A0A077Z429_TRITR Loading...

Forkhead box protein F1

AlphaFold DB , UniProt , Accession A0A077Z429, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 335 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
1M51.7Low48.6Very low250 Ų250146.1 Ų146.1100%1.23283%0.826SS**  0143.90-75.6167.6166.100107.6
2S44Very low48.3Very low111 Ų111140.9 Ų140.978%0.77682%0.815SS**  trans-53.3162.4-175.2-35.70000113.9
3T49.9Very low47.5Very low128 Ų128145.8 Ų145.879%0.78582%0.821SS**  cis-163.9134.5-3.54.20000106.6
4A46Very low47.1Very low79 Ų79145 Ų14565%0.65382%0.821SS**  44.7104.5106.300000115.9
5I49.3Very low46.4Very low163 Ų163145.2 Ų145.284%0.83682%0.819SS**  53.212292.866.5158.3000116.3
6D50.9Low46.4Very low145 Ų145145.5 Ų145.578%0.77583%0.825SS**  -167.5171.4103.8-150.57.9000113.9
7E48.6Very low46Very low164 Ų164148.6 Ų148.677%0.76682%0.822SS**  trans-64139.7-171.4-70.9-176.7141.800116.4
8T47.6Very low45.8Very low121 Ų121148.8 Ų148.874%0.74282%0.821SS**  73.9106.684.4-42.10000115.4
9D55.1Low45.4Very low159 Ų159145.9 Ų145.985%0.8581%0.812SS**  trans-158.4136.4148.1-122.9-21.1000111.6
10P45.8Very low45.2Very low114 Ų114148.8 Ų148.874%0.7482%0.819SS**  trans-113.473-173.540.7-31.3000114.3
11D46Very low44.9Very low173 Ų173146.6 Ų146.693%0.92581%0.814SS**  trans-98.9103.1171.6-105.6-23.3000112.2
12A44.1Very low44.6Very low84 Ų84142 Ų14269%0.69480%0.8SS**  trans-93131.7179.800000112.3
13F38.5Very low44Very low205 Ų205140.9 Ų140.990%0.89981%0.806SS**  trans58.179.2150.4-88.4-95.5000118.8
14T41.8Very low43.3Very low134 Ų134144.8 Ų144.882%0.82281%0.812SS**  trans-161.6104.6135.2420000112.5
15N37.2Very low42.7Very low148 Ų148146 Ų14679%0.79182%0.816SS**  trans-177.7116.7134.6-110.8-38.9000111.6
16V46Very low41.9Very low150 Ų150142.3 Ų142.391%0.90981%0.81SS**  trans-129.3101.3151.7179.20000105.9
17Y38.7Very low41Very low198 Ų198143 Ų14378%0.77681%0.813SS**  trans-112.8160.8172.1-161.4-89.9000107.9
18L42.5Very low40.4Very low153 Ų153143.3 Ų143.380%0.80181%0.812SS**  trans95.5133.3-172.7-58.3165.6000113.1
19S38.1Very low39.6Very low94 Ų94142.6 Ų142.666%0.65782%0.819SS**  cis163.4113.4-14.8154.80000103.3
20E42.6Very low38.4Very low202 Ų202138 Ų13894%0.94481%0.809SS**  trans-151137.4150.9-123.5168.9-155.700110.6
21S39.5Very low38Very low104 Ų104135.3 Ų135.373%0.72779%0.793SS**  trans-125.9125.4-164.957.30000110.9
22V44.7Very low37.5Very low154 Ų154134.7 Ų134.793%0.93379%0.789SS**  trans-141.4126.4148.2-79.60000107.8
23G30.9Very low37.2Very low86 Ų86138.1 Ų138.189%0.88779%0.791SS**  trans-88.2157.8-159.900000115.1
24F35.1Very low37Very low210 Ų210138.5 Ų138.592%0.92179%0.788SS**  trans-116.9111.2153.9-166.3-100.8000107.9
25S34.1Very low36.9Very low105 Ų105136.4 Ų136.473%0.73477%0.767SS**  trans-71.4142.2-173.9-165.70000111.2N27S25-N27 PolarHBondContact O-N 3.35Å
26A32.7Very low36.7Very low85 Ų85136.5 Ų136.570%0.70277%0.768SS**  trans-62.6127.5175.100000111
27N31.1Very low36.1Very low159 Ų159134 Ų13485%0.8576%0.758SS**  trans-171.789.5155.9-93.5-28.9000109.6S25S25-N27 PolarHBondContact O-N 3.35Å
28F36.1Very low35.7Very low171 Ų171131.1 Ų131.175%0.7576%0.76SS**  trans-142.960.3163.6-153-102.4000111.5S31F28-S31 VanDerWaalsContact CE1-CB 3.44Å
29A32.2Very low35.2Very low107 Ų107131.7 Ų131.788%0.88476%0.759SS**  trans-76.8118.3155.600000108
30G29.9Very low34.8Very low62 Ų62133.8 Ų133.864%0.63977%0.767SS**  trans96.690.7168.400000116.4
31S35.5Very low34.3Very low57 Ų57129.6 Ų129.640%0.39976%0.76SS.*  trans-15665.6145.3-150.20000112.6F28 H33F28-S31 VanDerWaalsContact CE1-CB 3.44Å; S31-H33 PolarHBondContact O-N 2.66Å
32D36.3Very low33.7Very low160 Ų160129.9 Ų129.986%0.85676%0.762SS**THydrogen-bonded Turntrans-70.713.2170.5-65-56.1000113.6
33H38.2Very low33.3Very low157 Ų157128 Ų12873%0.72776%0.756SS**THydrogen-bonded Turntrans-103.3-9-169.7-101.5-85.6000115.5S31 F35S31-H33 PolarHBondContact O-N 2.66Å; H33-F35 VanDerWaalsContact C-N 3.34Å; H33-F35 PolarHBondContact O-N 3.39Å
34Y33.1Very low33.4Very low212 Ų212133 Ų13383%0.83175%0.753SS**THydrogen-bonded Turntrans-81.61.8-166.3-126.5-89.1000116.6
35F39.9Very low33.2Very low90 Ų90130.9 Ų130.940%0.39575%0.746SS.*THydrogen-bonded Turntrans-129.41.1-176.6-141.4-106.1000115.7H33 Y93 M101H33-F35 VanDerWaalsContact C-N 3.34Å; H33-F35 PolarHBondContact O-N 3.39Å; F35-Y93 HydrophobicContact CE1-CE2 4.15Å; F35-Y93 AromaticContact CE1-CZ 3.77Å; F35-Y93 WeakPolarHBondContact CE1-OH 3.38Å; F35-M101 HydrophobicContact CE1-SD 4.06Å; F35-M101 HydrophobicContact CZ-SD 4.32Å
36N33.9Very low33.4Very low150 Ų150133.4 Ų133.480%0.80275%0.746SS**SBendtrans-106.9-0.3179.6-83.6-27.8000114.1
37S32Very low33.4Very low99 Ų99138.8 Ų138.869%0.69276%0.757SS**  trans-113.255.4-174.5-168.40000113.7
38V32Very low33.5Very low137 Ų137140 Ų14083%0.8376%0.757SS**  trans-105.670.3159.2-1750000108.1
39Q30.7Very low33.3Very low165 Ų165140.7 Ų140.777%0.77176%0.763SS**  trans-76.4129.4167.3-80.3-82.8-91.800108.8S41Q39-S41 PolarHBondContact O-N 3.28Å
40V29.4Very low33.4Very low138 Ų138142.2 Ų142.284%0.83676%0.762SS**  trans-65.798.9-178.3176.40000110
41S32.2Very low33.3Very low113 Ų113143 Ų14379%0.7977%0.77SS**  trans-94.3108.5169.9-68.40000109.4Q39Q39-S41 PolarHBondContact O-N 3.28Å
42S28.4Very low33.4Very low111 Ų111148 Ų14878%0.77679%0.79SS**  trans-83120.2-176-175.90000111.5
43S35.8Very low33.3Very low115 Ų115147.2 Ų147.280%0.80479%0.785SS**  trans-141.3121.916453.80000109.5
44K33Very low33Very low191 Ų191145.9 Ų145.983%0.8379%0.788SS**  trans-77.7139.5-174-55.8168.6179.3177.60111.1
45Q31.3Very low33.1Very low165 Ų165141.1 Ų141.177%0.77179%0.785SS**  -176.7143.4126.4-101.3172.8-9500110.6
46E38.3Very low32.9Very low157 Ų157142.5 Ų142.573%0.73480%0.797SS**  trans50.390.9162.2-66.8134.5-122.100116.6
47E31.6Very low33.2Very low199 Ų199140.4 Ų140.493%0.9378%0.781SS**  56.665.766.5-63.5-165.3178.400116
48E34.6Very low33.6Very low183 Ų183142 Ų14286%0.85578%0.782SS**  trans-146.6112.3138.1-137.1172.3-165.400113.1
49E30.9Very low34.4Very low186 Ų186138.4 Ų138.487%0.86976%0.76SS**SBendtrans43.670.6148.1-151.3176.2-142.700121.6
50T35.1Very low35Very low140 Ų140138.6 Ų138.686%0.85976%0.761SS**  trans-136.846.515147.80000113.8I52T50-I52 VanDerWaalsContact C-N 3.31Å; T50-I52 PolarHBondContact O-N 3.34Å
51G27.7Very low35.6Very low78 Ų78138.9 Ų138.980%0.80476%0.758SS**  trans-72.371.1174.700000114.2
52I37.3Very low36.2Very low161 Ų161142 Ų14283%0.82676%0.76SS**  trans-121.465.3171-49.8-175.5000111.1T50T50-I52 VanDerWaalsContact C-N 3.31Å; T50-I52 PolarHBondContact O-N 3.34Å
53L34.8Very low37Very low144 Ų144140.7 Ų140.775%0.75476%0.756SS**  27.9111.7127.7-135.5164.6000117.6S55L53-S55 PolarHBondContact O-N 3.26Å
54V32.1Very low37Very low129 Ų129139.2 Ų139.278%0.78276%0.758SS**  trans-32.796.8157.4-176.70000112.6N56V54-N56 PolarHBondContact O-N 3.22Å; V54-N56 VanDerWaalsContact O-N 3.11Å
55S34.3Very low37.5Very low112 Ų112136.5 Ų136.578%0.78375%0.753SS**  trans-84.889.8176.765.60000111.5L53L53-S55 PolarHBondContact O-N 3.26Å
56N36.1Very low38Very low120 Ų120137 Ų13764%0.64276%0.761SS**  trans38.1108.9154.3-59.3-2.9000118.6V54 D58V54-N56 PolarHBondContact O-N 3.22Å; V54-N56 VanDerWaalsContact O-N 3.11Å; N56-D58 WeakPolarHBondContact CB-OD2 3.49Å; N56-D58 PolarHBondContact O-N 3.01Å
57F39.4Very low38.5Very low106 Ų106134.2 Ų134.247%0.46576%0.759SS.*  trans-95.772.2164.6-145.1-61.7000108.8V59 Y95F57-V59 HydrophobicContact CD1-CG2 3.9Å; F57-V59 HydrophobicContact CE1-CG2 4.17Å; F57-V59 PolarHBondContact O-N 3.5Å; F57-Y95 AromaticContact CZ-CE2 3.92Å; F57-Y95 HydrophobicContact CZ-CE2 3.92Å; F57-Y95 AromaticContact CZ-CZ 3.95Å
58D41.5Very low39.1Very low133 Ų133129.7 Ų129.771%0.71175%0.749SS**  trans-66.296.4177.3-65.5-50.8000109.7N56N56-D58 WeakPolarHBondContact CB-OD2 3.49Å; N56-D58 PolarHBondContact O-N 3.01Å
59V47.6Very low39.7Very low60 Ų60128.4 Ų128.436%0.36475%0.748SS.*  trans-94.9101.3161.2176.50000105.6F57 D61F57-V59 HydrophobicContact CD1-CG2 3.9Å; F57-V59 HydrophobicContact CE1-CG2 4.17Å; F57-V59 PolarHBondContact O-N 3.5Å; V59-D61 PolarHBondContact O-N 3.09Å
60E44.6Very low40.6Very low170 Ų170128 Ų12879%0.79475%0.746SS**  trans-64.299.6169.2-66.8178.4111.500108.7Q62E60-Q62 VanDerWaalsContact C-N 3.27Å; E60-Q62 PolarHBondContact O-N 2.74Å
61D42Very low41Very low143 Ų143127.1 Ų127.177%0.76575%0.746SS**  trans-82.872.4-179.9-160.917.7000109.6V59 A63V59-D61 PolarHBondContact O-N 3.09Å; D61-A63 PolarHBondContact O-N 3.39Å
62Q43Very low41.6Very low180 Ų180127.1 Ų127.184%0.84175%0.746SS**  trans-80.270.4170-69.8-147.820.200110.6E60 G64E60-Q62 VanDerWaalsContact C-N 3.27Å; E60-Q62 PolarHBondContact O-N 2.74Å; Q62-G64 VanDerWaalsContact C-N 3.26Å; Q62-G64 PolarHBondContact O-N 3.38Å
63A46.1Very low41.9Very low83 Ų83129.2 Ų129.269%0.68675%0.752SS**  trans-73.680.9164.200000109.7D61 D65D61-A63 PolarHBondContact O-N 3.39Å; A63-D65 PolarHBondContact O-N 3.12Å
64G36Very low42.3Very low83 Ų83125.9 Ų125.986%0.85675%0.752SS**  trans-75.5102.7166.700000110.2Q62Q62-G64 VanDerWaalsContact C-N 3.26Å; Q62-G64 PolarHBondContact O-N 3.38Å
65D43.6Very low43Very low134 Ų134127.1 Ų127.172%0.71775%0.754SS**  trans-124.9110.9168.4-1680.4000109.6A63A63-D65 PolarHBondContact O-N 3.12Å
66N40.7Very low43.4Very low175 Ų175128.9 Ų128.994%0.93675%0.754SS**  trans-96.399.4174.5-88.6-27.8000108.4
67S49.8Very low44Very low100 Ų100128.4 Ų128.470%0.69975%0.754SS**  trans-142.1111.5157.9520000111.5
68S44.6Very low44.4Very low103 Ų103129.4 Ų129.472%0.7277%0.769SS**  trans-69.8141.516249.80000109.9
69D47.3Very low44.7Very low157 Ų157130.3 Ų130.384%0.8477%0.769SS**  -177159.1115.3-86.7-13.3000111.9
70Q49.5Very low44.7Very low177 Ų177133.3 Ų133.383%0.82779%0.79SS**  trans-102.5152.8-163.3-66.5-178.1-4.300114.5
71S43.3Very low44.7Very low121 Ų121128 Ų12885%0.84677%0.772SS**  trans59.1121.4145.461.50000120.6
72G41Very low45Very low78 Ų78131.7 Ų131.780%0.80478%0.781SS**  trans-169.6114.4159.400000109.9
73E42.1Very low45.1Very low206 Ų206131.1 Ų131.196%0.96378%0.776SS**  trans-69.7144.8-178.9-60.8169.611200111.6
74G44.3Very low45.2Very low73 Ų73130.7 Ų130.775%0.75377%0.772SS**  trans154.399.2165.700000117.6
75N45.9Very low45.8Very low155 Ų155134.4 Ų134.483%0.82977%0.771SS**  trans69.3138.3155-153.36.5000119.2V77N75-V77 PolarHBondContact O-N 2.83Å; N75-V77 VanDerWaalsContact O-N 3.16Å
76I43Very low46.2Very low150 Ų150135.6 Ų135.677%0.76977%0.769SS**  trans-82.695.2-176.2-59.6170.4000109.1V78I76-V78 HydrophobicContact CG2-CG2 4.23Å
77V49.7Very low46.8Very low109 Ų109138.6 Ų138.666%0.66177%0.768SS**  trans-116.3106.3155.3-178.20000107.4N75 Q79N75-V77 PolarHBondContact O-N 2.83Å; N75-V77 VanDerWaalsContact O-N 3.16Å; V77-Q79 HydrophobicContact CG1-CG 3.92Å; V77-Q79 PolarHBondContact O-N 2.89Å
78V46.9Very low47.1Very low128 Ų128137.8 Ų137.878%0.77676%0.762SS**  trans-71.775.2170.6-175.30000108.1I76I76-V78 HydrophobicContact CG2-CG2 4.23Å
79Q47.9Very low48.3Very low152 Ų152136.6 Ų136.671%0.7175%0.747SS**  trans-60.4141.3160.8-65-161.341.600107.5V77 S81V77-Q79 HydrophobicContact CG1-CG 3.92Å; V77-Q79 PolarHBondContact O-N 2.89Å; Q79-S81 PolarHBondContact O-N 3.26Å
80P48.6Very low49.5Very low122 Ų122133.7 Ų133.779%0.79273%0.727SS**  trans-66.790.7172.428.3-32.9000108.5K82P80-K82 PolarHBondContact O-N 2.82Å
