A0A077ZAP4_TRITR Loading...

E3 ubiquitin protein ligase MARCH8

AlphaFold DB , UniProt , Accession A0A077ZAP4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 289 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
1M33.1Very low37.2Very low240 Ų240170.9 Ų170.9100%1.18286%0.859SS**  0113.20-75.9-159.7174.900108.8
2L40.4Very low36.6Very low185 Ų185173.3 Ų173.397%0.96986%0.861SS**  trans178.991159.1-99.6149.3000107.5
3S38Very low36.5Very low106 Ų106168.5 Ų168.574%0.74185%0.847SS**  trans-142.2104.9160.1-176.40000106.4
4K44Very low35.9Very low213 Ų213168 Ų16893%0.92684%0.84SS**  trans-135.5103.8167.7-84.8-171.7175.9175.30108.1
5N32.8Very low35.8Very low155 Ų155169.8 Ų169.883%0.82984%0.841SS**  trans-63.4134.3164.8-73.9-29.3000111
6K38.9Very low35.4Very low202 Ų202169.3 Ų169.388%0.87884%0.835SS**  trans-158.5102.7154.4-116.4179.5179.1-175.10106
7C29.5Very low35Very low125 Ų125170 Ų17085%0.84583%0.832SS**  54.492.388.9-167.10000113.5
8S37.8Very low34.4Very low99 Ų99166.9 Ų166.969%0.69283%0.829SS**  trans-157.194.8142.4-147.20000107.6D10S8-D10 PolarHBondContact OG-OD2 3.18Å
9R41.2Very low34.1Very low252 Ų252170.6 Ų170.695%0.95183%0.832SS**  trans-120.487165.6-148.3177.5-149.8176.16.2106.7
10D37.3Very low33.8Very low120 Ų120167.6 Ų167.664%0.64283%0.829SS**  trans-59.2143.8175.4-74.8-68.4000112.6S8S8-D10 PolarHBondContact OG-OD2 3.18Å
11K36.3Very low33.8Very low183 Ų183167.9 Ų167.980%0.79683%0.828SS**  trans66.5105.5156.4-61.6168.5-175.3-1740115.2
12F30.1Very low33.8Very low200 Ų200164.4 Ų164.488%0.87781%0.809SS**  cis38.368.639.5-149.1-92.4000115
13T34.6Very low33.5Very low111 Ų111167.1 Ų167.168%0.68181%0.806SS**  trans-173.293.9141.542.40000104.7
14E29.3Very low33.4Very low161 Ų161168.1 Ų168.175%0.75280%0.802SS**  60.810091.5-157.4-170.1150.900112.2
15K33.1Very low33.2Very low195 Ų195159.5 Ų159.585%0.84877%0.774SS**  trans-175.7100.7137.6-102.9168-175.2-179.10111.4
16H29.8Very low34Very low161 Ų161157.8 Ų157.875%0.74577%0.769SS**  trans46.7111.3130.1-82.6-96.1000120
17K28.2Very low34.6Very low182 Ų182151.5 Ų151.579%0.79176%0.755SS**  110.6123.8109.2-165.2159-174.81740117.8
18C24.9Very low35.8Very low114 Ų114150.2 Ų150.277%0.7774%0.739SS**  trans68.384.8157.2-75.50000118.4
19R28.5Very low36.5Very low238 Ų238151.4 Ų151.490%0.89874%0.738SS**  trans-99115.1143.3-169169.3-175.8161.8-0.9107.9E21R19-E21 PolarHBondContact O-N 3.26Å
20S28.6Very low37.1Very low110 Ų110145 Ų14577%0.76972%0.721SS**  trans-58.5114169.450.60000111.1
21E32.6Very low37.9Very low173 Ų173141.9 Ų141.981%0.80871%0.713SS**  trans-98.2108.2160.2-82.5178.8111.700108.6R19R19-E21 PolarHBondContact O-N 3.26Å
22E33Very low38.6Very low167 Ų167135.5 Ų135.578%0.7869%0.694SS**  trans52.386.7139.1-69.7168.6122.900117.7I24E22-I24 PolarHBondContact O-N 3.09Å
23R34.9Very low39.7Very low242 Ų242131.8 Ų131.891%0.91368%0.679SS**  trans-55.796.8155.1-173-171.3-61.1-135.41.4109G25R23-G25 PolarHBondContact O-N 2.9Å; R23-G25 VanDerWaalsContact O-N 3.15Å
24I35.7Very low40.6Very low128 Ų128136.5 Ų136.566%0.65668%0.684SS**  trans-49.5119.8164.6-63.5169.3000107.2E22 D28E22-I24 PolarHBondContact O-N 3.09Å; I24-D28 HydrophobicContact CG2-CB 3.94Å
25G39.5Very low41.3Very low32 Ų32137.3 Ų137.333%0.3369%0.685SS.*  trans-63.8145.4-169.900000111.4R23 A27 D28R23-G25 PolarHBondContact O-N 2.9Å; R23-G25 VanDerWaalsContact O-N 3.15Å; G25-A27 PolarHBondContact O-N 3.29Å; G25-D28 PolarHBondContact O-N 2.8Å
26T49.3Very low41.9Very low119 Ų119135.5 Ų135.573%0.7368%0.682SS**Hα-helixtrans-54.4-19.9171.546.90000113.3L30T26-L30 PolarHBondContact O-N 2.64Å
27A53.4Low42.9Very low69 Ų69133 Ų13357%0.5767%0.67SS**Hα-helixtrans-65.4-36.7171.600000113.2G25 L30 A31G25-A27 PolarHBondContact O-N 3.29Å; A27-L30 PolarHBondContact O-N 3.35Å; A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 2.99Å
28D52.8Low43.7Very low98 Ų98126.7 Ų126.752%0.52465%0.648SS.*Hα-helixtrans-74.8-34.1-180-65.9-39.3000111.7I24 G25 A31 A32I24-D28 HydrophobicContact CG2-CB 3.94Å; G25-D28 PolarHBondContact O-N 2.8Å; D28-A31 PolarHBondContact O-N 2.99Å; D28-A32 VanDerWaalsContact O-CB 3.28Å; D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 2.94Å
29L53.3Low44.6Very low125 Ų125128.7 Ų128.765%0.65465%0.65SS**Hα-helixtrans-67.1-37.5172.2-90.7164000112.1H33L29-H33 VanDerWaalsContact O-CB 3.28Å; L29-H33 WeakPolarHBondContact O-CB 3.44Å; L29-H33 PolarHBondContact O-N 2.71Å
30L53.9Low45.2Very low117 Ų117120.8 Ų120.861%0.61363%0.632SS**Hα-helixtrans-69.4-37.2172.8-87.5163.2000112.1T26 A27 H33 R34T26-L30 PolarHBondContact O-N 2.64Å; A27-L30 PolarHBondContact O-N 3.35Å; L30-H33 PolarHBondContact O-N 2.75Å; L30-R34 WeakPolarHBondContact O-CG 3.18Å; L30-R34 PolarHBondContact O-N 3.18Å
31A53.2Low45.8Very low55 Ų55119.3 Ų119.346%0.45562%0.618SS.*Hα-helixtrans-65.3-44.217400000111.6A27 D28 R34 F35A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 2.99Å; D28-A31 PolarHBondContact O-N 2.99Å; A31-R34 PolarHBondContact O-N 3.1Å; A31-F35 PolarHBondContact O-N 3.06Å
32A51.8Low45.9Very low48 Ų48119.3 Ų119.340%0.39761%0.611SS.*Hα-helixtrans-63.6-40.2174.900000112D28 R34 F35 M36D28-A32 VanDerWaalsContact O-CB 3.28Å; D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 2.94Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.07Å; A32-F35 CarbonylContact O-C 3.6Å; A32-F35 PolarHBondContact O-N 3.1Å; A32-F35 VanDerWaalsContact O-N 3.14Å; A32-M36 PolarHBondContact O-N 3.46Å
33H53.1Low46.3Very low122 Ų122118.8 Ų118.857%0.56561%0.608SS**Hα-helixtrans-67-33.5176.1-167.7-89.9000112.5L29 L30 Q37L29-H33 VanDerWaalsContact O-CB 3.28Å; L29-H33 WeakPolarHBondContact O-CB 3.44Å; L29-H33 PolarHBondContact O-N 2.71Å; L30-H33 PolarHBondContact O-N 2.75Å; H33-Q37 WeakPolarHBondContact O-CG 3.42Å
34R52.9Low46.7Very low211 Ų211111.2 Ų111.280%0.79659%0.588SS**Hα-helixtrans-71.1-30.5170.3-72.2-154.7-170.7-133.86.3113L30 A31 A32L30-R34 WeakPolarHBondContact O-CG 3.18Å; L30-R34 PolarHBondContact O-N 3.18Å; A31-R34 PolarHBondContact O-N 3.1Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.07Å
35F45Very low47.1Very low177 Ų177109 Ų10978%0.77658%0.584SS**Hα-helixtrans-77.7-19176.4-122.6-88.3000114A31 A32 P38A31-F35 PolarHBondContact O-N 3.06Å; A32-F35 CarbonylContact O-C 3.6Å; A32-F35 PolarHBondContact O-N 3.1Å; A32-F35 VanDerWaalsContact O-N 3.14Å; F35-P38 VanDerWaalsContact C-CD 3.49Å; F35-P38 WeakPolarHBondContact O-CD 3.48Å; F35-P38 VanDerWaalsContact O-CG 3.28Å; F35-P38 WeakPolarHBondContact O-CG 2.99Å
36M46.7Very low47.2Very low157 Ų157112.2 Ų112.277%0.77359%0.592SS**Hα-helixtrans-94.2-7.2178.3-78.7-177153.800115.1A32 P38A32-M36 PolarHBondContact O-N 3.46Å; M36-P38 VanDerWaalsContact C-N 3.3Å; M36-P38 WeakPolarHBondContact O-CD 2.96Å
37Q49.4Very low46.8Very low109 Ų109109.1 Ų109.151%0.50958%0.575SS.*THydrogen-bonded Turntrans-68.3-0.9169.3-68.1-106.5-74.400117.2H33 L39 T41H33-Q37 WeakPolarHBondContact O-CG 3.42Å; Q37-L39 VanDerWaalsContact C-N 3.35Å; Q37-L39 PolarHBondContact O-N 3.21Å; Q37-T41 PolarHBondContact O-OG1 2.9Å; Q37-T41 VanDerWaalsContact O-OG1 3.11Å
38P46.4Very low46.4Very low50 Ų50111.8 Ų111.833%0.32558%0.575SS.*Hα-helixtrans-65.6-24.8175.4-26.836.8000115.6F35 M36 S40 T41 W42F35-P38 VanDerWaalsContact C-CD 3.49Å; F35-P38 WeakPolarHBondContact O-CD 3.48Å; F35-P38 VanDerWaalsContact O-CG 3.28Å; F35-P38 WeakPolarHBondContact O-CG 2.99Å; M36-P38 VanDerWaalsContact C-N 3.3Å; M36-P38 WeakPolarHBondContact O-CD 2.96Å; P38-S40 PolarHBondContact O-N 3.07Å; P38-T41 PolarHBondContact O-OG1 3.4Å; P38-W42 VanDerWaalsContact O-CB 3.25Å; P38-W42 WeakPolarHBondContact O-CB 3.45Å; P38-W42 PolarHBondContact O-N 3.02Å
39L42.5Very low46.2Very low156 Ų156109.9 Ų109.982%0.81757%0.57SS**Hα-helixtrans-68.5-34.8-173.7-77.1164.8000113.8Q37Q37-L39 VanDerWaalsContact C-N 3.35Å; Q37-L39 PolarHBondContact O-N 3.21Å
40S42.1Very low45.9Very low72 Ų72106.9 Ų106.950%0.50356%0.556SS.*Hα-helixtrans-81.4-35.7178.359.10000113P38P38-S40 PolarHBondContact O-N 3.07Å
41T40.8Very low45.5Very low78 Ų78105.9 Ų105.948%0.47955%0.552SS.*Hα-helixtrans-77.6-28.1-178.453.80000113Q37 P38 V44 S45Q37-T41 PolarHBondContact O-OG1 2.9Å; Q37-T41 VanDerWaalsContact O-OG1 3.11Å; P38-T41 PolarHBondContact O-OG1 3.4Å; T41-V44 PolarHBondContact O-N 3.48Å; T41-S45 VanDerWaalsContact O-CB 3.28Å; T41-S45 WeakPolarHBondContact O-CB 3.28Å; T41-S45 PolarHBondContact O-N 3.37Å
42W35Very low45Very low174 Ų174106.8 Ų106.866%0.65955%0.554SS**Hα-helixtrans-68-35.6175.6-84.567.3000112.9P38 S45 M46P38-W42 VanDerWaalsContact O-CB 3.25Å; P38-W42 WeakPolarHBondContact O-CB 3.45Å; P38-W42 PolarHBondContact O-N 3.02Å; W42-S45 PolarHBondContact O-N 2.98Å; W42-M46 PolarHBondContact O-N 3.11Å
43H41.7Very low44.9Very low156 Ų156108.6 Ų108.672%0.72256%0.555SS**Hα-helixtrans-67.9-40176.1-123.6-92.2000112S47H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 2.88Å
44V42.9Very low44.5Very low83 Ų83106.3 Ų106.350%0.50355%0.552SS.*Hα-helixtrans-71.2-35.3176.8179.40000111.8T41 S47 H48T41-V44 PolarHBondContact O-N 3.48Å; V44-S47 PolarHBondContact O-OG 2.76Å; V44-H48 WeakPolarHBondContact O-CB 3.32Å; V44-H48 PolarHBondContact O-CD2 2.87Å; V44-H48 PolarHBondContact O-N 3.32Å
45S43.3Very low44Very low81 Ų81103 Ų10357%0.56655%0.546SS*.Hα-helixtrans-71.4-38.4178.6-1710000112.3T41 W42 S49T41-S45 VanDerWaalsContact O-CB 3.28Å; T41-S45 WeakPolarHBondContact O-CB 3.28Å; T41-S45 PolarHBondContact O-N 3.37Å; W42-S45 PolarHBondContact O-N 2.98Å; S45-S49 WeakPolarHBondContact O-CB 3.43Å; S45-S49 PolarHBondContact O-N 2.99Å
46M41.1Very low44.2Very low100 Ų100100.4 Ų100.449%0.49354%0.538SS..Hα-helixtrans-67.3-46.7175-85.3178.165.300111.6W42 H48 S49 V50W42-M46 PolarHBondContact O-N 3.11Å; M46-H48 PolarHBondContact O-N 3.07Å; M46-S49 PolarHBondContact O-N 2.72Å; M46-S49 PolarHBondContact O-OG 2.71Å; M46-V50 WeakPolarHBondContact O-CG2 3.47Å; M46-V50 PolarHBondContact O-N 2.76Å
47S41.7Very low43.9Very low53 Ų5398 Ų9837%0.37153%0.528SS..Hα-helixtrans-59.9-46.8175.9550000111.6H43 V44 S49 V50 D51H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 2.88Å; V44-S47 PolarHBondContact O-OG 2.76Å; S47-S49 PolarHBondContact O-N 3.42Å; S47-V50 PolarHBondContact O-N 3.41Å; S47-V50 VanDerWaalsContact O-N 3.13Å; S47-D51 WeakPolarHBondContact O-CB 3.29Å; S47-D51 VanDerWaalsContact O-CG 3.27Å; S47-D51 PolarHBondContact O-N 2.82Å
48H44.9Very low43.5Very low126 Ų126100.6 Ų100.658%0.58354%0.54SS*.Hα-helixtrans-59.4-32.8173.2-96.3-104.5000113V44 M46 C52V44-H48 WeakPolarHBondContact O-CB 3.32Å; V44-H48 PolarHBondContact O-CD2 2.87Å; V44-H48 PolarHBondContact O-N 3.32Å; M46-H48 PolarHBondContact O-N 3.07Å; H48-C52 WeakPolarHBondContact O-CA 3.35Å; H48-C52 WeakPolarHBondContact O-CB 3.48Å; H48-C52 PolarHBondContact O-N 3.48Å
49S48.2Very low42.7Very low58 Ų58105.3 Ų105.341%0.40656%0.562SS.*Hα-helixtrans-71.6-36177.275.50000112.8S45 M46 S47 M53S45-S49 WeakPolarHBondContact O-CB 3.43Å; S45-S49 PolarHBondContact O-N 2.99Å; M46-S49 PolarHBondContact O-N 2.72Å; M46-S49 PolarHBondContact O-OG 2.71Å; S47-S49 PolarHBondContact O-N 3.42Å; S49-M53 WeakPolarHBondContact O-CB 3.37Å; S49-M53 PolarHBondContact O-N 2.93Å
50V48.2Very low42.3Very low61 Ų61103 Ų10337%0.3755%0.55SS..Hα-helixtrans-75.3-40.8176-156.90000110.5M46 S47 M53 S54 M254M46-V50 WeakPolarHBondContact O-CG2 3.47Å; M46-V50 PolarHBondContact O-N 2.76Å; S47-V50 PolarHBondContact O-N 3.41Å; S47-V50 VanDerWaalsContact O-N 3.13Å; V50-M53 PolarHBondContact O-N 3.09Å; V50-S54 WeakPolarHBondContact O-CB 3.27Å; V50-S54 PolarHBondContact O-N 3.4Å; V50-M254 HydrophobicContact CG1-CE 4.46Å
51D44.4Very low41.8Very low97 Ų97105.7 Ų105.752%0.51957%0.565SS.*Hα-helixtrans-68.5-43.1177.7-67.5-31.1000111.3S47 M53 S54 Q55S47-D51 WeakPolarHBondContact O-CB 3.29Å; S47-D51 VanDerWaalsContact O-CG 3.27Å; S47-D51 PolarHBondContact O-N 2.82Å; D51-M53 VanDerWaalsContact C-N 3.3Å; D51-M53 PolarHBondContact O-N 3.3Å; D51-S54 CarbonylContact O-C 3.59Å; D51-S54 PolarHBondContact O-N 3.17Å; D51-S54 VanDerWaalsContact O-N 3.17Å; D51-Q55 VanDerWaalsContact O-CB 3.29Å; D51-Q55 WeakPolarHBondContact O-CB 3.18Å; D51-Q55 PolarHBondContact O-N 2.96Å
52C43.3Very low41.3Very low73 Ų73105 Ų10549%0.49357%0.573SS.*Hα-helixtrans-62.6-36.4174.9-175.80000111.9H48 Q55 M56H48-C52 WeakPolarHBondContact O-CA 3.35Å; H48-C52 WeakPolarHBondContact O-CB 3.48Å; H48-C52 PolarHBondContact O-N 3.48Å; C52-Q55 PolarHBondContact O-N 3.02Å; C52-M56 PolarHBondContact O-N 3.5Å
53M49.1Very low41.2Very low87 Ų87102.2 Ų102.243%0.42957%0.57SS.*Hα-helixtrans-68.6-41174.4-147.191.170.800111.3S49 V50 D51 Q55 M254S49-M53 WeakPolarHBondContact O-CB 3.37Å; S49-M53 PolarHBondContact O-N 2.93Å; V50-M53 PolarHBondContact O-N 3.09Å; D51-M53 VanDerWaalsContact C-N 3.3Å; D51-M53 PolarHBondContact O-N 3.3Å; M53-Q55 VanDerWaalsContact C-N 3.3Å; M53-Q55 PolarHBondContact O-N 3.36Å; M53-M254 HydrophobicContact CE-SD 3.83Å
54S45.5Very low40.9Very low73 Ų7399 Ų9951%0.5156%0.562SS.*Hα-helixtrans-68.2-28.8176.8-167.80000112.7V50 D51V50-S54 WeakPolarHBondContact O-CB 3.27Å; V50-S54 PolarHBondContact O-N 3.4Å; D51-S54 CarbonylContact O-C 3.59Å; D51-S54 PolarHBondContact O-N 3.17Å; D51-S54 VanDerWaalsContact O-N 3.17Å
55Q41.2Very low40.5Very low143 Ų143100.7 Ų100.767%0.66857%0.572SS**Hα-helixtrans-84.5-20.6-177.3-149.2168.319.500112.6D51 C52 M53 D57 H58D51-Q55 VanDerWaalsContact O-CB 3.29Å; D51-Q55 WeakPolarHBondContact O-CB 3.18Å; D51-Q55 PolarHBondContact O-N 2.96Å; C52-Q55 PolarHBondContact O-N 3.02Å; M53-Q55 VanDerWaalsContact C-N 3.3Å; M53-Q55 PolarHBondContact O-N 3.36Å; Q55-D57 VanDerWaalsContact C-N 3.27Å; Q55-D57 PolarHBondContact O-N 2.85Å; Q55-H58 PolarHBondContact O-N 3.48Å
56M49.1Very low39.7Very low121 Ų121100 Ų10060%0.59658%0.578SS**G310 helixtrans-70.9-17.8173.9-90.6179.9109.300114C52 H58 L59C52-M56 PolarHBondContact O-N 3.5Å; M56-H58 PolarHBondContact O-N 3.33Å; M56-L59 PolarHBondContact O-N 3.03Å
57D40.8Very low39.3Very low107 Ų107102 Ų10257%0.57260%0.596SS**G310 helixtrans-64.3-17175.1-79.7-34.9000112.9Q55Q55-D57 VanDerWaalsContact C-N 3.27Å; Q55-D57 PolarHBondContact O-N 2.85Å
58H41.4Very low38.7Very low164 Ų164106.3 Ų106.376%0.75961%0.614SS**G310 helixtrans-94.2-7-179.1-73.5-65.5000115.6Q55 M56Q55-H58 PolarHBondContact O-N 3.48Å; M56-H58 PolarHBondContact O-N 3.33Å
59L30.3Very low37.9Very low149 Ų149109.6 Ų109.678%0.7863%0.63SS**SBendtrans-115.68.3-170.7-70.5176.4000115.8M56 P61M56-L59 PolarHBondContact O-N 3.03Å; L59-P61 WeakPolarHBondContact O-CD 3.48Å
