.40000113.1D178 Y179D178-C182 WeakPolarHBondContact O-CB 3.42Å; D178-C182 PolarHBondContact O-N 2.84Å; D178-C182 PolarHBondContact O-SG 2.79Å; Y179-C182 PolarHBondContact O-N 3.47Å
183K69.8Low71.6Confident135 Ų135101.5 Ų101.559%0.58752%0.515SS*.Hα-helixtrans-82.3-26.9178.3-86.7-164.3163-176.20115Y179 K181Y179-K183 HydrophobicContact CD1-CD 4.18Å; Y179-K183 HydrophobicContact CE1-CD 3.5Å; Y179-K183 HydrophobicContact CE1-CG 4.3Å; Y179-K183 HydrophobicContact CE2-CD 4.36Å; Y179-K183 WeakPolarHBondContact O-CB 3.35Å; Y179-K183 PolarHBondContact O-N 3.12Å; Y179-K183 WeakPolarHBondContact OH-CE 3.47Å; Y179-K183 PolarHBondContact OH-NZ 3.33Å; K181-K183 VanDerWaalsContact C-N 3.34Å; K181-K183 PolarHBondContact O-N 2.87Å
184I65Low70.9Confident30 Ų3097.3 Ų97.315%0.15451%0.506CS..SBendtrans-106.1113.3-178.2-53.1-172.7000109.7H180 K181 A188 R189 L192H180-I184 WeakPolarHBondContact CE1-CD1 3.48Å; H180-I184 WeakPolarHBondContact NE2-CD1 3.48Å; H180-I184 PolarHBondContact O-N 3.48Å; H180-I184 VanDerWaalsContact O-N 3.16Å; K181-I184 VanDerWaalsContact O-O 3.13Å; I184-A188 HydrophobicContact CG2-CB 3.73Å; I184-R189 HydrophobicContact CB-CG 4.02Å; I184-R189 HydrophobicContact CG2-CG 3.48Å; I184-R189 VanDerWaalsContact CG2-CG 3.48Å; I184-R189 PolarHBondContact O-NE 3.21Å; I184-R189 VanDerWaalsContact O-NE 3.11Å; I184-R189 PolarHBondContact O-NH2 2.94Å; I184-L192 HydrophobicContact CD1-CD1 4.45Å
185P69.8Low70.1Confident70 Ų7097.6 Ų97.646%0.45551%0.507SS..  trans-59.7145.8177.123.6-30.6000109.9S187 A188 R189P185-S187 PolarHBondContact O-N 2.97Å; P185-A188 HydrophobicContact CG-CB 3.82Å; P185-A188 PolarHBondContact O-N 3.4Å; P185-R189 PolarHBondContact O-N 3.49Å
186P65.5Low69.3Low105 Ų10594.5 Ų94.568%0.68251%0.505SS*.Hα-helixtrans-52.1-33.9-176.4-28.134.6000114.1R189 K190P186-R189 PolarHBondContact O-N 3.49Å; P186-K190 PolarHBondContact O-N 3.01Å
187S64.9Low68.5Low92 Ų92100.9 Ų100.964%0.64352%0.515SS*.Hα-helixtrans-63.6-43175.753.30000113.1P185 R189 K190 A191P185-S187 PolarHBondContact O-N 2.97Å; S187-R189 VanDerWaalsContact C-N 3.34Å; S187-R189 PolarHBondContact O-N 3.24Å; S187-K190 PolarHBondContact O-N 2.93Å; S187-A191 PolarHBondContact O-N 3.38Å
188A64.3Low67.7Low35 Ų35102.8 Ų102.829%0.28953%0.526SS..Hα-helixtrans-70.8-28.6178.900000112.4I184 P185 A191 L192I184-A188 HydrophobicContact CG2-CB 3.73Å; P185-A188 HydrophobicContact CG-CB 3.82Å; P185-A188 PolarHBondContact O-N 3.4Å; A188-A191 PolarHBondContact O-N 2.93Å; A188-L192 WeakPolarHBondContact O-CB 3.34Å; A188-L192 PolarHBondContact O-N 2.97Å
