A0A060Y9Z2_ONCMY Loading...

HMG box domain-containing protein

AlphaFold DB , UniProt , Accession A0A060Y9Z2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene sox19b, Length 299 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M39.1Very low47.7Very low245 Ų245176 Ų176100%1.20787%0.866SS**  0144.90-68.6169.3176.800107.4
2Y35.5Very low46.8Very low225 Ų225171.5 Ų171.588%0.88287%0.865SS**  trans-67.3144.2-172-81.8-102.8000112.3
3S54.8Low45.9Very low119 Ų119163.5 Ų163.583%0.83285%0.852SS**  trans-136.396.2155.8-165.90000108.9
4M56.7Low45.4Very low173 Ų173164.5 Ų164.585%0.85285%0.851SS**  trans-140.480.5165.9-78-145.2-4900107.5
5M58.6Low45.1Very low172 Ų172165.1 Ų165.185%0.84785%0.848SS**  trans-154.397.9164.7-77.9-163.5-67.900108.5
6E55.3Low44.8Very low192 Ų192165 Ų16590%0.89784%0.843SS**  trans-143.6111.9134.6-75.4-151.2139.700107.7
7H41.8Very low44.5Very low169 Ų169165.7 Ų165.778%0.78284%0.842SS**  trans-101.2107.1170.7-93.2-104.2000107.1
8E46.8Very low44.2Very low180 Ų180164.6 Ų164.684%0.84183%0.833SS**  trans-96.5117167.4-84.7-60.9130.400110.3
9L45.4Very low43.9Very low141 Ų141165.1 Ų165.174%0.73883%0.831SS**  trans-142.5102.3-175.6-110.8175.3000109.2
10K43.2Very low43.6Very low201 Ų201165 Ų16587%0.87483%0.828SS**  trans172.2166.1154.2-103.3167.3-179.9176.50111.3
11P47.1Very low43.3Very low119 Ų119164.9 Ų164.977%0.77382%0.824SS**  cis-125.5174-22.331-12.8000113.3
12S36.8Very low43.2Very low122 Ų122160.1 Ų160.185%0.85380%0.799SS**  trans-77.6149.6175.251.80000114.6
13G35.5Very low43.2Very low68 Ų68155 Ų15570%0.70179%0.791SS**  trans176.3107.7157.700000117.5
14Q39.2Very low42.3Very low177 Ų177153 Ų15383%0.82778%0.782SS**  trans62.2156.1146-60.6-179.4-5.200118.1
15Q40.8Very low41.4Very low173 Ų173154.1 Ų154.181%0.80879%0.785SS**  cis-149.8173.1-7.9-128.7170.823.800110.7
16Q40.5Very low40.3Very low164 Ų164149.3 Ų149.377%0.76678%0.78SS**  trans-92.6135-176.7172.9-175.355.200111.4
17Q39.5Very low39.7Very low177 Ų177149.2 Ų149.283%0.82778%0.782SS**  trans-148.2133.3153.7-154.2159.461.300112.1
18Q39.6Very low39.8Very low146 Ų146146.6 Ų146.668%0.68278%0.783SS**  trans-98.5143.3176.3-57.5171.7800108.9
19H38.2Very low39.9Very low173 Ų173144.1 Ų144.180%0.80178%0.782SS**  trans-139.6121.1153.9-90.8-78.9000110.6
20H37.5Very low39.8Very low164 Ų164144.2 Ų144.276%0.75979%0.788SS**  trans-82147.7165.4-92.369.2000110.2
21H37.5Very low39.6Very low162 Ų162141 Ų14175%0.7579%0.785SS**  trans146.5147.1144.1-88.171.7000109.3
22Q37.3Very low39Very low146 Ų146139 Ų13968%0.68279%0.787SS**  cis-174.3140.6-24.6-119-158.470.200103.6
23T34.3Very low38.9Very low116 Ų116140.2 Ų140.271%0.71278%0.784SS**  trans54.3115.4141.9-34.80000120.1
24A36Very low39.3Very low78 Ų78145.1 Ų145.165%0.64579%0.792SS**  156.4134.6103.700000114.5
25Q39.2Very low39.1Very low196 Ų196139.4 Ų139.492%0.91678%0.781SS**  trans61.5140.3157.9-28.5-163.72.500117.9
26G35.6Very low38.9Very low72 Ų72138.9 Ų138.974%0.74278%0.784SS**  cis127.760.76.800000111.9
27M42.8Very low38.9Very low189 Ų189135.2 Ų135.293%0.93178%0.776SS**  trans-132.498.8179.5-63.1-175.381.800111.3
28S44Very low38.7Very low115 Ų115134.8 Ų134.880%0.80477%0.774SS**PPolyproline II helixtrans-73.8142.6168.7-540000110.5V30S28-V30 PolarHBondContact O-N 2.9Å
29P46.9Very low38.8Very low128 Ų128135.2 Ų135.283%0.83178%0.78SS**PPolyproline II helixtrans-71125169.729.1-32.2000110
30V44.1Very low38.6Very low142 Ų142130.1 Ų130.186%0.86177%0.774SS**PPolyproline II helixtrans-78.5136.9178.766.90000111.6S28 G32S28-V30 PolarHBondContact O-N 2.9Å; V30-G32 PolarHBondContact O-N 3.45Å
31T38.6Very low38.7Very low133 Ų133128.5 Ų128.582%0.81678%0.781SS**  trans-74.9114.5-179.5-29.90000111.2
32G35.5Very low39.3Very low79 Ų79129.7 Ų129.781%0.81478%0.784SS**  trans-10791.8172.900000111.7V30V30-G32 PolarHBondContact O-N 3.45Å
33N34.9Very low39.7Very low147 Ų147128.6 Ų128.679%0.78679%0.79SS**  trans-95.5115.2-178.5-179.351.4000111.3
34I42.9Very low40.2Very low170 Ų170129.7 Ų129.787%0.87280%0.796SS**  trans-126.3122.6162.4-58.6-179000107.2
35G34.4Very low40.8Very low58 Ų58130.1 Ų130.160%0.59879%0.793SS**  trans-104.9-171.5-170.800000115.3
36N37.1Very low41.4Very low162 Ų162125.8 Ų125.887%0.86678%0.782SS**  trans70.1138.1178.3-862.9000117.6
37S40.1Very low42.1Very low86 Ų86128.7 Ų128.760%0.60179%0.788SS**  cis-173167.8-1541.70000110.2
38H36.3Very low42.5Very low169 Ų169123.3 Ų123.378%0.78278%0.781SS**  trans72.4136.3164.1-90.839.7000116.1
39L40.9Very low42.9Very low155 Ų155120.9 Ų120.981%0.81277%0.774SS**  cis-148.5153.72-88.6155000109.4
40G34.8Very low43.5Very low66 Ų66120.3 Ų120.368%0.6876%0.764SS**  trans139.361161.200000117.2K42G40-K42 PolarHBondContact O-N 2.88Å
41S40.5Very low44.3Very low129 Ų129118.9 Ų118.990%0.90276%0.758SS**  trans-60.898.2176.1-54.90000112.5
42K48.9Very low45.4Very low188 Ų188120.7 Ų120.782%0.81776%0.759SS**PPolyproline II helixtrans-70.3137.1160.6-70.3178.6-179.3169.70108.1G40 V44G40-K42 PolarHBondContact O-N 2.88Å; K42-V44 PolarHBondContact O-N 3.25Å
43P44.9Very low47.5Very low122 Ų122122.3 Ų122.379%0.79275%0.749SS**PPolyproline II helixtrans-61.8123.8179.524.7-33.1000109.9C45P43-C45 PolarHBondContact O-N 3.19Å
44V45.8Very low50Low139 Ų139122.2 Ų122.284%0.84274%0.741SS**PPolyproline II helixtrans-56.1117.9179.4171.60000109.3K42K42-V44 PolarHBondContact O-N 3.25Å
45C48.5Very low52.5Low87 Ų87116.3 Ų116.359%0.58871%0.713SS**PPolyproline II helixtrans-71.8146.6162.8-73.80000108.5P43P43-C45 PolarHBondContact O-N 3.19Å
46P51.3Low55.4Low106 Ų106122.1 Ų122.169%0.68872%0.722SS**PPolyproline II helixtrans-59.3147.9-177.625.4-35000111.5G48P46-G48 PolarHBondContact O-N 3.29Å
47P51.8Low58.3Low133 Ų133122.3 Ų122.386%0.86471%0.71SS**SBendtrans-66.8127.1-177.528.7-34.4000110.1
48G51.1Low61Low76 Ų76120.2 Ų120.278%0.78470%0.695SS**  trans167.174.2-177.300000114.2P46P46-G48 PolarHBondContact O-N 3.29Å
49G52.3Low64Low63 Ų63115.6 Ų115.665%0.64967%0.674SS**  trans87.2137.6174.300000113.8
50D58.7Low66.7Low116 Ų116112.3 Ų112.362%0.6266%0.658SS**  trans-66.2147.9172-85.4-55.4000109.4M52 D53D50-M52 PolarHBondContact O-N 3.31Å; D50-D53 PolarHBondContact N-OD2 3.08Å; D50-D53 PolarHBondContact O-N 3.34Å
51P61.7Low69.7Low113 Ų113110 Ų11073%0.73463%0.632SS**THydrogen-bonded Turntrans-62.7-10.118026.3-34.9000113.5
52M61.1Low72.5Confident171 Ų171106 Ų10684%0.84260%0.599SS**THydrogen-bonded Turntrans-80.8-32173.5-61.7-57.2-179.100113.2D50 K54D50-M52 PolarHBondContact O-N 3.31Å; M52-K54 PolarHBondContact O-N 3.26Å
53D79.3Confident74.9Confident112 Ų112101.4 Ų101.460%0.59958%0.581SS**THydrogen-bonded Turntrans-70.8-17.9-179-55.8-34000112.4D50 V55D50-D53 PolarHBondContact N-OD2 3.08Å; D50-D53 PolarHBondContact O-N 3.34Å; D53-V55 PolarHBondContact O-N 3.06Å
54K88.4Confident77.4Confident145 Ų14596.9 Ų96.963%0.6355%0.551SS**SBendtrans-72.6104.9-178-170.4-173.9177.6-175.60111.3M52 K56M52-K54 PolarHBondContact O-N 3.26Å; K54-K56 PolarHBondContact O-N 3.37Å; K54-K56 VanDerWaalsContact O-N 3.15Å
55V94.2Very high79.9Confident46 Ų4691 Ų9128%0.27951%0.514SS..  trans-41.9118169.5-1790000111.8D53 H115 Y119 Y122D53-V55 PolarHBondContact O-N 3.06Å; V55-H115 WeakPolarHBondContact CG1-CE1 3.19Å; V55-Y119 HydrophobicContact CB-CD1 4.49Å; V55-Y119 HydrophobicContact CG1-CD1 3.92Å; V55-Y119 HydrophobicContact CG1-CD2 3.77Å; V55-Y119 HydrophobicContact CG1-CE1 4.14Å; V55-Y119 HydrophobicContact CG1-CE2 3.99Å; V55-Y119 HydrophobicContact CG1-CG 3.72Å; V55-Y119 HydrophobicContact CG2-CD1 3.68Å; V55-Y119 HydrophobicContact CG2-CE1 3.72Å; V55-Y119 HydrophobicContact CG2-CG 4.32Å; V55-Y122 HydrophobicContact CB-CD2 3.96Å; V55-Y122 HydrophobicContact CB-CE2 4.03Å; V55-Y122 HydrophobicContact CG1-CD2 3.48Å; V55-Y122 VanDerWaalsContact CG1-CD2 3.48Å; V55-Y122 HydrophobicContact CG1-CE2 3.68Å; V55-Y122 HydrophobicContact CG1-CG 4.46Å; V55-Y122 WeakPolarHBondContact O-CE2 3.49Å
56K95.8Very high82.3Confident180 Ų18086.9 Ų86.978%0.78349%0.486SS*.PPolyproline II helixtrans-83.8146.9-176.2-67.6164.871.7171.70110.3K54 H115K54-K56 PolarHBondContact O-N 3.37Å; K54-K56 VanDerWaalsContact O-N 3.15Å; K56-H115 PolarHBondContact O-CE1 3.02Å
57R97.6Very high84.5Confident166 Ų16690.4 Ų90.463%0.62649%0.486SS*.PPolyproline II helixtrans-58.8143.7177.9-65.3172.870.6-163.81.8110.9Y122 Y124R57-Y122 WeakPolarHBondContact CG-OH 3.38Å; R57-Y124 HydrophobicContact CG-CD2 4.4Å
58P98Very high86.6Confident43 Ų4385.6 Ų85.628%0.27946%0.461SS..PPolyproline II helixtrans-64.2153.6170.327.9-32.7000110.5H115P58-H115 HydrophobicContact CB-CB 3.9Å; P58-H115 HydrophobicContact CG-CB 4.18Å
59M98.1Very high88.8Confident71 Ų7185.1 Ų85.135%0.3544%0.438SS..PPolyproline II helixtrans-76.5131.1-175.3-156170.4-66.300110.5M63 V64 L111M59-M63 HydrophobicContact CG-CB 3.35Å; M59-M63 VanDerWaalsContact SD-C 3.53Å; M59-M63 HydrophobicContact SD-CB 4.22Å; M59-M63 VanDerWaalsContact SD-O 3.41Å; M59-V64 HydrophobicContact CB-CG2 3.85Å; M59-V64 HydrophobicContact CG-CG2 3.74Å; M59-V64 HydrophobicContact SD-CB 4.37Å; M59-V64 HydrophobicContact SD-CG2 3.94Å; M59-L111 HydrophobicContact CB-CD1 4Å