60L33.8Very low36.8Very low108 Ų108113.9 Ų113.957%0.56565%0.648SS**  trans-89.5117.8168-76.9174.6000111.1G62L60-G62 PolarHBondContact O-N 3.33Å
61P31Very low35.6Very low128 Ų128117 Ų11783%0.83167%0.669SS**THydrogen-bonded Turntrans-71.9127171.421.1-16.1000109.4L59L59-P61 WeakPolarHBondContact O-CD 3.48Å
62G30.9Very low34.8Very low62 Ų62120.6 Ų120.664%0.63969%0.687SS**THydrogen-bonded Turntrans112.617.5167.900000116.8L60 V64L60-G62 PolarHBondContact O-N 3.33Å; G62-V64 PolarHBondContact O-N 3.23Å
63I33.1Very low33.9Very low116 Ų116125.8 Ų125.860%0.59570%0.704SS**  trans-64.1106.6163.5-69.7173.8000107.9T65I63-T65 PolarHBondContact O-N 2.93Å
64V34.8Very low32.9Very low90 Ų90130.6 Ų130.655%0.54573%0.725SS.*  trans-64.8102.9160.1-177.30000105.9G62 K158G62-V64 PolarHBondContact O-N 3.23Å; V64-K158 VanDerWaalsContact CG1-NZ 3.28Å
65T33.9Very low31.9Very low118 Ų118136.6 Ų136.672%0.72474%0.742SS**  trans-52.8143168.745.30000109.5I63I63-T65 PolarHBondContact O-N 2.93Å
66G26.8Very low31.1Very low67 Ų67138.2 Ų138.269%0.69175%0.75SS**  trans-53.3145.7-163.700000115
67V32Very low30Very low142 Ų142138.3 Ų138.386%0.86176%0.757SS**  trans-108.9104.4139.3-1760000103.7E69V67-E69 PolarHBondContact O-N 3.4Å
68D30.7Very low29.2Very low142 Ų142140.7 Ų140.776%0.75977%0.77SS**  trans-54.7135165.7-72.5-62.4000108.4L70D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.47Å
69E26.6Very low28.5Very low195 Ų195138.1 Ų138.191%0.91178%0.777SS**  trans-62.392.4172.8-78.2-170.285.100109.2V67V67-E69 PolarHBondContact O-N 3.4Å
70L25.7Very low28.4Very low149 Ų149134.9 Ų134.978%0.7878%0.78SS**  trans-120.5117.6158.1-96.8163.8000108.1D68 L72D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.47Å; L70-L72 PolarHBondContact O-N 2.99Å; L70-L72 VanDerWaalsContact O-N 3.16Å
71P24.1Very low28.1Very low125 Ų125138.5 Ų138.581%0.81279%0.794SS**  trans-63.1115.4179.7-19.431.2000110.4Q73P71-Q73 PolarHBondContact O-N 2.97Å
72L27.6Very low28Very low174 Ų174142.3 Ų142.391%0.91180%0.797SS**  trans-85.6105.8173.1-107.3159.2000109.4L70L70-L72 PolarHBondContact O-N 2.99Å; L70-L72 VanDerWaalsContact O-N 3.16Å
73Q23.8Very low27.7Very low181 Ų181145 Ų14585%0.84680%0.797SS**  trans-58.4129.2166.6-146.1142.4-21.300109.5P71 K75P71-Q73 PolarHBondContact O-N 2.97Å; Q73-K75 PolarHBondContact O-N 3.44Å; Q73-K75 VanDerWaalsContact O-N 3.17Å
74E27Very low27.6Very low188 Ų188145.3 Ų145.388%0.87981%0.807SS**  trans-59111.5179.5-162.3157.3114.300110.4
75K25.6Very low27.2Very low199 Ų199145.4 Ų145.487%0.86581%0.811SS**  trans-129.3111.8167.2-162.2172.1-177-178.60110.2Q73Q73-K75 PolarHBondContact O-N 3.44Å; Q73-K75 VanDerWaalsContact O-N 3.17Å
76Q23.3Very low27.3Very low177 Ų177149.7 Ų149.783%0.82782%0.82SS**  trans-62128.4177.8-57.5169.8-45.600111.5
77V27.8Very low27.2Very low124 Ų124153.2 Ų153.275%0.75283%0.828SS**  trans-152112.4150.8-175.60000111.7
78N22.8Very low27.4Very low157 Ų157151 Ų15184%0.8483%0.825SS**  trans33.3119.8144.3-60.1-24.8000122.8
79A27.8Very low27.3Very low109 Ų109152 Ų15290%0.90183%0.83SS**  trans-70.8129.5164.900000112.4
80G27Very low27.4Very low82 Ų82152.1 Ų152.185%0.84582%0.824SS**  trans-106117163.900000109.5
81Q28.8Very low27.8Very low184 Ų184149.6 Ų149.686%0.8683%0.825SS**  trans-72.1143.1-175.4-171.6164.8-0.800112.7
82K27.6Very low28Very low208 Ų208151.3 Ų151.390%0.90482%0.822SS**  trans-168105.1143.1-104.5166.1-169.6-175.50111.6
83D24.1Very low28.5Very low119 Ų119148.8 Ų148.864%0.63682%0.816SS**  trans-79.2145.3162.3-170.2-84.7000108.9S85D83-S85 WeakPolarHBondContact OD1-CB 3.16Å; D83-S85 PolarHBondContact OD1-N 3.03Å; D83-S85 PolarHBondContact OD1-OG 3Å
84P31.5Very low28.9Very low122 Ų122148.3 Ų148.379%0.79282%0.818SS**  -139.9107113.430.3-12.6000112.3
85S27.7Very low29.3Very low91 Ų91145.4 Ų145.464%0.63682%0.816SS**  18.2118.7120.4-63.80000116.2D83D83-S85 WeakPolarHBondContact OD1-CB 3.16Å; D83-S85 PolarHBondContact OD1-N 3.03Å; D83-S85 PolarHBondContact OD1-OG 3Å
86K34.5Very low29.6Very low208 Ų208139.1 Ų139.190%0.90481%0.807SS**  trans-163.4116.4132.7-106.3167.5-171.5-174.90111.7
87T25.1Very low30.2Very low141 Ų141138.7 Ų138.787%0.86581%0.81SS**  trans-60.6138.1164.842.10000112.7
88A35.8Very low30.4Very low96 Ų96144.6 Ų144.679%0.79382%0.819SS**  trans-153.494.9155.700000105.6
89D28.7Very low31.2Very low164 Ų164142 Ų14288%0.87782%0.82SS**  75.8128.193-158.2-92000113.1
90Y28.9Very low31.6Very low196 Ų196142.3 Ų142.377%0.76982%0.815SS**  trans-105.3111.9-157-161.8-91.4000107.2Q92Y90-Q92 HydrophobicContact CD1-CB 4.44Å; Y90-Q92 HydrophobicContact CE1-CB 4.4Å
91A35.2Very low32.3Very low97 Ų97144.4 Ų144.480%0.80282%0.817SS**  trans-106.9107.6172.600000110
92Q28.7Very low32.7Very low161 Ų161140.4 Ų140.475%0.75282%0.815SS**PPolyproline II helixtrans-97.7124.1174.6-172.3179.1-71.500109.4Y90Y90-Q92 HydrophobicContact CD1-CB 4.44Å; Y90-Q92 HydrophobicContact CE1-CB 4.4Å
93P36.8Very low33.2Very low121 Ų121135.9 Ų135.979%0.78681%0.81SS**PPolyproline II helixtrans-93.9155.2165.4-14.732.6000114.4
94L33.2Very low34.1Very low171 Ų171135.5 Ų135.590%0.89582%0.817SS**PPolyproline II helixtrans-79.8167.1-161.7-73.2158.1000116.5
95P35.4Very low34.5Very low127 Ų127135.8 Ų135.883%0.82582%0.818SS**PPolyproline II helixtrans-100144.6-173.637.2-29.9000115
96G31.1Very low35.3Very low67 Ų67141 Ų14169%0.69183%0.83SS**  trans165.4130170.100000107
97D35.9Very low35.6Very low167 Ų167136.9 Ų136.989%0.89383%0.827SS**  cis-151.5158.837-85.3-55.1000112.5
98R32.3Very low36.4Very low249 Ų249135.5 Ų135.594%0.9483%0.83SS**  trans-54.3139.4166.7-80.9172.7164.6161.7-4.6112.5
99A39.7Very low36.4Very low102 Ų102134.8 Ų134.884%0.84383%0.831SS**  trans-163.1137.9130.500000111.8
100S34.8Very low36.8Very low116 Ų116131.2 Ų131.281%0.81182%0.819SS**  trans-55.3146.6-176.5-48.10000116
101S43.4Very low37.4Very low126 Ų126131 Ų13188%0.88183%0.827SS**  -173.2128.3118.7-79.90000111.2
102A36.4Very low38Very low99 Ų99131.3 Ų131.382%0.81882%0.82SS**  trans-77.5140.9177.800000111.8
103S38.7Very low39.6Very low114 Ų114129 Ų12980%0.79782%0.821SS**  171.9139.8120.5490000112.7
104S41.4Very low41.5Very low111 Ų111125.4 Ų125.478%0.77680%0.802SS**  trans90.9104.3165.8-560000118.3
105P41.6Very low44.1Very low128 Ų128121.3 Ų121.383%0.83178%0.781SS**  trans-86.7114.9172.132.7-26.3000109.8
106K43Very low46.9Very low201 Ų201118.6 Ų118.687%0.87476%0.758SS**  trans-129.5106.8154-69.9-155174.9-174.70109.1
107S42.2Very low50.1Low121 Ų121115.4 Ų115.485%0.84673%0.726SS**  trans58.978.7157.5-50.70000116.4
108A41.9Very low52.9Low112 Ų112109.1 Ų109.193%0.92669%0.689SS**  trans-67.4125.9151.900000109
109G34.5Very low56Low80 Ų80100.3 Ų100.383%0.82566%0.66SS**  trans129.460.3167.400000115.1
110S37.3Very low58.7Low89 Ų8997.6 Ų97.662%0.62264%0.635SS**  trans169.580.3130.5-1660000108.1T112S110-T112 PolarHBondContact O-N 3.35Å; S110-T112 WeakPolarHBondContact OG-CG2 3.3Å
111M41.2Very low61.5Low191 Ų19198.8 Ų98.894%0.94163%0.627SS**  trans-71.767.9154.5-67.9-92.697.700105.8S113M111-S113 VanDerWaalsContact C-N 3.35Å; M111-S113 PolarHBondContact O-N 3.16Å
112T48.6Very low64Low105 Ų10596 Ų9664%0.64461%0.607SS**  trans-54.5115.5155.149.60000103.5S110 A114S110-T112 PolarHBondContact O-N 3.35Å; S110-T112 WeakPolarHBondContact OG-CG2 3.3Å; T112-A114 PolarHBondContact O-N 2.9Å
113S61.8Low66.8Low112 Ų11297.2 Ų97.278%0.78360%0.596SS**  trans-56.484.9175.952.20000107.9M111 D115M111-S113 VanDerWaalsContact C-N 3.35Å; M111-S113 PolarHBondContact O-N 3.16Å; S113-D115 PolarHBondContact O-N 3.38Å
114A76.7Confident69.4Low45 Ų4594.3 Ų94.337%0.37258%0.578SS.*  trans-65.8130.7179.400000105.6T112 I116 E123T112-A114 PolarHBondContact O-N 2.9Å; A114-I116 PolarHBondContact O-N 2.78Å; A114-E123 HydrophobicContact CB-CG 4.24Å
115D87.9Confident71.8Confident86 Ų8692.6 Ų92.646%0.4656%0.563SS.*  trans-57.4127.1173-67.6-38.5000107.9S113 L130 F142S113-D115 PolarHBondContact O-N 3.38Å; D115-L130 VanDerWaalsContact C-CD1 3.4Å; D115-L130 HydrophobicContact CB-CD1 3.87Å; D115-L130 WeakPolarHBondContact O-CD1 3.43Å; D115-F142 HydrophobicContact CB-CB 4.48Å; D115-F142 HydrophobicContact CB-CD1 4.31Å; D115-F142 HydrophobicContact CB-CD2 3.65Å; D115-F142 HydrophobicContact CB-CE1 4.46Å; D115-F142 HydrophobicContact CB-CE2 3.83Å; D115-F142 HydrophobicContact CB-CG 3.9Å; D115-F142 HydrophobicContact CB-CZ 4.21Å; D115-F142 VanDerWaalsContact CG-CZ 3.43Å; D115-F142 WeakPolarHBondContact OD1-CD2 3.34Å; D115-F142 WeakPolarHBondContact OD1-CE2 3.17Å; D115-F142 WeakPolarHBondContact OD2-CE2 3.33Å; D115-F142 WeakPolarHBondContact OD2-CZ 3.27Å
116I94.8Very high74.1Confident69 Ų6994.6 Ų94.635%0.35457%0.567SS.*BIsolated β-bridgetrans-113.8151.2178.855.7166.2000110A114 R118 E123A114-I116 PolarHBondContact O-N 2.78Å; I116-R118 PolarHBondContact O-N 3.22Å; I116-E123 HydrophobicContact CG2-CG 3.86Å
117C97.2Very high76.4Confident0 Ų092.7 Ų92.70%057%0.566CS.*  trans-67.8124.6174.5178.10000110.9I119 H121 C122 L130 H144C117-I119 PolarHBondContact O-N 3.04Å; C117-I119 VanDerWaalsContact O-N 3.09Å; C117-H121 WeakPolarHBondContact O-CA 3.35Å; C117-H121 PolarHBondContact O-N 3.35Å; C117-C122 WeakPolarHBondContact CB-O 3.43Å; C117-C122 PolarHBondContact N-O 2.93Å; C117-L130 HydrophobicContact CB-CD2 3.64Å; C117-H144 WeakPolarHBondContact CB-CE1 3.36Å; C117-H144 VanDerWaalsContact CB-ND1 3.27Å; C117-H144 WeakPolarHBondContact CB-ND1 3.38Å; C117-H144 PolarHBondContact SG-N 2.88Å; C117-H144 VanDerWaalsContact SG-N 3.41Å; C117-H144 PolarHBondContact SG-ND1 3.49Å; C117-H144 VanDerWaalsContact SG-ND1 3.4Å
118R95.7Very high78.8Confident35 Ų3587.4 Ų87.413%0.13253%0.53CS..THydrogen-bonded Turntrans-63.7-16178.282.6179.1-174.8-129-3.2115.4I116 H121 S139 L140 F142I116-R118 PolarHBondContact O-N 3.22Å; R118-H121 PolarHBondContact O-NE2 3.26Å; R118-S139 VanDerWaalsContact CB-O 3.32Å; R118-S139 WeakPolarHBondContact CB-O 3.41Å; R118-L140 WeakPolarHBondContact CD-O 3.27Å; R118-L140 PolarHBondContact NH1-O 2.96Å; R118-F142 PolarHBondContact N-O 2.84Å
119I96.1Very high81.3Confident65 Ų6585.8 Ų85.833%0.33351%0.51SS..THydrogen-bonded Turntrans-96.4-46.8-175.1-60.3-177.7000111.1C117 V143 C147 W151C117-I119 PolarHBondContact O-N 3.04Å; C117-I119 VanDerWaalsContact O-N 3.09Å; I119-V143 HydrophobicContact CD1-CG2 3.5Å; I119-V143 HydrophobicContact CG1-CG2 3.9Å; I119-C147 HydrophobicContact CB-CB 4Å; I119-C147 HydrophobicContact CD1-CB 4.04Å; I119-C147 HydrophobicContact CG2-CB 4.11Å; I119-W151 HydrophobicContact CD1-CB 3.99Å; I119-W151 HydrophobicContact CD1-CG 4.36Å
120C96.5Very high84.2Confident44 Ų4483.5 Ų83.530%0.29748%0.479SS..THydrogen-bonded Turntrans-108.1-3.8-177.176.30000114C122 H144C120-C122 PolarHBondContact O-N 2.9Å; C120-C122 VanDerWaalsContact O-N 3.11Å; C120-C122 PolarHBondContact O-SG 2.78Å; C120-C122 VanDerWaalsContact O-SG 3.36Å; C120-C122 VanDerWaalsContact SG-SG 3.66Å; C120-H144 VanDerWaalsContact SG-CE1 3.51Å; C120-H144 PolarHBondContact SG-ND1 3.48Å
121H95.3Very high87Confident142 Ų14280.2 Ų80.266%0.65745%0.454SS*.  trans55.325-178.3-51142.8000114.6C117 R118C117-H121 WeakPolarHBondContact O-CA 3.35Å; C117-H121 PolarHBondContact O-N 3.35Å; R118-H121 PolarHBondContact O-NE2 3.26Å
122C95.2Very high89.6Confident67 Ų6771.8 Ų71.845%0.45342%0.415SS..PPolyproline II helixtrans-101150.5172.3-500000110.5C117 C120 H144C117-C122 WeakPolarHBondContact CB-O 3.43Å; C117-C122 PolarHBondContact N-O 2.93Å; C120-C122 PolarHBondContact O-N 2.9Å; C120-C122 VanDerWaalsContact O-N 3.11Å; C120-C122 PolarHBondContact O-SG 2.78Å; C120-C122 VanDerWaalsContact O-SG 3.36Å; C120-C122 VanDerWaalsContact SG-SG 3.66Å; C122-H144 PolarHBondContact O-CE1 2.72Å
123E94.7Very high91.9Very high125 Ų12566.8 Ų66.858%0.58438%0.384SS*.BIsolated β-bridgetrans-65166.9174.3-65.3174-175.700112.4A114 I116 H144A114-E123 HydrophobicContact CB-CG 4.24Å; I116-E123 HydrophobicContact CG2-CG 3.86Å; E123-H144 PolarHBondContact O-CE1 3.46Å; E123-H144 PolarHBondContact O-NE2 2.86Å
124A93.1Very high93.5Very high52 Ų5261.5 Ų61.543%0.4335%0.347SS..PPolyproline II helixtrans-65.8138.216800000110.5L130A124-L130 HydrophobicContact CB-CB 4.39Å; A124-L130 HydrophobicContact CB-CD1 3.84Å; A124-L130 HydrophobicContact CB-CG 3.79Å
125T92.1Very high94.4Very high75 Ų7563.6 Ų63.646%0.4635%0.346SS..BIsolated β-bridgetrans-118.7162.5166.470.30000109.6D127 A128 P129T125-D127 PolarHBondContact O-N 3.24Å; T125-A128 PolarHBondContact N-O 3.18Å; T125-A128 CarbonylContact O-C 3.57Å; T125-A128 PolarHBondContact O-N 3.32Å; T125-A128 WeakPolarHBondContact OG1-CB 3.32Å; T125-A128 PolarHBondContact OG1-N 2.98Å; T125-P129 VanDerWaalsContact O-N 3.16Å
126N89.9Confident94.8Very high170 Ų17060 Ų6091%0.90933%0.327SS*.THydrogen-bonded Turntrans-56-35175.9-70.6-47.3000112.3
127D91.6Very high94.7Very high161 Ų16161.6 Ų61.686%0.86135%0.345SS*.THydrogen-bonded Turntrans-83.2-20.2177.8-60.6-49.8000113.6T125T125-D127 PolarHBondContact O-N 3.24Å
128A92.5Very high94.5Very high11 Ų1164.4 Ų64.49%0.09137%0.373CS..BIsolated β-bridgetrans-137.375.9-179.400000110.2T125 H144T125-A128 PolarHBondContact N-O 3.18Å; T125-A128 CarbonylContact O-C 3.57Å; T125-A128 PolarHBondContact O-N 3.32Å; T125-A128 WeakPolarHBondContact OG1-CB 3.32Å; T125-A128 PolarHBondContact OG1-N 2.98Å; A128-H144 PolarHBondContact O-CD2 3.45Å; A128-H144 PolarHBondContact O-NE2 2.98Å
129P94.5Very high94.2Very high78 Ų7867 Ų6751%0.50640%0.397SS..  trans-68.4158.3176.329.2-35.4000111.2T125T125-P129 VanDerWaalsContact O-N 3.16Å
130L95.9Very high94.1Very high31 Ų3167.3 Ų67.316%0.16240%0.399CS..EExtended strand (participates in β ladder)trans-87.3143.8172.6-68.4168.8000110.6D115 C117 A124 F142D115-L130 VanDerWaalsContact C-CD1 3.4Å; D115-L130 HydrophobicContact CB-CD1 3.87Å; D115-L130 WeakPolarHBondContact O-CD1 3.43Å; C117-L130 HydrophobicContact CB-CD2 3.64Å; A124-L130 HydrophobicContact CB-CB 4.39Å; A124-L130 HydrophobicContact CB-CD1 3.84Å; A124-L130 HydrophobicContact CB-CG 3.79Å; L130-F142 HydrophobicContact CB-CB 4.24Å; L130-F142 HydrophobicContact CB-CD1 4.37Å; L130-F142 HydrophobicContact CD1-CB 4.12Å; L130-F142 HydrophobicContact CD2-CB 4.34Å; L130-F142 HydrophobicContact CG-CB 4.47Å