189R65Low66.6Low89 Ų89100.5 Ų100.534%0.33652%0.518SS..Hα-helixtrans-65.5-39.9172-60.2-170.3-151158.712.2111.7K181 I184 P185 P186 S187 L192 C193K181-R189 VanDerWaalsContact C-NH2 3.25Å; K181-R189 PolarHBondContact O-NH2 3.46Å; I184-R189 HydrophobicContact CB-CG 4.02Å; I184-R189 HydrophobicContact CG2-CG 3.48Å; I184-R189 VanDerWaalsContact CG2-CG 3.48Å; I184-R189 PolarHBondContact O-NE 3.21Å; I184-R189 VanDerWaalsContact O-NE 3.11Å; I184-R189 PolarHBondContact O-NH2 2.94Å; P185-R189 PolarHBondContact O-N 3.49Å; P186-R189 PolarHBondContact O-N 3.49Å; S187-R189 VanDerWaalsContact C-N 3.34Å; S187-R189 PolarHBondContact O-N 3.24Å; R189-L192 PolarHBondContact O-N 3.4Å; R189-C193 WeakPolarHBondContact O-CB 3.41Å; R189-C193 PolarHBondContact O-N 3.41Å; R189-C193 PolarHBondContact O-SG 3.27Å; R189-C193 VanDerWaalsContact O-SG 3.39Å
190K66.2Low66Low152 Ų15295.9 Ų95.966%0.66151%0.509SS*.Hα-helixtrans-65.3-41177.4-161175.8-175.8-177.70111.2P186 S187 C193 N194P186-K190 PolarHBondContact O-N 3.01Å; S187-K190 PolarHBondContact O-N 2.93Å; K190-C193 PolarHBondContact O-N 3.43Å; K190-N194 VanDerWaalsContact O-CB 3.32Å; K190-N194 WeakPolarHBondContact O-CB 3.37Å; K190-N194 PolarHBondContact O-N 3.25Å
191A66.6Low65.5Low61 Ų6192.1 Ų92.150%0.50450%0.498SS..Hα-helixtrans-63.4-44.6173.800000112.3S187 A188 N194 W195S187-A191 PolarHBondContact O-N 3.38Å; A188-A191 PolarHBondContact O-N 2.93Å; A191-N194 PolarHBondContact O-N 3.37Å; A191-W195 WeakPolarHBondContact O-CB 3.28Å; A191-W195 PolarHBondContact O-N 2.99Å
192L65.1Low64.8Low86 Ų8694.2 Ų94.245%0.4551%0.51SS..Hα-helixtrans-62.4-45.3175.1-99.3150.8000112.6I184 A188 R189 N194 W195 V196I184-L192 HydrophobicContact CD1-CD1 4.45Å; A188-L192 WeakPolarHBondContact O-CB 3.34Å; A188-L192 PolarHBondContact O-N 2.97Å; R189-L192 PolarHBondContact O-N 3.4Å; L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 3.31Å; L192-W195 PolarHBondContact O-N 3.48Å; L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.45Å; L192-V196 PolarHBondContact O-N 3.36Å
193C64.1Low64Low81 Ų8196.1 Ų96.155%0.54751%0.507SS..Hα-helixtrans-64.5-38.4176.2-73.20000112.2R189 K190 R197R189-C193 WeakPolarHBondContact O-CB 3.41Å; R189-C193 PolarHBondContact O-N 3.41Å; R189-C193 PolarHBondContact O-SG 3.27Å; R189-C193 VanDerWaalsContact O-SG 3.39Å; K190-C193 PolarHBondContact O-N 3.43Å; C193-R197 WeakPolarHBondContact O-CB 3.45Å; C193-R197 WeakPolarHBondContact O-CG 3.43Å; C193-R197 PolarHBondContact O-N 3.06Å
194N71.3Confident62.9Low86 Ų8698.9 Ų98.946%0.4651%0.514SS..Hα-helixtrans-66.7-41.9174.8-74.7-8.3000111.3K190 A191 L192 R197 M198K190-N194 VanDerWaalsContact O-CB 3.32Å; K190-N194 WeakPolarHBondContact O-CB 3.37Å; K190-N194 PolarHBondContact O-N 3.25Å; A191-N194 PolarHBondContact O-N 3.37Å; L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 3.31Å; N194-R197 PolarHBondContact O-N 3.44Å; N194-M198 WeakPolarHBondContact O-CB 3.3Å; N194-M198 VanDerWaalsContact O-CG 3.3Å; N194-M198 WeakPolarHBondContact O-CG 3.43Å; N194-M198 PolarHBondContact O-N 2.91Å