60N98.6Very high91Very high87 Ų8784.6 Ų84.647%0.46542%0.416SS..PPolyproline II helixtrans-83.3167.2173.175.416.6000111.1F62 M63 V64N60-F62 PolarHBondContact O-N 3.37Å; N60-F62 PolarHBondContact OD1-N 3.12Å; N60-M63 WeakPolarHBondContact O-CA 3.21Å; N60-M63 PolarHBondContact O-N 3.03Å; N60-M63 WeakPolarHBondContact OD1-CB 3.43Å; N60-M63 WeakPolarHBondContact OD1-CG 3.23Å; N60-M63 PolarHBondContact OD1-N 3.44Å; N60-V64 WeakPolarHBondContact O-CG2 3.41Å; N60-V64 PolarHBondContact O-N 3.09Å
61A98.1Very high92.8Very high17 Ų1787.2 Ų87.214%0.1442%0.417CS..Hα-helixtrans-52.5-48.6-173.700000113.6M63 V64 W65 W93 F104 I105 A108A61-M63 VanDerWaalsContact C-N 3.33Å; A61-M63 PolarHBondContact O-N 3.07Å; A61-V64 PolarHBondContact O-N 3.45Å; A61-W65 PolarHBondContact O-N 3.06Å; A61-W93 HydrophobicContact CB-CH2 4.06Å; A61-W93 HydrophobicContact CB-CZ2 4.1Å; A61-F104 WeakPolarHBondContact CA-O 3.46Å; A61-I105 HydrophobicContact CB-CB 4.47Å; A61-I105 HydrophobicContact CB-CG1 3.84Å; A61-A108 HydrophobicContact CB-CB 4.11Å; A61-A108 VanDerWaalsContact N-CB 3.3Å
62F98.4Very high94.5Very high46 Ų4686.9 Ų86.920%0.20241%0.405CS..Hα-helixtrans-60.8-39.2175.8171.7-98.1000112.7N60 W65 S66 W93N60-F62 PolarHBondContact O-N 3.37Å; N60-F62 PolarHBondContact OD1-N 3.12Å; F62-W65 AromaticContact CD2-CE3 3.99Å; F62-W65 HydrophobicContact CD2-CE3 3.99Å; F62-W65 HydrophobicContact CD2-CZ3 4.07Å; F62-W65 HydrophobicContact CE2-CE3 4.11Å; F62-W65 AromaticContact CE2-CZ3 3.77Å; F62-W65 HydrophobicContact CE2-CZ3 3.77Å; F62-S66 WeakPolarHBondContact O-CB 3.45Å; F62-S66 PolarHBondContact O-N 3.06Å; F62-S66 PolarHBondContact O-OG 3.38Å; F62-W93 HydrophobicContact CB-CD2 4.42Å; F62-W93 HydrophobicContact CD2-CB 3.78Å; F62-W93 AromaticContact CD2-CD1 3.91Å; F62-W93 AromaticContact CD2-CD2 3.95Å; F62-W93 HydrophobicContact CD2-CD2 3.95Å; F62-W93 AromaticContact CD2-CG 3.57Å; F62-W93 HydrophobicContact CD2-CG 3.57Å; F62-W93 HydrophobicContact CE2-CB 3.95Å; F62-W93 HydrophobicContact CE2-CG 4.24Å
63M98.4Very high96.2Very high90 Ų9079.7 Ų79.744%0.44337%0.369SS..Hα-helixtrans-71.2-34.1178.4-68.8-69176.600112M59 N60 A61 R67M59-M63 HydrophobicContact CG-CB 3.35Å; M59-M63 VanDerWaalsContact SD-C 3.53Å; M59-M63 HydrophobicContact SD-CB 4.22Å; M59-M63 VanDerWaalsContact SD-O 3.41Å; N60-M63 WeakPolarHBondContact O-CA 3.21Å; N60-M63 PolarHBondContact O-N 3.03Å; N60-M63 WeakPolarHBondContact OD1-CB 3.43Å; N60-M63 WeakPolarHBondContact OD1-CG 3.23Å; N60-M63 PolarHBondContact OD1-N 3.44Å; A61-M63 VanDerWaalsContact C-N 3.33Å; A61-M63 PolarHBondContact O-N 3.07Å; M63-R67 PolarHBondContact O-N 2.89Å
64V98.4Very high97Very high28 Ų2876.4 Ų76.417%0.1736%0.357CS..Hα-helixtrans-63.1-55.7172.91770000109.8M59 N60 A61 R67 F104 E107 A108 L111M59-V64 HydrophobicContact CB-CG2 3.85Å; M59-V64 HydrophobicContact CG-CG2 3.74Å; M59-V64 HydrophobicContact SD-CB 4.37Å; M59-V64 HydrophobicContact SD-CG2 3.94Å; N60-V64 WeakPolarHBondContact O-CG2 3.41Å; N60-V64 PolarHBondContact O-N 3.09Å; A61-V64 PolarHBondContact O-N 3.45Å; V64-R67 WeakPolarHBondContact O-CB 2.78Å; V64-R67 PolarHBondContact O-N 2.96Å; V64-F104 HydrophobicContact CG1-CD1 4.15Å; V64-E107 HydrophobicContact CG1-CB 4.39Å; V64-E107 HydrophobicContact CG1-CG 3.79Å; V64-E107 HydrophobicContact CG2-CG 4.49Å; V64-A108 HydrophobicContact CG2-CB 4.37Å; V64-L111 HydrophobicContact CG2-CD1 3.75Å
65W98.4Very high97.4Very high15 Ų1576 Ų766%0.05736%0.358CS..Hα-helixtrans-59.9-52.2179169.983.3000112.6A61 F62 R67 G68 Q69 L89 E92 W93 L96 F104A61-W65 PolarHBondContact O-N 3.06Å; F62-W65 AromaticContact CD2-CE3 3.99Å; F62-W65 HydrophobicContact CD2-CE3 3.99Å; F62-W65 HydrophobicContact CD2-CZ3 4.07Å; F62-W65 HydrophobicContact CE2-CE3 4.11Å; F62-W65 AromaticContact CE2-CZ3 3.77Å; F62-W65 HydrophobicContact CE2-CZ3 3.77Å; W65-R67 PolarHBondContact O-N 3.05Å; W65-R67 VanDerWaalsContact O-N 3.1Å; W65-G68 PolarHBondContact O-N 2.9Å; W65-Q69 HydrophobicContact CD2-CG 4.26Å; W65-Q69 HydrophobicContact CH2-CG 4.41Å; W65-Q69 HydrophobicContact CZ2-CB 4.48Å; W65-Q69 HydrophobicContact CZ2-CG 3.78Å; W65-L89 HydrophobicContact CH2-CB 4.08Å; W65-L89 HydrophobicContact CH2-CD2 3.81Å; W65-L89 VanDerWaalsContact CH2-O 3.3Å; W65-L89 WeakPolarHBondContact CH2-O 3.49Å; W65-L89 HydrophobicContact CZ3-CB 3.91Å; W65-L89 HydrophobicContact CZ3-CD2 4.2Å; W65-L89 VanDerWaalsContact CZ3-O 3.27Å; W65-L89 WeakPolarHBondContact CZ3-O 3.45Å; W65-E92 HydrophobicContact CH2-CB 3.86Å; W65-E92 HydrophobicContact CZ2-CB 4.18Å; W65-W93 HydrophobicContact CB-CE3 4.05Å; W65-W93 HydrophobicContact CB-CZ3 3.62Å; W65-W93 AromaticContact CD2-CE3 3.5Å; W65-W93 HydrophobicContact CD2-CE3 3.5Å; W65-W93 AromaticContact CD2-CZ3 3.96Å; W65-W93 HydrophobicContact CD2-CZ3 3.96Å; W65-W93 HydrophobicContact CE3-CB 4.2Å; W65-W93 HydrophobicContact CE3-CD2 4.25Å; W65-W93 AromaticContact CE3-CE3 3.56Å; W65-W93 HydrophobicContact CE3-CE3 3.56Å; W65-W93 HydrophobicContact CE3-CZ3 4.33Å; W65-W93 AromaticContact CG-CE3 3.72Å; W65-W93 HydrophobicContact CG-CE3 3.72Å; W65-W93 AromaticContact CG-CZ3 3.63Å; W65-W93 HydrophobicContact CG-CZ3 3.63Å; W65-W93 HydrophobicContact CH2-CB 4.08Å; W65-W93 HydrophobicContact CZ3-CB 3.74Å; W65-W93 HydrophobicContact CZ3-CE3 4.24Å; W65-L96 HydrophobicContact CD2-CD1 4.43Å; W65-L96 HydrophobicContact CZ2-CD1 3.94Å; W65-F104 HydrophobicContact CB-CB 4.18Å; W65-F104 HydrophobicContact CB-CD1 3.77Å; W65-F104 HydrophobicContact CB-CD2 4.15Å; W65-F104 HydrophobicContact CB-CE1 4.21Å; W65-F104 HydrophobicContact CB-CG 3.74Å; W65-F104 AromaticContact CD1-CD2 3.89Å; W65-F104 AromaticContact CD1-CE2 3.59Å; W65-F104 AromaticContact CD1-CZ 3.7Å; W65-F104 HydrophobicContact CG-CD2 4.36Å; W65-F104 HydrophobicContact CG-CE2 4.43Å; W65-F104 HydrophobicContact CG-CG 4.41Å
66S98.1Very high97.4Very high0 Ų079.2 Ų79.20%037%0.37CS..Hα-helixtrans-66.5-15.9-175.467.80000113.2F62 R70F62-S66 WeakPolarHBondContact O-CB 3.45Å; F62-S66 PolarHBondContact O-N 3.06Å; F62-S66 PolarHBondContact O-OG 3.38Å; S66-R70 WeakPolarHBondContact O-CB 3.49Å; S66-R70 PolarHBondContact O-N 3.14Å; S66-R70 PolarHBondContact O-NH1 3.27Å; S66-R70 VanDerWaalsContact O-NH1 3.07Å; S66-R70 PolarHBondContact OG-NH1 3.07Å
67R97.6Very high97.2Very high180 Ų18074 Ų7468%0.67935%0.35SS*.Hα-helixtrans-62.4-43.8175.2-171.9179.6-177.7-167.2-0111.6M63 V64 W65M63-R67 PolarHBondContact O-N 2.89Å; V64-R67 WeakPolarHBondContact O-CB 2.78Å; V64-R67 PolarHBondContact O-N 2.96Å; W65-R67 PolarHBondContact O-N 3.05Å; W65-R67 VanDerWaalsContact O-N 3.1Å
68G96.6Very high97Very high33 Ų3371.5 Ų71.534%0.3436%0.356SS..Hα-helixtrans-69.9-52.3177.100000111.7W65 R70 R71 K72W65-G68 PolarHBondContact O-N 2.9Å; G68-R70 PolarHBondContact O-N 3.08Å; G68-R71 WeakPolarHBondContact O-CB 3.33Å; G68-R71 PolarHBondContact O-N 3.05Å; G68-R71 VanDerWaalsContact O-N 3.14Å; G68-K72 PolarHBondContact O-N 2.89Å; G68-K72 VanDerWaalsContact O-N 3.08Å
69Q97.6Very high96.8Very high65 Ų6579.5 Ų79.530%0.30439%0.386SS..Hα-helixtrans-65.5-40.3-175.6-55.3-56.2-14.200112.8W65 R71 K72 M73 L89W65-Q69 HydrophobicContact CD2-CG 4.26Å; W65-Q69 HydrophobicContact CH2-CG 4.41Å; W65-Q69 HydrophobicContact CZ2-CB 4.48Å; W65-Q69 HydrophobicContact CZ2-CG 3.78Å; Q69-R71 VanDerWaalsContact C-N 3.26Å; Q69-R71 PolarHBondContact O-N 2.77Å; Q69-K72 PolarHBondContact O-N 3.46Å; Q69-M73 WeakPolarHBondContact O-CG 3.43Å; Q69-M73 PolarHBondContact O-N 2.91Å; Q69-L89 HydrophobicContact CB-CD2 3.37Å; Q69-L89 HydrophobicContact CG-CD2 4.38Å
70R97.8Very high96.7Very high53 Ų5377.8 Ų77.820%0.238%0.378CS..Hα-helixtrans-58.4-37.9173.6-177.6-173.3-72.1101-0.9112.3S66 G68 A74 I85 L89S66-R70 WeakPolarHBondContact O-CB 3.49Å; S66-R70 PolarHBondContact O-N 3.14Å; S66-R70 PolarHBondContact O-NH1 3.27Å; S66-R70 VanDerWaalsContact O-NH1 3.07Å; S66-R70 PolarHBondContact OG-NH1 3.07Å; G68-R70 PolarHBondContact O-N 3.08Å; R70-A74 VanDerWaalsContact O-CB 3.23Å; R70-A74 WeakPolarHBondContact O-CB 3.34Å; R70-A74 PolarHBondContact O-N 3.1Å; R70-A74 VanDerWaalsContact O-N 3.07Å; R70-I85 HydrophobicContact CB-CG2 4.22Å; R70-I85 HydrophobicContact CG-CG2 3.9Å; R70-L89 HydrophobicContact CB-CD1 3.69Å; R70-L89 HydrophobicContact CG-CD1 4.48Å
71R97.6Very high96.6Very high170 Ų17080.2 Ų80.264%0.64239%0.386SS*.Hα-helixtrans-68-45.5177-179.4175.662.3-171.90.1111G68 Q69 A74 Q75G68-R71 WeakPolarHBondContact O-CB 3.33Å; G68-R71 PolarHBondContact O-N 3.05Å; G68-R71 VanDerWaalsContact O-N 3.14Å; Q69-R71 VanDerWaalsContact C-N 3.26Å; Q69-R71 PolarHBondContact O-N 2.77Å; R71-A74 PolarHBondContact O-N 2.91Å; R71-Q75 WeakPolarHBondContact O-CG 3.4Å; R71-Q75 PolarHBondContact O-N 3.19Å
72K97.3Very high96.4Very high107 Ų10783.3 Ų83.347%0.46540%0.4SS..Hα-helixtrans-56.6-55.3175.3-179.9-177.9170.6-176.50111.1G68 Q69 A74 Q75 E76G68-K72 PolarHBondContact O-N 2.89Å; G68-K72 VanDerWaalsContact O-N 3.08Å; Q69-K72 PolarHBondContact O-N 3.46Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.3Å; K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 PolarHBondContact O-N 2.97Å; K72-E76 WeakPolarHBondContact CE-OE1 3.47Å; K72-E76 WeakPolarHBondContact CG-OE1 3.4Å; K72-E76 IonicContact NZ-OE1 3.55Å; K72-E76 WeakPolarHBondContact O-CG 3.3Å; K72-E76 PolarHBondContact O-N 2.96Å