131I96Very high94Very high21 Ų2168.8 Ų68.811%0.10840%0.4CS..EExtended strand (participates in β ladder)trans-119.7156.2172.359157000110P133 F142 V143 L148 V271 N273I131-P133 HydrophobicContact CD1-CB 4.31Å; I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.43Å; I131-F142 WeakPolarHBondContact O-CA 3.19Å; I131-V143 HydrophobicContact CG1-CG1 4.11Å; I131-V143 WeakPolarHBondContact CG1-O 3.46Å; I131-V143 PolarHBondContact N-O 3.48Å; I131-V143 PolarHBondContact O-N 2.81Å; I131-L148 HydrophobicContact CD1-CD2 4.01Å; I131-V271 HydrophobicContact CD1-CB 4.21Å; I131-V271 HydrophobicContact CD1-CG1 4.34Å; I131-N273 WeakPolarHBondContact CA-OD1 3.28Å; I131-N273 WeakPolarHBondContact CB-OD1 3.4Å
132A96.2Very high94.1Very high13 Ų1363.9 Ų63.911%0.10738%0.377CS..  trans-109.584.6173.200000109.4C134 K141 N273 C274A132-C134 VanDerWaalsContact C-N 3.25Å; A132-C134 PolarHBondContact O-N 2.87Å; A132-K141 WeakPolarHBondContact CA-O 3.39Å; A132-K141 HydrophobicContact CB-CD 4.47Å; A132-K141 HydrophobicContact CB-CG 3.9Å; A132-N273 PolarHBondContact N-OD1 3.46Å; A132-N273 CarbonylContact O-C 3.57Å; A132-N273 VanDerWaalsContact O-CA 3.27Å; A132-N273 WeakPolarHBondContact O-CA 2.9Å; A132-C274 PolarHBondContact O-N 2.82Å; A132-C274 PolarHBondContact O-SG 3.35Å
133P96.1Very high94.2Very high0 Ų060.7 Ų60.70%036%0.356CS..  trans-77.5-9.6-17135.8-42.4000113.4I131 V143 L148 F165 F167 V271I131-P133 HydrophobicContact CD1-CB 4.31Å; I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.43Å; P133-V143 HydrophobicContact CG-CG1 3.57Å; P133-L148 HydrophobicContact CB-CD2 3.55Å; P133-L148 HydrophobicContact CG-CD2 3.74Å; P133-F165 WeakPolarHBondContact O-CD1 3.5Å; P133-F165 WeakPolarHBondContact O-CE1 3.49Å; P133-F167 HydrophobicContact CB-CD1 3.66Å; P133-F167 HydrophobicContact CB-CE1 3.76Å; P133-F167 HydrophobicContact CG-CD1 4.31Å; P133-F167 HydrophobicContact CG-CE1 3.88Å; P133-F167 VanDerWaalsContact O-CD1 3.32Å; P133-F167 WeakPolarHBondContact O-CD1 3.47Å; P133-V271 HydrophobicContact CB-CG1 3.87Å
134C96.5Very high94.3Very high1 Ų154.8 Ų54.81%0.00733%0.328CS..SBendtrans-154.6169.1-17564.10000112.1A132 C136 C160 C163 F165 F167A132-C134 VanDerWaalsContact C-N 3.25Å; A132-C134 PolarHBondContact O-N 2.87Å; C134-C136 PolarHBondContact O-N 3.41Å; C134-C136 VanDerWaalsContact SG-SG 3.62Å; C134-C160 HydrophobicContact CB-CB 3.96Å; C134-C163 VanDerWaalsContact CB-SG 3.59Å; C134-F165 HydrophobicContact CB-CB 4.08Å; C134-F165 HydrophobicContact CB-CD1 3.92Å; C134-F165 HydrophobicContact CB-CG 4.4Å; C134-F167 HydrophobicContact CB-CD1 4.44Å; C134-F167 HydrophobicContact CB-CE1 3.94Å
135Y95.5Very high94.5Very high89 Ų8954.1 Ų54.135%0.34932%0.316SS..SBendtrans-76.215-178.3-59.7-65.9000116F165 C274 P275 F277Y135-F165 HydrophobicContact CD2-CB 4.24Å; Y135-F165 AromaticContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CE2 4.19Å; Y135-F165 AromaticContact CD2-CG 3.95Å; Y135-F165 HydrophobicContact CD2-CG 3.95Å; Y135-F165 AromaticContact CE2-CD2 3.38Å; Y135-F165 HydrophobicContact CE2-CD2 3.38Å; Y135-F165 AromaticContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CE2 3.46Å; Y135-F165 VanDerWaalsContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CG 4.07Å; Y135-F165 HydrophobicContact CE2-CZ 4.2Å; Y135-C274 HydrophobicContact CE1-CB 4.34Å; Y135-P275 WeakPolarHBondContact CE1-O 3.42Å; Y135-P275 WeakPolarHBondContact OH-CG 3.49Å; Y135-P275 PolarHBondContact OH-O 3.29Å; Y135-F277 AromaticContact CD1-CD2 3.68Å; Y135-F277 HydrophobicContact CD1-CD2 3.68Å; Y135-F277 AromaticContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD1-CE2 3.46Å; Y135-F277 VanDerWaalsContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD2-CE2 4.19Å; Y135-F277 AromaticContact CE1-CD2 3.49Å; Y135-F277 HydrophobicContact CE1-CD2 3.49Å; Y135-F277 VanDerWaalsContact CE1-CD2 3.49Å; Y135-F277 AromaticContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CE2 3.41Å; Y135-F277 VanDerWaalsContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CG 4.5Å; Y135-F277 HydrophobicContact CE1-CZ 4.36Å; Y135-F277 HydrophobicContact CE2-CE2 4.15Å; Y135-F277 HydrophobicContact CG-CD2 4.49Å; Y135-F277 AromaticContact CG-CE2 3.85Å; Y135-F277 HydrophobicContact CG-CE2 3.85Å; Y135-F277 AromaticContact CZ-CE2 3.78Å
136C95.9Very high94.7Very high11 Ų1156.4 Ų56.47%0.07432%0.316CS..  trans-63.7144.2172.5-67.20000110.1C134 L140 K141C134-C136 PolarHBondContact O-N 3.41Å; C134-C136 VanDerWaalsContact SG-SG 3.62Å; C136-L140 HydrophobicContact CB-CB 3.81Å; C136-K141 VanDerWaalsContact O-CB 3.28Å; C136-K141 WeakPolarHBondContact O-CB 3.12Å; C136-K141 WeakPolarHBondContact O-CG 3.33Å
137S92.7Very high95Very high103 Ų10349 Ų4972%0.7228%0.278SS*.  trans-100.5166.3177.256.60000111.5
138G91.6Very high95.3Very high58 Ų5841.4 Ų41.460%0.59824%0.237SC*.G310 helixtrans61.1-142.417700000114.1L140 K141G138-L140 PolarHBondContact O-N 3.35Å; G138-L140 VanDerWaalsContact O-N 3.1Å; G138-K141 VanDerWaalsContact O-CB 3.29Å; G138-K141 WeakPolarHBondContact O-CB 3.37Å; G138-K141 PolarHBondContact O-N 2.84Å
139S90.8Very high95.4Very high89 Ų8943.2 Ų43.262%0.62224%0.244SC*.G310 helixtrans-62.5-16.4-17757.10000114.3R118R118-S139 VanDerWaalsContact CB-O 3.32Å; R118-S139 WeakPolarHBondContact CB-O 3.41Å
140L93.8Very high95.5Very high73 Ų7345.3 Ų45.338%0.38225%0.247SC..G310 helixtrans-85.8-9.7177.7-62.8178.2000113.3R118 C136 G138 V162R118-L140 WeakPolarHBondContact CD-O 3.27Å; R118-L140 PolarHBondContact NH1-O 2.96Å; C136-L140 HydrophobicContact CB-CB 3.81Å; G138-L140 PolarHBondContact O-N 3.35Å; G138-L140 VanDerWaalsContact O-N 3.1Å; L140-V162 HydrophobicContact CD1-CG1 4.39Å; L140-V162 HydrophobicContact CD1-CG2 4.32Å
141K95Very high95.5Very high75 Ų7546.2 Ų46.233%0.32625%0.248SC..SBendtrans-69.8-42.9-176.3-174.7173.4176.8-179.70112.6A132 C136 G138A132-K141 WeakPolarHBondContact CA-O 3.39Å; A132-K141 HydrophobicContact CB-CD 4.47Å; A132-K141 HydrophobicContact CB-CG 3.9Å; C136-K141 VanDerWaalsContact O-CB 3.28Å; C136-K141 WeakPolarHBondContact O-CB 3.12Å; C136-K141 WeakPolarHBondContact O-CG 3.33Å; G138-K141 VanDerWaalsContact O-CB 3.29Å; G138-K141 WeakPolarHBondContact O-CB 3.37Å; G138-K141 PolarHBondContact O-N 2.84Å
142F96.5Very high95.4Very high39 Ų3945.9 Ų45.917%0.17125%0.246CC..  trans-101.9138.8-164.9-60.1-75.2000113.8D115 R118 L130 I131D115-F142 HydrophobicContact CB-CB 4.48Å; D115-F142 HydrophobicContact CB-CD1 4.31Å; D115-F142 HydrophobicContact CB-CD2 3.65Å; D115-F142 HydrophobicContact CB-CE1 4.46Å; D115-F142 HydrophobicContact CB-CE2 3.83Å; D115-F142 HydrophobicContact CB-CG 3.9Å; D115-F142 HydrophobicContact CB-CZ 4.21Å; D115-F142 VanDerWaalsContact CG-CZ 3.43Å; D115-F142 WeakPolarHBondContact OD1-CD2 3.34Å; D115-F142 WeakPolarHBondContact OD1-CE2 3.17Å; D115-F142 WeakPolarHBondContact OD2-CE2 3.33Å; D115-F142 WeakPolarHBondContact OD2-CZ 3.27Å; R118-F142 PolarHBondContact N-O 2.84Å; L130-F142 HydrophobicContact CB-CB 4.24Å; L130-F142 HydrophobicContact CB-CD1 4.37Å; L130-F142 HydrophobicContact CD1-CB 4.12Å; L130-F142 HydrophobicContact CD2-CB 4.34Å; L130-F142 HydrophobicContact CG-CB 4.47Å; I131-F142 WeakPolarHBondContact O-CA 3.19Å
143V97.2Very high95.3Very high0 Ų053.1 Ų53.10%028%0.275CS..EExtended strand (participates in β ladder)trans-152.7146.1178.558.70000111.2I119 I131 P133 C147 L148I119-V143 HydrophobicContact CD1-CG2 3.5Å; I119-V143 HydrophobicContact CG1-CG2 3.9Å; I131-V143 HydrophobicContact CG1-CG1 4.11Å; I131-V143 WeakPolarHBondContact CG1-O 3.46Å; I131-V143 PolarHBondContact N-O 3.48Å; I131-V143 PolarHBondContact O-N 2.81Å; P133-V143 HydrophobicContact CG-CG1 3.57Å; V143-C147 HydrophobicContact CG2-CB 4Å; V143-L148 HydrophobicContact CG1-CB 4.14Å; V143-L148 HydrophobicContact CG1-CD2 4.03Å; V143-L148 HydrophobicContact CG1-CG 4.49Å; V143-L148 HydrophobicContact CG2-CB 3.86Å
144H97.5Very high95.2Very high0 Ų057.4 Ų57.40%031%0.305CS..EExtended strand (participates in β ladder)trans-71.9145.1171.6-60.2119.9000111.2C117 C120 C122 E123 A128 R146 C147 L148C117-H144 WeakPolarHBondContact CB-CE1 3.36Å; C117-H144 VanDerWaalsContact CB-ND1 3.27Å; C117-H144 WeakPolarHBondContact CB-ND1 3.38Å; C117-H144 PolarHBondContact SG-N 2.88Å; C117-H144 VanDerWaalsContact SG-N 3.41Å; C117-H144 PolarHBondContact SG-ND1 3.49Å; C117-H144 VanDerWaalsContact SG-ND1 3.4Å; C120-H144 VanDerWaalsContact SG-CE1 3.51Å; C120-H144 PolarHBondContact SG-ND1 3.48Å; C122-H144 PolarHBondContact O-CE1 2.72Å; E123-H144 PolarHBondContact O-CE1 3.46Å; E123-H144 PolarHBondContact O-NE2 2.86Å; A128-H144 PolarHBondContact O-CD2 3.45Å; A128-H144 PolarHBondContact O-NE2 2.98Å; H144-R146 VanDerWaalsContact C-N 3.31Å; H144-R146 HydrophobicContact CB-CG 4.05Å; H144-R146 PolarHBondContact O-N 3.45Å; H144-C147 HydrophobicContact CB-CB 4.1Å; H144-C147 PolarHBondContact O-N 3.16Å; H144-L148 PolarHBondContact O-N 2.83Å
145Q96.6Very high95.1Very high39 Ų3959.8 Ų59.818%0.18232%0.322CS..Hα-helixtrans-48.3-51.4175.7-173.968.4-4.200113C147 L148 Q149 Y270 V271Q145-C147 PolarHBondContact O-N 3.06Å; Q145-L148 PolarHBondContact O-N 2.68Å; Q145-Q149 WeakPolarHBondContact O-CB 3.26Å; Q145-Q149 WeakPolarHBondContact O-CG 3.31Å; Q145-Q149 PolarHBondContact O-N 2.72Å; Q145-Y270 HydrophobicContact CG-CD1 4.46Å; Q145-V271 PolarHBondContact NE2-O 3.27Å; Q145-V271 PolarHBondContact OE1-O 3Å
146R95.7Very high95Very high123 Ų12363.2 Ų63.246%0.46434%0.341SS..Hα-helixtrans-62-39.6179.153.6178.9166.475.54.4113.2H144 Q150H144-R146 VanDerWaalsContact C-N 3.31Å; H144-R146 HydrophobicContact CB-CG 4.05Å; H144-R146 PolarHBondContact O-N 3.45Å; R146-Q150 WeakPolarHBondContact O-CB 3.49Å; R146-Q150 PolarHBondContact O-N 2.98Å
147C97.2Very high95Very high15 Ų1565.2 Ų65.210%0.10135%0.353CS..Hα-helixtrans-67.7-43.6-179.9-68.50000110.6I119 V143 H144 Q145 Q150 W151I119-C147 HydrophobicContact CB-CB 4Å; I119-C147 HydrophobicContact CD1-CB 4.04Å; I119-C147 HydrophobicContact CG2-CB 4.11Å; V143-C147 HydrophobicContact CG2-CB 4Å; H144-C147 HydrophobicContact CB-CB 4.1Å; H144-C147 PolarHBondContact O-N 3.16Å; Q145-C147 PolarHBondContact O-N 3.06Å; C147-Q150 PolarHBondContact O-N 3.4Å; C147-W151 WeakPolarHBondContact O-CB 3.35Å; C147-W151 PolarHBondContact O-N 3.25Å
148L96.9Very high95.1Very high0 Ų065.1 Ų65.10%034%0.34CS..Hα-helixtrans-67.6-41.7177.2-173.659.4000112I131 P133 V143 H144 Q145 Q150 W151 I152 F167 V271I131-L148 HydrophobicContact CD1-CD2 4.01Å; P133-L148 HydrophobicContact CB-CD2 3.55Å; P133-L148 HydrophobicContact CG-CD2 3.74Å; V143-L148 HydrophobicContact CG1-CB 4.14Å; V143-L148 HydrophobicContact CG1-CD2 4.03Å; V143-L148 HydrophobicContact CG1-CG 4.49Å; V143-L148 HydrophobicContact CG2-CB 3.86Å; H144-L148 PolarHBondContact O-N 2.83Å; Q145-L148 PolarHBondContact O-N 2.68Å; L148-Q150 VanDerWaalsContact C-N 3.34Å; L148-Q150 PolarHBondContact O-N 2.81Å; L148-W151 HydrophobicContact CD1-CE3 4.17Å; L148-W151 PolarHBondContact O-N 3.18Å; L148-I152 HydrophobicContact CD1-CD1 4.3Å; L148-I152 HydrophobicContact CD1-CG1 4.39Å; L148-I152 HydrophobicContact CG-CD1 3.91Å; L148-I152 HydrophobicContact CG-CG1 4.45Å; L148-I152 VanDerWaalsContact O-CG1 3.31Å; L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.39Å; L148-F167 HydrophobicContact CD1-CE2 4.03Å; L148-F167 HydrophobicContact CD1-CZ 4.02Å; L148-V271 HydrophobicContact CD2-CB 3.76Å; L148-V271 HydrophobicContact CD2-CG1 3.59Å; L148-V271 HydrophobicContact CD2-CG2 3.85Å; L148-V271 HydrophobicContact CG-CG2 4.23Å
149Q95.7Very high95.3Very high50 Ų5063.4 Ų63.423%0.23432%0.319CS..Hα-helixtrans-56.8-47.1174.1-77.1170.5-20.700112Q145 I152 K153 I269Q145-Q149 WeakPolarHBondContact O-CB 3.26Å; Q145-Q149 WeakPolarHBondContact O-CG 3.31Å; Q145-Q149 PolarHBondContact O-N 2.72Å; Q149-I152 PolarHBondContact O-N 2.82Å; Q149-K153 WeakPolarHBondContact O-CB 3.27Å; Q149-K153 PolarHBondContact O-N 3.38Å; Q149-I269 VanDerWaalsContact CG-O 3.26Å; Q149-I269 WeakPolarHBondContact CG-O 3.5Å; Q149-I269 PolarHBondContact NE2-O 2.98Å
150Q95.6Very high95.6Very high122 Ų12259.2 Ų59.257%0.5729%0.29SS*.Hα-helixtrans-62.5-43.6177.2-170.873.46.900111.1R146 C147 L148 K153 S154R146-Q150 WeakPolarHBondContact O-CB 3.49Å; R146-Q150 PolarHBondContact O-N 2.98Å; C147-Q150 PolarHBondContact O-N 3.4Å; L148-Q150 VanDerWaalsContact C-N 3.34Å; L148-Q150 PolarHBondContact O-N 2.81Å; Q150-K153 PolarHBondContact O-N 2.77Å; Q150-S154 PolarHBondContact O-N 3.5Å; Q150-S154 PolarHBondContact O-OG 3.29Å
151W95.9Very high95.7Very high50 Ų5061.2 Ų61.219%0.18930%0.297CS..Hα-helixtrans-62.7-46.4178-179.691.8000112.1I119 C147 L148 K153 S154 S155 T157 A159 E161 F167I119-W151 HydrophobicContact CD1-CB 3.99Å; I119-W151 HydrophobicContact CD1-CG 4.36Å; C147-W151 WeakPolarHBondContact O-CB 3.35Å; C147-W151 PolarHBondContact O-N 3.25Å; L148-W151 HydrophobicContact CD1-CE3 4.17Å; L148-W151 PolarHBondContact O-N 3.18Å; W151-K153 VanDerWaalsContact C-N 3.3Å; W151-K153 PolarHBondContact O-N 3.3Å; W151-S154 PolarHBondContact O-N 3.28Å; W151-S155 VanDerWaalsContact O-CB 3.27Å; W151-S155 WeakPolarHBondContact O-CB 3.4Å; W151-S155 PolarHBondContact O-N 2.94Å; W151-S155 PolarHBondContact O-OG 2.97Å; W151-T157 HydrophobicContact CH2-CG2 3.22Å; W151-T157 HydrophobicContact CZ2-CG2 3.94Å; W151-T157 HydrophobicContact CZ3-CG2 3.56Å; W151-A159 WeakPolarHBondContact CH2-O 3.25Å; W151-E161 HydrophobicContact CZ2-CB 4.36Å; W151-E161 WeakPolarHBondContact CZ2-OE2 3.32Å; W151-F167 HydrophobicContact CE3-CE2 4.48Å; W151-F167 HydrophobicContact CH2-CE2 4.49Å; W151-F167 AromaticContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CZ 4.45Å
152I95.4Very high95.7Very high13 Ų1361.7 Ų61.77%0.06731%0.306CS..Hα-helixtrans-59.5-43.9176.2-69.7162.6000110.1L148 Q149 S154 Q156 F167 M169 V271L148-I152 HydrophobicContact CD1-CD1 4.3Å; L148-I152 HydrophobicContact CD1-CG1 4.39Å; L148-I152 HydrophobicContact CG-CD1 3.91Å; L148-I152 HydrophobicContact CG-CG1 4.45Å; L148-I152 VanDerWaalsContact O-CG1 3.31Å; L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.39Å; Q149-I152 PolarHBondContact O-N 2.82Å; I152-S154 PolarHBondContact O-N 3.07Å; I152-Q156 VanDerWaalsContact O-CA 3.32Å; I152-Q156 WeakPolarHBondContact O-CA 3.18Å; I152-Q156 PolarHBondContact O-N 3.36Å; I152-F167 HydrophobicContact CD1-CD2 4.2Å; I152-F167 HydrophobicContact CG1-CD2 4.44Å; I152-M169 HydrophobicContact CD1-CE 3.48Å; I152-M169 VanDerWaalsContact CD1-CE 3.48Å; I152-M169 HydrophobicContact CG1-CE 4.11Å; I152-M169 HydrophobicContact CG2-CE 4.19Å; I152-V271 HydrophobicContact CD1-CG2 3.52Å