81S42.8Very low50.9Low60 Ų60126.3 Ų126.342%0.4270%0.695SS.*  trans-32.5135.715852.30000109.5Q79 K83Q79-S81 PolarHBondContact O-N 3.26Å; S81-K83 WeakPolarHBondContact O-CB 3.45Å; S81-K83 PolarHBondContact O-N 2.94Å; S81-K83 WeakPolarHBondContact OG-CD 3.4Å; S81-K83 WeakPolarHBondContact OG-CE 3.48Å; S81-K83 WeakPolarHBondContact OG-CG 3.24Å; S81-K83 PolarHBondContact OG-NZ 3.28Å
82K49.4Very low52.9Low220 Ų220126.2 Ų126.296%0.95769%0.691SS**  trans-6357.1-176.7-59.3172.8-176.8172.10112.7P80 A84P80-K82 PolarHBondContact O-N 2.82Å; K82-A84 PolarHBondContact O-N 3.06Å; K82-A84 VanDerWaalsContact O-N 3.11Å
83K44.7Very low55.3Low168 Ų168125.4 Ų125.473%0.7366%0.664SS**  trans-76.295.4-173.6-84.5167.2176.6154.50108.5S81S81-K83 WeakPolarHBondContact O-CB 3.45Å; S81-K83 PolarHBondContact O-N 2.94Å; S81-K83 WeakPolarHBondContact OG-CD 3.4Å; S81-K83 WeakPolarHBondContact OG-CE 3.48Å; S81-K83 WeakPolarHBondContact OG-CG 3.24Å; S81-K83 PolarHBondContact OG-NZ 3.28Å
84A48.9Very low57.7Low73 Ų73117.3 Ų117.360%0.60363%0.63SS**  trans51.4111.1170.100000114.3K82 K86K82-A84 PolarHBondContact O-N 3.06Å; K82-A84 VanDerWaalsContact O-N 3.11Å; A84-K86 PolarHBondContact O-N 3.22Å
85I48.3Very low60.1Low162 Ų162115.6 Ų115.683%0.83160%0.602SS**  trans-53.7104.4141.9-64.2173.3000104.4
86K50.8Low62.4Low159 Ų159108.5 Ų108.569%0.69156%0.564SS**  trans-64.7159.1-163.9-118.3176.6177-179.20107.9A84 S88A84-K86 PolarHBondContact O-N 3.22Å; K86-S88 PolarHBondContact O-N 3.34Å; K86-S88 PolarHBondContact O-OG 3.1Å
87R53.2Low64.8Low238 Ų238101.5 Ų101.590%0.89853%0.528SS*.THydrogen-bonded Turntrans-68.820.4179.2-54.2-179.1-176.2114.3-1.9113.4
88S56.9Low66.9Low83 Ų8396.4 Ų96.458%0.5850%0.497SS*.THydrogen-bonded Turntrans-78-29.2-174.240.20000114.2K86 K90K86-S88 PolarHBondContact O-N 3.34Å; K86-S88 PolarHBondContact O-OG 3.1Å; S88-K90 VanDerWaalsContact C-N 3.34Å; S88-K90 PolarHBondContact O-N 2.9Å
89D70.6Confident69.3Low78 Ų7890.3 Ų90.342%0.41746%0.46SS..SBendtrans-95.35.8-161.1-43.2-22000112.7C126D89-C126 PolarHBondContact O-SG 3.39Å
90K71.1Confident71.5Confident95 Ų9583.1 Ų83.141%0.41343%0.427SS..SBendtrans-88.2120.1175-69.1-178.7-178.91780109.2S88S88-K90 VanDerWaalsContact C-N 3.34Å; S88-K90 PolarHBondContact O-N 2.9Å
91P80.1Confident73.7Confident22 Ų2277.8 Ų77.814%0.14339%0.391CS..  trans-64148.117924.2-33000112Y93 L98 F124P91-Y93 HydrophobicContact CB-CD2 3.7Å; P91-Y93 HydrophobicContact CB-CE2 4.33Å; P91-Y93 HydrophobicContact CB-CG 4.46Å; P91-Y93 PolarHBondContact O-N 3.47Å; P91-L98 HydrophobicContact CG-CD2 4.05Å; P91-F124 HydrophobicContact CB-CD1 3.72Å; P91-F124 HydrophobicContact CB-CE1 3.58Å; P91-F124 HydrophobicContact CB-CG 4.43Å; P91-F124 HydrophobicContact CB-CZ 4.19Å; P91-F124 HydrophobicContact CG-CB 4.48Å; P91-F124 HydrophobicContact CG-CD1 3.72Å; P91-F124 HydrophobicContact CG-CD2 4.36Å; P91-F124 HydrophobicContact CG-CE1 3.95Å; P91-F124 HydrophobicContact CG-CG 3.93Å; P91-F124 HydrophobicContact CG-CZ 4.35Å
92P85.4Confident76.2Confident120 Ų12075.2 Ų75.278%0.77937%0.374SS*.SBendtrans-74.836.3175.934.2-37.3000112.6
93Y89.7Confident78.4Confident60 Ų6064.8 Ų64.824%0.23533%0.328CS..  trans-123.6126.7-174.5-57-51.7000111.1F35 P91 L98 M101 F124F35-Y93 HydrophobicContact CE1-CE2 4.15Å; F35-Y93 AromaticContact CE1-CZ 3.77Å; F35-Y93 WeakPolarHBondContact CE1-OH 3.38Å; P91-Y93 HydrophobicContact CB-CD2 3.7Å; P91-Y93 HydrophobicContact CB-CE2 4.33Å; P91-Y93 HydrophobicContact CB-CG 4.46Å; P91-Y93 PolarHBondContact O-N 3.47Å; Y93-L98 HydrophobicContact CD2-CD2 4.32Å; Y93-M101 HydrophobicContact CD2-CE 3.59Å; Y93-M101 HydrophobicContact CE2-CE 4.14Å; Y93-M101 HydrophobicContact CG-CE 3.9Å; Y93-F124 HydrophobicContact CD2-CE1 4.43Å; Y93-F124 HydrophobicContact CD2-CZ 4.19Å
94S92.9Very high80.7Confident36 Ų3659.3 Ų59.325%0.25231%0.306SS..  trans-60.1158167.966.40000112.5I96 A97 L98 R183S94-I96 VanDerWaalsContact C-N 3.3Å; S94-I96 PolarHBondContact O-N 3.27Å; S94-A97 WeakPolarHBondContact O-CB 3.42Å; S94-A97 PolarHBondContact O-N 3.11Å; S94-A97 PolarHBondContact OG-N 2.98Å; S94-L98 WeakPolarHBondContact O-CG 3.49Å; S94-L98 PolarHBondContact O-N 3Å; S94-R183 PolarHBondContact OG-NH1 2.84Å
95Y95.3Very high82.9Confident37 Ų3760.5 Ų60.515%0.14530%0.302CS..Hα-helixtrans-53.4-39176-73.1-69.6000114.7F57 L98 I99 F127 W134 S137 V138F57-Y95 AromaticContact CZ-CE2 3.92Å; F57-Y95 HydrophobicContact CZ-CE2 3.92Å; F57-Y95 AromaticContact CZ-CZ 3.95Å; Y95-L98 HydrophobicContact CD1-CD1 4.25Å; Y95-L98 PolarHBondContact O-N 3.06Å; Y95-I99 WeakPolarHBondContact O-CD1 3.5Å; Y95-I99 WeakPolarHBondContact O-CG1 3.23Å; Y95-I99 PolarHBondContact O-N 3.18Å; Y95-F127 HydrophobicContact CE1-CE1 4.42Å; Y95-W134 HydrophobicContact CE1-CB 4.38Å; Y95-S137 VanDerWaalsContact CE2-CB 3.43Å; Y95-S137 VanDerWaalsContact CZ-CB 3.44Å; Y95-V138 HydrophobicContact CD1-CG2 3.96Å; Y95-V138 HydrophobicContact CE1-CG2 4.27Å
96I94.1Very high85.1Confident7 Ų753.6 Ų53.64%0.03627%0.269CS..Hα-helixtrans-62.5-45.6175.7-55.3-174000110.7S94 L98 I99 V100 N141 N145 F148 F174S94-I96 VanDerWaalsContact C-N 3.3Å; S94-I96 PolarHBondContact O-N 3.27Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 2.97Å; I96-I99 PolarHBondContact O-N 3.16Å; I96-V100 HydrophobicContact CG2-CG2 4.21Å; I96-V100 VanDerWaalsContact O-CB 3.3Å; I96-V100 WeakPolarHBondContact O-CB 3.05Å; I96-V100 VanDerWaalsContact O-CG2 3.27Å; I96-V100 WeakPolarHBondContact O-CG2 3.18Å; I96-V100 PolarHBondContact O-N 2.89Å; I96-N141 WeakPolarHBondContact CG1-OD1 3.45Å; I96-N145 HydrophobicContact CD1-CB 4.2Å; I96-N145 WeakPolarHBondContact CD1-ND2 3.14Å; I96-N145 WeakPolarHBondContact CD1-OD1 3.45Å; I96-F148 HydrophobicContact CB-CE2 4.32Å; I96-F148 HydrophobicContact CB-CZ 4.29Å; I96-F148 HydrophobicContact CG1-CE2 4.31Å; I96-F148 HydrophobicContact CG2-CE2 3.89Å; I96-F148 HydrophobicContact CG2-CZ 3.65Å; I96-F174 HydrophobicContact CG2-CE1 3.9Å; I96-F174 HydrophobicContact CG2-CE2 4.09Å; I96-F174 HydrophobicContact CG2-CZ 3.66Å
97A93.1Very high87.2Confident3 Ų352.6 Ų52.63%0.02528%0.279CS..Hα-helixtrans-62.3-40.5177.600000111.9S94 V100 M101 V181S94-A97 WeakPolarHBondContact O-CB 3.42Å; S94-A97 PolarHBondContact O-N 3.11Å; S94-A97 PolarHBondContact OG-N 2.98Å; A97-V100 PolarHBondContact O-N 3.33Å; A97-M101 WeakPolarHBondContact O-CG 3.33Å; A97-M101 PolarHBondContact O-N 3.01Å; A97-V181 HydrophobicContact CB-CG1 3.69Å
98L94.7Very high89.1Confident2 Ų244.3 Ų44.31%0.0126%0.257CS..Hα-helixtrans-60.7-45.1175.1-70.6173.8000112.4P91 Y93 S94 Y95 I96 M101 A102 L120 F124 F127P91-L98 HydrophobicContact CG-CD2 4.05Å; Y93-L98 HydrophobicContact CD2-CD2 4.32Å; S94-L98 WeakPolarHBondContact O-CG 3.49Å; S94-L98 PolarHBondContact O-N 3Å; Y95-L98 HydrophobicContact CD1-CD1 4.25Å; Y95-L98 PolarHBondContact O-N 3.06Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 2.97Å; L98-M101 HydrophobicContact CD2-CE 3.84Å; L98-A102 PolarHBondContact O-N 2.87Å; L98-A102 VanDerWaalsContact O-N 3.17Å; L98-L120 HydrophobicContact CB-CD2 3.78Å; L98-L120 HydrophobicContact CD2-CD2 4.07Å; L98-L120 HydrophobicContact CG-CD2 4.39Å; L98-F124 HydrophobicContact CD2-CD2 4.08Å; L98-F124 HydrophobicContact CD2-CE2 3.43Å; L98-F124 VanDerWaalsContact CD2-CE2 3.43Å; L98-F124 HydrophobicContact CD2-CZ 3.82Å; L98-F127 HydrophobicContact CD1-CE2 4.15Å; L98-F127 HydrophobicContact CD1-CZ 3.78Å
99I96.1Very high90.9Very high0 Ų045.3 Ų45.30%025%0.251CS..Hα-helixtrans-68.9-42177.4-64.6159.6000111Y95 I96 M101 A102 I103 I116 V138 N141 L142 F148Y95-I99 WeakPolarHBondContact O-CD1 3.5Å; Y95-I99 WeakPolarHBondContact O-CG1 3.23Å; Y95-I99 PolarHBondContact O-N 3.18Å; I96-I99 PolarHBondContact O-N 3.16Å; I99-M101 PolarHBondContact O-N 3.28Å; I99-A102 WeakPolarHBondContact O-CB 3.49Å; I99-A102 PolarHBondContact O-N 3.02Å; I99-A102 VanDerWaalsContact O-N 3.12Å; I99-I103 HydrophobicContact CG2-CD1 3.88Å; I99-I103 HydrophobicContact CG2-CG1 4.47Å; I99-I103 PolarHBondContact O-N 3.21Å; I99-I116 HydrophobicContact CG1-CG2 4.31Å; I99-I116 HydrophobicContact CG2-CD1 4.26Å; I99-V138 HydrophobicContact CD1-CG1 4.22Å; I99-V138 HydrophobicContact CG1-CG1 4.26Å; I99-N141 HydrophobicContact CD1-CB 3.8Å; I99-L142 HydrophobicContact CD1-CD2 4.35Å; I99-L142 HydrophobicContact CD1-CG 4.17Å; I99-L142 HydrophobicContact CG2-CD2 3.69Å; I99-F148 HydrophobicContact CB-CE1 3.99Å; I99-F148 HydrophobicContact CB-CE2 4.3Å; I99-F148 HydrophobicContact CB-CZ 3.62Å; I99-F148 HydrophobicContact CD1-CE2 4.08Å; I99-F148 HydrophobicContact CD1-CZ 4.25Å; I99-F148 HydrophobicContact CG2-CD1 3.92Å; I99-F148 HydrophobicContact CG2-CE1 3.36Å; I99-F148 HydrophobicContact CG2-CE2 4.12Å; I99-F148 HydrophobicContact CG2-CZ 3.46Å; I99-F148 VanDerWaalsContact CG2-CZ 3.46Å
100V94.8Very high92.1Very high1 Ų146.5 Ų46.51%0.00625%0.25CC..Hα-helixtrans-58.9-46.5177.1160.40000110.7I96 A97 A102 I103 E104 F148 I166 F174 F175I96-V100 HydrophobicContact CG2-CG2 4.21Å; I96-V100 VanDerWaalsContact O-CB 3.3Å; I96-V100 WeakPolarHBondContact O-CB 3.05Å; I96-V100 VanDerWaalsContact O-CG2 3.27Å; I96-V100 WeakPolarHBondContact O-CG2 3.18Å; I96-V100 PolarHBondContact O-N 2.89Å; A97-V100 PolarHBondContact O-N 3.33Å; V100-A102 VanDerWaalsContact C-N 3.33Å; V100-A102 PolarHBondContact O-N 3.43Å; V100-I103 PolarHBondContact O-N 3.29Å; V100-E104 PolarHBondContact O-N 3.04Å; V100-F148 HydrophobicContact CG2-CE1 3.75Å; V100-F148 HydrophobicContact CG2-CZ 3.92Å; V100-I166 HydrophobicContact CB-CD1 4.29Å; V100-I166 HydrophobicContact CG1-CD1 4.06Å; V100-I166 HydrophobicContact CG2-CD1 4.2Å; V100-I166 HydrophobicContact CG2-CG1 4.33Å; V100-F174 HydrophobicContact CG1-CB 4.26Å; V100-F174 HydrophobicContact CG2-CD2 4.16Å; V100-F174 HydrophobicContact CG2-CG 4.42Å; V100-F175 HydrophobicContact CG1-CD2 4.36Å; V100-F175 HydrophobicContact CG1-CE1 4.23Å; V100-F175 HydrophobicContact CG1-CE2 3.3Å; V100-F175 HydrophobicContact CG1-CZ 3.2Å
101M93.9Very high93.3Very high9 Ų942 Ų424%0.04423%0.231CC..Hα-helixtrans-58.3-43.3172.7-74.6-173.1-69.400112.4F35 Y93 A97 L98 I99 I103 E104 N105 F119 F124F35-M101 HydrophobicContact CE1-SD 4.06Å; F35-M101 HydrophobicContact CZ-SD 4.32Å; Y93-M101 HydrophobicContact CD2-CE 3.59Å; Y93-M101 HydrophobicContact CE2-CE 4.14Å; Y93-M101 HydrophobicContact CG-CE 3.9Å; A97-M101 WeakPolarHBondContact O-CG 3.33Å; A97-M101 PolarHBondContact O-N 3.01Å; L98-M101 HydrophobicContact CD2-CE 3.84Å; I99-M101 PolarHBondContact O-N 3.28Å; M101-I103 PolarHBondContact O-N 3.01Å; M101-E104 PolarHBondContact O-N 3.45Å; M101-N105 PolarHBondContact O-N 2.78Å; M101-N105 VanDerWaalsContact O-N 3.11Å; M101-N105 PolarHBondContact O-ND2 2.91Å; M101-F119 HydrophobicContact CB-CE1 4.12Å; M101-F119 HydrophobicContact CB-CZ 4.33Å; M101-F124 HydrophobicContact CE-CZ 4.15Å
102A96Very high94Very high6 Ų641.7 Ų41.75%0.0523%0.228CC..Hα-helixtrans-62.1-40.7179.900000112.8L98 I99 V100 A106 I116 F119L98-A102 PolarHBondContact O-N 2.87Å; L98-A102 VanDerWaalsContact O-N 3.17Å; I99-A102 WeakPolarHBondContact O-CB 3.49Å; I99-A102 PolarHBondContact O-N 3.02Å; I99-A102 VanDerWaalsContact O-N 3.12Å; V100-A102 VanDerWaalsContact C-N 3.33Å; V100-A102 PolarHBondContact O-N 3.43Å; A102-A106 PolarHBondContact O-N 3.45Å; A102-I116 HydrophobicContact CB-CG1 4.3Å; A102-I116 HydrophobicContact CB-CG2 4.35Å; A102-F119 VanDerWaalsContact CA-CD1 3.48Å; A102-F119 HydrophobicContact CB-CB 4.11Å; A102-F119 HydrophobicContact CB-CD1 3.37Å; A102-F119 HydrophobicContact CB-CE1 3.89Å; A102-F119 HydrophobicContact CB-CG 3.8Å