195W68.4Low62.2Low179 Ų179105.3 Ų105.368%0.67854%0.543SS*.Hα-helixtrans-64.2-43.7176.3-17671.1000112.2A191 L192 R197 M198 A199A191-W195 WeakPolarHBondContact O-CB 3.28Å; A191-W195 PolarHBondContact O-N 2.99Å; L192-W195 PolarHBondContact O-N 3.48Å; W195-R197 VanDerWaalsContact C-N 3.31Å; W195-R197 PolarHBondContact O-N 2.94Å; W195-M198 PolarHBondContact O-N 2.93Å; W195-A199 WeakPolarHBondContact O-CB 3.4Å; W195-A199 PolarHBondContact O-N 2.91Å
196V68.4Low61.4Low86 Ų86107.3 Ų107.352%0.52156%0.558SS.*Hα-helixtrans-62.5-37.8174171.40000111.5L192 A200L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.45Å; L192-V196 PolarHBondContact O-N 3.36Å; V196-A200 VanDerWaalsContact O-CB 3.24Å; V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 3.48Å
197R65.5Low60.8Low194 Ų194105.2 Ų105.273%0.73255%0.546SS*.Hα-helixtrans-68-40.7174.3-76.2179.2100.2162.96112.4C193 N194 W195 A200 A201C193-R197 WeakPolarHBondContact O-CB 3.45Å; C193-R197 WeakPolarHBondContact O-CG 3.43Å; C193-R197 PolarHBondContact O-N 3.06Å; N194-R197 PolarHBondContact O-N 3.44Å; W195-R197 VanDerWaalsContact C-N 3.31Å; W195-R197 PolarHBondContact O-N 2.94Å; R197-A200 PolarHBondContact O-N 3.03Å; R197-A201 WeakPolarHBondContact O-CB 3.48Å; R197-A201 PolarHBondContact O-N 2.85Å
198M63Low60.1Low124 Ų124104.3 Ų104.361%0.61155%0.551SS**Hα-helixtrans-66-46.9176.4-73.8-59.9-61.800111.2N194 W195 A200 A201 E202N194-M198 WeakPolarHBondContact O-CB 3.3Å; N194-M198 VanDerWaalsContact O-CG 3.3Å; N194-M198 WeakPolarHBondContact O-CG 3.43Å; N194-M198 PolarHBondContact O-N 2.91Å; W195-M198 PolarHBondContact O-N 2.93Å; M198-A200 VanDerWaalsContact C-N 3.29Å; M198-A200 PolarHBondContact O-N 3.25Å; M198-A201 CarbonylContact O-C 3.58Å; M198-A201 WeakPolarHBondContact O-CB 3.5Å; M198-A201 PolarHBondContact O-N 3.24Å; M198-E202 VanDerWaalsContact O-CB 3.31Å; M198-E202 WeakPolarHBondContact O-CB 3.32Å; M198-E202 PolarHBondContact O-N 3.44Å
199A59.2Low59.3Low33 Ų33109.2 Ų109.227%0.27357%0.572SS.*Hα-helixtrans-61.5-37.7176.200000111.9W195 E202 H203W195-A199 WeakPolarHBondContact O-CB 3.4Å; W195-A199 PolarHBondContact O-N 2.91Å; A199-E202 PolarHBondContact O-N 3.49Å; A199-H203 WeakPolarHBondContact O-CB 3.44Å; A199-H203 PolarHBondContact O-N 2.98Å
200A58.6Low58.2Low45 Ų45110 Ų11037%0.37259%0.589SS.*Hα-helixtrans-70.4-31.9173.800000113.1V196 R197 M198 R204V196-A200 VanDerWaalsContact O-CB 3.24Å; V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 3.48Å; R197-A200 PolarHBondContact O-N 3.03Å; M198-A200 VanDerWaalsContact C-N 3.29Å; M198-A200 PolarHBondContact O-N 3.25Å; A200-R204 WeakPolarHBondContact O-CB 3.48Å; A200-R204 WeakPolarHBondContact O-CD 3.35Å; A200-R204 WeakPolarHBondContact O-CG 3.36Å; A200-R204 PolarHBondContact O-N 3.41Å