153K92.5Very high95.7Very high165 Ų16562.1 Ų62.172%0.71731%0.314SS*.Hα-helixtrans-62.4-42.4-180-173.5179.2178.8-177.30112Q149 Q150 W151Q149-K153 WeakPolarHBondContact O-CB 3.27Å; Q149-K153 PolarHBondContact O-N 3.38Å; Q150-K153 PolarHBondContact O-N 2.77Å; W151-K153 VanDerWaalsContact C-N 3.3Å; W151-K153 PolarHBondContact O-N 3.3Å
154S95Very high95.6Very high90 Ų9071.2 Ų71.263%0.62935%0.348SS*.Hα-helixtrans-76.6-39.7-179.1-62.20000113.2Q150 W151 I152Q150-S154 PolarHBondContact O-N 3.5Å; Q150-S154 PolarHBondContact O-OG 3.29Å; W151-S154 PolarHBondContact O-N 3.28Å; I152-S154 PolarHBondContact O-N 3.07Å
155S94.5Very high95.6Very high51 Ų5173.4 Ų73.436%0.35736%0.358SS..Hα-helixtrans-86.8-17.1-175.864.70000113.8W151 T157W151-S155 VanDerWaalsContact O-CB 3.27Å; W151-S155 WeakPolarHBondContact O-CB 3.4Å; W151-S155 PolarHBondContact O-N 2.94Å; W151-S155 PolarHBondContact O-OG 2.97Å; S155-T157 PolarHBondContact O-N 3.13Å; S155-T157 WeakPolarHBondContact OG-CG2 3.43Å; S155-T157 PolarHBondContact OG-N 3.16Å
156Q93.3Very high95.6Very high162 Ų16275.5 Ų75.576%0.75738%0.377SS*.  trans57.613.5-174.2-55.418047.600114.5I152I152-Q156 VanDerWaalsContact O-CA 3.32Å; I152-Q156 WeakPolarHBondContact O-CA 3.18Å; I152-Q156 PolarHBondContact O-N 3.36Å
157T95.2Very high95.6Very high53 Ų5370.3 Ų70.333%0.32536%0.358SS..  trans-99144.4175.1174.90000111.7W151 S155 A159W151-T157 HydrophobicContact CH2-CG2 3.22Å; W151-T157 HydrophobicContact CZ2-CG2 3.94Å; W151-T157 HydrophobicContact CZ3-CG2 3.56Å; S155-T157 PolarHBondContact O-N 3.13Å; S155-T157 WeakPolarHBondContact OG-CG2 3.43Å; S155-T157 PolarHBondContact OG-N 3.16Å; T157-A159 PolarHBondContact OG1-N 2.82Å; T157-A159 PolarHBondContact OG1-O 3.38Å
158K95.4Very high95.5Very high101 Ų10173.6 Ų73.644%0.43937%0.374SS..  trans-107.610.2179.3-62.2-177.1-177.81730113.2V64 F167 M169V64-K158 VanDerWaalsContact CG1-NZ 3.28Å; K158-F167 WeakPolarHBondContact O-CD2 3.46Å; K158-F167 PolarHBondContact O-N 3.41Å; K158-M169 VanDerWaalsContact CA-CE 3.48Å; K158-M169 HydrophobicContact CB-CE 3.52Å; K158-M169 HydrophobicContact CB-SD 4.17Å; K158-M169 HydrophobicContact CD-CE 4.46Å; K158-M169 HydrophobicContact CD-SD 4.06Å; K158-M169 HydrophobicContact CG-CE 3.71Å; K158-M169 HydrophobicContact CG-SD 3.91Å
159A96.5Very high95.4Very high21 Ų2176.1 Ų76.117%0.17439%0.386CS..BIsolated β-bridgetrans-128.6154.5179.900000111W151 T157 E161 F165W151-A159 WeakPolarHBondContact CH2-O 3.25Å; T157-A159 PolarHBondContact OG1-N 2.82Å; T157-A159 PolarHBondContact OG1-O 3.38Å; A159-E161 PolarHBondContact O-N 3.31Å; A159-F165 CarbonylContact C-O 3.01Å; A159-F165 VanDerWaalsContact CA-O 3.27Å; A159-F165 WeakPolarHBondContact CA-O 3.26Å
160C96.6Very high95.3Very high1 Ų179.1 Ų79.11%0.00740%0.4CS..  trans-63.7132.6174.4178.70000110.8C134 V162 C163 R164 F165 F167C134-C160 HydrophobicContact CB-CB 3.96Å; C160-V162 VanDerWaalsContact C-N 3.25Å; C160-V162 PolarHBondContact O-N 3.01Å; C160-V162 PolarHBondContact SG-N 3.44Å; C160-C163 VanDerWaalsContact CB-SG 3.57Å; C160-R164 WeakPolarHBondContact O-CA 3.37Å; C160-R164 PolarHBondContact O-N 2.88Å; C160-F165 PolarHBondContact N-O 3.35Å; C160-F167 HydrophobicContact CB-CE1 3.89Å; C160-F167 HydrophobicContact CB-CZ 3.82Å
161E95.4Very high95.1Very high115 Ų11577 Ų7754%0.53740%0.395SS..THydrogen-bonded Turntrans-65.3-27.7178.966.7-161.8170.600113.7W151 A159 R164W151-E161 HydrophobicContact CZ2-CB 4.36Å; W151-E161 WeakPolarHBondContact CZ2-OE2 3.32Å; A159-E161 PolarHBondContact O-N 3.31Å; E161-R164 PolarHBondContact O-NE 3.02Å
162V95.6Very high94.9Very high85 Ų8581.1 Ų81.152%0.51541%0.411SS..THydrogen-bonded Turntrans-89.2-69-176.9-1760000111.2L140 C160 R164L140-V162 HydrophobicContact CD1-CG1 4.39Å; L140-V162 HydrophobicContact CD1-CG2 4.32Å; C160-V162 VanDerWaalsContact C-N 3.25Å; C160-V162 PolarHBondContact O-N 3.01Å; C160-V162 PolarHBondContact SG-N 3.44Å; V162-R164 PolarHBondContact O-N 3.19Å
163C95.6Very high94.6Very high49 Ų4983.1 Ų83.133%0.33142%0.423SS..THydrogen-bonded Turntrans-86.1-3.6-175.469.80000114.4C134 C160 F165C134-C163 VanDerWaalsContact CB-SG 3.59Å; C160-C163 VanDerWaalsContact CB-SG 3.57Å; C163-F165 PolarHBondContact O-N 3.28Å
164R96.1Very high94.5Very high190 Ų19077.3 Ų77.372%0.71740%0.398SS*.  trans60.57179.4-51.4-59.9176.377.10116C160 E161 V162 S166C160-R164 WeakPolarHBondContact O-CA 3.37Å; C160-R164 PolarHBondContact O-N 2.88Å; E161-R164 PolarHBondContact O-NE 3.02Å; V162-R164 PolarHBondContact O-N 3.19Å; R164-S166 PolarHBondContact O-N 2.89Å
165F96.1Very high94.2Very high47 Ų4776.8 Ų76.821%0.20639%0.393CS..PPolyproline II helixtrans-60.4130.2172.4-179.1-104.5000110.9P133 C134 Y135 A159 C160 C163 I168 C274P133-F165 WeakPolarHBondContact O-CD1 3.5Å; P133-F165 WeakPolarHBondContact O-CE1 3.49Å; C134-F165 HydrophobicContact CB-CB 4.08Å; C134-F165 HydrophobicContact CB-CD1 3.92Å; C134-F165 HydrophobicContact CB-CG 4.4Å; Y135-F165 HydrophobicContact CD2-CB 4.24Å; Y135-F165 AromaticContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CE2 4.19Å; Y135-F165 AromaticContact CD2-CG 3.95Å; Y135-F165 HydrophobicContact CD2-CG 3.95Å; Y135-F165 AromaticContact CE2-CD2 3.38Å; Y135-F165 HydrophobicContact CE2-CD2 3.38Å; Y135-F165 AromaticContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CE2 3.46Å; Y135-F165 VanDerWaalsContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CG 4.07Å; Y135-F165 HydrophobicContact CE2-CZ 4.2Å; A159-F165 CarbonylContact C-O 3.01Å; A159-F165 VanDerWaalsContact CA-O 3.27Å; A159-F165 WeakPolarHBondContact CA-O 3.26Å; C160-F165 PolarHBondContact N-O 3.35Å; C163-F165 PolarHBondContact O-N 3.28Å; F165-I168 HydrophobicContact CZ-CD1 4.48Å; F165-I168 HydrophobicContact CZ-CG1 4.38Å; F165-C274 HydrophobicContact CD1-CB 4.27Å; F165-C274 HydrophobicContact CE1-CB 3.6Å; F165-C274 HydrophobicContact CZ-CB 3.91Å
166S96.8Very high93.8Very high83 Ų8382 Ų8258%0.5841%0.409SS*.BIsolated β-bridgetrans-75.6121.7174.5-67.10000109.7R164R164-S166 PolarHBondContact O-N 2.89Å
167F96.4Very high93.5Very high13 Ų1386 Ų866%0.05742%0.418CS..PPolyproline II helixtrans-64.3142.6-177.3-60.3-51.1000111.6P133 C134 L148 W151 I152 K158 C160 M169 V271P133-F167 HydrophobicContact CB-CD1 3.66Å; P133-F167 HydrophobicContact CB-CE1 3.76Å; P133-F167 HydrophobicContact CG-CD1 4.31Å; P133-F167 HydrophobicContact CG-CE1 3.88Å; P133-F167 VanDerWaalsContact O-CD1 3.32Å; P133-F167 WeakPolarHBondContact O-CD1 3.47Å; C134-F167 HydrophobicContact CB-CD1 4.44Å; C134-F167 HydrophobicContact CB-CE1 3.94Å; L148-F167 HydrophobicContact CD1-CE2 4.03Å; L148-F167 HydrophobicContact CD1-CZ 4.02Å; W151-F167 HydrophobicContact CE3-CE2 4.48Å; W151-F167 HydrophobicContact CH2-CE2 4.49Å; W151-F167 AromaticContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CZ 4.45Å; I152-F167 HydrophobicContact CD1-CD2 4.2Å; I152-F167 HydrophobicContact CG1-CD2 4.44Å; K158-F167 WeakPolarHBondContact O-CD2 3.46Å; K158-F167 PolarHBondContact O-N 3.41Å; C160-F167 HydrophobicContact CB-CE1 3.89Å; C160-F167 HydrophobicContact CB-CZ 3.82Å; F167-M169 HydrophobicContact CB-CE 3.78Å; F167-M169 HydrophobicContact CB-CG 4.26Å; F167-M169 HydrophobicContact CD2-CE 3.91Å; F167-M169 HydrophobicContact CG-CE 4.35Å; F167-M169 PolarHBondContact O-N 2.89Å; F167-V271 HydrophobicContact CB-CG1 3.86Å; F167-V271 HydrophobicContact CG-CG1 4.33Å
168I95Very high93.1Very high85 Ų8590.9 Ų90.944%0.43643%0.434SS..  trans-78.5106.6173.9-61.5173000107.8F165 V271 G272F165-I168 HydrophobicContact CZ-CD1 4.48Å; F165-I168 HydrophobicContact CZ-CG1 4.38Å; I168-V271 CarbonylContact O-C 3.53Å; I168-V271 WeakPolarHBondContact O-CA 3.42Å; I168-G272 PolarHBondContact O-N 2.9Å
169M94.8Very high92.9Very high53 Ų5387.7 Ų87.726%0.26142%0.419SS..EExtended strand (participates in β ladder)trans-110.5136.8-175.3-60.7-170.7-178.200111.8I152 K158 F167 I269 Y270 V271I152-M169 HydrophobicContact CD1-CE 3.48Å; I152-M169 VanDerWaalsContact CD1-CE 3.48Å; I152-M169 HydrophobicContact CG1-CE 4.11Å; I152-M169 HydrophobicContact CG2-CE 4.19Å; K158-M169 VanDerWaalsContact CA-CE 3.48Å; K158-M169 HydrophobicContact CB-CE 3.52Å; K158-M169 HydrophobicContact CB-SD 4.17Å; K158-M169 HydrophobicContact CD-CE 4.46Å; K158-M169 HydrophobicContact CD-SD 4.06Å; K158-M169 HydrophobicContact CG-CE 3.71Å; K158-M169 HydrophobicContact CG-SD 3.91Å; F167-M169 HydrophobicContact CB-CE 3.78Å; F167-M169 HydrophobicContact CB-CG 4.26Å; F167-M169 HydrophobicContact CD2-CE 3.91Å; F167-M169 HydrophobicContact CG-CE 4.35Å; F167-M169 PolarHBondContact O-N 2.89Å; M169-I269 HydrophobicContact CB-CG2 4.01Å; M169-I269 HydrophobicContact CG-CG2 4.15Å; M169-I269 HydrophobicContact SD-CG2 3.91Å; M169-Y270 CarbonylContact C-O 3.54Å; M169-Y270 WeakPolarHBondContact CA-O 3.37Å; M169-V271 HydrophobicContact CG-CG2 4.36Å
170Q93.2Very high92.4Very high112 Ų11291.2 Ų91.252%0.52343%0.432SS..EExtended strand (participates in β ladder)trans-127.6124.6172-154.417737.700109.6Y270Q170-Y270 PolarHBondContact N-O 3.34Å; Q170-Y270 PolarHBondContact O-N 3.47Å
171T92.7Very high92Very high77 Ų77100.2 Ų100.247%0.47247%0.471SS..EExtended strand (participates in β ladder)trans-91.7126.2178.8-57.60000109.7K267T171-K267 HydrophobicContact CG2-CB 3.84Å; T171-K267 HydrophobicContact CG2-CD 4Å; T171-K267 HydrophobicContact CG2-CG 4.11Å
172R90.3Very high91.5Very high137 Ų13795.7 Ų95.752%0.51745%0.451SS..EExtended strand (participates in β ladder)trans-127.2145.2176.1-62.8-68.4-171.41600.2109.7V268 Y270R172-V268 PolarHBondContact N-O 3.14Å; R172-V268 PolarHBondContact O-N 2.93Å; R172-V268 VanDerWaalsContact O-O 3.09Å; R172-Y270 HydrophobicContact CB-CD2 4.05Å; R172-Y270 HydrophobicContact CB-CE2 3.96Å; R172-Y270 HydrophobicContact CG-CD2 4.24Å
173V90.7Very high91Very high55 Ų5597.4 Ų97.433%0.33346%0.457SS..EExtended strand (participates in β ladder)trans-79.4138.2173.4-173.60000108.3W179 K263 K267V173-W179 HydrophobicContact CG1-CZ2 3.45Å; V173-W179 VanDerWaalsContact CG1-CZ2 3.45Å; V173-K263 HydrophobicContact CG2-CG 4.32Å; V173-K267 HydrophobicContact CG2-CG 4.03Å
174K88.6Confident90.6Very high43 Ų4396.5 Ų96.519%0.18745%0.449CS..PPolyproline II helixtrans-52.7148.7172-68.2176.3-175.7176.90109.1F176 W179 E180 N266 V268K174-F176 PolarHBondContact O-N 3.5Å; K174-W179 PolarHBondContact O-NE1 2.87Å; K174-E180 IonicContact NZ-OE1 2.81Å; K174-E180 PolarHBondContact NZ-OE1 2.91Å; K174-E180 IonicContact NZ-OE2 3.05Å; K174-E180 PolarHBondContact NZ-OE2 2.85Å; K174-N266 WeakPolarHBondContact CG-O 3.32Å; K174-N266 PolarHBondContact N-O 3.38Å; K174-V268 HydrophobicContact CD-CG2 4.04Å; K174-V268 HydrophobicContact CG-CG2 3.57Å
175P88.6Confident90.3Very high80 Ų8090.6 Ų90.652%0.51944%0.436SS..PPolyproline II helixtrans-58.9140.5169.525.3-33.2000109.5R177 K178 W179P175-R177 PolarHBondContact O-N 3.05Å; P175-K178 HydrophobicContact CG-CB 4.25Å; P175-K178 HydrophobicContact CG-CD 4.17Å; P175-K178 HydrophobicContact CG-CG 4.18Å; P175-K178 PolarHBondContact O-N 3.46Å; P175-W179 VanDerWaalsContact O-CD1 3.27Å
176F86.7Confident90Very high159 Ų15992.5 Ų92.570%0.69746%0.456SS*.G310 helixtrans-49.5-33-172.8-67.5-73.8000114.4K174 K178 W179K174-F176 PolarHBondContact O-N 3.5Å; F176-K178 VanDerWaalsContact C-N 3.28Å; F176-K178 PolarHBondContact O-N 3.39Å; F176-W179 HydrophobicContact CD1-CD2 4.08Å; F176-W179 AromaticContact CD1-CE2 3.59Å; F176-W179 HydrophobicContact CD1-CE3 4.39Å; F176-W179 AromaticContact CD1-CH2 3.85Å; F176-W179 HydrophobicContact CD1-CH2 3.85Å; F176-W179 AromaticContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ2 3.45Å; F176-W179 VanDerWaalsContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ3 4.3Å; F176-W179 AromaticContact CE1-CE2 4Å; F176-W179 AromaticContact CE1-CH2 3.56Å; F176-W179 HydrophobicContact CE1-CH2 3.56Å; F176-W179 AromaticContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ3 4.34Å; F176-W179 HydrophobicContact CZ-CZ2 4.35Å; F176-W179 WeakPolarHBondContact O-CB 3.28Å; F176-W179 PolarHBondContact O-N 3.27Å
177R87.1Confident89.7Confident248 Ų24892.6 Ų92.694%0.93645%0.452SS*.G310 helixtrans-66.7-24.3178.2-64-176.1179.2179.2-0.3114.4P175P175-R177 PolarHBondContact O-N 3.05Å
178K87.3Confident89.4Confident154 Ų15493.4 Ų93.467%0.6746%0.456SS*.G310 helixtrans-103.715178.3-62-171.1178.4-175.80112P175 F176 E180P175-K178 HydrophobicContact CG-CB 4.25Å; P175-K178 HydrophobicContact CG-CD 4.17Å; P175-K178 HydrophobicContact CG-CG 4.18Å; P175-K178 PolarHBondContact O-N 3.46Å; F176-K178 VanDerWaalsContact C-N 3.28Å; F176-K178 PolarHBondContact O-N 3.39Å; K178-E180 PolarHBondContact O-N 3.32Å
179W89.9Confident89.1Confident35 Ų3596.8 Ų96.813%0.13346%0.463CS..PPolyproline II helixtrans-68.6128.3176.4-80.724.1000110.1V173 K174 P175 F176 F259 W262 K263 N266V173-W179 HydrophobicContact CG1-CZ2 3.45Å; V173-W179 VanDerWaalsContact CG1-CZ2 3.45Å; K174-W179 PolarHBondContact O-NE1 2.87Å; P175-W179 VanDerWaalsContact O-CD1 3.27Å; F176-W179 HydrophobicContact CD1-CD2 4.08Å; F176-W179 AromaticContact CD1-CE2 3.59Å; F176-W179 HydrophobicContact CD1-CE3 4.39Å; F176-W179 AromaticContact CD1-CH2 3.85Å; F176-W179 HydrophobicContact CD1-CH2 3.85Å; F176-W179 AromaticContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ2 3.45Å; F176-W179 VanDerWaalsContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ3 4.3Å; F176-W179 AromaticContact CE1-CE2 4Å; F176-W179 AromaticContact CE1-CH2 3.56Å; F176-W179 HydrophobicContact CE1-CH2 3.56Å; F176-W179 AromaticContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ3 4.34Å; F176-W179 HydrophobicContact CZ-CZ2 4.35Å; F176-W179 WeakPolarHBondContact O-CB 3.28Å; F176-W179 PolarHBondContact O-N 3.27Å; W179-F259 HydrophobicContact CH2-CE2 4.26Å; W179-F259 HydrophobicContact CH2-CZ 4.19Å; W179-F259 HydrophobicContact CZ3-CE2 4.05Å; W179-F259 HydrophobicContact CZ3-CZ 4.44Å; W179-W262 HydrophobicContact CB-CZ2 4.45Å; W179-W262 AromaticContact CE3-CD2 3.95Å; W179-W262 HydrophobicContact CE3-CD2 3.95Å; W179-W262 AromaticContact CE3-CE2 3.79Å; W179-W262 HydrophobicContact CE3-CE3 4.16Å; W179-W262 HydrophobicContact CE3-CH2 4.1Å; W179-W262 AromaticContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ3 4.23Å; W179-W262 HydrophobicContact CZ3-CD2 4.07Å; W179-W262 HydrophobicContact CZ3-CE3 4.01Å; W179-W262 HydrophobicContact CZ3-CZ3 4.28Å; W179-K263 HydrophobicContact CH2-CB 4.21Å; W179-K263 HydrophobicContact CH2-CG 4.28Å; W179-N266 VanDerWaalsContact CA-OD1 3.25Å; W179-N266 WeakPolarHBondContact CA-OD1 3.47Å; W179-N266 HydrophobicContact CD2-CB 3.98Å; W179-N266 HydrophobicContact CG-CB 4.03Å