103I95.8Very high94.6Very high1 Ų138.3 Ų38.31%0.00520%0.203CC..Hα-helixtrans-73.5-38.7179.9-65.5170.2000111.4I99 V100 M101 N105 A106 K109 A111 F148 W164 I166I99-I103 HydrophobicContact CG2-CD1 3.88Å; I99-I103 HydrophobicContact CG2-CG1 4.47Å; I99-I103 PolarHBondContact O-N 3.21Å; V100-I103 PolarHBondContact O-N 3.29Å; M101-I103 PolarHBondContact O-N 3.01Å; I103-N105 PolarHBondContact O-N 3.17Å; I103-A106 WeakPolarHBondContact O-CB 3.32Å; I103-A106 PolarHBondContact O-N 3.11Å; I103-K109 WeakPolarHBondContact CG2-O 3.48Å; I103-A111 HydrophobicContact CG1-CB 4.15Å; I103-F148 HydrophobicContact CD1-CD1 4.02Å; I103-F148 HydrophobicContact CD1-CE1 4.21Å; I103-W164 HydrophobicContact CD1-CB 4.34Å; I103-I166 HydrophobicContact CB-CD1 3.89Å; I103-I166 HydrophobicContact CB-CG1 4.08Å; I103-I166 HydrophobicContact CD1-CG1 4.06Å; I103-I166 HydrophobicContact CG2-CD1 3.85Å; I103-I166 HydrophobicContact CG2-CG1 3.87Å
104E93.7Very high94.9Very high54 Ų5438 Ų3825%0.25221%0.214SC..Hα-helixtrans-67.7-33.1177.7-79.4-50.2131.800113.9V100 M101 A106 K109 I166 F175V100-E104 PolarHBondContact O-N 3.04Å; M101-E104 PolarHBondContact O-N 3.45Å; E104-A106 VanDerWaalsContact C-N 3.26Å; E104-A106 PolarHBondContact O-N 2.62Å; E104-K109 PolarHBondContact O-NZ 2.82Å; E104-K109 WeakPolarHBondContact OE2-CD 3.32Å; E104-K109 WeakPolarHBondContact OE2-CE 3.15Å; E104-K109 IonicContact OE2-NZ 2.66Å; E104-K109 PolarHBondContact OE2-NZ 2.74Å; E104-I166 HydrophobicContact CG-CD1 4.07Å; E104-I166 WeakPolarHBondContact OE1-CD1 3.48Å; E104-F175 HydrophobicContact CB-CZ 4.19Å; E104-F175 HydrophobicContact CG-CD2 4.46Å; E104-F175 HydrophobicContact CG-CE1 4.31Å; E104-F175 HydrophobicContact CG-CE2 3.36Å; E104-F175 HydrophobicContact CG-CZ 3.27Å
105N94.1Very high95.1Very high97 Ų9740.5 Ų40.552%0.51922%0.221SC..Hα-helixtrans-75-16.5175.9-78.5-98.8000112.3M101 I103 F119M101-N105 PolarHBondContact O-N 2.78Å; M101-N105 VanDerWaalsContact O-N 3.11Å; M101-N105 PolarHBondContact O-ND2 2.91Å; I103-N105 PolarHBondContact O-N 3.17Å; N105-F119 HydrophobicContact CB-CD2 4.29Å; N105-F119 HydrophobicContact CB-CE2 3.53Å; N105-F119 HydrophobicContact CB-CZ 4.1Å
106A95Very high95.2Very high18 Ų1838.7 Ų38.715%0.14921%0.214CC..SBendtrans-73.1129.4174.700000110.4A102 I103 E104 S108 K109 R110 A111A102-A106 PolarHBondContact O-N 3.45Å; I103-A106 WeakPolarHBondContact O-CB 3.32Å; I103-A106 PolarHBondContact O-N 3.11Å; E104-A106 VanDerWaalsContact C-N 3.26Å; E104-A106 PolarHBondContact O-N 2.62Å; A106-S108 PolarHBondContact O-N 2.77Å; A106-K109 PolarHBondContact O-N 3.35Å; A106-R110 WeakPolarHBondContact CB-O 3.22Å; A106-A111 HydrophobicContact CB-CB 4.48Å
107P94.8Very high95.3Very high137 Ų13739.9 Ų39.989%0.8922%0.218SC*.THydrogen-bonded Turntrans-64.5-17.7-173.325.2-35.4000113.9
108S93.7Very high95.5Very high65 Ų6544.7 Ų44.746%0.45524%0.24SC..THydrogen-bonded Turntrans-101.611.4175.7660000114.4A106 R110A106-S108 PolarHBondContact O-N 2.77Å; S108-R110 PolarHBondContact O-N 2.91Å; S108-R110 VanDerWaalsContact OG-CG 3.31Å; S108-R110 WeakPolarHBondContact OG-CG 3.47Å; S108-R110 PolarHBondContact OG-NE 3.38Å
109K94.4Very high95.6Very high103 Ų10346.1 Ų46.145%0.44825%0.246SC..SBendtrans50.129.7-177.2-56.9-62.4-176.5176.30114I103 E104 A106 T165I103-K109 WeakPolarHBondContact CG2-O 3.48Å; E104-K109 PolarHBondContact O-NZ 2.82Å; E104-K109 WeakPolarHBondContact OE2-CD 3.32Å; E104-K109 WeakPolarHBondContact OE2-CE 3.15Å; E104-K109 IonicContact OE2-NZ 2.66Å; E104-K109 PolarHBondContact OE2-NZ 2.74Å; A106-K109 PolarHBondContact O-N 3.35Å; K109-T165 PolarHBondContact O-OG1 3.48Å
110R94.8Very high95.7Very high103 Ų10346.1 Ų46.139%0.38925%0.246SC..EExtended strand (participates in β ladder)trans-149.2145.2174.465.5-173.3176.9-174.5-2.6108.8A106 S108 L151 Y163 W164A106-R110 WeakPolarHBondContact CB-O 3.22Å; S108-R110 PolarHBondContact O-N 2.91Å; S108-R110 VanDerWaalsContact OG-CG 3.31Å; S108-R110 WeakPolarHBondContact OG-CG 3.47Å; S108-R110 PolarHBondContact OG-NE 3.38Å; R110-L151 HydrophobicContact CB-CD1 4.32Å; R110-Y163 HydrophobicContact CG-CD1 4.01Å; R110-Y163 HydrophobicContact CG-CG 4.36Å; R110-W164 CarbonylContact C-O 3.5Å; R110-W164 WeakPolarHBondContact CA-O 3.17Å; R110-W164 WeakPolarHBondContact CB-O 3.39Å
111A96.1Very high95.7Very high2 Ų248.7 Ų48.72%0.01726%0.259CS..EExtended strand (participates in β ladder)trans-138.4147.317800000110.4I103 A106 E115 I116 W164I103-A111 HydrophobicContact CG1-CB 4.15Å; A106-A111 HydrophobicContact CB-CB 4.48Å; A111-E115 HydrophobicContact CB-CB 4.22Å; A111-I116 HydrophobicContact CB-CD1 4.38Å; A111-I116 HydrophobicContact CB-CG1 3.85Å; A111-W164 PolarHBondContact N-O 2.93Å; A111-W164 WeakPolarHBondContact O-CB 3.41Å; A111-W164 PolarHBondContact O-N 3.12Å
112T96.4Very high95.7Very high14 Ų1454.5 Ų54.59%0.08629%0.286CS..EExtended strand (participates in β ladder)trans-78.6163.8166.864.40000110.4A114 E115 I116 Y163T112-A114 PolarHBondContact O-N 3.17Å; T112-E115 WeakPolarHBondContact CA-OE2 3.48Å; T112-E115 VanDerWaalsContact CB-OE2 3.22Å; T112-E115 WeakPolarHBondContact CB-OE2 3.45Å; T112-E115 VanDerWaalsContact CG2-OE2 3.28Å; T112-E115 WeakPolarHBondContact CG2-OE2 3.42Å; T112-E115 PolarHBondContact N-OE2 3.46Å; T112-E115 PolarHBondContact O-N 2.84Å; T112-E115 PolarHBondContact OG1-N 2.97Å; T112-E115 PolarHBondContact OG1-OE2 3.3Å; T112-I116 WeakPolarHBondContact O-CG1 3.23Å; T112-I116 PolarHBondContact O-N 3.17Å; T112-Y163 HydrophobicContact CG2-CD1 3.68Å; T112-Y163 HydrophobicContact CG2-CE1 3.6Å; T112-Y163 HydrophobicContact CG2-CG 4.42Å
113L97.2Very high95.6Very high49 Ų4959.3 Ų59.326%0.25730%0.302SS..Hα-helixtrans-56.6-31.1174.6-176.763.9000113Y117 V138 R139 L142L113-Y117 HydrophobicContact CD1-CD1 4.34Å; L113-Y117 HydrophobicContact CD1-CE1 3.61Å; L113-Y117 HydrophobicContact CD1-CE2 4.32Å; L113-Y117 HydrophobicContact CD2-CE2 4.27Å; L113-Y117 HydrophobicContact CG-CE1 4.07Å; L113-Y117 HydrophobicContact CG-CE2 3.86Å; L113-Y117 WeakPolarHBondContact O-CD2 3.37Å; L113-Y117 PolarHBondContact O-N 3.3Å; L113-Y117 VanDerWaalsContact O-N 3.17Å; L113-V138 HydrophobicContact CD1-CG1 4.14Å; L113-R139 HydrophobicContact CD1-CG 3.98Å; L113-R139 HydrophobicContact CD2-CG 3.86Å; L113-L142 HydrophobicContact CD1-CD1 3.66Å
114A96.2Very high95.4Very high55 Ų5560.6 Ų60.646%0.45531%0.308SS..Hα-helixtrans-71.6-46.117800000111.8T112 I116 Y117 Q118T112-A114 PolarHBondContact O-N 3.17Å; A114-I116 VanDerWaalsContact C-N 3.33Å; A114-I116 PolarHBondContact O-N 2.88Å; A114-Y117 WeakPolarHBondContact O-CB 3.21Å; A114-Y117 PolarHBondContact O-N 2.89Å; A114-Y117 VanDerWaalsContact O-N 3.13Å; A114-Q118 WeakPolarHBondContact O-CG 3.49Å; A114-Q118 PolarHBondContact O-N 3.18Å
115E96.9Very high95.3Very high87 Ų8764.1 Ų64.141%0.40733%0.325SS..Hα-helixtrans-62.4-39.7176.6-70.8154.9142.500111.2A111 T112 Y117 Q118 F119A111-E115 HydrophobicContact CB-CB 4.22Å; T112-E115 WeakPolarHBondContact CA-OE2 3.48Å; T112-E115 VanDerWaalsContact CB-OE2 3.22Å; T112-E115 WeakPolarHBondContact CB-OE2 3.45Å; T112-E115 VanDerWaalsContact CG2-OE2 3.28Å; T112-E115 WeakPolarHBondContact CG2-OE2 3.42Å; T112-E115 PolarHBondContact N-OE2 3.46Å; T112-E115 PolarHBondContact O-N 2.84Å; T112-E115 PolarHBondContact OG1-N 2.97Å; T112-E115 PolarHBondContact OG1-OE2 3.3Å; E115-Y117 VanDerWaalsContact C-N 3.35Å; E115-Y117 PolarHBondContact O-N 2.97Å; E115-Q118 PolarHBondContact O-N 3.07Å; E115-F119 WeakPolarHBondContact O-CB 3.35Å; E115-F119 PolarHBondContact O-N 3.22Å
116I97.4Very high95.2Very high0 Ų061.9 Ų61.90%032%0.316CS..Hα-helixtrans-61-42.8173.2-64.4164.1000111I99 A102 A111 T112 A114 L120 V138 L142I99-I116 HydrophobicContact CG1-CG2 4.31Å; I99-I116 HydrophobicContact CG2-CD1 4.26Å; A102-I116 HydrophobicContact CB-CG1 4.3Å; A102-I116 HydrophobicContact CB-CG2 4.35Å; A111-I116 HydrophobicContact CB-CD1 4.38Å; A111-I116 HydrophobicContact CB-CG1 3.85Å; T112-I116 WeakPolarHBondContact O-CG1 3.23Å; T112-I116 PolarHBondContact O-N 3.17Å; A114-I116 VanDerWaalsContact C-N 3.33Å; A114-I116 PolarHBondContact O-N 2.88Å; I116-L120 HydrophobicContact CG2-CD1 4.2Å; I116-L120 VanDerWaalsContact O-CG 3.28Å; I116-L120 WeakPolarHBondContact O-CG 3.27Å; I116-L120 PolarHBondContact O-N 3.31Å; I116-V138 HydrophobicContact CG2-CG1 3.99Å; I116-L142 HydrophobicContact CD1-CD1 4.17Å; I116-L142 HydrophobicContact CD1-CD2 4.21Å
117Y97.4Very high95.1Very high31 Ų3161.6 Ų61.612%0.12231%0.311CS..Hα-helixtrans-64.9-39.7176.1-65.4-21.2000112.3L113 A114 E115 Q121 W134 K135 V138 R139L113-Y117 HydrophobicContact CD1-CD1 4.34Å; L113-Y117 HydrophobicContact CD1-CE1 3.61Å; L113-Y117 HydrophobicContact CD1-CE2 4.32Å; L113-Y117 HydrophobicContact CD2-CE2 4.27Å; L113-Y117 HydrophobicContact CG-CE1 4.07Å; L113-Y117 HydrophobicContact CG-CE2 3.86Å; L113-Y117 WeakPolarHBondContact O-CD2 3.37Å; L113-Y117 PolarHBondContact O-N 3.3Å; L113-Y117 VanDerWaalsContact O-N 3.17Å; A114-Y117 WeakPolarHBondContact O-CB 3.21Å; A114-Y117 PolarHBondContact O-N 2.89Å; A114-Y117 VanDerWaalsContact O-N 3.13Å; E115-Y117 VanDerWaalsContact C-N 3.35Å; E115-Y117 PolarHBondContact O-N 2.97Å; Y117-Q121 WeakPolarHBondContact O-CG 3.19Å; Y117-Q121 PolarHBondContact O-N 2.8Å; Y117-Q121 PolarHBondContact O-NE2 3.41Å; Y117-W134 HydrophobicContact CD1-CH2 4.13Å; Y117-W134 AromaticContact CD1-CZ3 3.7Å; Y117-W134 HydrophobicContact CD1-CZ3 3.7Å; Y117-W134 HydrophobicContact CE1-CZ3 4.31Å; Y117-W134 HydrophobicContact CG-CH2 4.29Å; Y117-W134 HydrophobicContact CG-CZ3 4.32Å; Y117-K135 HydrophobicContact CD1-CG 4.06Å; Y117-K135 HydrophobicContact CD2-CD 4.06Å; Y117-K135 HydrophobicContact CD2-CG 4.45Å; Y117-K135 HydrophobicContact CE1-CB 3.86Å; Y117-K135 HydrophobicContact CE1-CD 4.35Å; Y117-K135 HydrophobicContact CE1-CG 3.75Å; Y117-K135 HydrophobicContact CE2-CB 4.45Å; Y117-K135 HydrophobicContact CE2-CD 3.87Å; Y117-K135 HydrophobicContact CE2-CG 4.17Å; Y117-K135 HydrophobicContact CG-CD 4.39Å; Y117-K135 HydrophobicContact CG-CG 4.4Å; Y117-K135 PolarHBondContact OH-O 3.12Å; Y117-V138 HydrophobicContact CD1-CG1 4.35Å; Y117-V138 HydrophobicContact CE1-CB 4.15Å; Y117-V138 HydrophobicContact CE1-CG1 3.92Å; Y117-R139 WeakPolarHBondContact OH-CG 3.27Å; Y117-R139 PolarHBondContact OH-NH1 2.96Å
118Q96.9Very high95Very high104 Ų10461.1 Ų61.149%0.48629%0.292SS..Hα-helixtrans-64.8-52.8178.5-74.6169.1-47.400110.8A114 E115 L120 Q121 E122A114-Q118 WeakPolarHBondContact O-CG 3.49Å; A114-Q118 PolarHBondContact O-N 3.18Å; E115-Q118 PolarHBondContact O-N 3.07Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.45Å; Q118-Q121 PolarHBondContact O-N 2.94Å; Q118-E122 WeakPolarHBondContact O-CB 3.44Å; Q118-E122 WeakPolarHBondContact O-CG 3.45Å; Q118-E122 PolarHBondContact O-N 3.14Å
119F97.1Very high94.9Very high32 Ų3259.9 Ų59.914%0.1429%0.289CS..Hα-helixtrans-52.6-43.4177.5179.4-91.8000113.2M101 A102 N105 E115 E122 R123M101-F119 HydrophobicContact CB-CE1 4.12Å; M101-F119 HydrophobicContact CB-CZ 4.33Å; A102-F119 VanDerWaalsContact CA-CD1 3.48Å; A102-F119 HydrophobicContact CB-CB 4.11Å; A102-F119 HydrophobicContact CB-CD1 3.37Å; A102-F119 HydrophobicContact CB-CE1 3.89Å; A102-F119 HydrophobicContact CB-CG 3.8Å; N105-F119 HydrophobicContact CB-CD2 4.29Å; N105-F119 HydrophobicContact CB-CE2 3.53Å; N105-F119 HydrophobicContact CB-CZ 4.1Å; E115-F119 WeakPolarHBondContact O-CB 3.35Å; E115-F119 PolarHBondContact O-N 3.22Å; F119-E122 PolarHBondContact O-N 3.48Å; F119-R123 WeakPolarHBondContact O-CB 3.3Å; F119-R123 PolarHBondContact O-N 2.88Å