73M95.9Very high96.3Very high19 Ų1984.4 Ų84.49%0.09441%0.413CS..Hα-helixtrans-60.6-36.1-179.7-65.6-174.77900113.4Q69 N77 M80 I85 R88 L89Q69-M73 WeakPolarHBondContact O-CG 3.43Å; Q69-M73 PolarHBondContact O-N 2.91Å; M73-N77 WeakPolarHBondContact O-CB 3.35Å; M73-N77 PolarHBondContact O-N 3.24Å; M73-M80 HydrophobicContact CE-SD 4.48Å; M73-I85 HydrophobicContact CB-CG1 4.38Å; M73-I85 HydrophobicContact CB-CG2 4.01Å; M73-I85 HydrophobicContact SD-CG2 3.91Å; M73-R88 HydrophobicContact CE-CB 3.87Å; M73-R88 HydrophobicContact CE-CG 4.39Å; M73-L89 HydrophobicContact SD-CD2 3.55Å; M73-L89 VanDerWaalsContact SD-CD2 3.55Å; M73-L89 HydrophobicContact SD-CG 3.83Å
74A96.7Very high96.3Very high43 Ų4382.7 Ų82.736%0.35540%0.404SS..Hα-helixtrans-71.5-28.3176.800000113.2R70 R71 K72 N77 P78 I85R70-A74 VanDerWaalsContact O-CB 3.23Å; R70-A74 WeakPolarHBondContact O-CB 3.34Å; R70-A74 PolarHBondContact O-N 3.1Å; R70-A74 VanDerWaalsContact O-N 3.07Å; R71-A74 PolarHBondContact O-N 2.91Å; K72-A74 VanDerWaalsContact C-N 3.3Å; K72-A74 PolarHBondContact O-N 3.3Å; A74-N77 CarbonylContact O-C 3.5Å; A74-P78 WeakPolarHBondContact O-CA 3.42Å; A74-I85 HydrophobicContact CB-CD1 4.01Å
75Q96.7Very high96.3Very high137 Ų13781.5 Ų81.564%0.6440%0.397SS*.Hα-helixtrans-75.8-43.2173.2-73.1169.9-25.800111.2R71 K72 N77 P78R71-Q75 WeakPolarHBondContact O-CG 3.4Å; R71-Q75 PolarHBondContact O-N 3.19Å; K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 PolarHBondContact O-N 2.97Å; Q75-N77 VanDerWaalsContact C-N 3.33Å; Q75-P78 WeakPolarHBondContact O-CD 3.27Å
76E94.8Very high96.2Very high113 Ų11382.6 Ų82.653%0.52841%0.407SS..Hα-helixtrans-67.8-32.3176.5-68168.3167.700112.4K72K72-E76 WeakPolarHBondContact CE-OE1 3.47Å; K72-E76 WeakPolarHBondContact CG-OE1 3.4Å; K72-E76 IonicContact NZ-OE1 3.55Å; K72-E76 WeakPolarHBondContact O-CG 3.3Å; K72-E76 PolarHBondContact O-N 2.96Å
77N90.8Very high96.2Very high71 Ų7189.1 Ų89.138%0.3844%0.435SS..  trans-132.173.7-178.3-62.4-101.4000111.6M73 A74 Q75 K79 M80M73-N77 WeakPolarHBondContact O-CB 3.35Å; M73-N77 PolarHBondContact O-N 3.24Å; A74-N77 CarbonylContact O-C 3.5Å; Q75-N77 VanDerWaalsContact C-N 3.33Å; N77-K79 PolarHBondContact O-N 2.94Å; N77-M80 HydrophobicContact CB-CB 3.71Å; N77-M80 HydrophobicContact CB-CE 3.84Å; N77-M80 WeakPolarHBondContact O-CB 3.23Å; N77-M80 PolarHBondContact O-N 3.23Å
78P93Very high96.3Very high113 Ų11385.9 Ų85.973%0.73442%0.423SS*.THydrogen-bonded Turntrans-60.9-21.4-175.8-25.836.2000115A74 Q75A74-P78 WeakPolarHBondContact O-CA 3.42Å; Q75-P78 WeakPolarHBondContact O-CD 3.27Å
79K94.9Very high96.3Very high211 Ų21184.3 Ų84.392%0.91741%0.407SS*.THydrogen-bonded Turntrans-85.8-10.2175.6-64-178.3179.5178.30113.6N77N77-K79 PolarHBondContact O-N 2.94Å
80M94.2Very high96.4Very high36 Ų3682.4 Ų82.418%0.17741%0.405CS..SBendtrans-79.5123.5-176.7-170.6-176.9-65.200110.9M73 N77 E84 I85M73-M80 HydrophobicContact CE-SD 4.48Å; N77-M80 HydrophobicContact CB-CB 3.71Å; N77-M80 HydrophobicContact CB-CE 3.84Å; N77-M80 WeakPolarHBondContact O-CB 3.23Å; N77-M80 PolarHBondContact O-N 3.23Å; M80-E84 HydrophobicContact CG-CB 3.97Å; M80-E84 HydrophobicContact CG-CG 3.81Å; M80-E84 HydrophobicContact SD-CB 4.45Å; M80-E84 HydrophobicContact SD-CG 3.9Å; M80-I85 HydrophobicContact CB-CD1 4.47Å; M80-I85 HydrophobicContact CB-CG1 4.33Å; M80-I85 HydrophobicContact CG-CD1 4.49Å; M80-I85 HydrophobicContact CG-CG1 3.84Å; M80-I85 HydrophobicContact SD-CG1 3.57Å; M80-I85 VanDerWaalsContact SD-CG1 3.57Å
81H96.4Very high96.4Very high138 Ų13882.4 Ų82.464%0.63942%0.416SS*.  trans-71.6149.8-178.7-164.862.8000112.5S83 E84 I85H81-S83 PolarHBondContact CD2-OG 3.37Å; H81-S83 PolarHBondContact O-N 2.79Å; H81-S83 VanDerWaalsContact O-N 3.15Å; H81-E84 WeakPolarHBondContact O-CB 3.45Å; H81-E84 PolarHBondContact O-N 3.24Å; H81-I85 PolarHBondContact O-N 3.09Å
82N95.3Very high96.4Very high82 Ų8278 Ų7844%0.43940%0.403SS..Hα-helixtrans-61.6-28.3-172.5-162.8-74.9000113.9E84 S86N82-E84 VanDerWaalsContact C-N 3.32Å; N82-S86 VanDerWaalsContact O-CB 3.26Å; N82-S86 WeakPolarHBondContact O-CB 3.32Å; N82-S86 PolarHBondContact O-N 2.97Å; N82-S86 PolarHBondContact O-OG 2.62Å; N82-S86 PolarHBondContact OD1-OG 3.32Å
83S96.9Very high96.4Very high68 Ų6875 Ų7548%0.47639%0.389SS..Hα-helixtrans-66.1-34174.765.60000112.5H81 K87H81-S83 PolarHBondContact CD2-OG 3.37Å; H81-S83 PolarHBondContact O-N 2.79Å; H81-S83 VanDerWaalsContact O-N 3.15Å; S83-K87 WeakPolarHBondContact O-CE 3.3Å; S83-K87 WeakPolarHBondContact O-CG 3.41Å; S83-K87 PolarHBondContact O-N 3Å; S83-K87 VanDerWaalsContact O-N 3.08Å
84E97.6Very high96.5Very high54 Ų5482.3 Ų82.325%0.25242%0.42SS..Hα-helixtrans-74-46.6176-179.958.3-161.200110.9M80 H81 N82 S86 K87 R88M80-E84 HydrophobicContact CG-CB 3.97Å; M80-E84 HydrophobicContact CG-CG 3.81Å; M80-E84 HydrophobicContact SD-CB 4.45Å; M80-E84 HydrophobicContact SD-CG 3.9Å; H81-E84 WeakPolarHBondContact O-CB 3.45Å; H81-E84 PolarHBondContact O-N 3.24Å; N82-E84 VanDerWaalsContact C-N 3.32Å; E84-S86 VanDerWaalsContact C-N 3.3Å; E84-S86 PolarHBondContact O-N 3.15Å; E84-K87 WeakPolarHBondContact O-CB 3.43Å; E84-K87 PolarHBondContact O-N 3.36Å; E84-K87 VanDerWaalsContact O-N 3.15Å; E84-K87 VanDerWaalsContact OE2-CE 3.3Å; E84-K87 WeakPolarHBondContact OE2-CE 3.36Å; E84-K87 IonicContact OE2-NZ 2.72Å; E84-K87 PolarHBondContact OE2-NZ 3.15Å; E84-R88 PolarHBondContact O-N 3.2Å; E84-R88 VanDerWaalsContact O-N 3.09Å; E84-R88 IonicContact OE1-CZ 3.86Å; E84-R88 VanDerWaalsContact OE1-CZ 3.29Å; E84-R88 IonicContact OE1-NE 2.89Å; E84-R88 PolarHBondContact OE1-NE 3.09Å; E84-R88 IonicContact OE1-NH2 3.29Å; E84-R88 PolarHBondContact OE1-NH2 2.94Å
85I97.5Very high96.6Very high3 Ų387.2 Ų87.22%0.01544%0.439CS..Hα-helixtrans-54.8-48.2172.3-62.8171.5000110.1R70 M73 A74 M80 H81 K87 R88 L89R70-I85 HydrophobicContact CB-CG2 4.22Å; R70-I85 HydrophobicContact CG-CG2 3.9Å; M73-I85 HydrophobicContact CB-CG1 4.38Å; M73-I85 HydrophobicContact CB-CG2 4.01Å; M73-I85 HydrophobicContact SD-CG2 3.91Å; A74-I85 HydrophobicContact CB-CD1 4.01Å; M80-I85 HydrophobicContact CB-CD1 4.47Å; M80-I85 HydrophobicContact CB-CG1 4.33Å; M80-I85 HydrophobicContact CG-CD1 4.49Å; M80-I85 HydrophobicContact CG-CG1 3.84Å; M80-I85 HydrophobicContact SD-CG1 3.57Å; M80-I85 VanDerWaalsContact SD-CG1 3.57Å; H81-I85 PolarHBondContact O-N 3.09Å; I85-K87 VanDerWaalsContact C-N 3.32Å; I85-K87 PolarHBondContact O-N 3.19Å; I85-R88 PolarHBondContact O-N 3.28Å; I85-L89 HydrophobicContact CG2-CD1 3.74Å; I85-L89 HydrophobicContact CG2-CG 4.19Å; I85-L89 WeakPolarHBondContact O-CB 3.33Å; I85-L89 VanDerWaalsContact O-CG 3.27Å; I85-L89 WeakPolarHBondContact O-CG 3.34Å; I85-L89 PolarHBondContact O-N 2.96Å
86S97.9Very high96.6Very high39 Ų3982.3 Ų82.327%0.27342%0.417SS..Hα-helixtrans-66.9-29.6-179-62.50000113.5N82 E84 G90N82-S86 VanDerWaalsContact O-CB 3.26Å; N82-S86 WeakPolarHBondContact O-CB 3.32Å; N82-S86 PolarHBondContact O-N 2.97Å; N82-S86 PolarHBondContact O-OG 2.62Å; N82-S86 PolarHBondContact OD1-OG 3.32Å; E84-S86 VanDerWaalsContact C-N 3.3Å; E84-S86 PolarHBondContact O-N 3.15Å; S86-G90 PolarHBondContact O-N 2.98Å; S86-G90 VanDerWaalsContact O-N 3.13Å
87K98.2Very high96.8Very high136 Ų13680.5 Ų80.559%0.59141%0.414SS*.Hα-helixtrans-64.4-49.5170.7-86-177.4-83152.20111.4S83 E84 I85 G90 A91S83-K87 WeakPolarHBondContact O-CE 3.3Å; S83-K87 WeakPolarHBondContact O-CG 3.41Å; S83-K87 PolarHBondContact O-N 3Å; S83-K87 VanDerWaalsContact O-N 3.08Å; E84-K87 WeakPolarHBondContact O-CB 3.43Å; E84-K87 PolarHBondContact O-N 3.36Å; E84-K87 VanDerWaalsContact O-N 3.15Å; E84-K87 VanDerWaalsContact OE2-CE 3.3Å; E84-K87 WeakPolarHBondContact OE2-CE 3.36Å; E84-K87 IonicContact OE2-NZ 2.72Å; E84-K87 PolarHBondContact OE2-NZ 3.15Å; I85-K87 VanDerWaalsContact C-N 3.32Å; I85-K87 PolarHBondContact O-N 3.19Å; K87-G90 PolarHBondContact O-N 2.67Å; K87-A91 PolarHBondContact O-N 3.03Å
88R97.9Very high97.1Very high112 Ų11282.9 Ų82.942%0.42343%0.427SS..Hα-helixtrans-63-48.3-179.6-65.8177.6-172.4-152.32.1112.2M73 E84 I85 G90 A91 E92M73-R88 HydrophobicContact CE-CB 3.87Å; M73-R88 HydrophobicContact CE-CG 4.39Å; E84-R88 PolarHBondContact O-N 3.2Å; E84-R88 VanDerWaalsContact O-N 3.09Å; E84-R88 IonicContact OE1-CZ 3.86Å; E84-R88 VanDerWaalsContact OE1-CZ 3.29Å; E84-R88 IonicContact OE1-NE 2.89Å; E84-R88 PolarHBondContact OE1-NE 3.09Å; E84-R88 IonicContact OE1-NH2 3.29Å; E84-R88 PolarHBondContact OE1-NH2 2.94Å; I85-R88 PolarHBondContact O-N 3.28Å; R88-G90 PolarHBondContact O-N 3.31Å; R88-A91 WeakPolarHBondContact O-CA 3.39Å; R88-A91 WeakPolarHBondContact O-CB 3.33Å; R88-A91 PolarHBondContact O-N 2.65Å; R88-E92 PolarHBondContact O-N 3.41Å
89L98.1Very high97.4Very high0 Ų081.1 Ų81.10%042%0.422CS..Hα-helixtrans-58.8-33.7174.5-66.4178.6000112.8W65 Q69 R70 M73 I85 A91 W93W65-L89 HydrophobicContact CH2-CB 4.08Å; W65-L89 HydrophobicContact CH2-CD2 3.81Å; W65-L89 VanDerWaalsContact CH2-O 3.3Å; W65-L89 WeakPolarHBondContact CH2-O 3.49Å; W65-L89 HydrophobicContact CZ3-CB 3.91Å; W65-L89 HydrophobicContact CZ3-CD2 4.2Å; W65-L89 VanDerWaalsContact CZ3-O 3.27Å; W65-L89 WeakPolarHBondContact CZ3-O 3.45Å; Q69-L89 HydrophobicContact CB-CD2 3.37Å; Q69-L89 HydrophobicContact CG-CD2 4.38Å; R70-L89 HydrophobicContact CB-CD1 3.69Å; R70-L89 HydrophobicContact CG-CD1 4.48Å; M73-L89 HydrophobicContact SD-CD2 3.55Å; M73-L89 VanDerWaalsContact SD-CD2 3.55Å; M73-L89 HydrophobicContact SD-CG 3.83Å; I85-L89 HydrophobicContact CG2-CD1 3.74Å; I85-L89 HydrophobicContact CG2-CG 4.19Å; I85-L89 WeakPolarHBondContact O-CB 3.33Å; I85-L89 VanDerWaalsContact O-CG 3.27Å; I85-L89 WeakPolarHBondContact O-CG 3.34Å; I85-L89 PolarHBondContact O-N 2.96Å; L89-A91 VanDerWaalsContact C-N 3.3Å; L89-A91 PolarHBondContact O-N 2.99Å; L89-W93 VanDerWaalsContact O-CB 3.31Å; L89-W93 WeakPolarHBondContact O-CB 3.28Å; L89-W93 PolarHBondContact O-N 3.01Å