180E87.8Confident89Confident94 Ų94102.8 Ų102.844%0.43948%0.483SS..PPolyproline II helixtrans-79.5146.3172.5-75.4152.4-163.200109K174 K178 L182 W262 Y265 N266K174-E180 IonicContact NZ-OE1 2.81Å; K174-E180 PolarHBondContact NZ-OE1 2.91Å; K174-E180 IonicContact NZ-OE2 3.05Å; K174-E180 PolarHBondContact NZ-OE2 2.85Å; K178-E180 PolarHBondContact O-N 3.32Å; E180-L182 PolarHBondContact O-N 3.06Å; E180-W262 PolarHBondContact O-NE1 3Å; E180-Y265 HydrophobicContact CB-CE1 3.93Å; E180-N266 PolarHBondContact N-OD1 3.09Å; E180-N266 PolarHBondContact O-ND2 3.49Å; E180-N266 VanDerWaalsContact O-ND2 3.16Å
181K87.3Confident88.9Confident191 Ų191104.5 Ų104.583%0.8349%0.489SS*.PPolyproline II helixtrans-62.5131.3172.2-66.9-178-179.9177.60107.8D183K181-D183 PolarHBondContact O-N 3.01Å
182L85.7Confident88.8Confident20 Ų20102.8 Ų102.811%0.10548%0.477CS..PPolyproline II helixtrans-55.9131.4175.5-175.760.1000109E180 I184 R261 W262 Y265E180-L182 PolarHBondContact O-N 3.06Å; L182-I184 VanDerWaalsContact C-N 3.28Å; L182-I184 HydrophobicContact CB-CD1 4.05Å; L182-I184 HydrophobicContact CB-CG1 3.77Å; L182-I184 HydrophobicContact CD2-CD1 3.86Å; L182-I184 HydrophobicContact CD2-CG1 3.63Å; L182-I184 HydrophobicContact CG-CD1 4.13Å; L182-I184 HydrophobicContact CG-CG1 3.53Å; L182-I184 PolarHBondContact O-N 3.47Å; L182-R261 HydrophobicContact CD1-CG 4.42Å; L182-R261 HydrophobicContact CD2-CB 4.4Å; L182-R261 HydrophobicContact CD2-CG 3.96Å; L182-W262 HydrophobicContact CB-CB 4.48Å; L182-W262 HydrophobicContact CB-CG 4.19Å; L182-W262 HydrophobicContact CD2-CB 4.23Å; L182-Y265 VanDerWaalsContact CD1-CB 3.46Å; L182-Y265 HydrophobicContact CD1-CD1 4.15Å; L182-Y265 HydrophobicContact CD1-CD2 3.74Å; L182-Y265 HydrophobicContact CD1-CG 3.52Å
183D83.5Confident88.9Confident121 Ų121103.4 Ų103.465%0.64748%0.483SS*.  trans-72.290.3171.5-168.915000108.9K181 Y265K181-D183 PolarHBondContact O-N 3.01Å; D183-Y265 HydrophobicContact CB-CE2 4.36Å
184I87.3Confident89Confident30 Ų30104.2 Ų104.215%0.15449%0.49CS..  trans-104.5133.2-178.7-60.2176.9000107.7L182 E188 R189 I192L182-I184 VanDerWaalsContact C-N 3.28Å; L182-I184 HydrophobicContact CB-CD1 4.05Å; L182-I184 HydrophobicContact CB-CG1 3.77Å; L182-I184 HydrophobicContact CD2-CD1 3.86Å; L182-I184 HydrophobicContact CD2-CG1 3.63Å; L182-I184 HydrophobicContact CG-CD1 4.13Å; L182-I184 HydrophobicContact CG-CG1 3.53Å; L182-I184 PolarHBondContact O-N 3.47Å; I184-E188 HydrophobicContact CG2-CB 3.53Å; I184-E188 HydrophobicContact CG2-CG 3.54Å; I184-R189 HydrophobicContact CG2-CB 4.25Å; I184-I192 HydrophobicContact CD1-CD1 4.25Å
185S90Very high89.1Confident65 Ų65103.6 Ų103.646%0.45549%0.492SS..  trans-53.6145.917371.90000111.2V187 E188 R189S185-V187 PolarHBondContact O-N 2.95Å; S185-V187 VanDerWaalsContact O-N 3.15Å; S185-E188 PolarHBondContact O-N 3.18Å; S185-E188 VanDerWaalsContact O-N 3.14Å; S185-E188 WeakPolarHBondContact OG-CB 3.47Å; S185-E188 PolarHBondContact OG-N 3.14Å; S185-R189 PolarHBondContact O-N 3.34Å
186S91Very high89.3Confident88 Ų88102.7 Ų102.762%0.61549%0.485SS*.Hα-helixtrans-56.5-34.5-179.656.70000112.7R190S186-R190 PolarHBondContact O-N 3.44Å; S186-R190 VanDerWaalsContact O-N 3.1Å
187V90.3Very high89.6Confident84 Ų8496.8 Ų96.851%0.50947%0.465SS..Hα-helixtrans-68.9-47.4177.2-179.80000111.5S185 R189 R190 K191S185-V187 PolarHBondContact O-N 2.95Å; S185-V187 VanDerWaalsContact O-N 3.15Å; V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 PolarHBondContact O-N 3.19Å; V187-R190 PolarHBondContact O-N 3.15Å; V187-K191 WeakPolarHBondContact O-CG 3.47Å; V187-K191 PolarHBondContact O-N 3.35Å
188E88.9Confident89.9Confident31 Ų3190.7 Ų90.715%0.14545%0.446CS..Hα-helixtrans-63.1-40.8177.4-177.6-179.6-178.200110.8I184 S185 R190 K191 I192 R261I184-E188 HydrophobicContact CG2-CB 3.53Å; I184-E188 HydrophobicContact CG2-CG 3.54Å; S185-E188 PolarHBondContact O-N 3.18Å; S185-E188 VanDerWaalsContact O-N 3.14Å; S185-E188 WeakPolarHBondContact OG-CB 3.47Å; S185-E188 PolarHBondContact OG-N 3.14Å; E188-R190 VanDerWaalsContact C-N 3.34Å; E188-R190 PolarHBondContact O-N 3.32Å; E188-K191 PolarHBondContact O-N 3.39Å; E188-I192 HydrophobicContact CG-CD1 4.12Å; E188-I192 VanDerWaalsContact O-CG1 3.32Å; E188-I192 WeakPolarHBondContact O-CG1 3.32Å; E188-I192 PolarHBondContact O-N 3.26Å; E188-R261 VanDerWaalsContact CD-NH1 3.33Å; E188-R261 IonicContact OE1-NH1 2.7Å; E188-R261 PolarHBondContact OE1-NH1 3.03Å; E188-R261 IonicContact OE2-CZ 2.77Å; E188-R261 IonicContact OE2-NH1 2.85Å; E188-R261 PolarHBondContact OE2-NH1 2.93Å
189R89.9Confident90.1Very high155 Ų15583.9 Ų83.959%0.58542%0.416SS*.Hα-helixtrans-59.3-43.1174.7-169.6-174.9-57.4175.64.5112.3I184 S185 V187 I192 F193I184-R189 HydrophobicContact CG2-CB 4.25Å; S185-R189 PolarHBondContact O-N 3.34Å; V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 PolarHBondContact O-N 3.19Å; R189-I192 PolarHBondContact O-N 3.45Å; R189-F193 WeakPolarHBondContact O-CB 3.42Å; R189-F193 PolarHBondContact O-N 2.92Å
190R92.4Very high90.3Very high179 Ų17986.3 Ų86.368%0.67544%0.435SS*.Hα-helixtrans-63.5-44.9176.9-173.3-178.8-61166.31.6111.4S186 V187 E188 I192 F193 C194S186-R190 PolarHBondContact O-N 3.44Å; S186-R190 VanDerWaalsContact O-N 3.1Å; V187-R190 PolarHBondContact O-N 3.15Å; E188-R190 VanDerWaalsContact C-N 3.34Å; E188-R190 PolarHBondContact O-N 3.32Å; R190-I192 VanDerWaalsContact C-N 3.33Å; R190-I192 PolarHBondContact O-N 2.76Å; R190-F193 PolarHBondContact O-N 3.09Å; R190-C194 WeakPolarHBondContact O-CB 3.32Å; R190-C194 PolarHBondContact O-N 3.22Å; R190-C194 PolarHBondContact O-SG 3.23Å
191K90.3Very high90.6Very high148 Ų14887 Ų8764%0.64344%0.441SS*.Hα-helixtrans-58.1-45.1176.8-70.4176178.7-178.10111.6V187 E188 S195V187-K191 WeakPolarHBondContact O-CG 3.47Å; V187-K191 PolarHBondContact O-N 3.35Å; E188-K191 PolarHBondContact O-N 3.39Å; K191-S195 WeakPolarHBondContact O-CB 3.16Å; K191-S195 PolarHBondContact O-N 3.27Å
192I91.2Very high90.8Very high42 Ų4279.5 Ų79.522%0.21541%0.414CS..Hα-helixtrans-62.8-47.8177.3-65.3164.6000110.4I184 E188 R189 R190 S195 V196 L258I184-I192 HydrophobicContact CD1-CD1 4.25Å; E188-I192 HydrophobicContact CG-CD1 4.12Å; E188-I192 VanDerWaalsContact O-CG1 3.32Å; E188-I192 WeakPolarHBondContact O-CG1 3.32Å; E188-I192 PolarHBondContact O-N 3.26Å; R189-I192 PolarHBondContact O-N 3.45Å; R190-I192 VanDerWaalsContact C-N 3.33Å; R190-I192 PolarHBondContact O-N 2.76Å; I192-S195 PolarHBondContact O-N 3.48Å; I192-V196 HydrophobicContact CG2-CG2 4.28Å; I192-V196 VanDerWaalsContact O-CG2 3.32Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.35Å; I192-L258 HydrophobicContact CD1-CD1 3.73Å; I192-L258 HydrophobicContact CD1-CD2 3.92Å; I192-L258 HydrophobicContact CD1-CG 4.49Å; I192-L258 HydrophobicContact CG1-CD1 3.83Å
193F92.4Very high91Very high149 Ų14982.5 Ų82.565%0.65443%0.429SS*.Hα-helixtrans-61-47.4179.6-178.7-95.7000112.2R189 R190 S195 V196 A197R189-F193 WeakPolarHBondContact O-CB 3.42Å; R189-F193 PolarHBondContact O-N 2.92Å; R190-F193 PolarHBondContact O-N 3.09Å; F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 3.38Å; F193-V196 PolarHBondContact O-N 2.72Å; F193-A197 WeakPolarHBondContact O-CB 3.43Å; F193-A197 PolarHBondContact O-N 3.27Å
194C92.3Very high91.5Very high72 Ų7280.5 Ų80.549%0.48642%0.421SS..Hα-helixtrans-59.4-42.4175.4-69.50000111.6R190 A197 F198R190-C194 WeakPolarHBondContact O-CB 3.32Å; R190-C194 PolarHBondContact O-N 3.22Å; R190-C194 PolarHBondContact O-SG 3.23Å; C194-A197 PolarHBondContact O-N 3Å; C194-F198 VanDerWaalsContact O-CB 3.32Å; C194-F198 WeakPolarHBondContact O-CB 3.07Å; C194-F198 PolarHBondContact O-N 3.41Å
195S91.4Very high91.8Very high30 Ų3082.3 Ų82.321%0.2144%0.436CS..Hα-helixtrans-61.3-50.8175.5-179.60000111.2K191 I192 F193 A197 F198 H199 Y255K191-S195 WeakPolarHBondContact O-CB 3.16Å; K191-S195 PolarHBondContact O-N 3.27Å; I192-S195 PolarHBondContact O-N 3.48Å; F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 3.38Å; S195-A197 VanDerWaalsContact C-N 3.35Å; S195-A197 PolarHBondContact O-N 3.3Å; S195-F198 WeakPolarHBondContact O-CB 3.48Å; S195-F198 PolarHBondContact O-N 3.42Å; S195-H199 PolarHBondContact O-N 3.23Å; S195-H199 PolarHBondContact O-ND1 3.22Å; S195-H199 PolarHBondContact OG-CE1 3.3Å; S195-Y255 PolarHBondContact OG-OH 3.2Å
196V92Very high91.8Very high62 Ų6282.9 Ų82.938%0.37644%0.436SS..Hα-helixtrans-59.1-45.4178.8172.80000111.3I192 F193 F198 H199 V200 Y255I192-V196 HydrophobicContact CG2-CG2 4.28Å; I192-V196 VanDerWaalsContact O-CG2 3.32Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.35Å; F193-V196 PolarHBondContact O-N 2.72Å; V196-F198 PolarHBondContact O-N 3.02Å; V196-H199 PolarHBondContact O-N 2.7Å; V196-V200 WeakPolarHBondContact O-CG2 3.46Å; V196-V200 PolarHBondContact O-N 2.85Å; V196-Y255 HydrophobicContact CG2-CE1 3.85Å; V196-Y255 WeakPolarHBondContact CG2-OH 3.35Å
197A92.9Very high91.8Very high35 Ų3583 Ų8329%0.28943%0.433SS..Hα-helixtrans-61.6-44.1177.700000112.1F193 C194 S195 H199 V200 I201F193-A197 WeakPolarHBondContact O-CB 3.43Å; F193-A197 PolarHBondContact O-N 3.27Å; C194-A197 PolarHBondContact O-N 3Å; S195-A197 VanDerWaalsContact C-N 3.35Å; S195-A197 PolarHBondContact O-N 3.3Å; A197-H199 VanDerWaalsContact C-N 3.29Å; A197-H199 PolarHBondContact O-N 3.39Å; A197-V200 PolarHBondContact O-N 3.22Å; A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 2.92Å
198F93.6Very high92Very high119 Ų11987.6 Ų87.652%0.52244%0.441SS..Hα-helixtrans-57.4-42.1175.1177.8-95.7000111.7C194 S195 V196 I201 A202 F247C194-F198 VanDerWaalsContact O-CB 3.32Å; C194-F198 WeakPolarHBondContact O-CB 3.07Å; C194-F198 PolarHBondContact O-N 3.41Å; S195-F198 WeakPolarHBondContact O-CB 3.48Å; S195-F198 PolarHBondContact O-N 3.42Å; V196-F198 PolarHBondContact O-N 3.02Å; F198-I201 PolarHBondContact O-N 2.84Å; F198-A202 VanDerWaalsContact O-CB 3.27Å; F198-A202 WeakPolarHBondContact O-CB 3.18Å; F198-A202 PolarHBondContact O-N 3.27Å; F198-F247 HydrophobicContact CD1-CE1 4.11Å; F198-F247 AromaticContact CD1-CZ 3.91Å; F198-F247 HydrophobicContact CD1-CZ 3.91Å; F198-F247 AromaticContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE2 4.42Å; F198-F247 AromaticContact CE1-CZ 3.47Å; F198-F247 HydrophobicContact CE1-CZ 3.47Å; F198-F247 VanDerWaalsContact CE1-CZ 3.47Å
199H92.8Very high92Very high12 Ų1289.9 Ų89.96%0.05646%0.461CS..Hα-helixtrans-66.6-43.8177.3-74.481.1000112.9S195 V196 A197 I201 A202 I203 F247 Q251S195-H199 PolarHBondContact O-N 3.23Å; S195-H199 PolarHBondContact O-ND1 3.22Å; S195-H199 PolarHBondContact OG-CE1 3.3Å; V196-H199 PolarHBondContact O-N 2.7Å; A197-H199 VanDerWaalsContact C-N 3.29Å; A197-H199 PolarHBondContact O-N 3.39Å; H199-I201 VanDerWaalsContact C-N 3.28Å; H199-I201 PolarHBondContact O-N 3.49Å; H199-A202 PolarHBondContact O-N 2.89Å; H199-I203 WeakPolarHBondContact O-CB 3.37Å; H199-I203 WeakPolarHBondContact O-CD1 3.28Å; H199-I203 WeakPolarHBondContact O-CG1 3.26Å; H199-I203 PolarHBondContact O-N 3.48Å; H199-F247 AromaticContact CD2-CE1 3.74Å; H199-F247 AromaticContact CE1-CE1 3.7Å; H199-F247 AromaticContact CE1-CZ 3.95Å; H199-F247 AromaticContact NE2-CD1 3.87Å; H199-F247 AromaticContact NE2-CE1 3.19Å; H199-F247 WeakPolarHBondContact NE2-CE1 3.42Å; H199-F247 AromaticContact NE2-CZ 3.84Å; H199-Q251 VanDerWaalsContact CE1-CG 3.48Å; H199-Q251 WeakPolarHBondContact CE1-CG 3.3Å; H199-Q251 VanDerWaalsContact NE2-CB 3.26Å; H199-Q251 WeakPolarHBondContact NE2-CB 3.17Å; H199-Q251 WeakPolarHBondContact NE2-CG 3.46Å
200V92.8Very high92Very high85 Ų8585.1 Ų85.152%0.51545%0.447SS..Hα-helixtrans-59.4-44.5178172.10000110.2V196 A197 T204V196-V200 WeakPolarHBondContact O-CG2 3.46Å; V196-V200 PolarHBondContact O-N 2.85Å; A197-V200 PolarHBondContact O-N 3.22Å; V200-T204 WeakPolarHBondContact O-CB 3.35Å; V200-T204 PolarHBondContact O-N 3.01Å; V200-T204 PolarHBondContact O-OG1 3.24Å
201I95.1Very high91.9Very high110 Ų11084.5 Ų84.556%0.56445%0.445SS*.Hα-helixtrans-64.1-50.3176.6-64.5166000110.4A197 F198 H199 I203 T204 C205A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 2.92Å; F198-I201 PolarHBondContact O-N 2.84Å; H199-I201 VanDerWaalsContact C-N 3.28Å; H199-I201 PolarHBondContact O-N 3.49Å; I201-I203 PolarHBondContact O-N 2.97Å; I201-T204 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-SG 3.42Å
202A91.2Very high91.9Very high32 Ų3279.8 Ų79.826%0.26443%0.429SS..Hα-helixtrans-59.2-45.7-179.100000112.5F198 H199 C205 V206F198-A202 VanDerWaalsContact O-CB 3.27Å; F198-A202 WeakPolarHBondContact O-CB 3.18Å; F198-A202 PolarHBondContact O-N 3.27Å; H199-A202 PolarHBondContact O-N 2.89Å; A202-C205 PolarHBondContact O-N 2.99Å; A202-V206 VanDerWaalsContact O-CG2 3.31Å; A202-V206 WeakPolarHBondContact O-CG2 3.33Å; A202-V206 PolarHBondContact O-N 3.25Å
203I90.4Very high91.7Very high83 Ų8380.1 Ų80.143%0.42643%0.431SS..Hα-helixtrans-61.7-45.8176.5-67.3165.1000110.1H199 I201 C205 V206 V207 M248H199-I203 WeakPolarHBondContact O-CB 3.37Å; H199-I203 WeakPolarHBondContact O-CD1 3.28Å; H199-I203 WeakPolarHBondContact O-CG1 3.26Å; H199-I203 PolarHBondContact O-N 3.48Å; I201-I203 PolarHBondContact O-N 2.97Å; I203-C205 VanDerWaalsContact C-N 3.32Å; I203-C205 PolarHBondContact O-N 3.24Å; I203-V206 PolarHBondContact O-N 3.03Å; I203-V207 HydrophobicContact CG2-CG2 4.25Å; I203-V207 WeakPolarHBondContact O-CB 3.4Å; I203-V207 VanDerWaalsContact O-CG2 3.28Å; I203-V207 WeakPolarHBondContact O-CG2 3.46Å; I203-V207 PolarHBondContact O-N 3.1Å; I203-M248 HydrophobicContact CD1-CE 3.88Å; I203-M248 HydrophobicContact CG1-CE 4.29Å
204T94.1Very high91.4Very high80 Ų8078.3 Ų78.349%0.49143%0.427SS..Hα-helixtrans-59.8-44178.2-56.90000111.1V200 I201 V207 W208V200-T204 WeakPolarHBondContact O-CB 3.35Å; V200-T204 PolarHBondContact O-N 3.01Å; V200-T204 PolarHBondContact O-OG1 3.24Å; I201-T204 PolarHBondContact O-N 3.43Å; T204-V207 PolarHBondContact O-N 3.35Å; T204-W208 WeakPolarHBondContact O-CB 3.47Å; T204-W208 PolarHBondContact O-N 3.39Å
205C93.6Very high91.1Very high68 Ų6879.7 Ų79.746%0.45943%0.43SS..Hα-helixtrans-62.6-46.5175.9-68.50000112.1I201 A202 I203 V207 W208 S209I201-C205 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-SG 3.42Å; A202-C205 PolarHBondContact O-N 2.99Å; I203-C205 VanDerWaalsContact C-N 3.32Å; I203-C205 PolarHBondContact O-N 3.24Å; C205-V207 PolarHBondContact O-N 2.87Å; C205-W208 PolarHBondContact O-N 3.32Å; C205-S209 WeakPolarHBondContact O-CB 3.36Å; C205-S209 PolarHBondContact O-N 3.04Å; C205-S209 PolarHBondContact O-OG 3.39Å; C205-S209 VanDerWaalsContact O-OG 3.07Å