120L96.4Very high94.8Very high0 Ų060.8 Ų60.80%031%0.309CS..Hα-helixtrans-68.2-40.5178.8-66.7178.6000112.6L98 I116 Q118 F124 F127 W134 V138L98-L120 HydrophobicContact CB-CD2 3.78Å; L98-L120 HydrophobicContact CD2-CD2 4.07Å; L98-L120 HydrophobicContact CG-CD2 4.39Å; I116-L120 HydrophobicContact CG2-CD1 4.2Å; I116-L120 VanDerWaalsContact O-CG 3.28Å; I116-L120 WeakPolarHBondContact O-CG 3.27Å; I116-L120 PolarHBondContact O-N 3.31Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.45Å; L120-F124 HydrophobicContact CD2-CD2 4.27Å; L120-F124 HydrophobicContact CD2-CE2 4.18Å; L120-F124 PolarHBondContact O-N 3.08Å; L120-F127 HydrophobicContact CB-CD2 3.8Å; L120-F127 HydrophobicContact CB-CE2 4.29Å; L120-F127 HydrophobicContact CB-CG 4.31Å; L120-F127 HydrophobicContact CD2-CE2 4.46Å; L120-F127 WeakPolarHBondContact O-CD2 3.23Å; L120-W134 HydrophobicContact CD1-CZ3 4.35Å; L120-V138 HydrophobicContact CD1-CG2 4.05Å
121Q95Very high94.7Very high56 Ų5662.6 Ų62.626%0.26232%0.316SS..Hα-helixtrans-67.6-37.7174.9-76.8166.297.100112.1Y117 Q118 F127 R128 W134Y117-Q121 WeakPolarHBondContact O-CG 3.19Å; Y117-Q121 PolarHBondContact O-N 2.8Å; Y117-Q121 PolarHBondContact O-NE2 3.41Å; Q118-Q121 PolarHBondContact O-N 2.94Å; Q121-F127 HydrophobicContact CG-CB 4.09Å; Q121-F127 WeakPolarHBondContact CG-O 3.44Å; Q121-R128 HydrophobicContact CB-CG 4.22Å; Q121-R128 WeakPolarHBondContact O-CG 3.48Å; Q121-R128 PolarHBondContact O-NE 3.44Å; Q121-R128 PolarHBondContact O-NH2 3.23Å; Q121-W134 HydrophobicContact CG-CH2 4.13Å; Q121-W134 HydrophobicContact CG-CZ2 4.08Å
122E95.5Very high94.7Very high131 Ų13166.2 Ų66.261%0.61233%0.333SS*.Hα-helixtrans-65.7-46.8177.3-74.7161.5-157.500110.8Q118 F119 R128Q118-E122 WeakPolarHBondContact O-CB 3.44Å; Q118-E122 WeakPolarHBondContact O-CG 3.45Å; Q118-E122 PolarHBondContact O-N 3.14Å; F119-E122 PolarHBondContact O-N 3.48Å; E122-R128 PolarHBondContact O-NH2 3.42Å
123R92.6Very high94.6Very high106 Ų10666.8 Ų66.840%0.434%0.341SS..Hα-helixtrans-83.5-29.4-173.5-161.9172.1-133.1-132.50.6115.4F119F119-R123 WeakPolarHBondContact O-CB 3.3Å; F119-R123 PolarHBondContact O-N 2.88Å
124F92.7Very high94.5Very high29 Ų2964.7 Ų64.713%0.12733%0.33CS..  trans-133.3121.2-177.9-45.4-80.7000111.8P91 Y93 L98 M101 L120 C126 F127P91-F124 HydrophobicContact CB-CD1 3.72Å; P91-F124 HydrophobicContact CB-CE1 3.58Å; P91-F124 HydrophobicContact CB-CG 4.43Å; P91-F124 HydrophobicContact CB-CZ 4.19Å; P91-F124 HydrophobicContact CG-CB 4.48Å; P91-F124 HydrophobicContact CG-CD1 3.72Å; P91-F124 HydrophobicContact CG-CD2 4.36Å; P91-F124 HydrophobicContact CG-CE1 3.95Å; P91-F124 HydrophobicContact CG-CG 3.93Å; P91-F124 HydrophobicContact CG-CZ 4.35Å; Y93-F124 HydrophobicContact CD2-CE1 4.43Å; Y93-F124 HydrophobicContact CD2-CZ 4.19Å; L98-F124 HydrophobicContact CD2-CD2 4.08Å; L98-F124 HydrophobicContact CD2-CE2 3.43Å; L98-F124 VanDerWaalsContact CD2-CE2 3.43Å; L98-F124 HydrophobicContact CD2-CZ 3.82Å; M101-F124 HydrophobicContact CE-CZ 4.15Å; L120-F124 HydrophobicContact CD2-CD2 4.27Å; L120-F124 HydrophobicContact CD2-CE2 4.18Å; L120-F124 PolarHBondContact O-N 3.08Å; F124-C126 PolarHBondContact O-N 3Å; F124-F127 HydrophobicContact CB-CD2 3.83Å; F124-F127 HydrophobicContact CB-CE2 4.01Å; F124-F127 HydrophobicContact CD2-CD2 4.18Å; F124-F127 AromaticContact CD2-CE2 3.93Å; F124-F127 HydrophobicContact CD2-CE2 3.93Å; F124-F127 HydrophobicContact CG-CD2 4.45Å; F124-F127 HydrophobicContact CG-CE2 4.27Å; F124-F127 PolarHBondContact O-N 2.85Å
125E91.7Very high94.6Very high128 Ų12864.2 Ų64.260%0.59832%0.318SS*.G310 helixtrans-64.5-28.7-172.7-47.6-153.612700112.8F127 R128E125-F127 PolarHBondContact O-N 3.34Å; E125-R128 WeakPolarHBondContact O-CB 3.48Å; E125-R128 PolarHBondContact O-N 2.96Å; E125-R128 IonicContact OE1-CZ 2.66Å; E125-R128 IonicContact OE1-NH1 3.83Å; E125-R128 PolarHBondContact OE1-NH1 3.2Å
126C90.4Very high94.6Very high50 Ų5064.6 Ų64.634%0.33832%0.323SS..G310 helixtrans-59.3-17.1177.865.20000114.7D89 F124D89-C126 PolarHBondContact O-SG 3.39Å; F124-C126 PolarHBondContact O-N 3Å
127F93.7Very high94.6Very high11 Ų1166.3 Ų66.35%0.04834%0.335CS..G310 helixtrans-94.1-8.8175.9-61.4-58000114.1Y95 L98 L120 Q121 F124 E125 W134Y95-F127 HydrophobicContact CE1-CE1 4.42Å; L98-F127 HydrophobicContact CD1-CE2 4.15Å; L98-F127 HydrophobicContact CD1-CZ 3.78Å; L120-F127 HydrophobicContact CB-CD2 3.8Å; L120-F127 HydrophobicContact CB-CE2 4.29Å; L120-F127 HydrophobicContact CB-CG 4.31Å; L120-F127 HydrophobicContact CD2-CE2 4.46Å; L120-F127 WeakPolarHBondContact O-CD2 3.23Å; Q121-F127 HydrophobicContact CG-CB 4.09Å; Q121-F127 WeakPolarHBondContact CG-O 3.44Å; F124-F127 HydrophobicContact CB-CD2 3.83Å; F124-F127 HydrophobicContact CB-CE2 4.01Å; F124-F127 HydrophobicContact CD2-CD2 4.18Å; F124-F127 AromaticContact CD2-CE2 3.93Å; F124-F127 HydrophobicContact CD2-CE2 3.93Å; F124-F127 HydrophobicContact CG-CD2 4.45Å; F124-F127 HydrophobicContact CG-CE2 4.27Å; F124-F127 PolarHBondContact O-N 2.85Å; E125-F127 PolarHBondContact O-N 3.34Å; F127-W134 HydrophobicContact CB-CD2 4.4Å; F127-W134 HydrophobicContact CB-CH2 4.26Å; F127-W134 HydrophobicContact CB-CZ2 3.91Å; F127-W134 HydrophobicContact CD1-CB 4.03Å; F127-W134 AromaticContact CD1-CD2 3.56Å; F127-W134 HydrophobicContact CD1-CD2 3.56Å; F127-W134 AromaticContact CD1-CE2 3.97Å; F127-W134 AromaticContact CD1-CE3 3.9Å; F127-W134 HydrophobicContact CD1-CE3 3.9Å; F127-W134 AromaticContact CD1-CG 3.63Å; F127-W134 HydrophobicContact CD1-CG 3.63Å; F127-W134 HydrophobicContact CE1-CB 4.02Å; F127-W134 HydrophobicContact CE1-CD2 4.29Å; F127-W134 HydrophobicContact CE1-CE3 4.43Å; F127-W134 HydrophobicContact CE1-CG 4.13Å; F127-W134 HydrophobicContact CG-CD2 4.31Å; F127-W134 HydrophobicContact CG-CE3 4.47Å; F127-W134 VanDerWaalsContact O-CZ2 3.27Å; F127-W134 WeakPolarHBondContact O-CZ2 3.5Å; F127-W134 PolarHBondContact O-NE1 2.95Å
128R93.4Very high94.6Very high127 Ų12764.9 Ų64.948%0.47933%0.329SS..SBendtrans-80.2-14.7-179-59.3-179.4-174.6151.35.7114.1Q121 E122 E125Q121-R128 HydrophobicContact CB-CG 4.22Å; Q121-R128 WeakPolarHBondContact O-CG 3.48Å; Q121-R128 PolarHBondContact O-NE 3.44Å; Q121-R128 PolarHBondContact O-NH2 3.23Å; E122-R128 PolarHBondContact O-NH2 3.42Å; E125-R128 WeakPolarHBondContact O-CB 3.48Å; E125-R128 PolarHBondContact O-N 2.96Å; E125-R128 IonicContact OE1-CZ 2.66Å; E125-R128 IonicContact OE1-NH1 3.83Å; E125-R128 PolarHBondContact OE1-NH1 3.2Å
129G90.8Very high94.6Very high39 Ų3965 Ų6540%0.40233%0.325SS..SBendtrans-69.2174.1-174.200000115Y131 Q132G129-Y131 VanDerWaalsContact C-N 3.26Å; G129-Y131 PolarHBondContact O-N 2.94Å; G129-Q132 PolarHBondContact O-NE2 3.09Å
130S92.9Very high94.6Very high123 Ų12368 Ų6886%0.8634%0.339SS*.SBendtrans-60.5-33.5177.755.50000112.9Q132S130-Q132 WeakPolarHBondContact O-CG 3.48Å; S130-Q132 PolarHBondContact O-N 2.83Å; S130-Q132 PolarHBondContact O-NE2 3.38Å
131Y92.8Very high94.7Very high140 Ų14069.1 Ų69.155%0.54935%0.345SS..  trans-64.4118.7178178.3-114.1000112.5G129 G133 W134G129-Y131 VanDerWaalsContact C-N 3.26Å; G129-Y131 PolarHBondContact O-N 2.94Å; Y131-G133 VanDerWaalsContact CZ-CA 3.48Å; Y131-W134 PolarHBondContact O-NE1 3Å
132Q94.6Very high94.8Very high79 Ų7966.7 Ų66.737%0.36933%0.334SS..  trans-105.91.5-178.5-58.4-55.5-6200114.1G129 S130 W134 K135G129-Q132 PolarHBondContact O-NE2 3.09Å; S130-Q132 WeakPolarHBondContact O-CG 3.48Å; S130-Q132 PolarHBondContact O-N 2.83Å; S130-Q132 PolarHBondContact O-NE2 3.38Å; Q132-W134 PolarHBondContact O-N 2.85Å; Q132-K135 VanDerWaalsContact O-CB 3.28Å; Q132-K135 WeakPolarHBondContact O-CB 3.47Å; Q132-K135 PolarHBondContact O-N 3.39Å
133G95.3Very high94.8Very high25 Ų2564.8 Ų64.826%0.25834%0.335SS..THydrogen-bonded Turntrans-61.6-28.7-174.300000113.9Y131 K135 N136 S137Y131-G133 VanDerWaalsContact CZ-CA 3.48Å; G133-K135 PolarHBondContact O-N 2.96Å; G133-N136 WeakPolarHBondContact O-CA 3.28Å; G133-N136 WeakPolarHBondContact O-CB 3.43Å; G133-N136 PolarHBondContact O-N 2.71Å; G133-S137 PolarHBondContact O-N 2.97Å
134W95.3Very high94.8Very high6 Ų664.5 Ų64.52%0.02334%0.341CS..Hα-helixtrans-56.4-30.5171.864.2-97000113.3Y95 Y117 L120 Q121 F127 Y131 Q132 N136 S137 V138Y95-W134 HydrophobicContact CE1-CB 4.38Å; Y117-W134 HydrophobicContact CD1-CH2 4.13Å; Y117-W134 AromaticContact CD1-CZ3 3.7Å; Y117-W134 HydrophobicContact CD1-CZ3 3.7Å; Y117-W134 HydrophobicContact CE1-CZ3 4.31Å; Y117-W134 HydrophobicContact CG-CH2 4.29Å; Y117-W134 HydrophobicContact CG-CZ3 4.32Å; L120-W134 HydrophobicContact CD1-CZ3 4.35Å; Q121-W134 HydrophobicContact CG-CH2 4.13Å; Q121-W134 HydrophobicContact CG-CZ2 4.08Å; F127-W134 HydrophobicContact CB-CD2 4.4Å; F127-W134 HydrophobicContact CB-CH2 4.26Å; F127-W134 HydrophobicContact CB-CZ2 3.91Å; F127-W134 HydrophobicContact CD1-CB 4.03Å; F127-W134 AromaticContact CD1-CD2 3.56Å; F127-W134 HydrophobicContact CD1-CD2 3.56Å; F127-W134 AromaticContact CD1-CE2 3.97Å; F127-W134 AromaticContact CD1-CE3 3.9Å; F127-W134 HydrophobicContact CD1-CE3 3.9Å; F127-W134 AromaticContact CD1-CG 3.63Å; F127-W134 HydrophobicContact CD1-CG 3.63Å; F127-W134 HydrophobicContact CE1-CB 4.02Å; F127-W134 HydrophobicContact CE1-CD2 4.29Å; F127-W134 HydrophobicContact CE1-CE3 4.43Å; F127-W134 HydrophobicContact CE1-CG 4.13Å; F127-W134 HydrophobicContact CG-CD2 4.31Å; F127-W134 HydrophobicContact CG-CE3 4.47Å; F127-W134 VanDerWaalsContact O-CZ2 3.27Å; F127-W134 WeakPolarHBondContact O-CZ2 3.5Å; F127-W134 PolarHBondContact O-NE1 2.95Å; Y131-W134 PolarHBondContact O-NE1 3Å; Q132-W134 PolarHBondContact O-N 2.85Å; W134-N136 PolarHBondContact O-N 3.08Å; W134-S137 WeakPolarHBondContact O-CB 3.2Å; W134-S137 PolarHBondContact O-N 3.34Å; W134-S137 VanDerWaalsContact O-N 3.17Å; W134-V138 HydrophobicContact CE3-CG2 4.15Å; W134-V138 HydrophobicContact CZ3-CG2 4.5Å; W134-V138 WeakPolarHBondContact O-CG2 3.2Å; W134-V138 PolarHBondContact O-N 3.31Å
135K97.3Very high94.8Very high45 Ų4564.9 Ų64.920%0.19634%0.344CS..Hα-helixtrans-63.3-28.7174.5-69.1-176.6169.4161.50111.6Y117 Q132 G133 R139Y117-K135 HydrophobicContact CD1-CG 4.06Å; Y117-K135 HydrophobicContact CD2-CD 4.06Å; Y117-K135 HydrophobicContact CD2-CG 4.45Å; Y117-K135 HydrophobicContact CE1-CB 3.86Å; Y117-K135 HydrophobicContact CE1-CD 4.35Å; Y117-K135 HydrophobicContact CE1-CG 3.75Å; Y117-K135 HydrophobicContact CE2-CB 4.45Å; Y117-K135 HydrophobicContact CE2-CD 3.87Å; Y117-K135 HydrophobicContact CE2-CG 4.17Å; Y117-K135 HydrophobicContact CG-CD 4.39Å; Y117-K135 HydrophobicContact CG-CG 4.4Å; Y117-K135 PolarHBondContact OH-O 3.12Å; Q132-K135 VanDerWaalsContact O-CB 3.28Å; Q132-K135 WeakPolarHBondContact O-CB 3.47Å; Q132-K135 PolarHBondContact O-N 3.39Å; G133-K135 PolarHBondContact O-N 2.96Å; K135-R139 WeakPolarHBondContact O-CG 3.45Å; K135-R139 PolarHBondContact O-N 2.95Å; K135-R139 PolarHBondContact O-NH1 3.19Å; K135-R139 VanDerWaalsContact O-NH1 3.14Å
136N97.3Very high94.9Very high95 Ų9565.8 Ų65.851%0.50835%0.354SS..Hα-helixtrans-69.9-47.4173-162.541.9000111.1G133 W134 V138 R139 H140G133-N136 WeakPolarHBondContact O-CA 3.28Å; G133-N136 WeakPolarHBondContact O-CB 3.43Å; G133-N136 PolarHBondContact O-N 2.71Å; W134-N136 PolarHBondContact O-N 3.08Å; N136-V138 VanDerWaalsContact C-N 3.27Å; N136-V138 PolarHBondContact O-N 2.86Å; N136-R139 PolarHBondContact O-N 3.49Å; N136-R139 PolarHBondContact OD1-NH2 3.2Å; N136-H140 WeakPolarHBondContact O-CB 3.37Å; N136-H140 PolarHBondContact O-N 2.93Å