90G98.2Very high97.5Very high25 Ų2575.6 Ų75.626%0.25840%0.399SS..Hα-helixtrans-67.9-26.6174.400000114S86 K87 R88 K94S86-G90 PolarHBondContact O-N 2.98Å; S86-G90 VanDerWaalsContact O-N 3.13Å; K87-G90 PolarHBondContact O-N 2.67Å; R88-G90 PolarHBondContact O-N 3.31Å; G90-K94 WeakPolarHBondContact O-CG 3.32Å
91A98.2Very high97.7Very high53 Ų5375.3 Ų75.344%0.43840%0.397SS..Hα-helixtrans-80.6-49.8173.100000111K87 R88 L89 W93 K94 L95K87-A91 PolarHBondContact O-N 3.03Å; R88-A91 WeakPolarHBondContact O-CA 3.39Å; R88-A91 WeakPolarHBondContact O-CB 3.33Å; R88-A91 PolarHBondContact O-N 2.65Å; L89-A91 VanDerWaalsContact C-N 3.3Å; L89-A91 PolarHBondContact O-N 2.99Å; A91-W93 VanDerWaalsContact C-N 3.32Å; A91-W93 PolarHBondContact O-N 2.98Å; A91-K94 WeakPolarHBondContact O-CB 3.49Å; A91-K94 PolarHBondContact O-N 3.33Å; A91-L95 PolarHBondContact O-N 3.23Å
92E97.9Very high97.8Very high77 Ų7776.6 Ų76.636%0.3640%0.396SS..Hα-helixtrans-53.9-46.1175.9-72.9169.2-158.100112.1W65 R88 K94 L95 L96W65-E92 HydrophobicContact CH2-CB 3.86Å; W65-E92 HydrophobicContact CZ2-CB 4.18Å; R88-E92 PolarHBondContact O-N 3.41Å; E92-K94 PolarHBondContact O-N 3Å; E92-L95 PolarHBondContact O-N 3.18Å; E92-L96 PolarHBondContact O-N 3.26Å
93W98.3Very high98Very high46 Ų4676.3 Ų76.317%0.17440%0.399CS..Hα-helixtrans-59.2-30.3177.4179.5-101.4000113.9A61 F62 W65 L89 A91 L96 K101 F104A61-W93 HydrophobicContact CB-CH2 4.06Å; A61-W93 HydrophobicContact CB-CZ2 4.1Å; F62-W93 HydrophobicContact CB-CD2 4.42Å; F62-W93 HydrophobicContact CD2-CB 3.78Å; F62-W93 AromaticContact CD2-CD1 3.91Å; F62-W93 AromaticContact CD2-CD2 3.95Å; F62-W93 HydrophobicContact CD2-CD2 3.95Å; F62-W93 AromaticContact CD2-CG 3.57Å; F62-W93 HydrophobicContact CD2-CG 3.57Å; F62-W93 HydrophobicContact CE2-CB 3.95Å; F62-W93 HydrophobicContact CE2-CG 4.24Å; W65-W93 HydrophobicContact CB-CE3 4.05Å; W65-W93 HydrophobicContact CB-CZ3 3.62Å; W65-W93 AromaticContact CD2-CE3 3.5Å; W65-W93 HydrophobicContact CD2-CE3 3.5Å; W65-W93 AromaticContact CD2-CZ3 3.96Å; W65-W93 HydrophobicContact CD2-CZ3 3.96Å; W65-W93 HydrophobicContact CE3-CB 4.2Å; W65-W93 HydrophobicContact CE3-CD2 4.25Å; W65-W93 AromaticContact CE3-CE3 3.56Å; W65-W93 HydrophobicContact CE3-CE3 3.56Å; W65-W93 HydrophobicContact CE3-CZ3 4.33Å; W65-W93 AromaticContact CG-CE3 3.72Å; W65-W93 HydrophobicContact CG-CE3 3.72Å; W65-W93 AromaticContact CG-CZ3 3.63Å; W65-W93 HydrophobicContact CG-CZ3 3.63Å; W65-W93 HydrophobicContact CH2-CB 4.08Å; W65-W93 HydrophobicContact CZ3-CB 3.74Å; W65-W93 HydrophobicContact CZ3-CE3 4.24Å; L89-W93 VanDerWaalsContact O-CB 3.31Å; L89-W93 WeakPolarHBondContact O-CB 3.28Å; L89-W93 PolarHBondContact O-N 3.01Å; A91-W93 VanDerWaalsContact C-N 3.32Å; A91-W93 PolarHBondContact O-N 2.98Å; W93-L96 HydrophobicContact CE3-CD1 3.79Å; W93-L96 HydrophobicContact CZ3-CD1 4.2Å; W93-K101 HydrophobicContact CE3-CG 4.46Å; W93-K101 HydrophobicContact CH2-CB 3.94Å; W93-K101 HydrophobicContact CH2-CG 3.76Å; W93-K101 HydrophobicContact CZ2-CB 4.3Å; W93-K101 HydrophobicContact CZ2-CD 4.39Å; W93-K101 HydrophobicContact CZ2-CG 3.91Å; W93-K101 HydrophobicContact CZ3-CG 4.05Å; W93-K101 WeakPolarHBondContact O-CE 3.41Å; W93-F104 HydrophobicContact CH2-CB 4.22Å; W93-F104 HydrophobicContact CZ3-CB 4.4Å; W93-F104 HydrophobicContact CZ3-CD2 4.33Å
94K98Very high98Very high171 Ų17176.1 Ų76.174%0.74339%0.39SS*.Hα-helixtrans-73-36.7175.6-70.6175.4178.6-1750111.5G90 A91 E92G90-K94 WeakPolarHBondContact O-CG 3.32Å; A91-K94 WeakPolarHBondContact O-CB 3.49Å; A91-K94 PolarHBondContact O-N 3.33Å; E92-K94 PolarHBondContact O-N 3Å
95L97.9Very high98.1Very high147 Ų14776.6 Ų76.677%0.7739%0.393SS*.Hα-helixtrans-75.4-27.7-178.5-64.5173.2000113.5A91 E92A91-L95 PolarHBondContact O-N 3.23Å; E92-L95 PolarHBondContact O-N 3.18Å
96L97.8Very high98.1Very high34 Ų3479.6 Ų79.618%0.17841%0.409CS..SBendtrans-55.3139.4173.9-70.2174.6000111.5W65 E92 W93 E100 K101W65-L96 HydrophobicContact CD2-CD1 4.43Å; W65-L96 HydrophobicContact CZ2-CD1 3.94Å; E92-L96 PolarHBondContact O-N 3.26Å; W93-L96 HydrophobicContact CE3-CD1 3.79Å; W93-L96 HydrophobicContact CZ3-CD1 4.2Å; L96-E100 HydrophobicContact CB-CB 4.33Å; L96-E100 HydrophobicContact CD2-CB 4.12Å; L96-K101 HydrophobicContact CB-CG 4.07Å; L96-K101 WeakPolarHBondContact O-CE 2.96Å; L96-K101 PolarHBondContact O-NZ 2.75Å
97T98.4Very high98.1Very high75 Ų7580.7 Ų80.746%0.4641%0.41SS..  trans-68160.8172.1640000111.5A99 E100 K101T97-A99 PolarHBondContact O-N 3.07Å; T97-E100 WeakPolarHBondContact CB-OE2 3.34Å; T97-E100 WeakPolarHBondContact CG2-OE2 3.42Å; T97-E100 PolarHBondContact N-OE2 3.24Å; T97-E100 PolarHBondContact O-N 2.82Å; T97-E100 WeakPolarHBondContact OG1-CG 3.09Å; T97-E100 PolarHBondContact OG1-N 3.49Å; T97-E100 PolarHBondContact OG1-OE2 3.19Å; T97-K101 WeakPolarHBondContact O-CG 3.5Å; T97-K101 PolarHBondContact O-N 3.21Å
98D97.5Very high98.2Very high121 Ų12174.9 Ų74.965%0.64739%0.388SS*.Hα-helixtrans-66.5-24.5176.1-70.9-18.6000112.8K101 R102D98-K101 WeakPolarHBondContact OD1-CD 3.31Å; D98-K101 IonicContact OD1-NZ 3.43Å; D98-R102 WeakPolarHBondContact O-CB 3.1Å; D98-R102 PolarHBondContact O-N 3.22Å
99A98.1Very high98.2Very high76 Ų7675.4 Ų75.463%0.62839%0.393SS*.Hα-helixtrans-64.3-46.7170.700000111.7T97 R102 P103T97-A99 PolarHBondContact O-N 3.07Å; A99-R102 WeakPolarHBondContact O-CB 3.49Å; A99-R102 PolarHBondContact O-N 2.89Å; A99-P103 WeakPolarHBondContact O-CD 3.45Å
100E97.8Very high98.2Very high94 Ų9481.4 Ų81.444%0.43942%0.415SS..Hα-helixtrans-68.9-34.1177-67.4163.3109.900112.6L96 T97 R102 P103 F104L96-E100 HydrophobicContact CB-CB 4.33Å; L96-E100 HydrophobicContact CD2-CB 4.12Å; T97-E100 WeakPolarHBondContact CB-OE2 3.34Å; T97-E100 WeakPolarHBondContact CG2-OE2 3.42Å; T97-E100 PolarHBondContact N-OE2 3.24Å; T97-E100 PolarHBondContact O-N 2.82Å; T97-E100 WeakPolarHBondContact OG1-CG 3.09Å; T97-E100 PolarHBondContact OG1-N 3.49Å; T97-E100 PolarHBondContact OG1-OE2 3.19Å; E100-R102 VanDerWaalsContact C-N 3.35Å; E100-P103 WeakPolarHBondContact O-CD 3.48Å; E100-P103 WeakPolarHBondContact O-CG 3.45Å; E100-F104 VanDerWaalsContact O-CD2 3.28Å; E100-F104 WeakPolarHBondContact O-CD2 3.49Å; E100-F104 WeakPolarHBondContact O-CE2 3.33Å
101K98.3Very high98.2Very high30 Ų3082.4 Ų82.413%0.1342%0.415CS..Hα-helixtrans-69.9-30.5174.6-69.1162.5175.1147.10112.5W93 L96 T97 D98 F104 I105W93-K101 HydrophobicContact CE3-CG 4.46Å; W93-K101 HydrophobicContact CH2-CB 3.94Å; W93-K101 HydrophobicContact CH2-CG 3.76Å; W93-K101 HydrophobicContact CZ2-CB 4.3Å; W93-K101 HydrophobicContact CZ2-CD 4.39Å; W93-K101 HydrophobicContact CZ2-CG 3.91Å; W93-K101 HydrophobicContact CZ3-CG 4.05Å; W93-K101 WeakPolarHBondContact O-CE 3.41Å; L96-K101 HydrophobicContact CB-CG 4.07Å; L96-K101 WeakPolarHBondContact O-CE 2.96Å; L96-K101 PolarHBondContact O-NZ 2.75Å; T97-K101 WeakPolarHBondContact O-CG 3.5Å; T97-K101 PolarHBondContact O-N 3.21Å; D98-K101 WeakPolarHBondContact OD1-CD 3.31Å; D98-K101 IonicContact OD1-NZ 3.43Å; K101-F104 PolarHBondContact O-N 2.91Å; K101-F104 VanDerWaalsContact O-N 3.09Å; K101-I105 HydrophobicContact CB-CD1 3.86Å; K101-I105 HydrophobicContact CB-CG1 4.49Å; K101-I105 WeakPolarHBondContact O-CG1 2.97Å; K101-I105 PolarHBondContact O-N 3.13Å
102R98.4Very high98.2Very high165 Ų16588.4 Ų88.462%0.62343%0.426SS*.Hα-helixtrans-50.5-52-172.8-159.1167.3-175.9108.9-5.5115D98 A99 E100 F104 I105 D106D98-R102 WeakPolarHBondContact O-CB 3.1Å; D98-R102 PolarHBondContact O-N 3.22Å; A99-R102 WeakPolarHBondContact O-CB 3.49Å; A99-R102 PolarHBondContact O-N 2.89Å; E100-R102 VanDerWaalsContact C-N 3.35Å; R102-F104 VanDerWaalsContact C-N 3.27Å; R102-F104 PolarHBondContact O-N 2.86Å; R102-I105 WeakPolarHBondContact O-CB 3.27Å; R102-I105 PolarHBondContact O-N 3.08Å; R102-I105 VanDerWaalsContact O-N 3.11Å; R102-D106 PolarHBondContact O-N 3.41Å
103P98.4Very high98.2Very high77 Ų7787.5 Ų87.550%0.543%0.432SS..Hα-helixtrans-58.3-36.9178.121.6-34.2000113.2A99 E100 E107A99-P103 WeakPolarHBondContact O-CD 3.45Å; E100-P103 WeakPolarHBondContact O-CD 3.48Å; E100-P103 WeakPolarHBondContact O-CG 3.45Å; P103-E107 VanDerWaalsContact O-CB 3.32Å; P103-E107 WeakPolarHBondContact O-CB 3.26Å; P103-E107 PolarHBondContact O-N 2.67Å
104F98.4Very high98.2Very high64 Ų6487.9 Ų87.928%0.28144%0.439SS..Hα-helixtrans-76-29.8178.3-52.8-73.1000112.8A61 V64 W65 W93 E100 K101 R102 A108A61-F104 WeakPolarHBondContact CA-O 3.46Å; V64-F104 HydrophobicContact CG1-CD1 4.15Å; W65-F104 HydrophobicContact CB-CB 4.18Å; W65-F104 HydrophobicContact CB-CD1 3.77Å; W65-F104 HydrophobicContact CB-CD2 4.15Å; W65-F104 HydrophobicContact CB-CE1 4.21Å; W65-F104 HydrophobicContact CB-CG 3.74Å; W65-F104 AromaticContact CD1-CD2 3.89Å; W65-F104 AromaticContact CD1-CE2 3.59Å; W65-F104 AromaticContact CD1-CZ 3.7Å; W65-F104 HydrophobicContact CG-CD2 4.36Å; W65-F104 HydrophobicContact CG-CE2 4.43Å; W65-F104 HydrophobicContact CG-CG 4.41Å; W93-F104 HydrophobicContact CH2-CB 4.22Å; W93-F104 HydrophobicContact CZ3-CB 4.4Å; W93-F104 HydrophobicContact CZ3-CD2 4.33Å; E100-F104 VanDerWaalsContact O-CD2 3.28Å; E100-F104 WeakPolarHBondContact O-CD2 3.49Å; E100-F104 WeakPolarHBondContact O-CE2 3.33Å; K101-F104 PolarHBondContact O-N 2.91Å; K101-F104 VanDerWaalsContact O-N 3.09Å; R102-F104 VanDerWaalsContact C-N 3.27Å; R102-F104 PolarHBondContact O-N 2.86Å; F104-A108 VanDerWaalsContact O-CB 3.28Å; F104-A108 WeakPolarHBondContact O-CB 3.46Å; F104-A108 PolarHBondContact O-N 3.05Å