206V89.2Confident90.8Very high76 Ų7685.6 Ų85.646%0.46145%0.447SS..Hα-helixtrans-61.4-46.4178.5170.70000110.7A202 I203 W208 S209 L210A202-V206 VanDerWaalsContact O-CG2 3.31Å; A202-V206 WeakPolarHBondContact O-CG2 3.33Å; A202-V206 PolarHBondContact O-N 3.25Å; I203-V206 PolarHBondContact O-N 3.03Å; V206-W208 PolarHBondContact O-N 3.36Å; V206-S209 PolarHBondContact O-N 2.88Å; V206-L210 HydrophobicContact CG1-CD1 3.83Å; V206-L210 HydrophobicContact CG1-CG 4.3Å; V206-L210 WeakPolarHBondContact O-CB 3.43Å; V206-L210 WeakPolarHBondContact O-CG 3.33Å; V206-L210 PolarHBondContact O-N 3.3Å
207V90Very high90.3Very high90 Ų9084 Ų8455%0.54544%0.437SS..Hα-helixtrans-62.1-44.9178.4172.10000111.2I203 T204 C205 L210 Y211I203-V207 HydrophobicContact CG2-CG2 4.25Å; I203-V207 WeakPolarHBondContact O-CB 3.4Å; I203-V207 VanDerWaalsContact O-CG2 3.28Å; I203-V207 WeakPolarHBondContact O-CG2 3.46Å; I203-V207 PolarHBondContact O-N 3.1Å; T204-V207 PolarHBondContact O-N 3.35Å; C205-V207 PolarHBondContact O-N 2.87Å; V207-L210 PolarHBondContact O-N 2.87Å; V207-Y211 WeakPolarHBondContact O-CB 3.39Å; V207-Y211 PolarHBondContact O-N 3.4Å
208W94.6Very high89.8Confident182 Ų18285 Ų8569%0.68945%0.446SS*.Hα-helixtrans-62.3-47.7176.7-173.4-63.6000111.9T204 C205 V206 L210 Y211 V212T204-W208 WeakPolarHBondContact O-CB 3.47Å; T204-W208 PolarHBondContact O-N 3.39Å; C205-W208 PolarHBondContact O-N 3.32Å; V206-W208 PolarHBondContact O-N 3.36Å; W208-L210 VanDerWaalsContact C-N 3.34Å; W208-L210 PolarHBondContact O-N 2.86Å; W208-Y211 WeakPolarHBondContact O-CB 3.44Å; W208-Y211 PolarHBondContact O-N 3.1Å; W208-V212 WeakPolarHBondContact O-CG2 3.35Å; W208-V212 PolarHBondContact O-N 3.14Å
209S90.2Very high89.3Confident78 Ų7882.7 Ų82.755%0.54544%0.437SS..Hα-helixtrans-61.7-41.9178.6-67.10000111.8C205 V206 L213C205-S209 WeakPolarHBondContact O-CB 3.36Å; C205-S209 PolarHBondContact O-N 3.04Å; C205-S209 PolarHBondContact O-OG 3.39Å; C205-S209 VanDerWaalsContact O-OG 3.07Å; V206-S209 PolarHBondContact O-N 2.88Å; S209-L213 VanDerWaalsContact O-CB 3.28Å; S209-L213 WeakPolarHBondContact O-CB 3.41Å; S209-L213 PolarHBondContact O-N 2.95Å
210L89Confident88.8Confident56 Ų5684.3 Ų84.329%0.29344%0.444SS..Hα-helixtrans-64-43174.9-72.2175000111.6V206 V207 W208 L213 I214 V237V206-L210 HydrophobicContact CG1-CD1 3.83Å; V206-L210 HydrophobicContact CG1-CG 4.3Å; V206-L210 WeakPolarHBondContact O-CB 3.43Å; V206-L210 WeakPolarHBondContact O-CG 3.33Å; V206-L210 PolarHBondContact O-N 3.3Å; V207-L210 PolarHBondContact O-N 2.87Å; W208-L210 VanDerWaalsContact C-N 3.34Å; W208-L210 PolarHBondContact O-N 2.86Å; L210-L213 PolarHBondContact O-N 3.45Å; L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3Å; L210-V237 HydrophobicContact CD2-CG1 3.73Å; L210-V237 HydrophobicContact CD2-CG2 4.31Å
211Y91.2Very high88.2Confident165 Ų16584.7 Ų84.765%0.64744%0.443SS*.Hα-helixtrans-56.9-51.9176.1174.4-95000111.7V207 W208 L213 I214 D215V207-Y211 WeakPolarHBondContact O-CB 3.39Å; V207-Y211 PolarHBondContact O-N 3.4Å; W208-Y211 WeakPolarHBondContact O-CB 3.44Å; W208-Y211 PolarHBondContact O-N 3.1Å; Y211-L213 VanDerWaalsContact C-N 3.26Å; Y211-L213 PolarHBondContact O-N 3.13Å; Y211-I214 PolarHBondContact O-N 3.18Å; Y211-D215 PolarHBondContact O-N 3.35Å
212V90Very high87.6Confident50 Ų5088.5 Ų88.530%0.30345%0.45SS..Hα-helixtrans-61.7-36.6178.7173.10000111.6W208 R216W208-V212 WeakPolarHBondContact O-CG2 3.35Å; W208-V212 PolarHBondContact O-N 3.14Å; V212-R216 WeakPolarHBondContact O-CG 3.44Å; V212-R216 PolarHBondContact O-N 2.84Å
213L85.9Confident87.2Confident48 Ų4893.6 Ų93.625%0.25147%0.468SS..Hα-helixtrans-73.9-39.7-179.7-175.260.6000112.6S209 L210 Y211 R216 T217 K233 V237S209-L213 VanDerWaalsContact O-CB 3.28Å; S209-L213 WeakPolarHBondContact O-CB 3.41Å; S209-L213 PolarHBondContact O-N 2.95Å; L210-L213 PolarHBondContact O-N 3.45Å; Y211-L213 VanDerWaalsContact C-N 3.26Å; Y211-L213 PolarHBondContact O-N 3.13Å; L213-R216 PolarHBondContact O-N 3.39Å; L213-T217 VanDerWaalsContact O-CB 3.28Å; L213-T217 WeakPolarHBondContact O-CB 3.11Å; L213-T217 PolarHBondContact O-N 3.17Å; L213-T217 PolarHBondContact O-OG1 3.42Å; L213-K233 HydrophobicContact CD1-CB 4.3Å; L213-K233 HydrophobicContact CD1-CD 4.21Å; L213-K233 HydrophobicContact CD1-CG 4.29Å; L213-V237 HydrophobicContact CD2-CG2 3.01Å; L213-V237 HydrophobicContact CG-CG2 4.36Å
214I86.7Confident86.7Confident112 Ų11292.2 Ų92.257%0.57448%0.475SS*.Hα-helixtrans-63.8-44.2176.8-69.6162.8000110.3L210 Y211 R216 T217 A218L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3Å; Y211-I214 PolarHBondContact O-N 3.18Å; I214-R216 PolarHBondContact O-N 3.47Å; I214-T217 PolarHBondContact O-N 3.38Å; I214-T217 VanDerWaalsContact O-N 3.16Å; I214-A218 WeakPolarHBondContact O-CB 3.5Å; I214-A218 PolarHBondContact O-N 3.07Å
215D86.3Confident85.8Confident101 Ų10193.8 Ų93.854%0.5448%0.476SS..Hα-helixtrans-56.5-48.7177-175.262.2000111.5Y211 T217 A218 E219Y211-D215 PolarHBondContact O-N 3.35Å; D215-T217 VanDerWaalsContact C-N 3.34Å; D215-T217 PolarHBondContact O-N 2.8Å; D215-A218 PolarHBondContact O-N 3.34Å; D215-E219 PolarHBondContact O-N 3.02Å
216R84.6Confident85Confident153 Ų15395.2 Ų95.258%0.57748%0.479SS*.Hα-helixtrans-63.5-38.6175.9-66.4-9217068.11.8112.7V212 L213 I214 E219 E220V212-R216 WeakPolarHBondContact O-CG 3.44Å; V212-R216 PolarHBondContact O-N 2.84Å; L213-R216 PolarHBondContact O-N 3.39Å; I214-R216 PolarHBondContact O-N 3.47Å; R216-E219 PolarHBondContact O-N 3.26Å; R216-E220 PolarHBondContact O-N 3.47Å
217T82.2Confident84.6Confident28 Ų2895.3 Ų95.317%0.17248%0.477CS..Hα-helixtrans-71.4-37.4-179-570000111.6L213 I214 D215 E219 E220 I221 F230L213-T217 VanDerWaalsContact O-CB 3.28Å; L213-T217 WeakPolarHBondContact O-CB 3.11Å; L213-T217 PolarHBondContact O-N 3.17Å; L213-T217 PolarHBondContact O-OG1 3.42Å; I214-T217 PolarHBondContact O-N 3.38Å; I214-T217 VanDerWaalsContact O-N 3.16Å; D215-T217 VanDerWaalsContact C-N 3.34Å; D215-T217 PolarHBondContact O-N 2.8Å; T217-E219 VanDerWaalsContact C-N 3.29Å; T217-E219 PolarHBondContact O-N 2.9Å; T217-E220 PolarHBondContact O-N 3.24Å; T217-I221 HydrophobicContact CG2-CD1 4.02Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.39Å; T217-I221 PolarHBondContact O-N 2.83Å; T217-F230 HydrophobicContact CG2-CD2 3.98Å; T217-F230 HydrophobicContact CG2-CE2 3.46Å; T217-F230 VanDerWaalsContact CG2-CE2 3.46Å
218A83.2Confident84.2Confident57 Ų57101.4 Ų101.447%0.47149%0.49SS..Hα-helixtrans-63.1-37.2175.600000111.6I214 D215 R222I214-A218 WeakPolarHBondContact O-CB 3.5Å; I214-A218 PolarHBondContact O-N 3.07Å; D215-A218 PolarHBondContact O-N 3.34Å; A218-R222 PolarHBondContact O-N 3.5Å; A218-R222 VanDerWaalsContact O-N 3.15Å
219E82.4Confident83.6Confident71 Ų7196.1 Ų96.133%0.33248%0.479SS..Hα-helixtrans-64.7-47.5173.9-169.159.5-129.500112D215 R216 T217 I221 R222 E223D215-E219 PolarHBondContact O-N 3.02Å; R216-E219 PolarHBondContact O-N 3.26Å; T217-E219 VanDerWaalsContact C-N 3.29Å; T217-E219 PolarHBondContact O-N 2.9Å; E219-I221 VanDerWaalsContact C-N 3.35Å; E219-I221 PolarHBondContact O-N 3.5Å; E219-R222 WeakPolarHBondContact O-CA 3.45Å; E219-R222 VanDerWaalsContact O-CB 3.3Å; E219-R222 WeakPolarHBondContact O-CB 3.29Å; E219-R222 PolarHBondContact O-N 3.49Å; E219-R222 IonicContact OE1-CZ 3.01Å; E219-R222 IonicContact OE1-NE 3.94Å; E219-R222 PolarHBondContact OE1-NE 2.88Å; E219-R222 IonicContact OE1-NH2 3.16Å; E219-R222 PolarHBondContact OE1-NH2 3.07Å; E219-R222 IonicContact OE2-CZ 3.95Å; E219-R222 IonicContact OE2-NE 2.6Å; E219-R222 IonicContact OE2-NH1 2.66Å; E219-R222 IonicContact OE2-NH2 3.21Å; E219-R222 PolarHBondContact OE2-NH2 2.86Å; E219-E223 PolarHBondContact O-N 3.27Å
220E81.5Confident83.4Confident45 Ų4593.8 Ų93.821%0.2146%0.459CS..Hα-helixtrans-64.4-37-179.8-72.9167.8-160.300113.1R216 T217 R222 E223 G224 H225 K233R216-E220 PolarHBondContact O-N 3.47Å; T217-E220 PolarHBondContact O-N 3.24Å; E220-R222 VanDerWaalsContact C-N 3.29Å; E220-R222 PolarHBondContact O-N 2.89Å; E220-E223 PolarHBondContact O-N 2.9Å; E220-G224 PolarHBondContact O-N 3.42Å; E220-G224 VanDerWaalsContact O-N 3.09Å; E220-H225 PolarHBondContact O-N 3.32Å; E220-K233 IonicContact OE1-NZ 3.64Å; E220-K233 PolarHBondContact OE1-NZ 3.22Å; E220-K233 IonicContact OE2-NZ 2.56Å; E220-K233 PolarHBondContact OE2-NZ 3.44Å
221I80.1Confident83.2Confident94 Ų9497.5 Ų97.548%0.48247%0.47SS..Hα-helixtrans-63.9-38.8173.2-68.2167.3000110.2T217 E219 E223 G224 F230T217-I221 HydrophobicContact CG2-CD1 4.02Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.39Å; T217-I221 PolarHBondContact O-N 2.83Å; E219-I221 VanDerWaalsContact C-N 3.35Å; E219-I221 PolarHBondContact O-N 3.5Å; I221-E223 VanDerWaalsContact C-N 3.31Å; I221-E223 PolarHBondContact O-N 3.37Å; I221-G224 PolarHBondContact O-N 2.95Å; I221-F230 HydrophobicContact CD1-CE2 4.17Å; I221-F230 HydrophobicContact CG1-CE2 4.14Å
222R82.5Confident83.1Confident189 Ų18993.3 Ų93.371%0.71346%0.461SS*.Hα-helixtrans-65.2-35.8176.2-173.4174.371.11785.7112A218 E219 E220 G224A218-R222 PolarHBondContact O-N 3.5Å; A218-R222 VanDerWaalsContact O-N 3.15Å; E219-R222 WeakPolarHBondContact O-CA 3.45Å; E219-R222 VanDerWaalsContact O-CB 3.3Å; E219-R222 WeakPolarHBondContact O-CB 3.29Å; E219-R222 PolarHBondContact O-N 3.49Å; E219-R222 IonicContact OE1-CZ 3.01Å; E219-R222 IonicContact OE1-NE 3.94Å; E219-R222 PolarHBondContact OE1-NE 2.88Å; E219-R222 IonicContact OE1-NH2 3.16Å; E219-R222 PolarHBondContact OE1-NH2 3.07Å; E219-R222 IonicContact OE2-CZ 3.95Å; E219-R222 IonicContact OE2-NE 2.6Å; E219-R222 IonicContact OE2-NH1 2.66Å; E219-R222 IonicContact OE2-NH2 3.21Å; E219-R222 PolarHBondContact OE2-NH2 2.86Å; E220-R222 VanDerWaalsContact C-N 3.29Å; E220-R222 PolarHBondContact O-N 2.89Å; R222-G224 VanDerWaalsContact C-N 3.27Å; R222-G224 PolarHBondContact O-N 3.39Å
223E83.4Confident83Confident139 Ų13993.8 Ų93.865%0.6546%0.459SS*.Hα-helixtrans-76.4-11.9175.2-67.1-176.8166.800113.4E219 E220 I221 H225E219-E223 PolarHBondContact O-N 3.27Å; E220-E223 PolarHBondContact O-N 2.9Å; I221-E223 VanDerWaalsContact C-N 3.31Å; I221-E223 PolarHBondContact O-N 3.37Å; E223-H225 VanDerWaalsContact C-N 3.34Å; E223-H225 PolarHBondContact O-N 2.87Å
224G79.6Confident83Confident55 Ų5595.6 Ų95.657%0.56747%0.469SS*.THydrogen-bonded Turntrans7812.1175.700000115E220 I221 R222 L226E220-G224 PolarHBondContact O-N 3.42Å; E220-G224 VanDerWaalsContact O-N 3.09Å; I221-G224 PolarHBondContact O-N 2.95Å; R222-G224 VanDerWaalsContact C-N 3.27Å; R222-G224 PolarHBondContact O-N 3.39Å; G224-L226 PolarHBondContact O-N 3.19Å
225H76Confident83.3Confident112 Ų11294.7 Ų94.752%0.51946%0.464SS..  trans-96.173.2-175.1-162.961.1000111.7E220 E223 D227E220-H225 PolarHBondContact O-N 3.32Å; E223-H225 VanDerWaalsContact C-N 3.34Å; E223-H225 PolarHBondContact O-N 2.87Å; H225-D227 IonicContact CE1-OD1 3.56Å; H225-D227 IonicContact CE1-OD2 2.83Å; H225-D227 PolarHBondContact CE1-OD2 2.87Å; H225-D227 IonicContact ND1-OD1 3.63Å; H225-D227 IonicContact ND1-OD2 3.7Å; H225-D227 IonicContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact NE2-OD2 3.37Å; H225-D227 VanDerWaalsContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact O-N 3.42Å
226L75.7Confident83.5Confident99 Ų9994.8 Ų94.852%0.51847%0.468SS..  trans-79.953.8176.7-73.489.4000112.6G224G224-L226 PolarHBondContact O-N 3.19Å
227D81.2Confident83.7Confident77 Ų7789.9 Ų89.941%0.41246%0.455SS..  trans-80.5173.3-178.5-84.316.3000112.6H225 P229 F230H225-D227 IonicContact CE1-OD1 3.56Å; H225-D227 IonicContact CE1-OD2 2.83Å; H225-D227 PolarHBondContact CE1-OD2 2.87Å; H225-D227 IonicContact ND1-OD1 3.63Å; H225-D227 IonicContact ND1-OD2 3.7Å; H225-D227 IonicContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact NE2-OD2 3.37Å; H225-D227 VanDerWaalsContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact O-N 3.42Å; D227-P229 WeakPolarHBondContact O-CD 3.19Å; D227-F230 VanDerWaalsContact O-CB 3.32Å; D227-F230 WeakPolarHBondContact O-CB 3.44Å; D227-F230 PolarHBondContact O-N 3.27Å
228W82Confident84.1Confident219 Ų21990.8 Ų90.883%0.8347%0.465SS*.Hα-helixtrans-43.5-37.3173.6-7399.4000115.5F230 W231 T232W228-F230 VanDerWaalsContact C-N 3.26Å; W228-F230 PolarHBondContact O-N 2.93Å; W228-W231 PolarHBondContact O-N 2.84Å; W228-T232 PolarHBondContact O-N 3.46Å; W228-T232 VanDerWaalsContact O-N 3.16Å
229P82.8Confident84.6Confident70 Ų7093.6 Ų93.646%0.45547%0.471SS..Hα-helixtrans-61.9-27175.5-24.336.5000114.8D227 T232 K233D227-P229 WeakPolarHBondContact O-CD 3.19Å; P229-T232 WeakPolarHBondContact CA-OG1 3.41Å; P229-T232 PolarHBondContact O-OG1 3.46Å; P229-K233 VanDerWaalsContact O-CG 3.32Å; P229-K233 WeakPolarHBondContact O-CG 3.13Å; P229-K233 PolarHBondContact O-N 2.94Å
230F84.5Confident84.9Confident29 Ų2992.5 Ų92.513%0.12748%0.478CS..Hα-helixtrans-68.7-47.4174.8169.6-94.6000110.8T217 I221 D227 W228 T232 K233 L234T217-F230 HydrophobicContact CG2-CD2 3.98Å; T217-F230 HydrophobicContact CG2-CE2 3.46Å; T217-F230 VanDerWaalsContact CG2-CE2 3.46Å; I221-F230 HydrophobicContact CD1-CE2 4.17Å; I221-F230 HydrophobicContact CG1-CE2 4.14Å; D227-F230 VanDerWaalsContact O-CB 3.32Å; D227-F230 WeakPolarHBondContact O-CB 3.44Å; D227-F230 PolarHBondContact O-N 3.27Å; W228-F230 VanDerWaalsContact C-N 3.26Å; W228-F230 PolarHBondContact O-N 2.93Å; F230-T232 VanDerWaalsContact C-N 3.34Å; F230-T232 PolarHBondContact O-N 2.71Å; F230-K233 WeakPolarHBondContact O-CB 3.36Å; F230-K233 PolarHBondContact O-N 3.18Å; F230-L234 PolarHBondContact O-N 3.5Å; F230-L234 VanDerWaalsContact O-N 3.14Å
231W86.2Confident85.4Confident135 Ų13596 Ų9651%0.51149%0.493SS..Hα-helixtrans-63.6-37.8179.7-71.6102.8000112.7W228 L234 I235W228-W231 PolarHBondContact O-N 2.84Å; W231-L234 PolarHBondContact O-N 2.95Å; W231-I235 VanDerWaalsContact O-CG1 3.3Å; W231-I235 WeakPolarHBondContact O-CG1 3.48Å; W231-I235 PolarHBondContact O-N 3.34Å
232T88.6Confident86Confident77 Ų7794.7 Ų94.747%0.47249%0.493SS..Hα-helixtrans-65.4-39.1176.757.90000112.1W228 P229 F230 I235 V236W228-T232 PolarHBondContact O-N 3.46Å; W228-T232 VanDerWaalsContact O-N 3.16Å; P229-T232 WeakPolarHBondContact CA-OG1 3.41Å; P229-T232 PolarHBondContact O-OG1 3.46Å; F230-T232 VanDerWaalsContact C-N 3.34Å; F230-T232 PolarHBondContact O-N 2.71Å; T232-I235 PolarHBondContact O-N 2.84Å; T232-V236 VanDerWaalsContact O-CG2 3.28Å; T232-V236 WeakPolarHBondContact O-CG2 3.22Å; T232-V236 PolarHBondContact O-N 3.03Å