201A58.9Low57Low37 Ų37112.2 Ų112.231%0.30659%0.594SS.*Hα-helixtrans-71.6-41.3172.500000111.3R197 M198 R204 H205R197-A201 WeakPolarHBondContact O-CB 3.48Å; R197-A201 PolarHBondContact O-N 2.85Å; M198-A201 CarbonylContact O-C 3.58Å; M198-A201 WeakPolarHBondContact O-CB 3.5Å; M198-A201 PolarHBondContact O-N 3.24Å; A201-R204 WeakPolarHBondContact O-CA 3.33Å; A201-R204 WeakPolarHBondContact O-CB 3.38Å; A201-R204 PolarHBondContact O-N 3.24Å; A201-H205 PolarHBondContact O-CD2 2.83Å; A201-H205 PolarHBondContact O-N 3.44Å; A201-H205 VanDerWaalsContact O-N 3.08Å
202E54.3Low55.9Low144 Ų144120.2 Ų120.267%0.67361%0.612SS**Hα-helixtrans-67-42.1179.3-164.8168-167.900111.7M198 A199 R204 H205 S206M198-E202 VanDerWaalsContact O-CB 3.31Å; M198-E202 WeakPolarHBondContact O-CB 3.32Å; M198-E202 PolarHBondContact O-N 3.44Å; A199-E202 PolarHBondContact O-N 3.49Å; E202-R204 PolarHBondContact O-N 3.21Å; E202-H205 PolarHBondContact O-N 3.44Å; E202-S206 PolarHBondContact O-N 2.92Å
203H49.9Very low55Low154 Ų154119.4 Ų119.471%0.71361%0.612SS**Hα-helixtrans-62.3-24.9169.9-109.3-73.8000113.5A199A199-H203 WeakPolarHBondContact O-CB 3.44Å; A199-H203 PolarHBondContact O-N 2.98Å
204R47.8Very low54Low193 Ų193126.2 Ų126.273%0.72863%0.627SS**Hα-helixtrans-85.8-21.7179.1-79.2175.4179.3-176.8-0.1113.9A200 A201 E202 S207A200-R204 WeakPolarHBondContact O-CB 3.48Å; A200-R204 WeakPolarHBondContact O-CD 3.35Å; A200-R204 WeakPolarHBondContact O-CG 3.36Å; A200-R204 PolarHBondContact O-N 3.41Å; A201-R204 WeakPolarHBondContact O-CA 3.33Å; A201-R204 WeakPolarHBondContact O-CB 3.38Å; A201-R204 PolarHBondContact O-N 3.24Å; E202-R204 PolarHBondContact O-N 3.21Å; R204-S207 PolarHBondContact O-OG 3.31Å
205H49.6Very low52.9Low166 Ų166126.2 Ų126.277%0.76963%0.627SS**Hα-helixtrans-80.2-25.5172.9-71.2-60000112.5A201 E202A201-H205 PolarHBondContact O-CD2 2.83Å; A201-H205 PolarHBondContact O-N 3.44Å; A201-H205 VanDerWaalsContact O-N 3.08Å; E202-H205 PolarHBondContact O-N 3.44Å
206S52.3Low52.3Low111 Ų111122.2 Ų122.278%0.77662%0.622SS**THydrogen-bonded Turntrans-83.3-14.2176.9-158.10000113.8E202E202-S206 PolarHBondContact O-N 2.92Å
207S53.5Low51.4Low61 Ų61121.9 Ų121.943%0.42763%0.629SS.*THydrogen-bonded Turntrans-90.5-2.6-175.963.10000115.4R204 L209R204-S207 PolarHBondContact O-OG 3.31Å; S207-L209 PolarHBondContact O-N 2.74Å
208G50Low50.8Low73 Ų73119 Ų11975%0.75362%0.623SS**  trans60.615.117300000116
209L47.8Very low50.3Low139 Ų139115.7 Ų115.773%0.72861%0.611SS**  trans-84.9134.2-176.9-80.7164.4000111.7S207 Y211S207-L209 PolarHBondContact O-N 2.74Å; L209-Y211 PolarHBondContact O-N 2.82Å
210P42Very low50.1Low105 Ų105118.5 Ų118.568%0.68262%0.62SS**  trans-64.3135-178.723.6-30.7000111.7W212P210-W212 PolarHBondContact O-N 3.26Å