105I98.3Very high98.2Very high63 Ų6380.8 Ų80.832%0.32341%0.409SS..Hα-helixtrans-66.5-46.5171.4-70.7166.8000110.1A61 K101 R102 A108 K109A61-I105 HydrophobicContact CB-CB 4.47Å; A61-I105 HydrophobicContact CB-CG1 3.84Å; K101-I105 HydrophobicContact CB-CD1 3.86Å; K101-I105 HydrophobicContact CB-CG1 4.49Å; K101-I105 WeakPolarHBondContact O-CG1 2.97Å; K101-I105 PolarHBondContact O-N 3.13Å; R102-I105 WeakPolarHBondContact O-CB 3.27Å; R102-I105 PolarHBondContact O-N 3.08Å; R102-I105 VanDerWaalsContact O-N 3.11Å; I105-A108 PolarHBondContact O-N 3.24Å; I105-K109 WeakPolarHBondContact O-CG 3.43Å; I105-K109 PolarHBondContact O-N 3.11Å
106D98.6Very high98.2Very high66 Ų6680.1 Ų80.135%0.35340%0.403SS..Hα-helixtrans-71.7-37.3-178.2-66.8-28000111.9R102 A108 K109 R110R102-D106 PolarHBondContact O-N 3.41Å; D106-A108 PolarHBondContact O-N 3.48Å; D106-K109 WeakPolarHBondContact O-CB 3.4Å; D106-K109 PolarHBondContact O-N 3.26Å; D106-K109 WeakPolarHBondContact OD1-CE 3.28Å; D106-K109 IonicContact OD1-NZ 3.56Å; D106-K109 PolarHBondContact OD1-NZ 3.43Å; D106-R110 PolarHBondContact O-N 2.71Å
107E98.5Very high98.2Very high63 Ų6386.6 Ų86.629%0.29443%0.43SS..Hα-helixtrans-62.6-39.9169.8176.556.6-166.600112.2V64 P103 K109 R110 L111V64-E107 HydrophobicContact CG1-CB 4.39Å; V64-E107 HydrophobicContact CG1-CG 3.79Å; V64-E107 HydrophobicContact CG2-CG 4.49Å; P103-E107 VanDerWaalsContact O-CB 3.32Å; P103-E107 WeakPolarHBondContact O-CB 3.26Å; P103-E107 PolarHBondContact O-N 2.67Å; E107-K109 PolarHBondContact O-N 2.72Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 3.47Å; E107-R110 IonicContact OE1-CZ 2.79Å; E107-R110 IonicContact OE1-NE 3.5Å; E107-R110 IonicContact OE1-NH2 2.67Å; E107-R110 PolarHBondContact OE1-NH2 2.97Å; E107-R110 IonicContact OE2-CZ 2.62Å; E107-R110 IonicContact OE2-NE 2.71Å; E107-R110 PolarHBondContact OE2-NE 3.23Å; E107-R110 IonicContact OE2-NH2 3.55Å; E107-R110 PolarHBondContact OE2-NH2 3.25Å; E107-L111 HydrophobicContact CG-CD1 4.23Å; E107-L111 WeakPolarHBondContact O-CB 3.46Å; E107-L111 WeakPolarHBondContact O-CG 3.49Å; E107-L111 PolarHBondContact O-N 3.31Å
108A98.4Very high98.2Very high14 Ų1487.2 Ų87.212%0.11643%0.43CS..Hα-helixtrans-66.9-34.2174.700000113A61 V64 F104 I105 D106 R112A61-A108 HydrophobicContact CB-CB 4.11Å; A61-A108 VanDerWaalsContact N-CB 3.3Å; V64-A108 HydrophobicContact CG2-CB 4.37Å; F104-A108 VanDerWaalsContact O-CB 3.28Å; F104-A108 WeakPolarHBondContact O-CB 3.46Å; F104-A108 PolarHBondContact O-N 3.05Å; I105-A108 PolarHBondContact O-N 3.24Å; D106-A108 PolarHBondContact O-N 3.48Å; A108-R112 WeakPolarHBondContact O-CB 3.44Å; A108-R112 PolarHBondContact O-N 3.4Å
109K98.7Very high98.1Very high123 Ų12386.6 Ų86.654%0.53542%0.42SS..Hα-helixtrans-63.4-46.3169.8-68.3169.7-168.3160.30110.5I105 D106 E107 R112 A113I105-K109 WeakPolarHBondContact O-CG 3.43Å; I105-K109 PolarHBondContact O-N 3.11Å; D106-K109 WeakPolarHBondContact O-CB 3.4Å; D106-K109 PolarHBondContact O-N 3.26Å; D106-K109 WeakPolarHBondContact OD1-CE 3.28Å; D106-K109 IonicContact OD1-NZ 3.56Å; D106-K109 PolarHBondContact OD1-NZ 3.43Å; E107-K109 PolarHBondContact O-N 2.72Å; K109-R112 WeakPolarHBondContact O-CB 3.45Å; K109-R112 PolarHBondContact O-N 2.86Å; K109-A113 PolarHBondContact O-N 2.91Å
110R98.6Very high98Very high125 Ų12587.7 Ų87.747%0.47242%0.421SS..Hα-helixtrans-58.5-49.3177.7-167.5-165.468.6802.3111.3D106 E107 R112 A113 V114D106-R110 PolarHBondContact O-N 2.71Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 3.47Å; E107-R110 IonicContact OE1-CZ 2.79Å; E107-R110 IonicContact OE1-NE 3.5Å; E107-R110 IonicContact OE1-NH2 2.67Å; E107-R110 PolarHBondContact OE1-NH2 2.97Å; E107-R110 IonicContact OE2-CZ 2.62Å; E107-R110 IonicContact OE2-NE 2.71Å; E107-R110 PolarHBondContact OE2-NE 3.23Å; E107-R110 IonicContact OE2-NH2 3.55Å; E107-R110 PolarHBondContact OE2-NH2 3.25Å; R110-R112 VanDerWaalsContact C-N 3.3Å; R110-R112 PolarHBondContact O-N 2.89Å; R110-A113 PolarHBondContact O-N 2.94Å; R110-V114 WeakPolarHBondContact O-CG2 3.18Å; R110-V114 PolarHBondContact O-N 3.41Å
111L98.4Very high97.9Very high47 Ų4790.8 Ų90.825%0.24644%0.44CS..Hα-helixtrans-60.8-37.1176.3-70.7172.3000112.5M59 V64 E107 H115M59-L111 HydrophobicContact CB-CD1 4Å; V64-L111 HydrophobicContact CG2-CD1 3.75Å; E107-L111 HydrophobicContact CG-CD1 4.23Å; E107-L111 WeakPolarHBondContact O-CB 3.46Å; E107-L111 WeakPolarHBondContact O-CG 3.49Å; E107-L111 PolarHBondContact O-N 3.31Å; L111-H115 WeakPolarHBondContact O-CB 3.37Å; L111-H115 PolarHBondContact O-N 2.9Å
112R98Very high97.8Very high178 Ų17892.7 Ų92.767%0.67245%0.447SS*.Hα-helixtrans-67.3-41.3173.9-176.7-179.9177.8-178.3-2.2112.2A108 K109 R110 H115 M116A108-R112 WeakPolarHBondContact O-CB 3.44Å; A108-R112 PolarHBondContact O-N 3.4Å; K109-R112 WeakPolarHBondContact O-CB 3.45Å; K109-R112 PolarHBondContact O-N 2.86Å; R110-R112 VanDerWaalsContact C-N 3.3Å; R110-R112 PolarHBondContact O-N 2.89Å; R112-H115 PolarHBondContact O-N 3.17Å; R112-M116 WeakPolarHBondContact O-CB 3.48Å; R112-M116 PolarHBondContact O-N 2.89Å
113A98.2Very high97.6Very high59 Ų5992.5 Ų92.549%0.48845%0.451SS..Hα-helixtrans-66.1-46.7178.400000111.7K109 R110 H115 M116 K117K109-A113 PolarHBondContact O-N 2.91Å; R110-A113 PolarHBondContact O-N 2.94Å; A113-H115 PolarHBondContact O-N 3.27Å; A113-M116 PolarHBondContact O-N 3.44Å; A113-K117 PolarHBondContact O-N 2.91Å
114V98.1Very high97.5Very high54 Ų5495.1 Ų95.133%0.32745%0.452SS..Hα-helixtrans-56.1-50.1172.5170.40000110.3R110 M116 K117 D118R110-V114 WeakPolarHBondContact O-CG2 3.18Å; R110-V114 PolarHBondContact O-N 3.41Å; V114-M116 VanDerWaalsContact C-N 3.3Å; V114-M116 PolarHBondContact O-N 3.4Å; V114-K117 WeakPolarHBondContact O-CB 3.46Å; V114-K117 PolarHBondContact O-N 3.38Å; V114-K117 VanDerWaalsContact O-N 3.12Å; V114-D118 WeakPolarHBondContact CG1-OD2 3.39Å; V114-D118 WeakPolarHBondContact O-CB 3.48Å; V114-D118 PolarHBondContact O-N 3.19Å
115H98.3Very high97.3Very high22 Ų2299.7 Ų99.710%0.10247%0.471CS..Hα-helixtrans-60.2-36.2178.7-171.182.8000114V55 K56 P58 L111 R112 A113 Y119 Y122V55-H115 WeakPolarHBondContact CG1-CE1 3.19Å; K56-H115 PolarHBondContact O-CE1 3.02Å; P58-H115 HydrophobicContact CB-CB 3.9Å; P58-H115 HydrophobicContact CG-CB 4.18Å; L111-H115 WeakPolarHBondContact O-CB 3.37Å; L111-H115 PolarHBondContact O-N 2.9Å; R112-H115 PolarHBondContact O-N 3.17Å; A113-H115 PolarHBondContact O-N 3.27Å; H115-Y119 AromaticContact CE1-CD2 3.52Å; H115-Y119 AromaticContact CE1-CE2 3.94Å; H115-Y119 AromaticContact ND1-CD2 3.48Å; H115-Y119 WeakPolarHBondContact ND1-CD2 3.17Å; H115-Y119 AromaticContact ND1-CE2 3.77Å; H115-Y119 WeakPolarHBondContact O-CB 3.35Å; H115-Y119 WeakPolarHBondContact O-CD2 3.5Å; H115-Y119 PolarHBondContact O-N 2.98Å; H115-Y122 AromaticContact CD2-CD1 3.96Å; H115-Y122 AromaticContact NE2-CD1 3.49Å; H115-Y122 WeakPolarHBondContact NE2-CD1 3.4Å; H115-Y122 AromaticContact NE2-CD2 3.62Å; H115-Y122 AromaticContact NE2-CE1 3.7Å; H115-Y122 AromaticContact NE2-CE2 3.82Å; H115-Y122 AromaticContact NE2-CG 3.44Å; H115-Y122 AromaticContact NE2-CZ 3.84Å
116M97.6Very high97Very high133 Ų133100.9 Ų100.966%0.65548%0.483SS*.Hα-helixtrans-74.3-29.1178.1-168.6176.981.300112.5R112 A113 V114 P120R112-M116 WeakPolarHBondContact O-CB 3.48Å; R112-M116 PolarHBondContact O-N 2.89Å; A113-M116 PolarHBondContact O-N 3.44Å; V114-M116 VanDerWaalsContact C-N 3.3Å; V114-M116 PolarHBondContact O-N 3.4Å; M116-P120 WeakPolarHBondContact O-CA 3.43Å
117K97.9Very high96.6Very high170 Ų170106.3 Ų106.374%0.73950%0.499SS*.Hα-helixtrans-72.1-48.5171.1171.6-168.4159.3-173.40111.2A113 V114 Y119A113-K117 PolarHBondContact O-N 2.91Å; V114-K117 WeakPolarHBondContact O-CB 3.46Å; V114-K117 PolarHBondContact O-N 3.38Å; V114-K117 VanDerWaalsContact O-N 3.12Å; K117-Y119 VanDerWaalsContact C-N 3.32Å
118D97.1Very high96.3Very high87 Ų87114.6 Ų114.647%0.46553%0.527SS..Hα-helixtrans-74.8-25.6-173.9-58.9-15000111.9V114V114-D118 WeakPolarHBondContact CG1-OD2 3.39Å; V114-D118 WeakPolarHBondContact O-CB 3.48Å; V114-D118 PolarHBondContact O-N 3.19Å
119Y96.6Very high95.7Very high108 Ų108122.5 Ų122.542%0.42456%0.559SS.*  trans-132.974178.8-50.9-75.5000111V55 H115 K117 D121 Y122V55-Y119 HydrophobicContact CB-CD1 4.49Å; V55-Y119 HydrophobicContact CG1-CD1 3.92Å; V55-Y119 HydrophobicContact CG1-CD2 3.77Å; V55-Y119 HydrophobicContact CG1-CE1 4.14Å; V55-Y119 HydrophobicContact CG1-CE2 3.99Å; V55-Y119 HydrophobicContact CG1-CG 3.72Å; V55-Y119 HydrophobicContact CG2-CD1 3.68Å; V55-Y119 HydrophobicContact CG2-CE1 3.72Å; V55-Y119 HydrophobicContact CG2-CG 4.32Å; H115-Y119 AromaticContact CE1-CD2 3.52Å; H115-Y119 AromaticContact CE1-CE2 3.94Å; H115-Y119 AromaticContact ND1-CD2 3.48Å; H115-Y119 WeakPolarHBondContact ND1-CD2 3.17Å; H115-Y119 AromaticContact ND1-CE2 3.77Å; H115-Y119 WeakPolarHBondContact O-CB 3.35Å; H115-Y119 WeakPolarHBondContact O-CD2 3.5Å; H115-Y119 PolarHBondContact O-N 2.98Å; K117-Y119 VanDerWaalsContact C-N 3.32Å; Y119-D121 VanDerWaalsContact C-N 3.31Å; Y119-D121 PolarHBondContact O-N 3.46Å; Y119-Y122 WeakPolarHBondContact O-CB 3.47Å; Y119-Y122 PolarHBondContact O-N 3.02Å