137S96.9Very high95Very high36 Ų3664 Ų6425%0.25234%0.341SS..Hα-helixtrans-56.5-40.4175.7-48.20000112Y95 G133 W134 N141Y95-S137 VanDerWaalsContact CE2-CB 3.43Å; Y95-S137 VanDerWaalsContact CZ-CB 3.44Å; G133-S137 PolarHBondContact O-N 2.97Å; W134-S137 WeakPolarHBondContact O-CB 3.2Å; W134-S137 PolarHBondContact O-N 3.34Å; W134-S137 VanDerWaalsContact O-N 3.17Å; S137-N141 WeakPolarHBondContact O-CB 3.4Å; S137-N141 PolarHBondContact O-N 3.14Å; S137-N141 PolarHBondContact O-ND2 3.18Å
138V97.4Very high95.1Very high0 Ų063.9 Ų63.90%034%0.341CS..Hα-helixtrans-62.8-51.1174.3171.30000111.9Y95 I99 L113 I116 Y117 L120 W134 N136 H140 N141 L142Y95-V138 HydrophobicContact CD1-CG2 3.96Å; Y95-V138 HydrophobicContact CE1-CG2 4.27Å; I99-V138 HydrophobicContact CD1-CG1 4.22Å; I99-V138 HydrophobicContact CG1-CG1 4.26Å; L113-V138 HydrophobicContact CD1-CG1 4.14Å; I116-V138 HydrophobicContact CG2-CG1 3.99Å; Y117-V138 HydrophobicContact CD1-CG1 4.35Å; Y117-V138 HydrophobicContact CE1-CB 4.15Å; Y117-V138 HydrophobicContact CE1-CG1 3.92Å; L120-V138 HydrophobicContact CD1-CG2 4.05Å; W134-V138 HydrophobicContact CE3-CG2 4.15Å; W134-V138 HydrophobicContact CZ3-CG2 4.5Å; W134-V138 WeakPolarHBondContact O-CG2 3.2Å; W134-V138 PolarHBondContact O-N 3.31Å; N136-V138 VanDerWaalsContact C-N 3.27Å; N136-V138 PolarHBondContact O-N 2.86Å; V138-H140 VanDerWaalsContact C-N 3.33Å; V138-H140 PolarHBondContact O-N 2.92Å; V138-N141 PolarHBondContact O-N 3.23Å; V138-L142 HydrophobicContact CG1-CD1 4.17Å; V138-L142 WeakPolarHBondContact O-CG 3.48Å; V138-L142 PolarHBondContact O-N 3.46Å
139R98.2Very high95.2Very high106 Ų10660.6 Ų60.640%0.434%0.335SS..Hα-helixtrans-59.2-44178.2-70.8-175.6-52-95.69.1112.3L113 Y117 K135 N136 L142 S143L113-R139 HydrophobicContact CD1-CG 3.98Å; L113-R139 HydrophobicContact CD2-CG 3.86Å; Y117-R139 WeakPolarHBondContact OH-CG 3.27Å; Y117-R139 PolarHBondContact OH-NH1 2.96Å; K135-R139 WeakPolarHBondContact O-CG 3.45Å; K135-R139 PolarHBondContact O-N 2.95Å; K135-R139 PolarHBondContact O-NH1 3.19Å; K135-R139 VanDerWaalsContact O-NH1 3.14Å; N136-R139 PolarHBondContact O-N 3.49Å; N136-R139 PolarHBondContact OD1-NH2 3.2Å; R139-L142 PolarHBondContact O-N 2.93Å; R139-S143 PolarHBondContact O-N 2.98Å; R139-S143 PolarHBondContact O-OG 3.2Å; R139-S143 VanDerWaalsContact O-OG 3.14Å
140H97.4Very high95.4Very high96 Ų9664.5 Ų64.544%0.44434%0.34SS..Hα-helixtrans-60.1-46176.4166.473.3000111.6N136 V138 L142 S143 L144N136-H140 WeakPolarHBondContact O-CB 3.37Å; N136-H140 PolarHBondContact O-N 2.93Å; V138-H140 VanDerWaalsContact C-N 3.33Å; V138-H140 PolarHBondContact O-N 2.92Å; H140-L142 PolarHBondContact O-N 3.27Å; H140-S143 PolarHBondContact O-N 3.03Å; H140-S143 PolarHBondContact O-OG 3.23Å; H140-S143 VanDerWaalsContact O-OG 3.07Å; H140-L144 WeakPolarHBondContact CE1-CD1 3.28Å; H140-L144 VanDerWaalsContact O-CB 3.23Å; H140-L144 WeakPolarHBondContact O-CB 3.43Å; H140-L144 PolarHBondContact O-N 3.32Å
141N97.1Very high95.4Very high24 Ų2461.1 Ų61.113%0.12831%0.312CS..Hα-helixtrans-65-36.9178.7-86.2-96.6000112.6I96 I99 S137 V138 S143 N145I96-N141 WeakPolarHBondContact CG1-OD1 3.45Å; I99-N141 HydrophobicContact CD1-CB 3.8Å; S137-N141 WeakPolarHBondContact O-CB 3.4Å; S137-N141 PolarHBondContact O-N 3.14Å; S137-N141 PolarHBondContact O-ND2 3.18Å; V138-N141 PolarHBondContact O-N 3.23Å; N141-S143 VanDerWaalsContact C-N 3.29Å; N141-S143 PolarHBondContact O-N 3.04Å; N141-N145 PolarHBondContact O-N 3.44Å; N141-N145 PolarHBondContact O-ND2 3.4Å
142L96.8Very high95.3Very high4 Ų459.9 Ų59.92%0.02132%0.322CS..Hα-helixtrans-63.4-32.2174.9-73.8168.7000113.1I99 L113 I116 V138 R139 H140 F148 W164I99-L142 HydrophobicContact CD1-CD2 4.35Å; I99-L142 HydrophobicContact CD1-CG 4.17Å; I99-L142 HydrophobicContact CG2-CD2 3.69Å; L113-L142 HydrophobicContact CD1-CD1 3.66Å; I116-L142 HydrophobicContact CD1-CD1 4.17Å; I116-L142 HydrophobicContact CD1-CD2 4.21Å; V138-L142 HydrophobicContact CG1-CD1 4.17Å; V138-L142 WeakPolarHBondContact O-CG 3.48Å; V138-L142 PolarHBondContact O-N 3.46Å; R139-L142 PolarHBondContact O-N 2.93Å; H140-L142 PolarHBondContact O-N 3.27Å; L142-F148 HydrophobicContact CD2-CB 4.06Å; L142-F148 HydrophobicContact CD2-CD1 4.32Å; L142-F148 HydrophobicContact CD2-CD2 4.16Å; L142-F148 HydrophobicContact CD2-CG 3.92Å; L142-W164 HydrophobicContact CB-CD2 4.31Å; L142-W164 HydrophobicContact CB-CE3 4.26Å; L142-W164 HydrophobicContact CB-CH2 4.01Å; L142-W164 HydrophobicContact CB-CZ2 4.08Å; L142-W164 HydrophobicContact CB-CZ3 4.11Å; L142-W164 HydrophobicContact CD1-CD2 4.38Å; L142-W164 HydrophobicContact CD1-CG 4.44Å; L142-W164 HydrophobicContact CD2-CB 4.2Å; L142-W164 HydrophobicContact CD2-CD2 3.9Å; L142-W164 HydrophobicContact CD2-CE3 4.07Å; L142-W164 HydrophobicContact CD2-CG 3.96Å; L142-W164 HydrophobicContact CG-CD2 4.43Å; L142-W164 WeakPolarHBondContact O-CZ3 3.5Å
143S95.7Very high94.9Very high91 Ų9158.8 Ų58.864%0.63632%0.316SS*.Hα-helixtrans-94.9-19.8179.653.60000115R139 H140 N141R139-S143 PolarHBondContact O-N 2.98Å; R139-S143 PolarHBondContact O-OG 3.2Å; R139-S143 VanDerWaalsContact O-OG 3.14Å; H140-S143 PolarHBondContact O-N 3.03Å; H140-S143 PolarHBondContact O-OG 3.23Å; H140-S143 VanDerWaalsContact O-OG 3.07Å; N141-S143 VanDerWaalsContact C-N 3.29Å; N141-S143 PolarHBondContact O-N 3.04Å
144L93.7Very high94.3Very high101 Ų10163.4 Ų63.453%0.52934%0.339SS..Hα-helixtrans-85.9-31.3-177.7180147.8000113.1H140H140-L144 WeakPolarHBondContact CE1-CD1 3.28Å; H140-L144 VanDerWaalsContact O-CB 3.23Å; H140-L144 WeakPolarHBondContact O-CB 3.43Å; H140-L144 PolarHBondContact O-N 3.32Å
145N93Very high93.4Very high36 Ų3668.4 Ų68.419%0.19338%0.382CS..  trans-109.2123-170.2-55.7-87.5000111.1I96 N141 C147 F148I96-N145 HydrophobicContact CD1-CB 4.2Å; I96-N145 WeakPolarHBondContact CD1-ND2 3.14Å; I96-N145 WeakPolarHBondContact CD1-OD1 3.45Å; N141-N145 PolarHBondContact O-N 3.44Å; N141-N145 PolarHBondContact O-ND2 3.4Å; N145-C147 VanDerWaalsContact CB-SG 3.51Å; N145-C147 PolarHBondContact O-N 3.37Å; N145-F148 HydrophobicContact CB-CD2 4.3Å; N145-F148 PolarHBondContact O-N 3.03Å; N145-F148 VanDerWaalsContact O-N 3.08Å
146D92.1Very high92.3Very high148 Ų14869.8 Ų69.879%0.79141%0.409SS*.THydrogen-bonded Turntrans-59-18.4179.7-53.4-46.3000113.7F148D146-F148 PolarHBondContact O-N 2.97Å; D146-F148 VanDerWaalsContact O-N 3.14Å
147C93.1Very high91.3Very high11 Ų1175.4 Ų75.47%0.07442%0.422CS..THydrogen-bonded Turntrans-62-17.1174.664.90000114.3N145 I166 E167 A170 F174N145-C147 VanDerWaalsContact CB-SG 3.51Å; N145-C147 PolarHBondContact O-N 3.37Å; C147-I166 WeakPolarHBondContact O-CA 3.35Å; C147-E167 PolarHBondContact O-N 3.2Å; C147-A170 HydrophobicContact CB-CB 3.42Å; C147-A170 VanDerWaalsContact CB-CB 3.42Å; C147-F174 HydrophobicContact CB-CE2 3.87Å
148F95.4Very high90.2Very high10 Ų1079.3 Ų79.34%0.04446%0.457CS..EExtended strand (participates in β ladder)trans-108.3103.5178.7-60.8-55000111.3I96 I99 V100 I103 L142 N145 D146 W164 T165 I166I96-F148 HydrophobicContact CB-CE2 4.32Å; I96-F148 HydrophobicContact CB-CZ 4.29Å; I96-F148 HydrophobicContact CG1-CE2 4.31Å; I96-F148 HydrophobicContact CG2-CE2 3.89Å; I96-F148 HydrophobicContact CG2-CZ 3.65Å; I99-F148 HydrophobicContact CB-CE1 3.99Å; I99-F148 HydrophobicContact CB-CE2 4.3Å; I99-F148 HydrophobicContact CB-CZ 3.62Å; I99-F148 HydrophobicContact CD1-CE2 4.08Å; I99-F148 HydrophobicContact CD1-CZ 4.25Å; I99-F148 HydrophobicContact CG2-CD1 3.92Å; I99-F148 HydrophobicContact CG2-CE1 3.36Å; I99-F148 HydrophobicContact CG2-CE2 4.12Å; I99-F148 HydrophobicContact CG2-CZ 3.46Å; I99-F148 VanDerWaalsContact CG2-CZ 3.46Å; V100-F148 HydrophobicContact CG2-CE1 3.75Å; V100-F148 HydrophobicContact CG2-CZ 3.92Å; I103-F148 HydrophobicContact CD1-CD1 4.02Å; I103-F148 HydrophobicContact CD1-CE1 4.21Å; L142-F148 HydrophobicContact CD2-CB 4.06Å; L142-F148 HydrophobicContact CD2-CD1 4.32Å; L142-F148 HydrophobicContact CD2-CD2 4.16Å; L142-F148 HydrophobicContact CD2-CG 3.92Å; N145-F148 HydrophobicContact CB-CD2 4.3Å; N145-F148 PolarHBondContact O-N 3.03Å; N145-F148 VanDerWaalsContact O-N 3.08Å; D146-F148 PolarHBondContact O-N 2.97Å; D146-F148 VanDerWaalsContact O-N 3.14Å; F148-W164 HydrophobicContact CB-CE3 4.12Å; F148-W164 HydrophobicContact CB-CZ3 4.47Å; F148-T165 WeakPolarHBondContact CA-O 3.42Å; F148-I166 HydrophobicContact CE1-CG1 4.42Å
149V95.3Very high89.4Confident58 Ų5881.2 Ų81.235%0.35248%0.477SS..EExtended strand (participates in β ladder)trans-88.7125.8-177.5-176.80000110.1L151 W164 T165 E167V149-L151 HydrophobicContact CG1-CD2 4.36Å; V149-L151 PolarHBondContact O-N 3.14Å; V149-W164 WeakPolarHBondContact O-CA 3.21Å; V149-T165 HydrophobicContact CB-CG2 3.96Å; V149-T165 PolarHBondContact N-O 3.3Å; V149-T165 PolarHBondContact O-N 3.17Å; V149-E167 HydrophobicContact CG2-CB 3.97Å; V149-E167 HydrophobicContact CG2-CG 4.47Å
150K96.1Very high88.7Confident120 Ų12086.1 Ų86.152%0.52250%0.501SS..EExtended strand (participates in β ladder)trans-81.4110.7175.4-177-170.2172.7-166.30110.2H162 W164K150-H162 WeakPolarHBondContact CE-CD2 3.4Å; K150-H162 VanDerWaalsContact CE-CE1 3.41Å; K150-H162 WeakPolarHBondContact CE-CE1 3.4Å; K150-H162 WeakPolarHBondContact CE-ND1 3.43Å; K150-H162 WeakPolarHBondContact CE-NE2 3.42Å; K150-H162 HydrophobicContact CG-CB 3.99Å; K150-H162 PolarHBondContact NZ-NE2 2.89Å; K150-W164 HydrophobicContact CB-CE3 4.09Å; K150-W164 HydrophobicContact CB-CH2 4.07Å; K150-W164 HydrophobicContact CB-CZ3 3.77Å; K150-W164 HydrophobicContact CG-CH2 4.35Å; K150-W164 HydrophobicContact CG-CZ2 4.5Å; K150-W164 HydrophobicContact CG-CZ3 4.49Å
151L93.4Very high88.4Confident52 Ų5283.6 Ų83.627%0.27250%0.501SS..EExtended strand (participates in β ladder)trans-91.1140.8178.6-61.1176.7000111.9R110 V149 Y163 T165R110-L151 HydrophobicContact CB-CD1 4.32Å; V149-L151 HydrophobicContact CG1-CD2 4.36Å; V149-L151 PolarHBondContact O-N 3.14Å; L151-Y163 PolarHBondContact N-O 2.94Å; L151-T165 HydrophobicContact CD1-CG2 3.74Å; L151-T165 HydrophobicContact CD2-CG2 4.04Å; L151-T165 HydrophobicContact CG-CG2 3.86Å
152P90.1Very high88.2Confident115 Ų11586.4 Ų86.475%0.74751%0.513SS*.PPolyproline II helixtrans-66.5147.1171.629.3-34.3000111
153K86.4Confident88.2Confident55 Ų5589 Ų8924%0.23952%0.523CS..PPolyproline II helixtrans-92.1142.6166.8-77.7-165.1179.4172.20110A155 G159 K160 G161 Y163K153-A155 PolarHBondContact O-N 3.49Å; K153-G159 WeakPolarHBondContact CD-O 3.46Å; K153-G159 PolarHBondContact NZ-O 3.12Å; K153-K160 PolarHBondContact NZ-O 2.86Å; K153-G161 WeakPolarHBondContact CD-O 3.42Å; K153-G161 WeakPolarHBondContact CE-O 3.33Å; K153-G161 PolarHBondContact NZ-O 3.5Å; K153-G161 VanDerWaalsContact NZ-O 3.14Å; K153-Y163 HydrophobicContact CD-CD2 4.34Å; K153-Y163 HydrophobicContact CD-CE2 4.13Å; K153-Y163 HydrophobicContact CG-CD2 3.72Å; K153-Y163 HydrophobicContact CG-CE2 3.87Å
154V82.9Confident88.2Confident122 Ų12286.5 Ų86.574%0.73950%0.5SS*.PPolyproline II helixtrans-61.3122.6170-177.90000108.5G156 R157V154-G156 PolarHBondContact O-N 2.95Å; V154-R157 PolarHBondContact O-N 3.43Å
155A75.7Confident88.3Confident112 Ų11283.2 Ų83.293%0.92648%0.484SS*.THydrogen-bonded Turntrans-64.3-5-167.500000115.8K153K153-A155 PolarHBondContact O-N 3.49Å
156G74.2Confident88.4Confident74 Ų7482 Ų8276%0.76348%0.477SS*.THydrogen-bonded Turntrans-95.6-7.7178.100000116.2V154V154-G156 PolarHBondContact O-N 2.95Å
