A0A061ICB6_CRIGR Loading...

Embryonic polyadenylate-binding protein 2

AlphaFold DB , UniProt , Accession A0A061ICB6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Pabpn1l, Length 275 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
1M37.1Very low50.9Low242 Ų242170.3 Ų170.3100%1.19286%0.855SS**  0106.90-93.9152.1115.200107.6
2W41.3Very low51.9Low242 Ų242164.9 Ų164.992%0.91784%0.841SS**  trans-104.7133.7167.7-74.671.7000106.8
3P55.5Low52.9Low120 Ų120160.1 Ų160.178%0.77983%0.827SS**PPolyproline II helixtrans-79.9141.8178.632.1-29.9000110.3
4F45.6Very low54.4Low206 Ų206155.8 Ų155.890%0.90481%0.812SS**PPolyproline II helixtrans-67.8130.8175.8-71.2-96.5000110.3
5L53.1Low54.8Low174 Ų174156.6 Ų156.691%0.91181%0.81SS**PPolyproline II helixtrans-89.4136.7164.4-85.8160000109.1
6N45.9Very low55.2Low145 Ų145151.6 Ų151.678%0.77580%0.799SS**PPolyproline II helixtrans-49.4145.9-176.1-74.4-19.9000114.6
7N50.7Low55.7Low155 Ų155152.2 Ų152.283%0.82979%0.788SS**  trans-9820.6-174.1-130.814.8000113.4L9N7-L9 PolarHBondContact O-N 3.35Å
8D56.8Low55.8Low142 Ų142150.3 Ų150.376%0.75978%0.779SS**THydrogen-bonded Turntrans-89.17.8-166.7-66.4-35.2000115.3
9L56.2Low56Low152 Ų152150.6 Ų150.680%0.79678%0.776SS**THydrogen-bonded Turntrans-101.4-4-177.7-118.994.6000116N7N7-L9 PolarHBondContact O-N 3.35Å
10F55.7Low56.2Low178 Ų178151.6 Ų151.678%0.78177%0.774SS**  trans-139.597.2177.6-75.5-83000110.7
11P62.7Low56.3Low117 Ų117148 Ų14876%0.7676%0.759SS**  trans-64.4140.8173.627-32.6000109.8
12P62.9Low57.1Low106 Ų106141.4 Ų141.469%0.68874%0.737SS**  trans-62.7145.7175.527-33.7000110.1T14P12-T14 PolarHBondContact O-N 3.12Å
13P64.4Low57.7Low102 Ų102134.3 Ų134.366%0.66273%0.725SS**  trans-61111.1-17724.4-32.8000110
14T74.2Confident57.4Low100 Ų100133.9 Ų133.961%0.61372%0.716SS**  trans-69152.3172.546.90000110.6P12 A16 W17P12-T14 PolarHBondContact O-N 3.12Å; T14-A16 PolarHBondContact O-N 3.48Å; T14-W17 WeakPolarHBondContact O-CB 3.42Å; T14-W17 PolarHBondContact O-N 3.18Å
15E60.1Low58Low168 Ų168129.8 Ų129.879%0.78571%0.71SS**Hα-helixtrans-51.2-25.9-179.5-69.5-177.1151.300114.4W17 L18 Q19E15-W17 VanDerWaalsContact C-N 3.25Å; E15-W17 PolarHBondContact O-N 3.43Å; E15-L18 PolarHBondContact O-N 2.9Å; E15-Q19 PolarHBondContact O-N 3.28Å
16A61.1Low58.2Low77 Ų77130.2 Ų130.264%0.63671%0.707SS**Hα-helixtrans-61.8-27.4173.900000114.2T14T14-A16 PolarHBondContact O-N 3.48Å
17W63.3Low58.7Low162 Ų162127.4 Ų127.461%0.61470%0.704SS**Hα-helixtrans-74.4-37.2177.4-16683.3000111.6T14 E15 Q19 K20 V21T14-W17 WeakPolarHBondContact O-CB 3.42Å; T14-W17 PolarHBondContact O-N 3.18Å; E15-W17 VanDerWaalsContact C-N 3.25Å; E15-W17 PolarHBondContact O-N 3.43Å; W17-Q19 VanDerWaalsContact C-N 3.34Å; W17-Q19 PolarHBondContact O-N 2.64Å; W17-K20 PolarHBondContact O-N 3.27Å; W17-V21 HydrophobicContact CE3-CG2 4.37Å; W17-V21 HydrophobicContact CH2-CG2 4.21Å; W17-V21 HydrophobicContact CZ2-CG2 4.35Å; W17-V21 HydrophobicContact CZ3-CG2 4.22Å; W17-V21 PolarHBondContact O-N 3.5Å