120P95.9Very high95Very high100 Ų100123.1 Ų123.165%0.64957%0.573SS**THydrogen-bonded Turntrans-61.5-36.5-176.124-33.8000113M116 Y122M116-P120 WeakPolarHBondContact O-CA 3.43Å; P120-Y122 PolarHBondContact O-N 2.97Å
121D94.6Very high94.1Very high158 Ų158126.5 Ų126.585%0.84559%0.591SS**THydrogen-bonded Turntrans-80.58.2177.2-61.3-58.9000114Y119 K123Y119-D121 VanDerWaalsContact C-N 3.31Å; Y119-D121 PolarHBondContact O-N 3.46Å; D121-K123 PolarHBondContact O-N 3.15Å
122Y96.6Very high92.8Very high70 Ų70129.6 Ų129.628%0.27561%0.614SS.*  trans-65.4108.8-176.6-177.2-99.8000112.6V55 R57 H115 Y119 P120V55-Y122 HydrophobicContact CB-CD2 3.96Å; V55-Y122 HydrophobicContact CB-CE2 4.03Å; V55-Y122 HydrophobicContact CG1-CD2 3.48Å; V55-Y122 VanDerWaalsContact CG1-CD2 3.48Å; V55-Y122 HydrophobicContact CG1-CE2 3.68Å; V55-Y122 HydrophobicContact CG1-CG 4.46Å; V55-Y122 WeakPolarHBondContact O-CE2 3.49Å; R57-Y122 WeakPolarHBondContact CG-OH 3.38Å; H115-Y122 AromaticContact CD2-CD1 3.96Å; H115-Y122 AromaticContact NE2-CD1 3.49Å; H115-Y122 WeakPolarHBondContact NE2-CD1 3.4Å; H115-Y122 AromaticContact NE2-CD2 3.62Å; H115-Y122 AromaticContact NE2-CE1 3.7Å; H115-Y122 AromaticContact NE2-CE2 3.82Å; H115-Y122 AromaticContact NE2-CG 3.44Å; H115-Y122 AromaticContact NE2-CZ 3.84Å; Y119-Y122 WeakPolarHBondContact O-CB 3.47Å; Y119-Y122 PolarHBondContact O-N 3.02Å; P120-Y122 PolarHBondContact O-N 2.97Å
123K95.3Very high91.4Very high162 Ų162129.3 Ų129.370%0.70463%0.625SS**  trans-116.5119.8175.1-166.3163.8-173.9167.90111.8D121 K125D121-K123 PolarHBondContact O-N 3.15Å; K123-K125 PolarHBondContact O-N 3.26Å; K123-K125 VanDerWaalsContact O-N 3.12Å
124Y95.8Very high90Very high132 Ų132134.2 Ų134.252%0.51864%0.642SS.*  trans-67.1110.6174.2179.9-125.7000110.9R57 P126R57-Y124 HydrophobicContact CG-CD2 4.4Å; Y124-P126 HydrophobicContact CD1-CG 4.12Å; Y124-P126 HydrophobicContact CE1-CG 3.64Å
125K93.1Very high87.9Confident160 Ų160139.4 Ų139.470%0.69666%0.66SS**  trans-112.897.4176.3-64.8176.1-175.4175.70109.5K123 R127K123-K125 PolarHBondContact O-N 3.26Å; K123-K125 VanDerWaalsContact O-N 3.12Å; K125-R127 PolarHBondContact O-N 2.93Å
126P92.8Very high85.9Confident87 Ų87147.1 Ų147.157%0.56569%0.694SS**  trans-62.5129.9175.1-1828.6000111.3Y124 R128Y124-P126 HydrophobicContact CD1-CG 4.12Å; Y124-P126 HydrophobicContact CE1-CG 3.64Å; P126-R128 PolarHBondContact O-N 2.92Å
127R91.1Very high83.8Confident181 Ų181145.9 Ų145.968%0.68369%0.69SS**  trans-84.6106.2174.3-168.6175.6-168.5-89.48.7109.9K125 K129K125-R127 PolarHBondContact O-N 2.93Å; R127-K129 PolarHBondContact O-N 3.23Å
128R90.3Very high81.8Confident237 Ų237144.6 Ų144.689%0.89469%0.691SS**PPolyproline II helixtrans-64.8131.1166.5-62-179.678.51763.5108.2P126P126-R128 PolarHBondContact O-N 2.92Å
129K86.8Confident79.7Confident179 Ų179149.2 Ų149.278%0.77871%0.71SS**PPolyproline II helixtrans-95.2127.1165.8-66.5-175.3179.4-176.90107.3R127 K131R127-K129 PolarHBondContact O-N 3.23Å; K129-K131 PolarHBondContact O-N 3.48Å
130T83.4Confident77.4Confident137 Ų137152.5 Ų152.584%0.8473%0.731SS**PPolyproline II helixtrans-63.4127163.438.10000107.8P132T130-P132 WeakPolarHBondContact O-CD 3.48Å
131K79.6Confident75.4Confident195 Ų195151.9 Ų151.985%0.84874%0.735SS**PPolyproline II helixtrans-72.5125.4167.1-68.2-175.3178.7-178.10106.3K129 L133K129-K131 PolarHBondContact O-N 3.48Å; K131-L133 PolarHBondContact O-N 3Å; K131-L133 VanDerWaalsContact O-N 3.14Å
132P72.8Confident73.2Confident113 Ų113153.3 Ų153.373%0.73473%0.733SS**PPolyproline II helixtrans-59.1121168.4-19.632.2000107.8T130 L134T130-P132 WeakPolarHBondContact O-CD 3.48Å; P132-L134 VanDerWaalsContact C-N 3.35Å; P132-L134 PolarHBondContact O-N 2.97Å
133L67.8Low70.6Confident172 Ų172160 Ų16090%0.90176%0.759SS**  trans-64.6104.2161.2-80.6160.1000105.5K131 K135K131-L133 PolarHBondContact O-N 3Å; K131-L133 VanDerWaalsContact O-N 3.14Å; L133-K135 PolarHBondContact O-N 3.12Å
134L67.9Low68.2Low161 Ų161158.7 Ų158.784%0.84377%0.767SS**  trans-58113.9171.9-70173.8000106.9P132 K136P132-L134 VanDerWaalsContact C-N 3.35Å; P132-L134 PolarHBondContact O-N 2.97Å; L134-K136 PolarHBondContact O-N 2.86Å
135K55.3Low66Low164 Ų164160.2 Ų160.271%0.71378%0.784SS**  trans-60.7111.2178.4-165.7-179.6175.7-140.40107L133 D137L133-K135 PolarHBondContact O-N 3.12Å; K135-D137 WeakPolarHBondContact CD-OD2 3.47Å; K135-D137 WeakPolarHBondContact CE-OD1 3.21Å; K135-D137 WeakPolarHBondContact CE-OD2 3.13Å; K135-D137 IonicContact NZ-OD1 3.68Å; K135-D137 IonicContact NZ-OD2 2.74Å; K135-D137 PolarHBondContact NZ-OD2 2.98Å; K135-D137 PolarHBondContact O-N 3.27Å
136K55.3Low63.6Low184 Ų184158 Ų15880%0.879%0.788SS**  trans-78.859.3-176-169173.5174.9176.70110.1L134 N138L134-K136 PolarHBondContact O-N 2.86Å; K136-N138 PolarHBondContact O-N 3.04Å
137D54.7Low61.4Low107 Ų107159.2 Ų159.257%0.57281%0.806SS**  trans-77.1115.6170.8-69.3-18.4000108.1K135K135-D137 WeakPolarHBondContact CD-OD2 3.47Å; K135-D137 WeakPolarHBondContact CE-OD1 3.21Å; K135-D137 WeakPolarHBondContact CE-OD2 3.13Å; K135-D137 IonicContact NZ-OD1 3.68Å; K135-D137 IonicContact NZ-OD2 2.74Å; K135-D137 PolarHBondContact NZ-OD2 2.98Å; K135-D137 PolarHBondContact O-N 3.27Å
138N55Low59Low143 Ų143152.9 Ų152.977%0.76580%0.797SS**SBendtrans68.558.8157.1-150.113.6000120.2K136K136-N138 PolarHBondContact O-N 3.04Å
139Q52.9Low56.8Low183 Ų183148.8 Ų148.886%0.85579%0.793SS**  trans-128.138.6159.9-75.4-121.378.700112.4
140M49Very low54.7Low177 Ų177149 Ų14987%0.87280%0.802SS**  trans-109.38.5-178.4-149.2157.881.700114.2K142M140-K142 PolarHBondContact O-N 3Å
141A54Low52.8Low88 Ų88150.7 Ų150.773%0.72780%0.804SS**THydrogen-bonded Turntrans-96.732.7-175.100000114.7
142K48.4Very low51.1Low187 Ų187146 Ų14681%0.81380%0.802SS**THydrogen-bonded Turntrans-136.24.5177.5-79.2-161.6174.4-174.80117.2M140M140-K142 PolarHBondContact O-N 3Å
143Y41.4Very low49.4Very low210 Ų210145.2 Ų145.282%0.82481%0.805SS**  trans-141.8100.3171.8-65.2-75.1000111.2L145Y143-L145 PolarHBondContact O-N 2.98Å
144P45.8Very low48.4Very low135 Ų135142.4 Ų142.488%0.87781%0.807SS**  trans-82.298.6170.332.2-30000109.4
145L48.5Very low47Very low165 Ų165139 Ų13986%0.86480%0.801SS**  trans-103.7114.9165.5-96.2157.1000108.9Y143 A147Y143-L145 PolarHBondContact O-N 2.98Å; L145-A147 PolarHBondContact O-N 3.33Å
146S43.7Very low46.2Very low113 Ų113135.7 Ų135.779%0.7981%0.805SS**  trans-49.8121.8-174.8-177.70000113
147A45.5Very low45.1Very low113 Ų113136.6 Ų136.693%0.93481%0.812SS**  trans-10476.8160.100000108.4L145L145-A147 PolarHBondContact O-N 3.33Å
148G40.9Very low44.1Very low48 Ų48135.3 Ų135.350%0.49582%0.824SS.*  trans-135.5133.3176.900000110.9
149N43.6Very low43Very low151 Ų151138.3 Ų138.381%0.80783%0.834SS**  trans75.384.2174.4-59.48.4000117.7
150L42.9Very low42Very low184 Ų184133.5 Ų133.596%0.96383%0.833SS**  trans-130.453.8150.4-74.6179.3000111.1
151L44.2Very low41.1Very low171 Ų171128.7 Ų128.790%0.89583%0.829SS**SBendtrans-143.119.3173-16549.6000114.3
152A43.5Very low40.3Very low96 Ų96130.3 Ų130.379%0.79384%0.835SS**  trans-145.476.2-178.800000112.8
153A37.4Very low39.8Very low98 Ų98126.2 Ų126.281%0.8184%0.836SS**  trans-165.652163.600000112A155A153-A155 VanDerWaalsContact C-N 3.31Å; A153-A155 PolarHBondContact O-N 3.05Å
154A46.5Very low39.7Very low113 Ų113128.1 Ų128.193%0.93484%0.842SS**  trans-88.665.1169.900000110.8
155A39Very low39.5Very low88 Ų88130.5 Ų130.573%0.72784%0.844SS**SBendtrans-174.9153.316500000111.5A153A153-A155 VanDerWaalsContact C-N 3.31Å; A153-A155 PolarHBondContact O-N 3.05Å
156A37.4Very low38.9Very low96 Ų96129 Ų12979%0.79383%0.832SS**  trans73.1115.716500000119.8
157Q33.8Very low38.6Very low203 Ų203129 Ų12995%0.94983%0.832SS**  trans-17.4144152-60.8157-55.700118
158G32.2Very low38.1Very low80 Ų80133 Ų13383%0.82582%0.824SS**  trans165.3136158.100000115.7
159Q32Very low37.8Very low205 Ų205134.2 Ų134.296%0.95884%0.837SS**  trans-70.4153.6174.8-58.6166.18.600112.3
160G31.8Very low37.5Very low82 Ų82139.7 Ų139.785%0.84585%0.846SS**  trans141.6120.7148.100000118.9
161G30.8Very low37.4Very low77 Ų77133.6 Ų133.679%0.79483%0.828SS**  82.377.6126.400000121.3
162S38.1Very low37.6Very low122 Ų122132.1 Ų132.185%0.85383%0.829SS**  trans40.9122.4132.3-157.80000122.1
163A36.9Very low37.3Very low100 Ų100132.6 Ų132.683%0.82683%0.833SS**  178.7124.6119.300000112.4
164R39.3Very low37.3Very low251 Ų251131.6 Ų131.695%0.94783%0.832SS**  trans-147.1130147.482.6-178.8-169.9-179.81.7111.5
165M40.6Very low36.7Very low185 Ų185130 Ų13091%0.91183%0.827SS**  trans-93.2143.6-168.8-172.8177-175.600112.1
166E37.2Very low36.6Very low132 Ų132137.1 Ų137.162%0.61784%0.836SS**  trans4.8121.4157.3-145.161.2-127.400119Y168E166-Y168 HydrophobicContact CB-CE2 4.33Å; E166-Y168 HydrophobicContact CG-CD2 3.91Å; E166-Y168 HydrophobicContact CG-CE1 4.29Å; E166-Y168 HydrophobicContact CG-CE2 3.45Å; E166-Y168 VanDerWaalsContact CG-CE2 3.45Å; E166-Y168 HydrophobicContact CG-CG 4.49Å
167S36.2Very low36.8Very low113 Ų113137.2 Ų137.279%0.7984%0.837SS**  trans-127.2105.4161.5-175.40000109.2G169S167-G169 PolarHBondContact O-N 3.26Å