157R75.7Confident88.4Confident212 Ų21278.5 Ų78.580%0.846%0.456SS*.SBendtrans-101.8115.2177.8-70.8-169.3-177.7-178.51.9111.2V154 G159V154-R157 PolarHBondContact O-N 3.43Å; R157-G159 PolarHBondContact O-N 3Å
158A75.2Confident88Confident118 Ų11883.4 Ų83.498%0.97549%0.488SS*.  trans-66.789.3178.300000111.9
159G79.9Confident87.3Confident40 Ų4086.3 Ų86.341%0.41251%0.51SS..  trans-153.1117.6178.100000112.5K153 R157K153-G159 WeakPolarHBondContact CD-O 3.46Å; K153-G159 PolarHBondContact NZ-O 3.12Å; R157-G159 PolarHBondContact O-N 3Å
160K84.1Confident86.1Confident209 Ų20983.9 Ų83.991%0.90950%0.495SS*.  trans-55.1147-176.9-170.5170.8-177.7172.70112.9K153K153-K160 PolarHBondContact NZ-O 2.86Å
161G89.7Confident84.7Confident43 Ų4379.2 Ų79.244%0.44348%0.479SS..SBendtrans73.7-177.5173.500000114.9K153K153-G161 WeakPolarHBondContact CD-O 3.42Å; K153-G161 WeakPolarHBondContact CE-O 3.33Å; K153-G161 PolarHBondContact NZ-O 3.5Å; K153-G161 VanDerWaalsContact NZ-O 3.14Å
162H94.2Very high83.1Confident83 Ų8381.3 Ų81.338%0.38450%0.497SS..  trans-105.9162.3-177.2-54.784.1000110.4K150K150-H162 WeakPolarHBondContact CE-CD2 3.4Å; K150-H162 VanDerWaalsContact CE-CE1 3.41Å; K150-H162 WeakPolarHBondContact CE-CE1 3.4Å; K150-H162 WeakPolarHBondContact CE-ND1 3.43Å; K150-H162 WeakPolarHBondContact CE-NE2 3.42Å; K150-H162 HydrophobicContact CG-CB 3.99Å; K150-H162 PolarHBondContact NZ-NE2 2.89Å
163Y95.6Very high81.8Confident60 Ų6078.9 Ų78.924%0.23548%0.476CS..EExtended strand (participates in β ladder)trans-83.2144.3165-74.2-70000109.6R110 T112 L151 K153R110-Y163 HydrophobicContact CG-CD1 4.01Å; R110-Y163 HydrophobicContact CG-CG 4.36Å; T112-Y163 HydrophobicContact CG2-CD1 3.68Å; T112-Y163 HydrophobicContact CG2-CE1 3.6Å; T112-Y163 HydrophobicContact CG2-CG 4.42Å; L151-Y163 PolarHBondContact N-O 2.94Å; K153-Y163 HydrophobicContact CD-CD2 4.34Å; K153-Y163 HydrophobicContact CD-CE2 4.13Å; K153-Y163 HydrophobicContact CG-CD2 3.72Å; K153-Y163 HydrophobicContact CG-CE2 3.87Å
164W96.9Very high80.6Confident38 Ų3877.6 Ų77.614%0.14447%0.47CS..EExtended strand (participates in β ladder)trans-115.8136.5171-63.393.3000108.6I103 R110 A111 L142 F148 V149 K150I103-W164 HydrophobicContact CD1-CB 4.34Å; R110-W164 CarbonylContact C-O 3.5Å; R110-W164 WeakPolarHBondContact CA-O 3.17Å; R110-W164 WeakPolarHBondContact CB-O 3.39Å; A111-W164 PolarHBondContact N-O 2.93Å; A111-W164 WeakPolarHBondContact O-CB 3.41Å; A111-W164 PolarHBondContact O-N 3.12Å; L142-W164 HydrophobicContact CB-CD2 4.31Å; L142-W164 HydrophobicContact CB-CE3 4.26Å; L142-W164 HydrophobicContact CB-CH2 4.01Å; L142-W164 HydrophobicContact CB-CZ2 4.08Å; L142-W164 HydrophobicContact CB-CZ3 4.11Å; L142-W164 HydrophobicContact CD1-CD2 4.38Å; L142-W164 HydrophobicContact CD1-CG 4.44Å; L142-W164 HydrophobicContact CD2-CB 4.2Å; L142-W164 HydrophobicContact CD2-CD2 3.9Å; L142-W164 HydrophobicContact CD2-CE3 4.07Å; L142-W164 HydrophobicContact CD2-CG 3.96Å; L142-W164 HydrophobicContact CG-CD2 4.43Å; L142-W164 WeakPolarHBondContact O-CZ3 3.5Å; F148-W164 HydrophobicContact CB-CE3 4.12Å; F148-W164 HydrophobicContact CB-CZ3 4.47Å; V149-W164 WeakPolarHBondContact O-CA 3.21Å; K150-W164 HydrophobicContact CB-CE3 4.09Å; K150-W164 HydrophobicContact CB-CH2 4.07Å; K150-W164 HydrophobicContact CB-CZ3 3.77Å; K150-W164 HydrophobicContact CG-CH2 4.35Å; K150-W164 HydrophobicContact CG-CZ2 4.5Å; K150-W164 HydrophobicContact CG-CZ3 4.49Å
165T95.5Very high79.5Confident32 Ų3275.2 Ų75.220%0.19645%0.45CS..EExtended strand (participates in β ladder)trans-129.4167.8173.1-1690000109.4K109 F148 V149 L151K109-T165 PolarHBondContact O-OG1 3.48Å; F148-T165 WeakPolarHBondContact CA-O 3.42Å; V149-T165 HydrophobicContact CB-CG2 3.96Å; V149-T165 PolarHBondContact N-O 3.3Å; V149-T165 PolarHBondContact O-N 3.17Å; L151-T165 HydrophobicContact CD1-CG2 3.74Å; L151-T165 HydrophobicContact CD2-CG2 4.04Å; L151-T165 HydrophobicContact CG-CG2 3.86Å
166I94.8Very high78.2Confident10 Ų1074.9 Ų74.95%0.05143%0.428CS..EExtended strand (participates in β ladder)trans-90.3134.6174.5-59.2156.7000107.6V100 I103 E104 C147 F148 A171V100-I166 HydrophobicContact CB-CD1 4.29Å; V100-I166 HydrophobicContact CG1-CD1 4.06Å; V100-I166 HydrophobicContact CG2-CD1 4.2Å; V100-I166 HydrophobicContact CG2-CG1 4.33Å; I103-I166 HydrophobicContact CB-CD1 3.89Å; I103-I166 HydrophobicContact CB-CG1 4.08Å; I103-I166 HydrophobicContact CD1-CG1 4.06Å; I103-I166 HydrophobicContact CG2-CD1 3.85Å; I103-I166 HydrophobicContact CG2-CG1 3.87Å; E104-I166 HydrophobicContact CG-CD1 4.07Å; E104-I166 WeakPolarHBondContact OE1-CD1 3.48Å; C147-I166 WeakPolarHBondContact O-CA 3.35Å; F148-I166 HydrophobicContact CE1-CG1 4.42Å; I166-A171 HydrophobicContact CG2-CB 3.85Å
167E91.8Very high77.1Confident74 Ų7481.4 Ų81.435%0.34644%0.439SS..  trans-61128.8170.3-170.4-156.9-179.400109.5C147 V149 S169 A170 A171C147-E167 PolarHBondContact O-N 3.2Å; V149-E167 HydrophobicContact CG2-CB 3.97Å; V149-E167 HydrophobicContact CG2-CG 4.47Å; E167-S169 PolarHBondContact O-N 3.26Å; E167-S169 VanDerWaalsContact O-N 3.12Å; E167-S169 WeakPolarHBondContact OE1-CB 3.43Å; E167-A170 HydrophobicContact CB-CB 4.01Å; E167-A170 WeakPolarHBondContact O-CA 3.44Å; E167-A170 WeakPolarHBondContact O-CB 3.15Å; E167-A170 PolarHBondContact O-N 3.4Å; E167-A171 PolarHBondContact O-N 2.79Å
168P85.2Confident75.8Confident114 Ų11477.1 Ų77.174%0.7443%0.431SS*.Hα-helixtrans-54.7-35-178.9-28.936000114.2A170 A171P168-A170 VanDerWaalsContact C-N 3.33Å; P168-A170 PolarHBondContact O-N 3.17Å; P168-A171 PolarHBondContact O-N 3.21Å
169S80.3Confident74.6Confident72 Ų7273.6 Ų73.650%0.50341%0.406SS..Hα-helixtrans-65.7-32.6174.5-175.30000113.3E167 Q173E167-S169 PolarHBondContact O-N 3.26Å; E167-S169 VanDerWaalsContact O-N 3.12Å; E167-S169 WeakPolarHBondContact OE1-CB 3.43Å; S169-Q173 PolarHBondContact O-NE2 3.02Å
170A71.1Confident73.4Confident6 Ų673.1 Ų73.15%0.0540%0.397CS..Hα-helixtrans-84.1-31177.600000112.7C147 E167 P168 C172 Q173 F174C147-A170 HydrophobicContact CB-CB 3.42Å; C147-A170 VanDerWaalsContact CB-CB 3.42Å; E167-A170 HydrophobicContact CB-CB 4.01Å; E167-A170 WeakPolarHBondContact O-CA 3.44Å; E167-A170 WeakPolarHBondContact O-CB 3.15Å; E167-A170 PolarHBondContact O-N 3.4Å; P168-A170 VanDerWaalsContact C-N 3.33Å; P168-A170 PolarHBondContact O-N 3.17Å; A170-C172 VanDerWaalsContact C-N 3.34Å; A170-C172 PolarHBondContact O-N 3.45Å; A170-Q173 WeakPolarHBondContact O-CB 3.42Å; A170-Q173 PolarHBondContact O-N 3.13Å; A170-F174 HydrophobicContact CB-CE2 4.34Å; A170-F174 VanDerWaalsContact O-CD2 3.23Å; A170-F174 WeakPolarHBondContact O-CD2 3.41Å; A170-F174 PolarHBondContact O-N 3.05Å
171A66.9Low71.9Confident22 Ų2264.8 Ų64.818%0.18236%0.364CS..Hα-helixtrans-54.2-48.9178.400000111.7I166 E167 P168 Q173 F174 F175I166-A171 HydrophobicContact CG2-CB 3.85Å; E167-A171 PolarHBondContact O-N 2.79Å; P168-A171 PolarHBondContact O-N 3.21Å; A171-Q173 PolarHBondContact O-N 3.46Å; A171-Q173 VanDerWaalsContact O-N 3.12Å; A171-F174 PolarHBondContact O-N 3.18Å; A171-F174 VanDerWaalsContact O-N 3.09Å; A171-F175 WeakPolarHBondContact O-CD2 3.37Å; A171-F175 PolarHBondContact O-N 3.21Å
172C57.8Low70.1Confident96 Ų9671.4 Ų71.465%0.64938%0.375SS*.Hα-helixtrans-58.6-23.3175.8-179.90000113.9A170A170-C172 VanDerWaalsContact C-N 3.34Å; A170-C172 PolarHBondContact O-N 3.45Å
173Q63.9Low68.1Low65 Ų6572.9 Ų72.930%0.30438%0.377SS..Hα-helixtrans-89.2-11.4179.9-66.3174.677.200113.9S169 A170 A171 K184S169-Q173 PolarHBondContact O-NE2 3.02Å; A170-Q173 WeakPolarHBondContact O-CB 3.42Å; A170-Q173 PolarHBondContact O-N 3.13Å; A171-Q173 PolarHBondContact O-N 3.46Å; A171-Q173 VanDerWaalsContact O-N 3.12Å; Q173-K184 VanDerWaalsContact OE1-CD 3.27Å
174F62.2Low66.4Low28 Ų2877 Ų7712%0.12340%0.396CS..Hα-helixtrans-109.6-24.7174.8-64.7-64.8000112.9I96 V100 C147 A170 A171 V181I96-F174 HydrophobicContact CG2-CE1 3.9Å; I96-F174 HydrophobicContact CG2-CE2 4.09Å; I96-F174 HydrophobicContact CG2-CZ 3.66Å; V100-F174 HydrophobicContact CG1-CB 4.26Å; V100-F174 HydrophobicContact CG2-CD2 4.16Å; V100-F174 HydrophobicContact CG2-CG 4.42Å; C147-F174 HydrophobicContact CB-CE2 3.87Å; A170-F174 HydrophobicContact CB-CE2 4.34Å; A170-F174 VanDerWaalsContact O-CD2 3.23Å; A170-F174 WeakPolarHBondContact O-CD2 3.41Å; A170-F174 PolarHBondContact O-N 3.05Å; A171-F174 PolarHBondContact O-N 3.18Å; A171-F174 VanDerWaalsContact O-N 3.09Å; F174-V181 WeakPolarHBondContact O-CA 3.33Å
175F59.1Low64.6Low71 Ų7180.6 Ų80.631%0.31143%0.425SS..  trans-104.888.4169.5-61.3-71.4000109.2V100 E104 A171V100-F175 HydrophobicContact CG1-CD2 4.36Å; V100-F175 HydrophobicContact CG1-CE1 4.23Å; V100-F175 HydrophobicContact CG1-CE2 3.3Å; V100-F175 HydrophobicContact CG1-CZ 3.2Å; E104-F175 HydrophobicContact CB-CZ 4.19Å; E104-F175 HydrophobicContact CG-CD2 4.46Å; E104-F175 HydrophobicContact CG-CE1 4.31Å; E104-F175 HydrophobicContact CG-CE2 3.36Å; E104-F175 HydrophobicContact CG-CZ 3.27Å; A171-F175 WeakPolarHBondContact O-CD2 3.37Å; A171-F175 PolarHBondContact O-N 3.21Å
176F49Very low63Low105 Ų10590.6 Ų90.646%0.46146%0.459SS..  trans-63.1143.7154.4-70.8-87.6000108D178 G179 S180 R182F176-D178 WeakPolarHBondContact CB-OD1 3.39Å; F176-D178 PolarHBondContact O-N 2.9Å; F176-G179 PolarHBondContact O-N 2.82Å; F176-S180 WeakPolarHBondContact CD2-O 3.42Å; F176-R182 HydrophobicContact CD2-CB 4.12Å; F176-R182 HydrophobicContact CE2-CB 3.96Å
177E50.1Low61.3Low212 Ų212101.2 Ų101.299%0.99150%0.498SS*.THydrogen-bonded Turntrans-66.2-5.6-169.9-150.8163162.200113.5
178D47.7Very low59.7Low121 Ų121105.8 Ų105.865%0.64752%0.524SS*.THydrogen-bonded Turntrans-92.30.8172.769.7-14000114.1F176 S180F176-D178 WeakPolarHBondContact CB-OD1 3.39Å; F176-D178 PolarHBondContact O-N 2.9Å; D178-S180 VanDerWaalsContact C-N 3.29Å; D178-S180 VanDerWaalsContact CG-OG 3.28Å; D178-S180 PolarHBondContact O-N 3.24Å; D178-S180 WeakPolarHBondContact OD1-CB 3.03Å; D178-S180 PolarHBondContact OD1-N 2.94Å; D178-S180 PolarHBondContact OD1-OG 2.74Å; D178-S180 WeakPolarHBondContact OD2-CB 3.16Å; D178-S180 PolarHBondContact OD2-OG 2.87Å; D178-S180 VanDerWaalsContact OD2-OG 3.08Å
179G51.6Low58.1Low44 Ų44111.6 Ų111.645%0.45453%0.531SS..SBendtrans78.76-175.200000114.6F176 V181F176-G179 PolarHBondContact O-N 2.82Å; G179-V181 PolarHBondContact O-N 3.46Å
180S54.5Low56.7Low30 Ų30113.6 Ų113.621%0.2155%0.546CS..  trans-80.1108.1178.175.80000111.3F176 D178 R182F176-S180 WeakPolarHBondContact CD2-O 3.42Å; D178-S180 VanDerWaalsContact C-N 3.29Å; D178-S180 VanDerWaalsContact CG-OG 3.28Å; D178-S180 PolarHBondContact O-N 3.24Å; D178-S180 WeakPolarHBondContact OD1-CB 3.03Å; D178-S180 PolarHBondContact OD1-N 2.94Å; D178-S180 PolarHBondContact OD1-OG 2.74Å; D178-S180 WeakPolarHBondContact OD2-CB 3.16Å; D178-S180 PolarHBondContact OD2-OG 2.87Å; D178-S180 VanDerWaalsContact OD2-OG 3.08Å; S180-R182 PolarHBondContact O-N 3.46Å
181V51.5Low55.7Low35 Ų35120.6 Ų120.621%0.21258%0.581CS.*  trans-77.772.8175.6-172.10000110.4A97 F174 G179A97-V181 HydrophobicContact CB-CG1 3.69Å; F174-V181 WeakPolarHBondContact O-CA 3.33Å; G179-V181 PolarHBondContact O-N 3.46Å
182R52Low54.9Low181 Ų181129.1 Ų129.168%0.68361%0.613SS**PPolyproline II helixtrans-95.2137.1179.7-73.8-177.5150.2-154.4-7.1111.2F176 S180F176-R182 HydrophobicContact CD2-CB 4.12Å; F176-R182 HydrophobicContact CE2-CB 3.96Å; S180-R182 PolarHBondContact O-N 3.46Å