211Y41.6Very low49.8Very low198 Ų198123.6 Ų123.678%0.77663%0.634SS**  trans-61.4110.3179.2173.9-104000111.3L209 P213L209-Y211 PolarHBondContact O-N 2.82Å; Y211-P213 HydrophobicContact CD1-CB 4.47Å; Y211-P213 HydrophobicContact CD1-CG 4.17Å; Y211-P213 HydrophobicContact CE1-CB 3.59Å; Y211-P213 HydrophobicContact CE1-CG 3.61Å
212W42.4Very low49.8Very low229 Ų229127.2 Ų127.287%0.86765%0.648SS**  trans-95.7111.2158.2-88.687.5000108.2P210 Y214P210-W212 PolarHBondContact O-N 3.26Å; W212-Y214 PolarHBondContact O-N 3.15Å
213P46.1Very low49.8Very low70 Ų70129.5 Ų129.546%0.45565%0.651SS.*  trans-62.3114.9175.810.1-8.7000108.3Y211 L215Y211-P213 HydrophobicContact CD1-CB 4.47Å; Y211-P213 HydrophobicContact CD1-CG 4.17Å; Y211-P213 HydrophobicContact CE1-CB 3.59Å; Y211-P213 HydrophobicContact CE1-CG 3.61Å; P213-L215 PolarHBondContact O-N 3.32Å
214Y43.8Very low50Low224 Ų224129.1 Ų129.188%0.87865%0.651SS**  trans-58.2107.6161.7-139.2-93.4000105.5W212 T216W212-Y214 PolarHBondContact O-N 3.15Å; Y214-T216 PolarHBondContact O-N 3.01Å
215L47.3Very low50.2Low85 Ų85123 Ų12345%0.44565%0.648SS.*  trans-52.7107.7174.4-82157000107.3P213 A217 T219P213-L215 PolarHBondContact O-N 3.32Å; L215-A217 PolarHBondContact O-N 3.03Å; L215-T219 HydrophobicContact CD2-CG2 3.9Å
216T55.7Low50.4Low95 Ų95122.8 Ų122.858%0.58365%0.647SS**  trans-55.2141.2174-25.30000107.2Y214 E218 T219 L220Y214-T216 PolarHBondContact O-N 3.01Å; T216-E218 PolarHBondContact O-N 3.33Å; T216-T219 PolarHBondContact N-OG1 3.36Å; T216-T219 WeakPolarHBondContact O-CB 3.35Å; T216-T219 PolarHBondContact O-N 3.26Å; T216-T219 PolarHBondContact O-OG1 2.87Å; T216-L220 PolarHBondContact O-N 3.18Å
217A51.2Low50.5Low80 Ų80126.2 Ų126.266%0.66165%0.651SS**Hα-helixtrans-51.8-28.8-178.800000112.7L215 T219 L220 K221L215-A217 PolarHBondContact O-N 3.03Å; A217-T219 PolarHBondContact O-N 2.72Å; A217-L220 PolarHBondContact O-N 2.99Å; A217-K221 PolarHBondContact O-N 3.11Å
218E52.1Low50.7Low132 Ų132128.7 Ų128.762%0.61767%0.666SS**Hα-helixtrans-52.2-47.8168.9-12882.7-143.200113.5T216 L220 K221 N222T216-E218 PolarHBondContact O-N 3.33Å; E218-L220 PolarHBondContact O-N 2.81Å; E218-K221 PolarHBondContact O-N 2.98Å; E218-N222 PolarHBondContact O-N 3.01Å; E218-N222 VanDerWaalsContact O-N 3.12Å
219T51.3Low51.1Low56 Ų56130.8 Ų130.834%0.34467%0.666SS.*Hα-helixtrans-69.3-33.4-177.3-90000112.4L215 T216 A217 R223L215-T219 HydrophobicContact CD2-CG2 3.9Å; T216-T219 PolarHBondContact N-OG1 3.36Å; T216-T219 WeakPolarHBondContact O-CB 3.35Å; T216-T219 PolarHBondContact O-N 3.26Å; T216-T219 PolarHBondContact O-OG1 2.87Å; A217-T219 PolarHBondContact O-N 2.72Å; T219-R223 PolarHBondContact O-N 3.14Å
220L55Low51.4Low91 Ų91129.5 Ų129.548%0.47667%0.666SS.*Hα-helixtrans-72.5-37.1176-119.7155.5000111.1T216 A217 E218 R223 M224T216-L220 PolarHBondContact O-N 3.18Å; A217-L220 PolarHBondContact O-N 2.99Å; E218-L220 PolarHBondContact O-N 2.81Å; L220-R223 PolarHBondContact O-N 3.1Å; L220-M224 HydrophobicContact CB-CE 4.45Å; L220-M224 HydrophobicContact CD2-CE 3.85Å; L220-M224 WeakPolarHBondContact O-CE 3.23Å; L220-M224 PolarHBondContact O-N 3.44Å