168Y36.2Very low37Very low198 Ų198131.2 Ų131.278%0.77683%0.829SS**  trans-6790.4-176-72.7-86000112.5E166E166-Y168 HydrophobicContact CB-CE2 4.33Å; E166-Y168 HydrophobicContact CG-CD2 3.91Å; E166-Y168 HydrophobicContact CG-CE1 4.29Å; E166-Y168 HydrophobicContact CG-CE2 3.45Å; E166-Y168 VanDerWaalsContact CG-CE2 3.45Å; E166-Y168 HydrophobicContact CG-CG 4.49Å
169G34.3Very low37.6Very low74 Ų74136.5 Ų136.576%0.76384%0.835SS**  trans-86107.417200000112.4S167 G171S167-G169 PolarHBondContact O-N 3.26Å; G169-G171 PolarHBondContact O-N 3.02Å
170W37.9Very low37.9Very low265 Ų265135.7 Ų135.7100%1.00483%0.831SS**  trans-67.6110.3170.2-88.969.9000111.1
171G40.9Very low38Very low56 Ų56137.8 Ų137.858%0.57782%0.823SS**  trans-124.6151.2169.300000111.2G169 A173G169-G171 PolarHBondContact O-N 3.02Å; G171-A173 PolarHBondContact O-N 3.12Å; G171-A173 VanDerWaalsContact O-N 3.14Å
172P46.5Very low38Very low141 Ų141143.6 Ų143.692%0.91683%0.829SS**  trans-77.3103.1-169.130.2-34.5000112.8
173A38.1Very low38Very low106 Ų106142 Ų14288%0.87682%0.823SS**  trans-78.1132.6163.500000110.4G171G171-A173 PolarHBondContact O-N 3.12Å; G171-A173 VanDerWaalsContact O-N 3.14Å
174G37.7Very low38.1Very low77 Ų77145.8 Ų145.879%0.79483%0.829SS**  trans171.125.8-17900000115.9
175G33.4Very low37.9Very low79 Ų79137 Ų13781%0.81482%0.817SS**PPolyproline II helixtrans-82.213217100000110.7
176Y37.5Very low37.6Very low238 Ų238139.8 Ų139.893%0.93382%0.819SS**PPolyproline II helixtrans-68.6131.6170.5-91.4-107.3000110
177A41.3Very low37.7Very low97 Ų97139.7 Ų139.780%0.80283%0.828SS**PPolyproline II helixtrans-74.8134.9167.200000109.7
178G38.8Very low37.8Very low77 Ų77142.7 Ų142.779%0.79483%0.829SS**PPolyproline II helixtrans-82.5154.3170.200000111.6
179M44.8Very low37.9Very low192 Ų192140.8 Ų140.895%0.94683%0.827SS**  trans-117.3120.7160.1-65.2-166.4100.400109.5
180Q37.9Very low38.1Very low187 Ų187143.6 Ų143.687%0.87482%0.824SS**  trans-65.4164.8153-83.5178.2-32.900109.4
181N33.7Very low38.3Very low127 Ų127139 Ų13968%0.67981%0.814SS**  cis179.9113.4-13.5162.432.6000105.8
182E31.4Very low38.1Very low198 Ų198147.5 Ų147.593%0.92583%0.828SS**  trans-138.2110.2172.6-68.5-171-137.300110.4
183A36.5Very low37.7Very low88 Ų88151 Ų15173%0.72783%0.825SS**  trans-102.8115.7178.800000110.4
184L40.7Very low37.7Very low180 Ų180151.7 Ų151.794%0.94281%0.814SS**  trans-129.5119.9158.4-70.1176.3000107
185G33.9Very low38.1Very low68 Ų68156.2 Ų156.270%0.70182%0.819SS**  trans-90.6171.2-166.300000114.2
186Y35.2Very low38.6Very low242 Ų242157.1 Ų157.195%0.94981%0.813SS**  trans-153.2148137.7-106.8-75.6000109.3
187T39.3Very low38.7Very low131 Ų131149.7 Ų149.780%0.80480%0.801SS**  trans-89.1146.2-177.153.70000111.2
188Q37.8Very low38.9Very low176 Ų176153 Ų15382%0.82280%0.804SS**  trans-153.4156.6155.4-110-68.435.800110.8
189Q38.6Very low38.8Very low157 Ų157157.7 Ų157.773%0.73481%0.805SS**  trans-98.5160.8-147.9-64-175.8-15.100116.1
190L38.3Very low38.4Very low133 Ų133158.5 Ų158.570%0.69680%0.799SS**  trans4.8133.6142.3-63.7164.2000117.4
191H41.1Very low39Very low168 Ų168155 Ų15578%0.77879%0.792SS**  -154.8123.292.5-82.4111.7000111
192R36.8Very low39.1Very low236 Ų236157.9 Ų157.989%0.89180%0.802SS**  trans-96.9111.3174.2173.8-173.2-176.2172.91107.4
193Y38.4Very low39.5Very low215 Ų215152.2 Ų152.284%0.84379%0.789SS**  trans-85144169.8-91.1-79.4000111.9
194D39.5Very low39.8Very low119 Ų119156.3 Ų156.364%0.63680%0.795SS**  trans-83.4143.7-175.4-179.514.6000111.3S196D194-S196 VanDerWaalsContact CG-OG 3.29Å; D194-S196 VanDerWaalsContact OD1-CB 3.24Å; D194-S196 WeakPolarHBondContact OD1-CB 3.48Å; D194-S196 PolarHBondContact OD1-N 3.47Å; D194-S196 PolarHBondContact OD1-OG 3.46Å; D194-S196 PolarHBondContact OD2-OG 3.36Å
195L45.5Very low40Very low173 Ų173154 Ų15491%0.90679%0.788SS**  trans-142.842.3172.3-103.1166.1000110.3A197L195-A197 VanDerWaalsContact C-N 3.29Å; L195-A197 PolarHBondContact O-N 3.39Å; L195-A197 VanDerWaalsContact O-N 3.11Å
196S43.3Very low40.3Very low98 Ų98155.4 Ų155.469%0.68579%0.794SS**  trans-8263.1174.158.30000112.9D194D194-S196 VanDerWaalsContact CG-OG 3.29Å; D194-S196 VanDerWaalsContact OD1-CB 3.24Å; D194-S196 WeakPolarHBondContact OD1-CB 3.48Å; D194-S196 PolarHBondContact OD1-N 3.47Å; D194-S196 PolarHBondContact OD1-OG 3.46Å; D194-S196 PolarHBondContact OD2-OG 3.36Å
197A39.7Very low40.5Very low82 Ų82148.5 Ų148.568%0.67879%0.787SS**  trans-150.692.9169.600000112.5L195L195-A197 VanDerWaalsContact C-N 3.29Å; L195-A197 PolarHBondContact O-N 3.39Å; L195-A197 VanDerWaalsContact O-N 3.11Å
198L44.9Very low40.6Very low167 Ų167150.1 Ų150.187%0.87479%0.785SS**  trans179.392.1132.4-95174000109.6
199Q38.2Very low40.9Very low175 Ų175147 Ų14782%0.81878%0.778SS**  trans-81.7120.8175176.786.714.400109.9
200Y36.7Very low41.1Very low208 Ų208149 Ų14982%0.81678%0.78SS**  trans-139.3148.9158-92-81.2000110.5
201P50Low41.2Very low113 Ų113150.8 Ų150.873%0.73479%0.787SS**  trans-92.2156.6-149.835-36.3000115.6
202Q34.6Very low41.2Very low189 Ų189150.9 Ų150.988%0.88379%0.794SS**  trans-80.2141.2177.3-164.5-170-14.300111.9
203A40Very low41.1Very low79 Ų79143.1 Ų143.165%0.65379%0.787SS**  trans-145.3150.9163.600000111.3
204M42.9Very low41.1Very low173 Ų173137.2 Ų137.285%0.85278%0.783SS**  trans78.984.6172.8-49.2-47.8170.800118.2
205T45.2Very low41Very low131 Ų131139.7 Ų139.780%0.80480%0.796SS**  trans-21.7154.2144.343.50000120.5
206A39.5Very low40.7Very low99 Ų99138.2 Ų138.282%0.81879%0.794SS**  trans82.185141.700000120.2
207A40.6Very low40.2Very low96 Ų96143.3 Ų143.379%0.79380%0.8SS**  trans-148.4103.5138.300000111.5
208Q40Very low40.1Very low166 Ų166145.2 Ų145.278%0.77681%0.808SS**  trans44.999.9131.9-59.9-70.7-1.200118.6
209T44.9Very low40.4Very low109 Ų109141.9 Ų141.967%0.66980%0.796SS**  16.2116.5115.9-52.40000116.5
210Y42Very low40.4Very low200 Ų200142.6 Ų142.678%0.78480%0.802SS**  -174.7135.5124.5-101.1-67.5000111.2
211M41.1Very low40.3Very low171 Ų171137.5 Ų137.584%0.84280%0.797SS**  trans67.468.4161.7-56.5-62.8166.100118.7
212N42.3Very low39.4Very low170 Ų170143 Ų14391%0.90981%0.805SS**  trans-113.2101.7146.1-167.1-14.4000108.2
213G34.4Very low39.2Very low73 Ų73139.9 Ų139.975%0.75380%0.804SS**  trans-111.9103.9-17400000111.5
214A37.4Very low39Very low91 Ų91141.4 Ų141.475%0.75281%0.81SS**PPolyproline II helixtrans-76.4143.1175.300000111.6
215N38.8Very low38.4Very low171 Ų171139 Ų13991%0.91481%0.81SS**PPolyproline II helixtrans-79.8128.7173.9-107.211.2000111
216T37.7Very low37.9Very low141 Ų141138.6 Ų138.687%0.86581%0.807SS**PPolyproline II helixtrans-87149.4-179.7-510000112.6
217Y33.4Very low37.8Very low206 Ų206143.3 Ų143.381%0.80881%0.812SS**PPolyproline II helixtrans-73.1150.5-174.1-134.7-108.7000114.6P219Y217-P219 HydrophobicContact CE1-CG 4.35Å
218S37.1Very low37.7Very low122 Ų122147.3 Ų147.385%0.85382%0.815SS**  trans-176.9125.6134.6-82.20000112.5
219P52.4Low38.2Very low97 Ų97144.1 Ų144.163%0.6381%0.809SS**  trans-101.8154.5173.237.8-31.5000112.6Y217Y217-P219 HydrophobicContact CE1-CG 4.35Å
220M37.4Very low37.5Very low189 Ų189144 Ų14493%0.93181%0.812SS**  trans-147.2163.9164.3-141.767.4178.900111.2
221S33.8Very low38Very low102 Ų102139.7 Ų139.771%0.71381%0.808SS**  trans-110.9163.8-140.849.60000117.7
222Y31.1Very low38Very low228 Ų228137.1 Ų137.189%0.89480%0.802SS**  trans-23.2141.6168.2-81.4-99.4000119.1
223S32Very low37.8Very low124 Ų124136.6 Ų136.687%0.86780%0.796SS**  -148.5143.9125.768.70000111.3
224S34.4Very low38.2Very low111 Ų111138.4 Ų138.478%0.77680%0.797SS**  trans-106.1146.9-172.453.30000112.6
225S30.3Very low38.6Very low122 Ų122143.1 Ų143.185%0.85381%0.806SS**  trans-152.8156.9142.479.40000112.9
226T34.9Very low38.7Very low122 Ų122141.6 Ų141.675%0.74880%0.802SS**  trans-103.6155.7-171.346.30000111.9
227Q37.3Very low38.6Very low198 Ų198143.7 Ų143.793%0.92580%0.8SS**  trans-168.7170.1131.7-107.4161.4110.400115.4
228Q38.5Very low39.3Very low180 Ų180139.1 Ų139.184%0.84180%0.795SS**  trans-97.6172.9-153.8-72.5-76.3-6.200114.5
229P50.2Low39.3Very low100 Ų100141.7 Ų141.765%0.64979%0.794SS**  trans-106.5-173.4-166.841.5-37.4000115.7
230S31.6Very low39Very low107 Ų107143 Ų14375%0.74880%0.802SS**  trans104.1165.3159.7-48.70000116.5
231P53Low39.1Very low108 Ų108139 Ų13970%0.70179%0.788SS**  cis-141.1174.9-39.533.1-13.2000116.3
232V40.2Very low39.4Very low117 Ų117139.9 Ų139.971%0.70980%0.795SS**  trans53.9142.7152.4-660000124.1
233M38Very low39.8Very low159 Ų159137.1 Ų137.178%0.78379%0.789SS**  151.596.3127.9-75.2-44.7178.400108.2
234S41.8Very low40Very low111 Ų111136.7 Ų136.778%0.77679%0.786SS**  50.189.581.4-167.50000114.3
235M46.2Very low40.9Very low190 Ų190137.5 Ų137.594%0.93679%0.789SS**  trans-139.6133.8150.8-70.4-159.5-168.900110.4
236V41.5Very low41.5Very low139 Ų139138.6 Ų138.684%0.84279%0.791SS**  trans-106.2-172.4-176.574.80000110.1
237K36.3Very low41.5Very low186 Ų186136.8 Ų136.881%0.80980%0.797SS**  trans93.9154.9162.4-114.2-179.5177.3176.20116.1
238P47.3Very low41.4Very low110 Ų110130.8 Ų130.871%0.71479%0.787SS**  -132.6176.4-82.343.4-31000114.6
239E36.8Very low42Very low175 Ų175129 Ų12982%0.81879%0.791SS**  trans-70.5155.9162-74.2-163.1140.100113.2
240P46.1Very low41.5Very low125 Ų125130.1 Ų130.181%0.81279%0.792SS**  trans-109.1120.7151.634.1-24.2000112.5