183R53.5Low54.1Low115 Ų115130.9 Ų130.943%0.43462%0.622SS.*PPolyproline II helixtrans-88.8134-177.7-57.3178.782.268.6-22.4110.1S94S94-R183 PolarHBondContact OG-NH1 2.84Å
184K59.6Low53.2Low146 Ų146133.9 Ų133.964%0.63565%0.649SS**PPolyproline II helixtrans-58.5129174.8-168173.6-168.2172.50111.3Q173 R186Q173-K184 VanDerWaalsContact OE1-CD 3.27Å; K184-R186 PolarHBondContact O-N 2.82Å
185P59.2Low52.3Low114 Ų114137 Ų13774%0.7468%0.681SS**PPolyproline II helixtrans-59.2134.2172-24.634.5000111.3R187P185-R187 PolarHBondContact O-N 3.48Å
186R60.9Low51.4Low241 Ų241143.1 Ų143.191%0.90970%0.703SS**  trans-72.3115.3174.4-156.2-172.3-56.6-108.27.6107.6K184 L188K184-R186 PolarHBondContact O-N 2.82Å; R186-L188 PolarHBondContact O-N 2.8Å
187R59.6Low51.3Low233 Ų233143 Ų14388%0.87971%0.711SS**  trans-56.1123.7177.8-72.4-172.1177-172.5-0.6109.6P185 R189P185-R187 PolarHBondContact O-N 3.48Å; R187-R189 PolarHBondContact O-N 3.01Å
188L58.8Low51.2Low171 Ų171140.1 Ų140.190%0.89570%0.702SS**  trans-61126.2170.9-156.475.7000107.8R186 S190R186-L188 PolarHBondContact O-N 2.8Å; L188-S190 PolarHBondContact O-N 2.89Å
189R51Low51Low235 Ų235137.6 Ų137.689%0.88771%0.705SS**  trans-72115.5175-67.4-175.1-135.3158.44.5107.8R187 I191R187-R189 PolarHBondContact O-N 3.01Å; R189-I191 PolarHBondContact O-N 2.98Å
190S50.6Low50.7Low115 Ų115142.4 Ų142.480%0.80473%0.725SS**  trans-61.4121.5175.9179.80000110.2L188L188-S190 PolarHBondContact O-N 2.89Å
191I51.1Low50.2Low153 Ų153148 Ų14879%0.78575%0.753SS**  trans-84.7120.9170.1-62.6177.9000107.1R189R189-I191 PolarHBondContact O-N 2.98Å
192K48.3Very low49.7Very low200 Ų200156 Ų15687%0.8779%0.785SS**  trans-96.8101.1-175.8-156.7176.2-172.6-177.70109.1
193T42.9Very low49.3Very low134 Ų134151.9 Ų151.982%0.82279%0.79SS**  trans-77.4131.917544.90000110.5
194S44.8Very low48.9Very low127 Ų127150.8 Ų150.889%0.88881%0.805SS**  trans-113.1135.4173.1-170.80000108.9
195A43.2Very low48.3Very low94 Ų94148.6 Ų148.678%0.77781%0.806SS**  trans-139.7121.5-176.300000111.5
196Y40Very low47.6Very low199 Ų199151.5 Ų151.578%0.7881%0.809SS**  trans-170.289.8166.1-160.1-92.2000107.8
197V46.8Very low47Very low104 Ų104147.7 Ų147.763%0.6381%0.807SS**  71.7154.186.3-51.40000117.2
198D47Very low46.2Very low150 Ų150142.1 Ų142.180%0.80280%0.801SS**  trans77.7131.4178.5-53.4-20.5000116.8
199G43.9Very low45.4Very low69 Ų69138.5 Ų138.571%0.71180%0.796SS**  cis-169.3155.5-800000106.9
200V44.9Very low44.9Very low145 Ų145134.6 Ų134.688%0.87979%0.788SS**  -170.9163.267.1-84.60000112
201N43.9Very low44.4Very low146 Ų146137.3 Ų137.378%0.78179%0.791SS**  trans-56.3155.7-173-50-75.3000118.2
202F42.7Very low44Very low205 Ų205137.4 Ų137.490%0.89979%0.786SS**  -165.5131.6108.9-118.4-85000114
203A43.3Very low43.4Very low94 Ų94138.8 Ų138.878%0.77779%0.787SS**  trans40.9121.2159.800000122.4
204A43.5Very low43.3Very low92 Ų92137 Ų13776%0.7679%0.786SS**  trans-85.2173158.900000111.1
205P47.4Very low42.9Very low100 Ų100139.4 Ų139.465%0.64978%0.783SS**  -147.7161.780.340.6-23000118.3
206E46Very low42.9Very low174 Ų174140.1 Ų140.181%0.81378%0.78SS**  trans65.7119.2142.670.2-147.6141.500126.1
207N46.8Very low42.8Very low162 Ų162138.8 Ų138.887%0.86678%0.778SS**  trans81.2139.6154.8-94.9-3000122
208P43.2Very low42.5Very low115 Ų115140.5 Ų140.575%0.74778%0.783SS**  trans-128.9122-147.835.6-15000115
209A41.4Very low41.8Very low95 Ų95140.4 Ų140.479%0.78578%0.778SS**  trans-160.672.8165.600000113.4
210H42Very low41.3Very low154 Ų154147.8 Ų147.871%0.71378%0.784SS**  trans-176.4111.8147.3-110.6-64.7000111.9K212H210-K212 HydrophobicContact CB-CG 4.42Å; H210-K212 WeakPolarHBondContact ND1-CE 3.28Å; H210-K212 PolarHBondContact O-N 2.71Å
211I39Very low40.7Very low171 Ų171144.3 Ų144.388%0.87777%0.767SS**  trans-81105.5157.9-62.5174.5000106.4
212K43.7Very low40.8Very low155 Ų155146.3 Ų146.367%0.67477%0.771SS**  trans-121.8136.6167.6-74.8-176.2179.9176.40108.4H210 A214H210-K212 HydrophobicContact CB-CG 4.42Å; H210-K212 WeakPolarHBondContact ND1-CE 3.28Å; H210-K212 PolarHBondContact O-N 2.71Å; K212-A214 PolarHBondContact O-N 3.11Å
213Y34.8Very low41.2Very low230 Ų230139.7 Ų139.790%0.90275%0.751SS**PPolyproline II helixtrans-58.7121.9177.2-74.9-99.3000110.7
214A40.3Very low41.5Very low97 Ų97141.2 Ų141.280%0.80275%0.746SS**PPolyproline II helixtrans-99.9133.9173.200000110.5K212K212-A214 PolarHBondContact O-N 3.11Å
215Q37.3Very low41.9Very low177 Ų177145 Ų14583%0.82775%0.752SS**PPolyproline II helixtrans-83.7137.7-178.8-66-82.6-38.700111K217Q215-K217 PolarHBondContact O-N 3.49Å
216P42.7Very low41.7Very low109 Ų109148.8 Ų148.871%0.70876%0.759SS**  trans-78.3112.2164.930.6-29.7000110.1L218P216-L218 PolarHBondContact O-N 3.44Å
217K38.3Very low41.6Very low170 Ų170145.6 Ų145.674%0.73976%0.755SS**  trans-73.8101.2173.2-175.2-165-175.9-154.60109.4Q215 E219Q215-K217 PolarHBondContact O-N 3.49Å; K217-E219 WeakPolarHBondContact CE-OE2 3.4Å; K217-E219 IonicContact NZ-OE2 2.84Å; K217-E219 PolarHBondContact NZ-OE2 3.33Å; K217-E219 PolarHBondContact O-N 3.02Å
218L41.1Very low41.4Very low140 Ų140147.6 Ų147.673%0.73376%0.759SS**  trans-76.9102.8161.9-87.9103000109.1P216 W220P216-L218 PolarHBondContact O-N 3.44Å; L218-W220 PolarHBondContact O-N 3.43Å
219E32.1Very low41.5Very low149 Ų149147.6 Ų147.670%0.69676%0.757SS**  trans-78.2107.3169.6-167.3160.3130.600108.9K217 S221K217-E219 WeakPolarHBondContact CE-OE2 3.4Å; K217-E219 IonicContact NZ-OE2 2.84Å; K217-E219 PolarHBondContact NZ-OE2 3.33Å; K217-E219 PolarHBondContact O-N 3.02Å; E219-S221 PolarHBondContact O-N 3.45Å
220W32.7Very low41.5Very low223 Ų223147.3 Ų147.385%0.84576%0.755SS**  trans-74.9113.3172.4-73.983.9000108.9L218 Q222L218-W220 PolarHBondContact O-N 3.43Å; W220-Q222 PolarHBondContact O-N 3.41Å
221S33.2Very low41.7Very low72 Ų72147 Ų14750%0.50376%0.764SS.*  trans-64.4128.4167.6-177.20000109.3E219 S223E219-S221 PolarHBondContact O-N 3.45Å; S221-S223 PolarHBondContact O-N 2.78Å; S221-S223 VanDerWaalsContact O-N 3.09Å; S221-S223 PolarHBondContact OG-N 2.66Å; S221-S223 PolarHBondContact OG-OG 3.01Å
222Q44.6Very low41.4Very low189 Ų189144.4 Ų144.488%0.88376%0.76SS**G310 helixtrans-67.9-8-179.7-158.7171.74.900112.9W220W220-Q222 PolarHBondContact O-N 3.41Å
223S52.6Low41.3Very low66 Ų66141.9 Ų141.946%0.46277%0.768SS.*G310 helixtrans-68.8-31.7178.754.40000114.7S221 L225S221-S223 PolarHBondContact O-N 2.78Å; S221-S223 VanDerWaalsContact O-N 3.09Å; S221-S223 PolarHBondContact OG-N 2.66Å; S221-S223 PolarHBondContact OG-OG 3.01Å; S223-L225 VanDerWaalsContact C-N 3.26Å; S223-L225 PolarHBondContact O-N 2.89Å
224D49.9Very low41.8Very low126 Ų126138.7 Ų138.767%0.67477%0.766SS**G310 helixtrans-82.9-5.8-162.9-61.8-9.8000113.3
225L50.2Low41.8Very low170 Ų170137.9 Ų137.989%0.8977%0.767SS**G310 helixtrans-88.70.9-179.8-147.472000114S223S223-L225 VanDerWaalsContact C-N 3.26Å; S223-L225 PolarHBondContact O-N 2.89Å
226F44.6Very low41.9Very low181 Ų181137.4 Ų137.479%0.79477%0.767SS**SBendtrans-123.31.6-169.9-144.2-101.5000116.6
227S44.3Very low41.8Very low106 Ų106139.5 Ų139.574%0.74177%0.772SS**  trans-102.36.6-173-64.40000116.7T229S227-T229 PolarHBondContact O-N 3.14Å
228Q41Very low42.1Very low204 Ų204139.8 Ų139.895%0.95377%0.773SS**  trans-85.760.4171.2-74.3-174.981.400112
229T46.1Very low42.3Very low115 Ų115138 Ų13871%0.70677%0.773SS**  trans-117.9116.7168.4-57.50000109.6S227S227-T229 PolarHBondContact O-N 3.14Å
230A42.2Very low43.1Very low89 Ų89138.9 Ų138.974%0.73678%0.776SS**  trans33.5107.3161.700000119.1
231T45.1Very low43.7Very low148 Ų148132.9 Ų132.991%0.90877%0.769SS**  trans-141.4141.2139.9-67.70000109.3
232C33.7Very low44.6Very low117 Ų117135.4 Ų135.479%0.79178%0.781SS**  trans-83.3155.1-160.9-47.30000113.9
233A41.7Very low44.4Very low102 Ų102132.7 Ų132.784%0.84378%0.78SS**  trans-137.1137150.500000108.8
234L43.7Very low44.3Very low162 Ų162136.9 Ų136.985%0.84880%0.796SS**  trans-87.7130.5-162.8-64.8160.7000112
235G40.4Very low44.2Very low80 Ų80136.3 Ų136.383%0.82580%0.802SS**  trans-124.995.1164.200000109.1
236M40.1Very low44Very low168 Ų168136 Ų13683%0.82880%0.801SS**  trans-90.4111.8176.9-66.9170.165.700109.8
237D39.9Very low44.5Very low152 Ų152133.3 Ų133.381%0.81380%0.798SS**  trans-137.8160.1140.4-144.6-25.1000110.3
238K45.4Very low45.3Very low177 Ų177133.1 Ų133.177%0.7780%0.795SS**  trans-96.7169.1-159.9-63.9160.9-177.8166.80111.1
239S44.8Very low46.5Very low103 Ų103129.4 Ų129.472%0.7279%0.788SS**  trans95127.1156.989.60000117.6
240H48.1Very low46.6Very low166 Ų166129 Ų12977%0.76979%0.789SS**  trans63.382.6157.8-54.7-61.3000121
241S45.8Very low47.6Very low98 Ų98128.6 Ų128.669%0.68579%0.785SS**  41.897.8119.159.20000119.8
242T52Low48.3Very low124 Ų124126.6 Ų126.676%0.76178%0.775SS**  174.1127.4115.729.60000110.1L244T242-L244 PolarHBondContact O-N 3.17Å
243P41.3Very low49.9Very low132 Ų132122.5 Ų122.586%0.85775%0.747SS**  trans-85.2103.8176.632.2-30.8000110.4
244L50.2Low51.3Low155 Ų155122.2 Ų122.281%0.81273%0.734SS**  trans-87.4131.6164.5-69.3179000109.9T242 L246T242-L244 PolarHBondContact O-N 3.17Å; L244-L246 PolarHBondContact O-N 2.63Å
245S47.2Very low52.7Low114 Ų114118.4 Ų118.480%0.79772%0.718SS**  trans-50.4120.3-170.2-1700000113.4V247S245-V247 PolarHBondContact O-N 3.37Å; S245-V247 VanDerWaalsContact O-N 3.17Å
246L46Very low54.3Low164 Ų164118.9 Ų118.986%0.85970%0.698SS**  trans-67.1110.2167.6-102.369.1000109.1L244 P248L244-L246 PolarHBondContact O-N 2.63Å; L246-P248 WeakPolarHBondContact O-CD 3.22Å
247V54.7Low55.7Low123 Ų123115.8 Ų115.875%0.74569%0.692SS**PPolyproline II helixtrans-72.1120.9165.3179.30000107.7S245S245-V247 PolarHBondContact O-N 3.37Å; S245-V247 VanDerWaalsContact O-N 3.17Å
248P63Low57Low103 Ų103110.3 Ų110.367%0.66967%0.668SS**PPolyproline II helixtrans-66145.8175.428-33.9000110.1L246 C250L246-P248 WeakPolarHBondContact O-CD 3.22Å; P248-C250 PolarHBondContact O-N 3.2Å
249P64.6Low58.1Low125 Ų125107.6 Ų107.681%0.81268%0.679SS**PPolyproline II helixtrans-62.6129.4179.425.9-33.7000110.5A251P249-A251 PolarHBondContact O-N 2.69Å
250C49.3Very low59.5Low108 Ų108108.2 Ų108.273%0.7367%0.674SS**PPolyproline II helixtrans-57.3122.6174.5-64.20000110.2P248 W268P248-C250 PolarHBondContact O-N 3.2Å; C250-W268 HydrophobicContact CB-CZ3 4.48Å
251A62.5Low60.2Low79 Ų79103.1 Ų103.165%0.65367%0.666SS**PPolyproline II helixtrans-63.4135.2172.400000109.9P249P249-A251 PolarHBondContact O-N 2.69Å
252P60.9Low60.7Low107 Ų107103.4 Ų103.470%0.69566%0.66SS**PPolyproline II helixtrans-67.9150.317729-34.6000111V254P252-V254 PolarHBondContact O-N 3.04Å
253P65.7Low61.9Low31 Ų31103.8 Ų103.820%0.20166%0.657CS.*PPolyproline II helixtrans-62.4135.5177.326.2-34.6000111.4M265 G266 W268P253-M265 HydrophobicContact CB-CB 4.3Å; P253-M265 HydrophobicContact CB-CG 4.43Å; P253-M265 HydrophobicContact CG-CG 4.35Å; P253-M265 HydrophobicContact CG-SD 3.86Å; P253-G266 WeakPolarHBondContact CB-O 3.44Å; P253-W268 HydrophobicContact CG-CZ2 4.5Å
254V72.4Confident63.6Low95 Ų95104 Ų10458%0.57664%0.64SS**PPolyproline II helixtrans-72.9134.8174.9178.20000109.5P252 G266P252-V254 PolarHBondContact O-N 3.04Å; V254-G266 PolarHBondContact O-N 3.28Å
255V73.2Confident64.7Low82 Ų82102.8 Ų102.850%0.49763%0.632SS.*EExtended strand (participates in β ladder)trans-86.2119.7171.1-174.60000108.7L263 W264 M265V255-L263 HydrophobicContact CG1-CB 3.96Å; V255-L263 HydrophobicContact CG1-CD2 3.86Å; V255-L263 HydrophobicContact CG1-CG 4.39Å; V255-W264 WeakPolarHBondContact CA-O 3.31Å; V255-M265 HydrophobicContact CG2-CG 3.93Å