18L58.8Low58.8Low117 Ų117128.9 Ų128.961%0.61371%0.706SS**Hα-helixtrans-67.7-31.8178.1-71.1171.8000112.5E15 K20E15-L18 PolarHBondContact O-N 2.9Å; L18-K20 VanDerWaalsContact C-N 3.34Å
19Q58.8Low58.5Low156 Ų156124.8 Ų124.873%0.72970%0.698SS**Hα-helixtrans-73.3-25.2175.4-69.9-153.1-4.400113.6E15 W17E15-Q19 PolarHBondContact O-N 3.28Å; W17-Q19 VanDerWaalsContact C-N 3.34Å; W17-Q19 PolarHBondContact O-N 2.64Å
20K59.4Low58.1Low170 Ų170130 Ų13074%0.73971%0.707SS**Hα-helixtrans-77.7-35.5-179.1-163.4146.3-175.1174.30112.9W17 L18 S22 S23W17-K20 PolarHBondContact O-N 3.27Å; L18-K20 VanDerWaalsContact C-N 3.34Å; K20-S22 VanDerWaalsContact C-N 3.31Å; K20-S22 PolarHBondContact O-N 2.94Å; K20-S23 PolarHBondContact O-N 3.28Å
21V58.4Low57.8Low77 Ų77125.4 Ų125.447%0.46771%0.709SS.*Hα-helixtrans-71.3-26.5175.5179.80000112W17 S23W17-V21 HydrophobicContact CE3-CG2 4.37Å; W17-V21 HydrophobicContact CH2-CG2 4.21Å; W17-V21 HydrophobicContact CZ2-CG2 4.35Å; W17-V21 HydrophobicContact CZ3-CG2 4.22Å; W17-V21 PolarHBondContact O-N 3.5Å; V21-S23 PolarHBondContact O-N 3.46Å
22S54.3Low56.9Low104 Ų104124.3 Ų124.373%0.72771%0.71SS**THydrogen-bonded Turntrans-71.6-8.1177.9-174.10000114.3K20K20-S22 VanDerWaalsContact C-N 3.31Å; K20-S22 PolarHBondContact O-N 2.94Å
23S53.4Low55.8Low93 Ų93132.1 Ų132.165%0.6573%0.726SS**THydrogen-bonded Turntrans-108.36.6-176.1-56.40000114K20 V21 P25K20-S23 PolarHBondContact O-N 3.28Å; V21-S23 PolarHBondContact O-N 3.46Å; S23-P25 WeakPolarHBondContact O-CD 3.27Å
24D49.7Very low54.9Low110 Ų110130.5 Ų130.559%0.58873%0.728SS**  trans-83.1110.6174.6-78.8-31.1000110.4E26D24-E26 PolarHBondContact O-N 3.48Å; D24-E26 VanDerWaalsContact O-N 3.1Å
25P59.3Low53.1Low120 Ų120134.7 Ų134.778%0.77974%0.738SS**THydrogen-bonded Turntrans-72.72.3-179.430.6-35.3000114S23S23-P25 WeakPolarHBondContact O-CD 3.27Å
26E56.8Low52.2Low183 Ų183133.7 Ų133.786%0.85574%0.743SS**THydrogen-bonded Turntrans-100.6-4.2-175.9-141.5176.2169.700113.6D24 Q28D24-E26 PolarHBondContact O-N 3.48Å; D24-E26 VanDerWaalsContact O-N 3.1Å; E26-Q28 VanDerWaalsContact C-N 3.26Å; E26-Q28 PolarHBondContact O-N 2.94Å
27A55.9Low51Low87 Ų87138.4 Ų138.472%0.71975%0.752SS**THydrogen-bonded Turntrans-86.122.7-178.800000114.6
28Q53.5Low49.9Very low186 Ų186140.5 Ų140.587%0.86977%0.766SS**THydrogen-bonded Turntrans-97.78.9176.1-74.1-177-20.800113.9E26E26-Q28 VanDerWaalsContact C-N 3.26Å; E26-Q28 PolarHBondContact O-N 2.94Å
29G49.9Very low49.2Very low56 Ų56141.4 Ų141.458%0.57778%0.776SS**SBendtrans-95.43.2-168.300000118.1
30W46.7Very low49.2Very low262 Ų262139 Ų13999%0.99277%0.774SS**SBendtrans-139.679.5-175-64.581.3000112.3
31G51.2Low48.1Very low81 Ų81139.4 Ų139.484%0.83578%0.783SS**  trans175.763.8173.300000115.1
32A41.9Very low47.1Very low94 Ų94139.3 Ų139.378%0.77780%0.798SS**  trans-161.970.5166.900000112.7G34A32-G34 VanDerWaalsContact C-N 3.26Å; A32-G34 PolarHBondContact O-N 3.02Å
33W41.8Very low47Very low269 Ų269141.1 Ų141.1100%1.01981%0.807SS**  trans-86.880.7158.4-73.560000107.2