241V39.6Very low41.9Very low104 Ų104131.9 Ų131.963%0.6379%0.788SS**  trans-76.1154.3165.9-81.30000111.9
242S40.1Very low41.3Very low122 Ų122136.1 Ų136.185%0.85380%0.798SS**  trans-155146.3159.5-82.40000111.6
243H39.1Very low41.1Very low169 Ų169142.4 Ų142.478%0.78281%0.809SS**  trans-112.3159.7-162.9-54.3-91000112.6
244S37.7Very low40.8Very low115 Ų115137.7 Ų137.780%0.80480%0.801SS**  trans-72.3170.3174.8-45.80000112.9
245P53Low41.2Very low128 Ų128138.7 Ų138.783%0.83181%0.805SS**  -140.8-174.5112.735.1-19.3000115.8
246T43.3Very low41.4Very low146 Ų146137.7 Ų137.790%0.89680%0.802SS**  trans-94.2161.3-159.346.40000116.7
247G33.3Very low41.7Very low84 Ų84140.1 Ų140.187%0.86681%0.805SS**  trans174.2130.815600000114.1
248G35.3Very low42.6Very low71 Ų71134.1 Ų134.173%0.73280%0.795SS**  trans-134.4164.1168.200000110.5
249P51Low43.6Very low142 Ų142133.3 Ų133.392%0.92279%0.785SS**  -139.6-176.1125.535.5-20.5000113.9
250N40.7Very low45.2Very low125 Ų125130.1 Ų130.167%0.66877%0.773SS**  trans-112.8172.9-159.9-166.34.6000112.7
251H40.1Very low46.1Very low144 Ų144133.2 Ų133.267%0.66777%0.769SS**  trans79.1135.8175.6-39.7-59.8000113.7
252H40Very low47.3Very low196 Ų196133.6 Ų133.691%0.90777%0.767SS**  cis-131.3169.149.1-61.2-69.6000117
253R36.3Very low49.1Very low250 Ų250133.3 Ų133.394%0.94375%0.753SS**  trans-100.5126.7-165179.7-177.6-174.9172.81.3111
254G31.9Very low50.4Low59 Ų59129.6 Ų129.661%0.60874%0.738SS**  trans-113.1153.1170.200000111.4L256G254-L256 PolarHBondContact O-N 3.41Å
255P49.9Very low51.9Low133 Ų133128 Ų12886%0.86473%0.727SS**SBendtrans-92.851.9-151.838.2-39.4000115
256L50.2Low52.9Low168 Ų168128.8 Ų128.888%0.8872%0.722SS**  trans-143.573172.4-74.6-179.8000112.3G254G254-L256 PolarHBondContact O-N 3.41Å
257Q48.6Very low54Low191 Ų191130.3 Ų130.389%0.89371%0.712SS**  trans-154.6103.1158.9-122.3167.52.400109.1
258G54.2Low55.7Low59 Ų59131.5 Ų131.561%0.60870%0.698SS**  trans-63.6131154.700000107.1L260G258-L260 PolarHBondContact O-N 3.19Å
259D68.3Low56.5Low93 Ų93134.3 Ų134.350%0.49770%0.703SS.*  trans-59.5138.9177.2-168.6-15.4000108.2R261 D262 M263D259-R261 HydrophobicContact CB-CB 4.27Å; D259-R261 PolarHBondContact O-N 3.02Å; D259-R261 VanDerWaalsContact O-N 3.09Å; D259-R261 PolarHBondContact OD1-N 3.47Å; D259-D262 PolarHBondContact O-N 3.2Å; D259-M263 PolarHBondContact O-N 2.91Å; D259-M263 VanDerWaalsContact O-N 3.12Å
260L70.6Confident56.6Low108 Ų108131.1 Ų131.157%0.56570%0.696SS**Hα-helixtrans-57-25.6173.4-176.162.8000110.4G258 M263 I264G258-L260 PolarHBondContact O-N 3.19Å; L260-M263 HydrophobicContact CD1-CE 4.3Å; L260-M263 HydrophobicContact CD1-SD 4.14Å; L260-M263 PolarHBondContact O-N 3.18Å; L260-I264 HydrophobicContact CD1-CD1 4.48Å; L260-I264 HydrophobicContact CG-CD1 4.02Å; L260-I264 WeakPolarHBondContact O-CD1 3.22Å; L260-I264 VanDerWaalsContact O-CG1 3.23Å; L260-I264 WeakPolarHBondContact O-CG1 3.11Å; L260-I264 PolarHBondContact O-N 3.14Å
261R64.8Low56.7Low191 Ų191128.3 Ų128.372%0.72170%0.697SS**Hα-helixtrans-62.3-46.1172.8-147.8163.6-172.3-108.6-2.6113.2D259 I264 S265D259-R261 HydrophobicContact CB-CB 4.27Å; D259-R261 PolarHBondContact O-N 3.02Å; D259-R261 VanDerWaalsContact O-N 3.09Å; D259-R261 PolarHBondContact OD1-N 3.47Å; R261-I264 PolarHBondContact O-N 3.14Å; R261-S265 PolarHBondContact O-N 2.74Å; R261-S265 VanDerWaalsContact O-N 3.08Å; R261-S265 PolarHBondContact O-OG 3.31Å
262D65.4Low56.8Low112 Ų112129.4 Ų129.460%0.59971%0.707SS**Hα-helixtrans-68.3-38175.7-68.4-22.6000111.3D259 I264 S265 M266D259-D262 PolarHBondContact O-N 3.2Å; D262-I264 VanDerWaalsContact C-N 3.27Å; D262-I264 PolarHBondContact O-N 3.01Å; D262-S265 PolarHBondContact O-N 2.84Å; D262-M266 PolarHBondContact O-N 3.35Å
263M78.2Confident57.3Low115 Ų115124.6 Ų124.657%0.56770%0.702SS**Hα-helixtrans-63-32.8177-162.1-172.2-50.600112.4D259 L260 Y267D259-M263 PolarHBondContact O-N 2.91Å; D259-M263 VanDerWaalsContact O-N 3.12Å; L260-M263 HydrophobicContact CD1-CE 4.3Å; L260-M263 HydrophobicContact CD1-SD 4.14Å; L260-M263 PolarHBondContact O-N 3.18Å; M263-Y267 WeakPolarHBondContact O-CD2 3.45Å
264I65.8Low57.5Low91 Ų91118.2 Ų118.247%0.46770%0.695SS.*Hα-helixtrans-78.8-41.4176.2-69.9165.2000111.1L260 R261 D262 M266 Y267 I268L260-I264 HydrophobicContact CD1-CD1 4.48Å; L260-I264 HydrophobicContact CG-CD1 4.02Å; L260-I264 WeakPolarHBondContact O-CD1 3.22Å; L260-I264 VanDerWaalsContact O-CG1 3.23Å; L260-I264 WeakPolarHBondContact O-CG1 3.11Å; L260-I264 PolarHBondContact O-N 3.14Å; R261-I264 PolarHBondContact O-N 3.14Å; D262-I264 VanDerWaalsContact C-N 3.27Å; D262-I264 PolarHBondContact O-N 3.01Å; I264-M266 PolarHBondContact O-N 3.15Å; I264-Y267 PolarHBondContact O-N 3.02Å; I264-I268 HydrophobicContact CG2-CD1 4.14Å
265S68.5Low57.8Low82 Ų82121.6 Ų121.657%0.57370%0.699SS**Hα-helixtrans-57.4-31.6177.9-71.10000113.4R261 D262 Y267R261-S265 PolarHBondContact O-N 2.74Å; R261-S265 VanDerWaalsContact O-N 3.08Å; R261-S265 PolarHBondContact O-OG 3.31Å; D262-S265 PolarHBondContact O-N 2.84Å; S265-Y267 PolarHBondContact O-N 3.39Å
266M74.4Confident57.5Low144 Ų144121.7 Ų121.771%0.70970%0.7SS**THydrogen-bonded Turntrans-69.1-15.6179-154.6-171.571.500114.1D262 I264D262-M266 PolarHBondContact O-N 3.35Å; I264-M266 PolarHBondContact O-N 3.15Å
267Y66.9Low57.1Low179 Ų179117.6 Ų117.670%0.70269%0.69SS**THydrogen-bonded Turntrans-1116.1-178.2-74.7-84000114.3M263 I264 S265M263-Y267 WeakPolarHBondContact O-CD2 3.45Å; I264-Y267 PolarHBondContact O-N 3.02Å; S265-Y267 PolarHBondContact O-N 3.39Å
268I68.3Low56.6Low109 Ų109113 Ų11356%0.55969%0.685SS**  trans-117.399.1174.1-57-175.6000109.1I264 G270I264-I268 HydrophobicContact CG2-CD1 4.14Å; I268-G270 PolarHBondContact O-N 3.11Å
269P52.3Low56.3Low130 Ų130119.4 Ų119.484%0.84470%0.699SS**SBendtrans-71.3113.3175.1-14.830000110.5
270G53.6Low55.1Low75 Ų75127 Ų12777%0.77372%0.721SS**  trans95.792.6176.200000113.3I268I268-G270 PolarHBondContact O-N 3.11Å
271G41.9Very low53.3Low66 Ų66125.8 Ų125.868%0.6873%0.734SS**  trans-174.267.5179.300000109.6
272D42Very low52.1Low166 Ų166119.9 Ų119.989%0.88873%0.732SS**  trans-60.2132.3-179.954.4-57.3000112.2
273A51.9Low50.7Low96 Ų96125.5 Ų125.579%0.79375%0.747SS**  trans-144.559-178.800000112
274S40.9Very low48.8Very low116 Ų116124.4 Ų124.481%0.81175%0.75SS**  trans-173.297.4154.547.90000113.3
275D37.9Very low47.6Very low129 Ų129125.9 Ų125.969%0.6976%0.763SS**  trans-148.8108.9143.7-162.2-16.2000111.9A277D275-A277 WeakPolarHBondContact OD1-CB 3.24Å; D275-A277 PolarHBondContact OD1-N 2.86Å
276P43.9Very low46.3Very low135 Ų135129.1 Ų129.188%0.87777%0.77SS**  trans-93.429.8173.137.9-33.6000113.5
277A40.5Very low44.8Very low82 Ų82131 Ų13168%0.67878%0.776SS**  trans-121.532.4-174.900000116.1D275D275-A277 WeakPolarHBondContact OD1-CB 3.24Å; D275-A277 PolarHBondContact OD1-N 2.86Å
278A38.7Very low43.4Very low94 Ų94128.1 Ų128.178%0.77777%0.769SS**  trans-120.942.5-179.400000115.4
279Q46.6Very low42.1Very low195 Ų195133.7 Ų133.791%0.91179%0.785SS**  trans-106.182.7159.3-81.8-164.138.900111.2
280R44Very low41.8Very low253 Ų253134.5 Ų134.596%0.95578%0.781SS**  trans-167140149.2-83.3-136.8176.4-155.7-1.9111.3
281G33.2Very low41.1Very low82 Ų82136.2 Ų136.285%0.84578%0.782SS**  trans101.58616000000115.5
282G38.2Very low41Very low66 Ų66136.9 Ų136.968%0.6879%0.788SS**  trans-99.2121.9160.700000110.7
283Y37.6Very low41.4Very low230 Ų230135.1 Ų135.190%0.90278%0.784SS**  trans-170.1152.3163.5-73-59.7000106.9
284S38.1Very low41.5Very low92 Ų92137.2 Ų137.264%0.64379%0.786SS**  cis-171.6175.2-21.355.70000107.8
285V39.7Very low42.4Very low122 Ų122137 Ų13774%0.73978%0.783SS**  trans71.1136.8161.7176.70000115.2
286Q41.7Very low42.9Very low151 Ų151138.3 Ų138.371%0.70679%0.789SS**  cis-148.8155.82.6-139.3161.4-3500110.5H288Q286-H288 PolarHBondContact NE2-CD2 2.71Å; Q286-H288 PolarHBondContact NE2-NE2 3.26Å
287Q42.5Very low43.4Very low182 Ų182137.5 Ų137.585%0.8579%0.786SS**  trans-114.3116.4170.2-82.6-82.12500110.3
288H38.1Very low43.7Very low119 Ų119142 Ų14255%0.55179%0.793SS**  trans-147.1133.3165.5-66.7-91000106Q286Q286-H288 PolarHBondContact NE2-CD2 2.71Å; Q286-H288 PolarHBondContact NE2-NE2 3.26Å
289Y40.2Very low44.3Very low227 Ų227149 Ų14989%0.8981%0.814SS**  cis-132.3167.744-95.1-100.7000115.3
290L45.7Very low44.2Very low147 Ų147146.7 Ų146.777%0.7781%0.81SS**  trans-88.4150.8-173.7-70.2106.3000115.1
291S39.6Very low44.2Very low111 Ų111141.1 Ų141.178%0.77680%0.802SS**  trans50118.7132.2-158.50000120.9
292G40.5Very low44.8Very low80 Ų80144.4 Ų144.483%0.82580%0.799SS**  trans-147.5126.7157.400000109.5
293T49.9Very low45.2Very low129 Ų129149 Ų14979%0.79181%0.806SS**  trans-94.8149.5-161.752.20000114.9
294V54.6Low45.7Very low139 Ų139143.9 Ų143.984%0.84280%0.8SS**  trans-76.4145.4169.8-137.90000111.6
295P58.7Low46.2Very low113 Ų113147.4 Ų147.473%0.73481%0.811SS**  -140145.4111.935.1-21.2000111.7
296L48.3Very low46.6Very low156 Ų156149.2 Ų149.282%0.81782%0.816SS**  65.595.760-165.182.2000115.6
297S54.1Low47Very low117 Ų117149.1 Ų149.182%0.81883%0.825SS**  trans-175.8160.3138.748.60000112.3
298H48.5Very low47.4Very low178 Ų178146.3 Ų146.382%0.82482%0.822SS**  trans-84.6149-175.8-62.310.5000114
299I50.4Low48.2Very low240 Ų240148.8 Ų148.8100%1.23185%0.847SS**  169.30113.8-88171.5000108.6

Retrieved 299 of 299 residues in 824.6 ms (Link to these results)