256H74Confident65.9Low91 Ų9197.8 Ų97.842%0.42160%0.599SS.*EExtended strand (participates in β ladder)trans-98139173.8-72-96.6000110.3L263 W264H256-L263 WeakPolarHBondContact O-CA 3.46Å; H256-W264 HydrophobicContact CB-CD2 4.38Å; H256-W264 HydrophobicContact CB-CG 4.49Å; H256-W264 HydrophobicContact CB-CZ2 4.17Å; H256-W264 PolarHBondContact N-O 2.86Å; H256-W264 PolarHBondContact O-N 2.93Å
257C68.8Low67Low102 Ų10295 Ų9569%0.68959%0.591SS**EExtended strand (participates in β ladder)trans-90.5128.5162.653.10000109.8L263C257-L263 HydrophobicContact CB-CD2 3.99Å
258A68.1Low67.4Low37 Ų3796.6 Ų96.631%0.30658%0.584SS.*PPolyproline II helixtrans-82.2157.7166.900000110.1N260 G261 N262A258-N260 VanDerWaalsContact CB-OD1 3.24Å; A258-N260 WeakPolarHBondContact CB-OD1 3.43Å; A258-N260 PolarHBondContact O-N 3.23Å; A258-G261 PolarHBondContact O-N 2.8Å; A258-N262 PolarHBondContact N-O 3.02Å
259A66.8Low66.9Low121 Ų12199.5 Ų99.5100%159%0.593SS**THydrogen-bonded Turntrans-61.5-15.3-176.500000114.6
260N74.3Confident66.2Low115 Ų115101 Ų10162%0.61559%0.589SS**THydrogen-bonded Turntrans-88.63.7173.664.8-5.9000114A258 N262A258-N260 VanDerWaalsContact CB-OD1 3.24Å; A258-N260 WeakPolarHBondContact CB-OD1 3.43Å; A258-N260 PolarHBondContact O-N 3.23Å; N260-N262 WeakPolarHBondContact OD1-CB 3.46Å; N260-N262 PolarHBondContact OD1-N 3.5Å; N260-N262 VanDerWaalsContact OD1-N 3.12Å
261G63.9Low66.1Low59 Ų59100.9 Ų100.961%0.60859%0.589SS**SBendtrans87.9-5.8-177.900000115.1A258A258-G261 PolarHBondContact O-N 2.8Å
262N57Low65.8Low105 Ų105103.1 Ų103.156%0.56160%0.597SS**  trans-70.5135.6177.5-73.35.3000111.2A258 N260A258-N262 PolarHBondContact N-O 3.02Å; N260-N262 WeakPolarHBondContact OD1-CB 3.46Å; N260-N262 PolarHBondContact OD1-N 3.5Å; N260-N262 VanDerWaalsContact OD1-N 3.12Å
263L75.2Confident65Low132 Ų132103.2 Ų103.269%0.69161%0.606SS**EExtended strand (participates in β ladder)trans-94.1134.1171.2-65167.9000109.8V255 H256 C257V255-L263 HydrophobicContact CG1-CB 3.96Å; V255-L263 HydrophobicContact CG1-CD2 3.86Å; V255-L263 HydrophobicContact CG1-CG 4.39Å; H256-L263 WeakPolarHBondContact O-CA 3.46Å; C257-L263 HydrophobicContact CB-CD2 3.99Å
264W77.5Confident63.7Low135 Ų135104.3 Ų104.351%0.51162%0.623SS.*EExtended strand (participates in β ladder)trans-137146.5172.166.4-74000110.7V255 H256V255-W264 WeakPolarHBondContact CA-O 3.31Å; H256-W264 HydrophobicContact CB-CD2 4.38Å; H256-W264 HydrophobicContact CB-CG 4.49Å; H256-W264 HydrophobicContact CB-CZ2 4.17Å; H256-W264 PolarHBondContact N-O 2.86Å; H256-W264 PolarHBondContact O-N 2.93Å
265M73.2Confident62Low130 Ų130107.1 Ų107.164%0.6464%0.635SS**EExtended strand (participates in β ladder)trans-85.7130.1173.4-86.1179.2-82.900109.8P253 V255P253-M265 HydrophobicContact CB-CB 4.3Å; P253-M265 HydrophobicContact CB-CG 4.43Å; P253-M265 HydrophobicContact CG-CG 4.35Å; P253-M265 HydrophobicContact CG-SD 3.86Å; V255-M265 HydrophobicContact CG2-CG 3.93Å
266G72.4Confident60.4Low10 Ų10111.8 Ų111.810%0.10365%0.654CS.*PPolyproline II helixtrans-63.4161.2171.800000112.2P253 V254P253-G266 WeakPolarHBondContact CB-O 3.44Å; V254-G266 PolarHBondContact O-N 3.28Å
267P69.7Low58.8Low105 Ų105112.7 Ų112.768%0.68267%0.67SS**PPolyproline II helixtrans-59.3150.4176-20.132.3000111.7L269P267-L269 PolarHBondContact O-N 3.49Å; P267-L269 VanDerWaalsContact O-N 3.1Å
268W62Low57.6Low157 Ų157113.4 Ų113.460%0.59568%0.677SS**  trans-60.9113.6168.3-69.185.9000109.6C250 P253 H270C250-W268 HydrophobicContact CB-CZ3 4.48Å; P253-W268 HydrophobicContact CG-CZ2 4.5Å; W268-H270 VanDerWaalsContact C-N 3.32Å; W268-H270 VanDerWaalsContact CB-CE1 3.5Å; W268-H270 WeakPolarHBondContact CB-CE1 3.42Å; W268-H270 PolarHBondContact O-N 2.89Å; W268-H270 PolarHBondContact O-ND1 3.24Å
269L53.3Low55.9Low164 Ų164120.5 Ų120.586%0.85971%0.705SS**  trans-66.192.8171.6-109.384.4000109.4P267P267-L269 PolarHBondContact O-N 3.49Å; P267-L269 VanDerWaalsContact O-N 3.1Å
270H50.3Low55.2Low157 Ų157121 Ų12173%0.72770%0.698SS**  trans-83.1111.8163.5-65.576.5000107W268 P272W268-H270 VanDerWaalsContact C-N 3.32Å; W268-H270 VanDerWaalsContact CB-CE1 3.5Å; W268-H270 WeakPolarHBondContact CB-CE1 3.42Å; W268-H270 PolarHBondContact O-N 2.89Å; W268-H270 PolarHBondContact O-ND1 3.24Å; H270-P272 VanDerWaalsContact O-CD 3.23Å; H270-P272 WeakPolarHBondContact O-CD 3.5Å
271S46Very low53.6Low105 Ų105120.7 Ų120.773%0.73471%0.705SS**  trans-74.3115.6172.4-700000110.1A273S271-A273 PolarHBondContact O-N 2.93Å
272P56.3Low52.5Low126 Ų126125.2 Ų125.282%0.81871%0.712SS**  trans-81.686174.533.7-31.4000109.5H270 G274H270-P272 VanDerWaalsContact O-CD 3.23Å; H270-P272 WeakPolarHBondContact O-CD 3.5Å; P272-G274 VanDerWaalsContact C-N 3.34Å; P272-G274 PolarHBondContact O-N 3.37Å
273A44.2Very low51.4Low109 Ų109127.3 Ų127.390%0.90172%0.719SS**  trans-73.487.3168.500000109.5S271S271-A273 PolarHBondContact O-N 2.93Å
274G38.7Very low49.6Very low54 Ų54126.3 Ų126.356%0.55772%0.723SS**  trans174.359.3-173.700000117.7P272P272-G274 VanDerWaalsContact C-N 3.34Å; P272-G274 PolarHBondContact O-N 3.37Å
275N38.1Very low48Very low154 Ų154125.1 Ų125.182%0.82473%0.733SS**  trans42.389.5136.6-163.239.8000118.5
276M39.6Very low46.4Very low179 Ų179126.5 Ų126.588%0.88274%0.743SS**  trans-155.5121.314741.8-159.97300113
277S40Very low44.7Very low110 Ų110134.1 Ų134.177%0.76978%0.776SS**  trans-80.9120.2-177.1-44.20000111.7
278S43.6Very low43.1Very low118 Ų118137.6 Ų137.683%0.82578%0.78SS**  trans171.2108.8144.233.50000111.1
279M32.5Very low42.1Very low185 Ų185134.2 Ų134.291%0.91179%0.786SS**  trans-102.6135.2162.8-61.6-176.987.100109.2
280P52.2Low41.8Very low131 Ų131132.8 Ų132.885%0.85178%0.784SS**  trans-88.4111.4149.131-23.4000108.8
281S41Very low41.5Very low109 Ų109133.1 Ų133.176%0.76279%0.785SS**  trans-88.7130.6161.9171.20000108.1
282M39Very low41.1Very low154 Ų154136.8 Ų136.876%0.75979%0.791SS**  trans-162126.6147.6-77.8-137.1106.200112.2
283Q35.7Very low40Very low149 Ų149134.2 Ų134.270%0.69679%0.787SS**  trans52.6109.1146.9-72.2139.4-26.900122.9
284S36.3Very low39.7Very low112 Ų112132.9 Ų132.978%0.78378%0.777SS**  32.5137.8110.4-159.70000120.4
285P43.9Very low39.5Very low109 Ų109141.2 Ų141.271%0.70879%0.793SS**  trans-92.5-177.3-167.240.2-39.9000115.8
286D40.2Very low39.5Very low159 Ų159144.7 Ų144.785%0.8580%0.796SS**  trans92.1144.3177.5-65.3-30.6000117.2
287E36.2Very low39.3Very low171 Ų171140.4 Ų140.480%0.79978%0.784SS**  trans86.8150.9-179-136.6176149.200118.7
288F36.3Very low39.3Very low177 Ų177140.3 Ų140.378%0.77678%0.783SS**  trans76.581.8-178.7-68.5-81.2000119.3
289A41.8Very low38.8Very low87 Ų87142.4 Ų142.472%0.71979%0.785SS**  trans-59171.4149.600000113.2
290V46.8Very low39.1Very low133 Ų133137.8 Ų137.881%0.80677%0.771SS**  trans71.489.3169.6-1680000115.3
291H43.1Very low38.3Very low164 Ų164141.6 Ų141.676%0.75977%0.77SS**  -158.6121.7127.3-118.3-90.4000110.9
292Q37.5Very low38.2Very low182 Ų182143.2 Ų143.285%0.8577%0.77SS**  trans66.6110.6163.9-52.2174.785.800116.3
293G33.6Very low38.3Very low72 Ų72143.7 Ų143.774%0.74277%0.774SS**  cis114.41115.300000111.8
294A36.8Very low38.5Very low82 Ų82141.2 Ų141.268%0.67877%0.773SS**  trans66.2134.3-167.300000113.9
295Y35Very low39.2Very low228 Ų228145.1 Ų145.189%0.89478%0.779SS**  cis-126.5116.728.3-73.3-101.6000114.3
296Y37.9Very low38.9Very low227 Ų227146.1 Ų146.189%0.8978%0.778SS**  trans-92.7165.4153.7-87.9-85.2000107.4
297S36.7Very low39.2Very low90 Ų90143.4 Ų143.463%0.62978%0.777SS**  cis-164.3165.3-11.8-164.10000107.8
298S39.1Very low39.7Very low107 Ų107143.1 Ų143.175%0.74878%0.776SS**  trans47.2130.7146.6-54.20000122.5
299N33.4Very low40.5Very low162 Ų162142.8 Ų142.887%0.86678%0.777SS**  trans-37.2136.1156.1-55-24000114
300S37.8Very low40.7Very low88 Ų88145.7 Ų145.762%0.61578%0.779SS**  -178.5153.4109.4-142.70000114.9
301Y37.1Very low40.7Very low211 Ų211144 Ų14483%0.82778%0.779SS**  trans62.3101.6159.7-57.3-59.9000121.7
302D37.8Very low41.3Very low143 Ų143142 Ų14277%0.76578%0.781SS**  32122.4114.4-1600.2000119.9
303I40.6Very low41.9Very low165 Ų165141.2 Ų141.285%0.84678%0.777SS**  trans-164.1132.6131.2-100.4153.7000109.7
304S41.5Very low42.6Very low97 Ų97144 Ų14468%0.67878%0.779SS**  trans-65.4149.1172.961.60000113.6
305Q49.5Very low43.4Very low194 Ų194145.2 Ų145.291%0.90778%0.779SS**  -163.4145.2126.8-85.5-120.3-0.200112.1
306N38.9Very low43.9Very low130 Ų130143.9 Ų143.970%0.69578%0.778SS**  trans-87.1132.4-174.1169.627.2000111.2
307A46.6Very low44.6Very low101 Ų101136.7 Ų136.784%0.83577%0.772SS**  trans-148.599.6167.100000111.5
308Q47.2Very low45.5Very low165 Ų165138.4 Ų138.477%0.77178%0.779SS**  trans-76136.3172.3-59.5170.9-1400110.3
309H51.4Low46.2Very low170 Ų170141.4 Ų141.479%0.78779%0.787SS**  trans-155101.8152.5-131.8-102.6000114.5
310L47.1Very low47.1Very low148 Ų148142 Ų14278%0.77578%0.784SS**  trans44.8118.6140.6-50.7-176.8000120.9
311A47.3Very low47.6Very low98 Ų98145.3 Ų145.381%0.8179%0.794SS**  trans-107.1154.1146.100000109.9
312P54.9Low48.2Very low122 Ų122139.4 Ų139.479%0.79278%0.784SS**  trans-139.6124.714432.6-16.5000115.1
313H49.9Very low49.1Very low166 Ų166140.6 Ų140.677%0.76979%0.785SS**  18138.4129.2-167.9-85.9000121.2
314V48.9Very low49.8Very low130 Ų130139 Ų13979%0.78878%0.782SS**  trans159.8141147.1149.80000108.5
315T53.6Low50.2Low108 Ų108142.1 Ų142.166%0.66379%0.791SS**  cis-162.4152.6-21.1-82.50000107.4
316F45Very low50.2Low200 Ų200138 Ų13888%0.87778%0.781SS**  trans-63.6137.9175.6-102.5-105.9000113.6
317G52.4Low50.7Low75 Ų75142.8 Ų142.877%0.77379%0.789SS**  trans-108.5116.1167.900000111.6
318T54.9Low51Low127 Ų127143.8 Ų143.878%0.77979%0.79SS**  trans-86149.2172.4460000111
319N54.9Low51.5Low169 Ų169140.3 Ų140.390%0.90479%0.789SS**  trans-135.7118.8162.7-111.6-36.5000109.5
320Q52Low51.8Low174 Ų174141.2 Ų141.281%0.81379%0.791SS**  trans-113.4123.5178.1-77.1-129.584.200110
321L47.5Very low52Low158 Ų158140.8 Ų140.883%0.82779%0.79SS**  trans-163.888.6158.3-104.8131.7000105.6
322S51.1Low52.7Low87 Ų87140.5 Ų140.561%0.60879%0.787SS**  58.3115.78379.10000113.2
323Q56Low52.8Low169 Ų169145.6 Ų145.679%0.7979%0.792SS**  171.8125.6125.6-87.6-59.5-1.600110.9
324V55.8Low53.1Low130 Ų130143.2 Ų143.279%0.78880%0.795SS**  trans66115.7158-168.20000120.3
325L49.9Very low53.7Low163 Ų163144 Ų14485%0.85383%0.828SS**  trans-115.1179.3165.2-100.5-180000109.1
326P49.8Very low53.7Low107 Ų107145.8 Ų145.870%0.69584%0.836SS**  trans-122.6-165.7-138.642-27000115.3
327R48.4Very low54.2Low232 Ų232142.9 Ų142.988%0.87583%0.834SS**  trans113.3158.2158.2-69.1-176157.2-154.3-5.3117.5
328S53Low54.3Low122 Ų122146.7 Ų146.785%0.85384%0.838SS**  trans73.1148.2176.6830000114
329A58.1Low54.3Low91 Ų91147.8 Ų147.875%0.75284%0.841SS**  cis-151.1-178.9-7.600000107.6
330F57.1Low54.2Low190 Ų190146.5 Ų146.583%0.83384%0.837SS**  cis-157.6173.8-0.1-162.8-126.8000108.8
331D51.3Low54.4Low139 Ų139144.7 Ų144.774%0.74384%0.839SS**  trans-73.1147.9165.1-64.4-73000112
332A61.4Low54.9Low92 Ų92143.7 Ų143.776%0.7684%0.84SS**  trans-169.9129.5146.100000115
333Y57.2Low55.1Low229 Ų229148.1 Ų148.190%0.89886%0.858SS**  trans76.3115.3145.3-98.9-96.9000122.9
334S57Low55.1Low116 Ų116146.3 Ų146.381%0.81186%0.863SS**  trans-59.6149159.9-170.50000112.9
335G62Low55Low145 Ų145147.8 Ų147.8100%1.49587%0.87SS**  trans-151.40161.600000108.8

Retrieved 335 of 335 residues in 88.5 ms (Link to these results)