233K86.9Confident86.4Confident60 Ų6087.8 Ų87.826%0.26148%0.48SS..Hα-helixtrans-59.7-45.9173-69.9167.2-166.5166.90111.5L213 E220 P229 F230 I235 V236 V237L213-K233 HydrophobicContact CD1-CB 4.3Å; L213-K233 HydrophobicContact CD1-CD 4.21Å; L213-K233 HydrophobicContact CD1-CG 4.29Å; E220-K233 IonicContact OE1-NZ 3.64Å; E220-K233 PolarHBondContact OE1-NZ 3.22Å; E220-K233 IonicContact OE2-NZ 2.56Å; E220-K233 PolarHBondContact OE2-NZ 3.44Å; P229-K233 VanDerWaalsContact O-CG 3.32Å; P229-K233 WeakPolarHBondContact O-CG 3.13Å; P229-K233 PolarHBondContact O-N 2.94Å; F230-K233 WeakPolarHBondContact O-CB 3.36Å; F230-K233 PolarHBondContact O-N 3.18Å; K233-I235 PolarHBondContact O-N 3.13Å; K233-V236 PolarHBondContact O-N 3.41Å; K233-V237 WeakPolarHBondContact O-CG2 3.31Å; K233-V237 PolarHBondContact O-N 3.25Å
234L87.6Confident86.8Confident86 Ų8683 Ų8345%0.4547%0.468SS..Hα-helixtrans-62.8-42.3178.7-171.2147.8000111.8F230 W231 V237 A238F230-L234 PolarHBondContact O-N 3.5Å; F230-L234 VanDerWaalsContact O-N 3.14Å; W231-L234 PolarHBondContact O-N 2.95Å; L234-V237 PolarHBondContact O-N 3.46Å; L234-A238 WeakPolarHBondContact O-CB 3.19Å; L234-A238 PolarHBondContact O-N 2.92Å
235I91.8Very high87.4Confident93 Ų9384.8 Ų84.848%0.47746%0.464SS..Hα-helixtrans-62.7-45.2176.3-70166.8000111.1W231 T232 K233 V237 A238 I239W231-I235 VanDerWaalsContact O-CG1 3.3Å; W231-I235 WeakPolarHBondContact O-CG1 3.48Å; W231-I235 PolarHBondContact O-N 3.34Å; T232-I235 PolarHBondContact O-N 2.84Å; K233-I235 PolarHBondContact O-N 3.13Å; I235-V237 VanDerWaalsContact C-N 3.29Å; I235-V237 PolarHBondContact O-N 3.01Å; I235-A238 PolarHBondContact O-N 2.68Å; I235-I239 HydrophobicContact CG2-CD1 3.85Å; I235-I239 HydrophobicContact CG2-CG1 4.47Å; I235-I239 WeakPolarHBondContact O-CG1 3.47Å; I235-I239 PolarHBondContact O-N 3.15Å
236V90.1Very high88.2Confident103 Ų10384 Ų8462%0.62447%0.467SS*.Hα-helixtrans-60.6-40.1178.2170.50000111.2T232 K233 G240T232-V236 VanDerWaalsContact O-CG2 3.28Å; T232-V236 WeakPolarHBondContact O-CG2 3.22Å; T232-V236 PolarHBondContact O-N 3.03Å; K233-V236 PolarHBondContact O-N 3.41Å; V236-G240 PolarHBondContact O-N 3.48Å
237V89.8Confident88.9Confident49 Ų4982.7 Ų82.730%0.29746%0.457SS..Hα-helixtrans-63.3-47.2174172.10000111.8L210 L213 K233 L234 I235 I239 G240 F241L210-V237 HydrophobicContact CD2-CG1 3.73Å; L210-V237 HydrophobicContact CD2-CG2 4.31Å; L213-V237 HydrophobicContact CD2-CG2 3.01Å; L213-V237 HydrophobicContact CG-CG2 4.36Å; K233-V237 WeakPolarHBondContact O-CG2 3.31Å; K233-V237 PolarHBondContact O-N 3.25Å; L234-V237 PolarHBondContact O-N 3.46Å; I235-V237 VanDerWaalsContact C-N 3.29Å; I235-V237 PolarHBondContact O-N 3.01Å; V237-I239 VanDerWaalsContact C-N 3.32Å; V237-I239 PolarHBondContact O-N 3.23Å; V237-G240 PolarHBondContact O-N 3.21Å; V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.5Å
238A90.3Very high89.4Confident47 Ų4782.2 Ų82.239%0.38845%0.453SS..Hα-helixtrans-60.6-41.8-17900000111.7L234 I235 S242L234-A238 WeakPolarHBondContact O-CB 3.19Å; L234-A238 PolarHBondContact O-N 2.92Å; I235-A238 PolarHBondContact O-N 2.68Å; A238-S242 VanDerWaalsContact O-CB 3.3Å; A238-S242 WeakPolarHBondContact O-CB 3.45Å; A238-S242 PolarHBondContact O-N 3.05Å; A238-S242 PolarHBondContact O-OG 3.46Å
239I93Very high90Very high117 Ų11779.6 Ų79.660%0.644%0.444SS*.Hα-helixtrans-65.3-46.9175.5-66.7170.1000110.8I235 V237 F241 S242 G243I235-I239 HydrophobicContact CG2-CD1 3.85Å; I235-I239 HydrophobicContact CG2-CG1 4.47Å; I235-I239 WeakPolarHBondContact O-CG1 3.47Å; I235-I239 PolarHBondContact O-N 3.15Å; V237-I239 VanDerWaalsContact C-N 3.32Å; V237-I239 PolarHBondContact O-N 3.23Å; I239-F241 PolarHBondContact O-N 3.05Å; I239-S242 PolarHBondContact O-N 3.46Å; I239-G243 PolarHBondContact O-N 3.27Å
240G90.3Very high90.4Very high47 Ų4779.3 Ų79.349%0.48544%0.441SS..Hα-helixtrans-60.6-43.2178.300000112.8V236 V237 G244V236-G240 PolarHBondContact O-N 3.48Å; V237-G240 PolarHBondContact O-N 3.21Å; G240-G244 PolarHBondContact O-N 2.82Å
241F90.5Very high90.6Very high119 Ų11979.6 Ų79.652%0.52244%0.443SS..Hα-helixtrans-65.1-46.4176.3-176-105000111.8V237 I239 G243 G244 L245V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.5Å; I239-F241 PolarHBondContact O-N 3.05Å; F241-G243 PolarHBondContact O-N 3.4Å; F241-G244 PolarHBondContact O-N 3.35Å; F241-L245 HydrophobicContact CD1-CD1 3.82Å; F241-L245 HydrophobicContact CD1-CG 4.21Å; F241-L245 HydrophobicContact CE1-CD1 3.29Å; F241-L245 HydrophobicContact CE1-CD2 4.43Å; F241-L245 HydrophobicContact CE1-CG 3.88Å; F241-L245 HydrophobicContact CE2-CD2 4.42Å; F241-L245 HydrophobicContact CE2-CG 4.4Å; F241-L245 HydrophobicContact CZ-CD1 3.75Å; F241-L245 HydrophobicContact CZ-CD2 4.05Å; F241-L245 HydrophobicContact CZ-CG 3.97Å; F241-L245 WeakPolarHBondContact O-CG 3.36Å; F241-L245 PolarHBondContact O-N 3.03Å
242S92.7Very high90.9Very high67 Ų6775.9 Ų75.947%0.46944%0.437SS..Hα-helixtrans-59.8-46.2178-58.70000111.7A238 I239 L245 V246A238-S242 VanDerWaalsContact O-CB 3.3Å; A238-S242 WeakPolarHBondContact O-CB 3.45Å; A238-S242 PolarHBondContact O-N 3.05Å; A238-S242 PolarHBondContact O-OG 3.46Å; I239-S242 PolarHBondContact O-N 3.46Å; S242-L245 PolarHBondContact O-N 2.64Å; S242-V246 WeakPolarHBondContact O-CG2 3.34Å; S242-V246 PolarHBondContact O-N 3.16Å; S242-V246 VanDerWaalsContact O-N 3.1Å
243G91.4Very high91.1Very high43 Ų4377.7 Ų77.744%0.44344%0.438SS..Hα-helixtrans-62-42.4174.900000112.8I239 F241 V246 F247I239-G243 PolarHBondContact O-N 3.27Å; F241-G243 PolarHBondContact O-N 3.4Å; G243-V246 PolarHBondContact O-N 2.91Å; G243-F247 WeakPolarHBondContact O-CB 3.27Å; G243-F247 PolarHBondContact O-N 3.43Å
244G91.2Very high91.2Very high39 Ų3976.3 Ų76.340%0.40243%0.433SS..Hα-helixtrans-61.7-40.9175.300000113.4G240 F241 F247 M248G240-G244 PolarHBondContact O-N 2.82Å; F241-G244 PolarHBondContact O-N 3.35Å; G244-F247 PolarHBondContact O-N 3.44Å; G244-M248 VanDerWaalsContact O-CB 3.3Å; G244-M248 WeakPolarHBondContact O-CB 3.29Å; G244-M248 PolarHBondContact O-N 3.35Å
245L92.4Very high91.5Very high92 Ų9275.6 Ų75.648%0.48243%0.425SS..Hα-helixtrans-65.2-44176.1-75.5-176.2000112.5F241 S242 F247 M248 Y249F241-L245 HydrophobicContact CD1-CD1 3.82Å; F241-L245 HydrophobicContact CD1-CG 4.21Å; F241-L245 HydrophobicContact CE1-CD1 3.29Å; F241-L245 HydrophobicContact CE1-CD2 4.43Å; F241-L245 HydrophobicContact CE1-CG 3.88Å; F241-L245 HydrophobicContact CE2-CD2 4.42Å; F241-L245 HydrophobicContact CE2-CG 4.4Å; F241-L245 HydrophobicContact CZ-CD1 3.75Å; F241-L245 HydrophobicContact CZ-CD2 4.05Å; F241-L245 HydrophobicContact CZ-CG 3.97Å; F241-L245 WeakPolarHBondContact O-CG 3.36Å; F241-L245 PolarHBondContact O-N 3.03Å; S242-L245 PolarHBondContact O-N 2.64Å; L245-F247 VanDerWaalsContact C-N 3.35Å; L245-M248 PolarHBondContact O-N 3.45Å; L245-Y249 WeakPolarHBondContact O-CB 3.34Å; L245-Y249 PolarHBondContact O-N 3.02Å
246V93.2Very high91.5Very high97 Ų9774.4 Ų74.459%0.58842%0.422SS*.Hα-helixtrans-62.3-44.8176.5173.40000110.5S242 G243 Y249 V250S242-V246 WeakPolarHBondContact O-CG2 3.34Å; S242-V246 PolarHBondContact O-N 3.16Å; S242-V246 VanDerWaalsContact O-N 3.1Å; G243-V246 PolarHBondContact O-N 2.91Å; V246-Y249 PolarHBondContact O-N 2.66Å; V246-V250 WeakPolarHBondContact O-CG2 3.47Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-V250 VanDerWaalsContact O-N 3.14Å
247F91Very high91.6Very high70 Ų7072.8 Ų72.831%0.30741%0.408SS..Hα-helixtrans-61-47.4175.9-177.6-103000111.7F198 H199 G243 G244 L245 Y249 V250 Q251F198-F247 HydrophobicContact CD1-CE1 4.11Å; F198-F247 AromaticContact CD1-CZ 3.91Å; F198-F247 HydrophobicContact CD1-CZ 3.91Å; F198-F247 AromaticContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE2 4.42Å; F198-F247 AromaticContact CE1-CZ 3.47Å; F198-F247 HydrophobicContact CE1-CZ 3.47Å; F198-F247 VanDerWaalsContact CE1-CZ 3.47Å; H199-F247 AromaticContact CD2-CE1 3.74Å; H199-F247 AromaticContact CE1-CE1 3.7Å; H199-F247 AromaticContact CE1-CZ 3.95Å; H199-F247 AromaticContact NE2-CD1 3.87Å; H199-F247 AromaticContact NE2-CE1 3.19Å; H199-F247 WeakPolarHBondContact NE2-CE1 3.42Å; H199-F247 AromaticContact NE2-CZ 3.84Å; G243-F247 WeakPolarHBondContact O-CB 3.27Å; G243-F247 PolarHBondContact O-N 3.43Å; G244-F247 PolarHBondContact O-N 3.44Å; L245-F247 VanDerWaalsContact C-N 3.35Å; F247-Y249 VanDerWaalsContact C-N 3.32Å; F247-Y249 PolarHBondContact O-N 2.6Å; F247-V250 PolarHBondContact O-N 3.5Å; F247-Q251 HydrophobicContact CD1-CG 4.34Å; F247-Q251 HydrophobicContact CE1-CG 4.07Å; F247-Q251 HydrophobicContact CE2-CG 4.25Å; F247-Q251 HydrophobicContact CZ-CG 4.01Å; F247-Q251 VanDerWaalsContact CZ-NE2 3.26Å; F247-Q251 WeakPolarHBondContact O-CB 3.32Å; F247-Q251 WeakPolarHBondContact O-CG 3.3Å; F247-Q251 PolarHBondContact O-N 3.41Å; F247-Q251 VanDerWaalsContact O-N 3.13Å
248M92Very high91.6Very high67 Ų6772.3 Ų72.333%0.3340%0.403SS..Hα-helixtrans-58.4-43.1176.2-17759.469.400111.6I203 G244 L245 Q251 C252I203-M248 HydrophobicContact CD1-CE 3.88Å; I203-M248 HydrophobicContact CG1-CE 4.29Å; G244-M248 VanDerWaalsContact O-CB 3.3Å; G244-M248 WeakPolarHBondContact O-CB 3.29Å; G244-M248 PolarHBondContact O-N 3.35Å; L245-M248 PolarHBondContact O-N 3.45Å; M248-Q251 PolarHBondContact O-N 2.9Å; M248-C252 WeakPolarHBondContact O-CB 3.39Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.96Å
249Y92.9Very high91.7Very high164 Ų16474.9 Ų74.964%0.64341%0.406SS*.Hα-helixtrans-60.1-48.1178.6170.5-102.6000112.8L245 V246 F247 Q251 C252 K253L245-Y249 WeakPolarHBondContact O-CB 3.34Å; L245-Y249 PolarHBondContact O-N 3.02Å; V246-Y249 PolarHBondContact O-N 2.66Å; F247-Y249 VanDerWaalsContact C-N 3.32Å; F247-Y249 PolarHBondContact O-N 2.6Å; Y249-Q251 PolarHBondContact O-N 3.05Å; Y249-C252 PolarHBondContact O-N 3.29Å; Y249-K253 PolarHBondContact O-N 2.99Å
250V91.3Very high91.7Very high64 Ų6477.4 Ų77.439%0.38841%0.408SS..Hα-helixtrans-59-39.6177.6173.90000110.5V246 F247 K253 M254V246-V250 WeakPolarHBondContact O-CG2 3.47Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-V250 VanDerWaalsContact O-N 3.14Å; F247-V250 PolarHBondContact O-N 3.5Å; V250-K253 WeakPolarHBondContact O-CB 3.28Å; V250-K253 PolarHBondContact O-N 3.35Å; V250-M254 PolarHBondContact O-N 3.04Å
251Q89.5Confident91.7Very high35 Ų3579.5 Ų79.516%0.16440%0.401CS..Hα-helixtrans-77-37.5-177.4-62.1-79.814.700111.7H199 F247 M248 Y249 K253 M254 Y255H199-Q251 VanDerWaalsContact CE1-CG 3.48Å; H199-Q251 WeakPolarHBondContact CE1-CG 3.3Å; H199-Q251 VanDerWaalsContact NE2-CB 3.26Å; H199-Q251 WeakPolarHBondContact NE2-CB 3.17Å; H199-Q251 WeakPolarHBondContact NE2-CG 3.46Å; F247-Q251 HydrophobicContact CD1-CG 4.34Å; F247-Q251 HydrophobicContact CE1-CG 4.07Å; F247-Q251 HydrophobicContact CE2-CG 4.25Å; F247-Q251 HydrophobicContact CZ-CG 4.01Å; F247-Q251 VanDerWaalsContact CZ-NE2 3.26Å; F247-Q251 WeakPolarHBondContact O-CB 3.32Å; F247-Q251 WeakPolarHBondContact O-CG 3.3Å; F247-Q251 PolarHBondContact O-N 3.41Å; F247-Q251 VanDerWaalsContact O-N 3.13Å; M248-Q251 PolarHBondContact O-N 2.9Å; Y249-Q251 PolarHBondContact O-N 3.05Å; Q251-K253 VanDerWaalsContact C-N 3.27Å; Q251-K253 PolarHBondContact O-N 3.31Å; Q251-M254 WeakPolarHBondContact O-CB 3.36Å; Q251-M254 PolarHBondContact O-N 3.25Å; Q251-M254 VanDerWaalsContact O-N 3.09Å; Q251-Y255 HydrophobicContact CB-CE2 4.27Å; Q251-Y255 WeakPolarHBondContact O-CD2 2.89Å; Q251-Y255 PolarHBondContact O-N 3.14Å
252C92.5Very high91.8Very high57 Ų5778.3 Ų78.339%0.38539%0.393SS..Hα-helixtrans-55.8-42.2168.7-75.20000111.4M248 Y249 M254 Y255 V256M248-C252 WeakPolarHBondContact O-CB 3.39Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.96Å; Y249-C252 PolarHBondContact O-N 3.29Å; C252-M254 VanDerWaalsContact C-N 3.33Å; C252-M254 PolarHBondContact O-N 3.36Å; C252-Y255 PolarHBondContact O-N 2.96Å; C252-V256 WeakPolarHBondContact O-CB 3.35Å; C252-V256 VanDerWaalsContact O-CG2 3.28Å; C252-V256 WeakPolarHBondContact O-CG2 3.19Å; C252-V256 PolarHBondContact O-N 3.39Å
253K92.5Very high91.7Very high115 Ų11579.8 Ų79.850%0.539%0.391SS..Hα-helixtrans-58.9-45174.9-174.2-176.2175.5-176.20111.5Y249 V250 Q251 V256 Q257Y249-K253 PolarHBondContact O-N 2.99Å; V250-K253 WeakPolarHBondContact O-CB 3.28Å; V250-K253 PolarHBondContact O-N 3.35Å; Q251-K253 VanDerWaalsContact C-N 3.27Å; Q251-K253 PolarHBondContact O-N 3.31Å; K253-V256 PolarHBondContact O-N 3Å; K253-Q257 WeakPolarHBondContact O-CG 3.49Å; K253-Q257 PolarHBondContact O-N 3.18Å
254M90.4Very high91.7Very high31 Ų3180.3 Ų80.315%0.15339%0.391CS..Hα-helixtrans-59.5-47.1175.1-66.8-71.1101.400111.8V50 M53 V250 Q251 C252 V256 Q257 L258V50-M254 HydrophobicContact CG1-CE 4.46Å; M53-M254 HydrophobicContact CE-SD 3.83Å; V250-M254 PolarHBondContact O-N 3.04Å; Q251-M254 WeakPolarHBondContact O-CB 3.36Å; Q251-M254 PolarHBondContact O-N 3.25Å; Q251-M254 VanDerWaalsContact O-N 3.09Å; C252-M254 VanDerWaalsContact C-N 3.33Å; C252-M254 PolarHBondContact O-N 3.36Å; M254-V256 PolarHBondContact O-N 2.98Å; M254-Q257 PolarHBondContact O-N 3.01Å; M254-L258 WeakPolarHBondContact O-CG 3.28Å; M254-L258 PolarHBondContact O-N 3.33Å
255Y91.9Very high91.6Very high71 Ų7183.4 Ų83.428%0.27839%0.391SS..Hα-helixtrans-65.2-38178.6-66.5-55000113.2S195 V196 Q251 C252 Q257 L258 F259S195-Y255 PolarHBondContact OG-OH 3.2Å; V196-Y255 HydrophobicContact CG2-CE1 3.85Å; V196-Y255 WeakPolarHBondContact CG2-OH 3.35Å; Q251-Y255 HydrophobicContact CB-CE2 4.27Å; Q251-Y255 WeakPolarHBondContact O-CD2 2.89Å; Q251-Y255 PolarHBondContact O-N 3.14Å; C252-Y255 PolarHBondContact O-N 2.96Å; Y255-Q257 VanDerWaalsContact C-N 3.34Å; Y255-Q257 PolarHBondContact O-N 3.5Å; Y255-L258 HydrophobicContact CD1-CD1 4.29Å; Y255-L258 PolarHBondContact O-N 2.98Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.5Å
256V93Very high91.5Very high69 Ų6979 Ų7942%0.41837%0.368SS..Hα-helixtrans-63.5-40.3175.3168.80000111C252 K253 M254 F259 R260C252-V256 WeakPolarHBondContact O-CB 3.35Å; C252-V256 VanDerWaalsContact O-CG2 3.28Å; C252-V256 WeakPolarHBondContact O-CG2 3.19Å; C252-V256 PolarHBondContact O-N 3.39Å; K253-V256 PolarHBondContact O-N 3Å; M254-V256 PolarHBondContact O-N 2.98Å; V256-F259 PolarHBondContact O-N 3.09Å; V256-R260 HydrophobicContact CG1-CG 4.45Å; V256-R260 WeakPolarHBondContact O-CB 3.39Å; V256-R260 VanDerWaalsContact O-CG 3.26Å; V256-R260 WeakPolarHBondContact O-CG 3.28Å; V256-R260 PolarHBondContact O-N 3.39Å