221K54.3Low51.7Low153 Ų153130.4 Ų130.467%0.66567%0.671SS**Hα-helixtrans-65.1-40.7175.6-170.6-179.6170.9-172.70112.3A217 E218 R223 M224A217-K221 PolarHBondContact O-N 3.11Å; E218-K221 PolarHBondContact O-N 2.98Å; K221-R223 VanDerWaalsContact C-N 3.32Å; K221-R223 PolarHBondContact O-N 2.85Å; K221-M224 PolarHBondContact O-N 3.21Å
222N56.9Low52.1Low112 Ų112127.5 Ų127.560%0.59967%0.674SS**Hα-helixtrans-69-28.2178.4-68.7-17.4000113.2E218E218-N222 PolarHBondContact O-N 3.01Å; E218-N222 VanDerWaalsContact O-N 3.12Å
223R55.7Low52.4Low192 Ų192125.6 Ų125.673%0.72568%0.675SS**Hα-helixtrans-78.3-27.4175.1-76-172.8178.3-170.7-0.1114T219 L220 K221 G225T219-R223 PolarHBondContact O-N 3.14Å; L220-R223 PolarHBondContact O-N 3.1Å; K221-R223 VanDerWaalsContact C-N 3.32Å; K221-R223 PolarHBondContact O-N 2.85Å; R223-G225 VanDerWaalsContact C-N 3.3Å
224M53.5Low52.6Low147 Ų147134.8 Ų134.872%0.72471%0.712SS**Hα-helixtrans-78.2-12176.3-79.8-177.2-82.100113.9L220 K221L220-M224 HydrophobicContact CB-CE 4.45Å; L220-M224 HydrophobicContact CD2-CE 3.85Å; L220-M224 WeakPolarHBondContact O-CE 3.23Å; L220-M224 PolarHBondContact O-N 3.44Å; K221-M224 PolarHBondContact O-N 3.21Å
225G51.6Low53Low64 Ų64130.4 Ų130.466%0.6670%0.704SS**THydrogen-bonded Turntrans-90.2-4.2-177.700000116.1R223R223-G225 VanDerWaalsContact C-N 3.3Å
226H54Low53.3Low161 Ų161132.7 Ų132.775%0.74572%0.718SS**  trans-102.1113.9179.8-76.557.7000110.1
227Q54.2Low53.2Low184 Ų184134.8 Ų134.886%0.8673%0.725SS**PPolyproline II helixtrans-69.3139.8164.6-80.4-165.7-5.800109.6
228P57.7Low53.3Low113 Ų113138.1 Ų138.173%0.73473%0.729SS**PPolyproline II helixtrans-6714517227.2-31.3000110.5
229P59.2Low53.4Low116 Ų116138.4 Ų138.475%0.75374%0.736SS**PPolyproline II helixtrans-64.9148.617827.1-33000110.9
230P54.5Low53.6Low112 Ų112143.9 Ų143.973%0.72776%0.762SS**PPolyproline II helixtrans-65.4144.9-17726.3-33.1000111.4T232P230-T232 PolarHBondContact O-N 3.38Å
231P47Very low53.4Low124 Ų124147.7 Ų147.781%0.80578%0.782SS**PPolyproline II helixtrans-67.5127.8-177.726.5-32.6000110.9Q233P231-Q233 PolarHBondContact O-N 3.45Å
232T50.1Low53.4Low137 Ų137147.3 Ų147.384%0.8479%0.791SS**PPolyproline II helixtrans-67.9123.2172.9-38.40000108.9P230P230-T232 PolarHBondContact O-N 3.38Å
233Q49.4Very low53.1Low190 Ų190150.3 Ų150.389%0.88881%0.808SS**PPolyproline II helixtrans-75.8129.2170.5-68.9-149.96.600109.5P231P231-Q233 PolarHBondContact O-N 3.45Å
234Q50.3Low52.9Low263 Ų263146.5 Ų146.5100%1.22982%0.815SS**  trans-108.70159.5-77.2-171.6-16.200108.1

Retrieved 234 of 234 residues in 50.5 ms (Link to these results)