257Q91.4Very high91.5Very high68 Ų6879.7 Ų79.732%0.31836%0.363SS..Hα-helixtrans-62.5-45.4174.6-74174.9-32.100111.7K253 M254 Y255 F259 R260 R261K253-Q257 WeakPolarHBondContact O-CG 3.49Å; K253-Q257 PolarHBondContact O-N 3.18Å; M254-Q257 PolarHBondContact O-N 3.01Å; Y255-Q257 VanDerWaalsContact C-N 3.34Å; Y255-Q257 PolarHBondContact O-N 3.5Å; Q257-F259 VanDerWaalsContact C-N 3.32Å; Q257-F259 PolarHBondContact O-N 3.28Å; Q257-R260 WeakPolarHBondContact O-CB 3.32Å; Q257-R260 PolarHBondContact O-N 2.7Å; Q257-R261 PolarHBondContact O-N 3.22Å
258L91Very high91.4Very high40 Ų4077.7 Ų77.721%0.20936%0.357CS..Hα-helixtrans-59.3-43.2175-70.2170.9000111.9I192 M254 Y255 R261 W262I192-L258 HydrophobicContact CD1-CD1 3.73Å; I192-L258 HydrophobicContact CD1-CD2 3.92Å; I192-L258 HydrophobicContact CD1-CG 4.49Å; I192-L258 HydrophobicContact CG1-CD1 3.83Å; M254-L258 WeakPolarHBondContact O-CG 3.28Å; M254-L258 PolarHBondContact O-N 3.33Å; Y255-L258 HydrophobicContact CD1-CD1 4.29Å; Y255-L258 PolarHBondContact O-N 2.98Å; L258-R261 PolarHBondContact O-N 3.48Å; L258-W262 WeakPolarHBondContact O-CB 3.47Å; L258-W262 PolarHBondContact O-N 3.45Å
259F91.9Very high91.4Very high100 Ų10077.2 Ų77.244%0.43936%0.355SS..Hα-helixtrans-64.6-40.3176.4-177.6-102.7000112.2W179 Y255 V256 Q257 W262 K263W179-F259 HydrophobicContact CH2-CE2 4.26Å; W179-F259 HydrophobicContact CH2-CZ 4.19Å; W179-F259 HydrophobicContact CZ3-CE2 4.05Å; W179-F259 HydrophobicContact CZ3-CZ 4.44Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.5Å; V256-F259 PolarHBondContact O-N 3.09Å; Q257-F259 VanDerWaalsContact C-N 3.32Å; Q257-F259 PolarHBondContact O-N 3.28Å; F259-W262 HydrophobicContact CD2-CE3 4.17Å; F259-W262 HydrophobicContact CE2-CE3 4.45Å; F259-W262 PolarHBondContact O-N 2.98Å; F259-K263 WeakPolarHBondContact O-CB 3.3Å; F259-K263 PolarHBondContact O-N 3.16Å
260R92.9Very high91.5Very high171 Ų17174.3 Ų74.365%0.64534%0.344SS*.Hα-helixtrans-61.7-44174.8-74172.5-178.4-1781.4111.5V256 Q257 W262 K263 A264V256-R260 HydrophobicContact CG1-CG 4.45Å; V256-R260 WeakPolarHBondContact O-CB 3.39Å; V256-R260 VanDerWaalsContact O-CG 3.26Å; V256-R260 WeakPolarHBondContact O-CG 3.28Å; V256-R260 PolarHBondContact O-N 3.39Å; Q257-R260 WeakPolarHBondContact O-CB 3.32Å; Q257-R260 PolarHBondContact O-N 2.7Å; R260-W262 VanDerWaalsContact C-N 3.35Å; R260-K263 PolarHBondContact O-N 3.28Å; R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 3.32Å
261R90.8Very high91.6Very high91 Ų9171.6 Ų71.634%0.34333%0.327SS..Hα-helixtrans-61.1-43.5174.3-174.2177.3176.7-167.6-1.5111.3L182 E188 Q257 L258 A264 Y265L182-R261 HydrophobicContact CD1-CG 4.42Å; L182-R261 HydrophobicContact CD2-CB 4.4Å; L182-R261 HydrophobicContact CD2-CG 3.96Å; E188-R261 VanDerWaalsContact CD-NH1 3.33Å; E188-R261 IonicContact OE1-NH1 2.7Å; E188-R261 PolarHBondContact OE1-NH1 3.03Å; E188-R261 IonicContact OE2-CZ 2.77Å; E188-R261 IonicContact OE2-NH1 2.85Å; E188-R261 PolarHBondContact OE2-NH1 2.93Å; Q257-R261 PolarHBondContact O-N 3.22Å; L258-R261 PolarHBondContact O-N 3.48Å; R261-A264 PolarHBondContact O-N 3.37Å; R261-Y265 PolarHBondContact O-N 2.56Å
262W91.3Very high91.8Very high94 Ų9471.4 Ų71.436%0.35633%0.334SS..Hα-helixtrans-67.1-39.9178.4-171.427.7000113W179 E180 L182 L258 F259 R260 A264 Y265 N266W179-W262 HydrophobicContact CB-CZ2 4.45Å; W179-W262 AromaticContact CE3-CD2 3.95Å; W179-W262 HydrophobicContact CE3-CD2 3.95Å; W179-W262 AromaticContact CE3-CE2 3.79Å; W179-W262 HydrophobicContact CE3-CE3 4.16Å; W179-W262 HydrophobicContact CE3-CH2 4.1Å; W179-W262 AromaticContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ3 4.23Å; W179-W262 HydrophobicContact CZ3-CD2 4.07Å; W179-W262 HydrophobicContact CZ3-CE3 4.01Å; W179-W262 HydrophobicContact CZ3-CZ3 4.28Å; E180-W262 PolarHBondContact O-NE1 3Å; L182-W262 HydrophobicContact CB-CB 4.48Å; L182-W262 HydrophobicContact CB-CG 4.19Å; L182-W262 HydrophobicContact CD2-CB 4.23Å; L258-W262 WeakPolarHBondContact O-CB 3.47Å; L258-W262 PolarHBondContact O-N 3.45Å; F259-W262 HydrophobicContact CD2-CE3 4.17Å; F259-W262 HydrophobicContact CE2-CE3 4.45Å; F259-W262 PolarHBondContact O-N 2.98Å; R260-W262 VanDerWaalsContact C-N 3.35Å; W262-A264 VanDerWaalsContact C-N 3.33Å; W262-Y265 PolarHBondContact O-N 3.33Å; W262-N266 PolarHBondContact NE1-ND2 3.11Å; W262-N266 VanDerWaalsContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.99Å; W262-N266 PolarHBondContact O-ND2 2.88Å
263K91.3Very high92Very high98 Ų9873.1 Ų73.143%0.42634%0.34SS..Hα-helixtrans-61.8-42.2172.7-175.9179.7178.9-178.70110.9V173 W179 F259 R260 N266 K267V173-K263 HydrophobicContact CG2-CG 4.32Å; W179-K263 HydrophobicContact CH2-CB 4.21Å; W179-K263 HydrophobicContact CH2-CG 4.28Å; F259-K263 WeakPolarHBondContact O-CB 3.3Å; F259-K263 PolarHBondContact O-N 3.16Å; R260-K263 PolarHBondContact O-N 3.28Å; K263-N266 PolarHBondContact O-N 3.02Å; K263-K267 PolarHBondContact O-N 2.83Å
264A90.6Very high92Very high53 Ų5368.3 Ų68.344%0.43832%0.321SS..Hα-helixtrans-63.5-42.4177.100000112.2R260 R261 W262 N266 K267R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 3.32Å; R261-A264 PolarHBondContact O-N 3.37Å; W262-A264 VanDerWaalsContact C-N 3.33Å; A264-N266 PolarHBondContact O-N 3.36Å; A264-K267 WeakPolarHBondContact O-CB 3.28Å; A264-K267 PolarHBondContact O-N 2.98Å; A264-K267 VanDerWaalsContact O-N 3.16Å
265Y89.5Confident92Very high104 Ų10470.1 Ų70.141%0.40834%0.335SS..Hα-helixtrans-59.5-33.6175.2-176.2-96.5000113E180 L182 D183 R261 W262 K267E180-Y265 HydrophobicContact CB-CE1 3.93Å; L182-Y265 VanDerWaalsContact CD1-CB 3.46Å; L182-Y265 HydrophobicContact CD1-CD1 4.15Å; L182-Y265 HydrophobicContact CD1-CD2 3.74Å; L182-Y265 HydrophobicContact CD1-CG 3.52Å; D183-Y265 HydrophobicContact CB-CE2 4.36Å; R261-Y265 PolarHBondContact O-N 2.56Å; W262-Y265 PolarHBondContact O-N 3.33Å; Y265-K267 VanDerWaalsContact C-N 3.35Å
266N91.1Very high91.6Very high0 Ų073.7 Ų73.70%036%0.358CS..THydrogen-bonded Turntrans-90.211.7179.2-77.3-74.3000114.7K174 W179 E180 W262 K263 A264K174-N266 WeakPolarHBondContact CG-O 3.32Å; K174-N266 PolarHBondContact N-O 3.38Å; W179-N266 VanDerWaalsContact CA-OD1 3.25Å; W179-N266 WeakPolarHBondContact CA-OD1 3.47Å; W179-N266 HydrophobicContact CD2-CB 3.98Å; W179-N266 HydrophobicContact CG-CB 4.03Å; E180-N266 PolarHBondContact N-OD1 3.09Å; E180-N266 PolarHBondContact O-ND2 3.49Å; E180-N266 VanDerWaalsContact O-ND2 3.16Å; W262-N266 PolarHBondContact NE1-ND2 3.11Å; W262-N266 VanDerWaalsContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.99Å; W262-N266 PolarHBondContact O-ND2 2.88Å; K263-N266 PolarHBondContact O-N 3.02Å; A264-N266 PolarHBondContact O-N 3.36Å
267K92.1Very high90.7Very high111 Ų11177.5 Ų77.548%0.48337%0.37SS..EExtended strand (participates in β ladder)trans-78.7139.2171.2-73.3177.2-179.4-176.70110.7T171 V173 K263 A264 Y265T171-K267 HydrophobicContact CG2-CB 3.84Å; T171-K267 HydrophobicContact CG2-CD 4Å; T171-K267 HydrophobicContact CG2-CG 4.11Å; V173-K267 HydrophobicContact CG2-CG 4.03Å; K263-K267 PolarHBondContact O-N 2.83Å; A264-K267 WeakPolarHBondContact O-CB 3.28Å; A264-K267 PolarHBondContact O-N 2.98Å; A264-K267 VanDerWaalsContact O-N 3.16Å; Y265-K267 VanDerWaalsContact C-N 3.35Å
268V90.4Very high89.1Confident28 Ų2879.5 Ų79.517%0.1739%0.389CS..EExtended strand (participates in β ladder)trans-124133.7174.71780000108.7R172 K174 Y270R172-V268 PolarHBondContact N-O 3.14Å; R172-V268 PolarHBondContact O-N 2.93Å; R172-V268 VanDerWaalsContact O-O 3.09Å; K174-V268 HydrophobicContact CD-CG2 4.04Å; K174-V268 HydrophobicContact CG-CG2 3.57Å; V268-Y270 HydrophobicContact CB-CE2 3.9Å; V268-Y270 HydrophobicContact CG1-CD2 4.2Å; V268-Y270 HydrophobicContact CG1-CE2 3.72Å
269I91.8Very high87.2Confident57 Ų5788.8 Ų88.829%0.29242%0.421SS..EExtended strand (participates in β ladder)trans-88.3121.8177.3-60.4169.7000107.8Q149 M169Q149-I269 VanDerWaalsContact CG-O 3.26Å; Q149-I269 WeakPolarHBondContact CG-O 3.5Å; Q149-I269 PolarHBondContact NE2-O 2.98Å; M169-I269 HydrophobicContact CB-CG2 4.01Å; M169-I269 HydrophobicContact CG-CG2 4.15Å; M169-I269 HydrophobicContact SD-CG2 3.91Å
270Y94.1Very high85.1Confident104 Ų10491.4 Ų91.441%0.40844%0.435SS..EExtended strand (participates in β ladder)trans-101.6133.4171.7-69.6-98.1000109.7Q145 M169 Q170 R172 V268Q145-Y270 HydrophobicContact CG-CD1 4.46Å; M169-Y270 CarbonylContact C-O 3.54Å; M169-Y270 WeakPolarHBondContact CA-O 3.37Å; Q170-Y270 PolarHBondContact N-O 3.34Å; Q170-Y270 PolarHBondContact O-N 3.47Å; R172-Y270 HydrophobicContact CB-CD2 4.05Å; R172-Y270 HydrophobicContact CB-CE2 3.96Å; R172-Y270 HydrophobicContact CG-CD2 4.24Å; V268-Y270 HydrophobicContact CB-CE2 3.9Å; V268-Y270 HydrophobicContact CG1-CD2 4.2Å; V268-Y270 HydrophobicContact CG1-CE2 3.72Å
271V94.7Very high82.7Confident7 Ų790.4 Ų90.44%0.04244%0.442CS..EExtended strand (participates in β ladder)trans-99.4133.8172.6-1740000109.5I131 P133 Q145 L148 I152 F167 I168 M169I131-V271 HydrophobicContact CD1-CB 4.21Å; I131-V271 HydrophobicContact CD1-CG1 4.34Å; P133-V271 HydrophobicContact CB-CG1 3.87Å; Q145-V271 PolarHBondContact NE2-O 3.27Å; Q145-V271 PolarHBondContact OE1-O 3Å; L148-V271 HydrophobicContact CD2-CB 3.76Å; L148-V271 HydrophobicContact CD2-CG1 3.59Å; L148-V271 HydrophobicContact CD2-CG2 3.85Å; L148-V271 HydrophobicContact CG-CG2 4.23Å; I152-V271 HydrophobicContact CD1-CG2 3.52Å; F167-V271 HydrophobicContact CB-CG1 3.86Å; F167-V271 HydrophobicContact CG-CG1 4.33Å; I168-V271 CarbonylContact O-C 3.53Å; I168-V271 WeakPolarHBondContact O-CA 3.42Å; M169-V271 HydrophobicContact CG-CG2 4.36Å
272G93.5Very high80.9Confident30 Ų3094.8 Ų94.831%0.30946%0.464SS..PPolyproline II helixtrans-93.8171.817400000112.5I168I168-G272 PolarHBondContact O-N 2.9Å
273N95Very high79Confident93 Ų9398.6 Ų98.650%0.49749%0.486SS..PPolyproline II helixtrans-68145.8169.9-66.2-51.8000110.4I131 A132I131-N273 WeakPolarHBondContact CA-OD1 3.28Å; I131-N273 WeakPolarHBondContact CB-OD1 3.4Å; A132-N273 PolarHBondContact N-OD1 3.46Å; A132-N273 CarbonylContact O-C 3.57Å; A132-N273 VanDerWaalsContact O-CA 3.27Å; A132-N273 WeakPolarHBondContact O-CA 2.9Å
274C93.4Very high77.2Confident15 Ų1599.4 Ų99.410%0.10150%0.501CS..PPolyproline II helixtrans-65.5147.6165.563.80000109.4A132 Y135 F165A132-C274 PolarHBondContact O-N 2.82Å; A132-C274 PolarHBondContact O-SG 3.35Å; Y135-C274 HydrophobicContact CE1-CB 4.34Å; F165-C274 HydrophobicContact CD1-CB 4.27Å; F165-C274 HydrophobicContact CE1-CB 3.6Å; F165-C274 HydrophobicContact CZ-CB 3.91Å
275P90.5Very high75.5Confident69 Ų69102.4 Ų102.445%0.44852%0.517SS..PPolyproline II helixtrans-62.9146.9175.826.7-32.2000109.6Y135Y135-P275 WeakPolarHBondContact CE1-O 3.42Å; Y135-P275 WeakPolarHBondContact OH-CG 3.49Å; Y135-P275 PolarHBondContact OH-O 3.29Å
276D84Confident74.1Confident145 Ų145102.9 Ų102.978%0.77553%0.533SS*.PPolyproline II helixtrans-68.4137.8171.8-67.2-54.7000109.3
277F74.4Confident73Confident149 Ų149110 Ų11065%0.65457%0.572SS**PPolyproline II helixtrans-58.3131165.8-89.3-83.2000107.7Y135 R279Y135-F277 AromaticContact CD1-CD2 3.68Å; Y135-F277 HydrophobicContact CD1-CD2 3.68Å; Y135-F277 AromaticContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD1-CE2 3.46Å; Y135-F277 VanDerWaalsContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD2-CE2 4.19Å; Y135-F277 AromaticContact CE1-CD2 3.49Å; Y135-F277 HydrophobicContact CE1-CD2 3.49Å; Y135-F277 VanDerWaalsContact CE1-CD2 3.49Å; Y135-F277 AromaticContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CE2 3.41Å; Y135-F277 VanDerWaalsContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CG 4.5Å; Y135-F277 HydrophobicContact CE1-CZ 4.36Å; Y135-F277 HydrophobicContact CE2-CE2 4.15Å; Y135-F277 HydrophobicContact CG-CD2 4.49Å; Y135-F277 AromaticContact CG-CE2 3.85Å; Y135-F277 HydrophobicContact CG-CE2 3.85Å; Y135-F277 AromaticContact CZ-CE2 3.78Å; F277-R279 PolarHBondContact O-N 2.93Å
278P56.9Low71.7Confident111 Ų111111.7 Ų111.772%0.72159%0.591SS**PPolyproline II helixtrans-54.6116.9162.9-14.426.3000105.2Q280P278-Q280 VanDerWaalsContact C-N 3.29Å; P278-Q280 PolarHBondContact O-N 3.43Å
279R50.5Low70.8Confident234 Ų234119.9 Ų119.988%0.88364%0.64SS**  trans-53.5104171-75.9-173.7175.3170.3-1.1105.4F277 N281F277-R279 PolarHBondContact O-N 2.93Å; R279-N281 PolarHBondContact O-N 3.2Å
280Q48.8Very low69.7Low155 Ų155123 Ų12372%0.72466%0.658SS**  trans-57.2115.9161.3-75.7180-1400103.3P278 F282P278-Q280 VanDerWaalsContact C-N 3.29Å; P278-Q280 PolarHBondContact O-N 3.43Å; Q280-F282 WeakPolarHBondContact O-CD2 3.28Å; Q280-F282 PolarHBondContact O-N 2.9Å
281N41.3Very low68.4Low150 Ų150124 Ų12480%0.80267%0.671SS**  trans-55.992.7166.5-84.4-20.7000105.2R279 Q283R279-N281 PolarHBondContact O-N 3.2Å; N281-Q283 PolarHBondContact O-N 2.97Å
282F53.4Low67Low183 Ų183130.5 Ų130.580%0.80371%0.706SS**  trans-63.988.8160.5-78.7-84.1000104Q280 P284Q280-F282 WeakPolarHBondContact O-CD2 3.28Å; Q280-F282 PolarHBondContact O-N 2.9Å; F282-P284 WeakPolarHBondContact O-CD 3.28Å
283Q52Low65.4Low174 Ų174136.4 Ų136.481%0.81373%0.729SS**PPolyproline II helixtrans-55.4123.6160.5-85.7-179.8-75.200105.3N281 C285N281-Q283 PolarHBondContact O-N 2.97Å; Q283-C285 PolarHBondContact O-N 3Å
284P52.8Low63.6Low116 Ų116139.1 Ų139.175%0.75374%0.743SS**PPolyproline II helixtrans-53.5132.2171.4-20.731.4000108.1F282F282-P284 WeakPolarHBondContact O-CD 3.28Å
285C56.1Low61.6Low115 Ų115147.4 Ų147.478%0.77779%0.786SS**PPolyproline II helixtrans-53.6130.8167.3-97.20000107.6Q283 D287Q283-C285 PolarHBondContact O-N 3Å; C285-D287 PolarHBondContact O-N 3.4Å
286P59.4Low59.5Low114 Ų114153 Ų15374%0.7481%0.81SS**PPolyproline II helixtrans-59129.417623.1-30.5000108.8V288P286-V288 PolarHBondContact O-N 3.15Å; P286-V288 VanDerWaalsContact O-N 3.09Å
287D67.7Low57.6Low151 Ų151153.6 Ų153.681%0.80781%0.813SS**PPolyproline II helixtrans-51.6116.6175.1-64.6-55.5000108.7C285 V289C285-D287 PolarHBondContact O-N 3.4Å; D287-V289 PolarHBondContact O-N 3.37Å
288V64.5Low56.2Low146 Ų146154 Ų15489%0.88583%0.826SS**  trans-76103167.3-176.40000105.5P286P286-V288 PolarHBondContact O-N 3.15Å; P286-V288 VanDerWaalsContact O-N 3.09Å
289V71.2Confident56.2Low199 Ų199157.9 Ų157.9100%1.20684%0.836SS**  trans-68.70170.6-176.40000110D287D287-V289 PolarHBondContact O-N 3.37Å

Retrieved 289 of 289 residues in 114.1 ms (Link to these results)