34G44.6Very low45.9Very low68 Ų68139.8 Ų139.870%0.70181%0.808SS**  trans-73131.4176.400000111.5A32A32-G34 VanDerWaalsContact C-N 3.26Å; A32-G34 PolarHBondContact O-N 3.02Å
35K35.3Very low45Very low188 Ų188142 Ų14282%0.81783%0.826SS**  trans-40.8129.4161.5-89.2162.6161.8172.30111.6E37K35-E37 PolarHBondContact O-N 3.41Å
36T41.6Very low43.6Very low147 Ų147139.5 Ų139.590%0.90282%0.822SS**  trans-72.7105.3160.3460000109.1
37E37.5Very low42.2Very low176 Ų176137 Ų13782%0.82282%0.824SS**PPolyproline II helixtrans-81.1149.9171-67.9-174.4162.500111.4K35K35-E37 PolarHBondContact O-N 3.41Å
38K39.9Very low40.9Very low207 Ų207136 Ų13690%0.982%0.823SS**PPolyproline II helixtrans-94.8124.3-166.7-149.5166.7-177.11750108.1
39T43.1Very low39.9Very low136 Ų136133.2 Ų133.283%0.83482%0.819SS**PPolyproline II helixtrans-94.2124.6174.1-50.60000110.3
40P59.4Low39.1Very low105 Ų105138.4 Ų138.468%0.68283%0.828SS**  trans-112.3131.5175.835.2-23.1000112
41L37Very low38.4Very low179 Ų179130.7 Ų130.794%0.93781%0.814SS**  trans-155.7121.9154.9-72.4-178.3000109.4
42G36.5Very low37.5Very low75 Ų75133.9 Ų133.977%0.77381%0.812SS**  trans-96-144.217000000111.7
43P52.5Low37.4Very low142 Ų142138.7 Ų138.792%0.92282%0.818SS**  cis-124.3168.8-47.138-23.5000112.8
44G30.2Very low37.1Very low65 Ų65134.4 Ų134.467%0.6781%0.81SS**  trans164.5103.8163.600000113
45T29.7Very low36.8Very low157 Ų157137.8 Ų137.896%0.96382%0.816SS**  58.4122.398.3-30.20000112.8
46G29.8Very low37.1Very low67 Ų67135.8 Ų135.869%0.69181%0.81SS**  cis166178.36.400000108
47S27.6Very low37.4Very low129 Ų129136.2 Ų136.290%0.90280%0.802SS**  trans86111.2172.4-162.60000115.6
48G29.4Very low37.3Very low68 Ų68135 Ų13570%0.70180%0.801SS**  102.5126.373.100000107.2
49T33.1Very low37.8Very low127 Ų127133.6 Ų133.678%0.77980%0.798SS**  -172.6159.351-51.80000109.8
50E32.8Very low38.1Very low164 Ų164136.8 Ų136.877%0.76680%0.8SS**  trans-31.9154.3171.2-60.2136.9163.900116.9
51S31.2Very low37.1Very low100 Ų100139 Ų13970%0.69981%0.806SS**  179.8129.768.921.80000108.7
52D32.3Very low37.4Very low148 Ų148135.3 Ų135.379%0.79180%0.802SS**  73.9114.4108.5-62.1-38.5000115.6
53E39.3Very low37.4Very low195 Ų195135 Ų13591%0.91180%0.798SS**  178.7118.4108.5-91.8179.1-166.600110.5
54E36.4Very low36.6Very low179 Ų179138.2 Ų138.284%0.83680%0.798SS**  trans-76.4158.7165.9-59.9177.4160.900110.4
55V37.9Very low37Very low139 Ų139142.1 Ų142.184%0.84280%0.803SS**  -173.999121.31690000108.6
56E41.8Very low37.7Very low147 Ų147142.6 Ų142.669%0.68780%0.798SS**  29.1130.8126.6-72.7-77155.200122.5
57E47.4Very low38.2Very low156 Ų156144.7 Ų144.773%0.72980%0.803SS**  trans-12.7156.5151.7-65.4-179.5162.400120.1
58N35.1Very low38.8Very low151 Ų151145 Ų14581%0.80779%0.794SS**  -174.2117118.1-92.2-61.3000111.9
59E50.8Low39.4Very low176 Ų176150.2 Ų150.282%0.82280%0.804SS**  trans-67.5136.6164.2-67.3174.6141.800111.1
60K49.2Very low40.3Very low203 Ų203151.1 Ų151.188%0.88380%0.799SS**  trans-141.1107155.5-72.2-171.8-178.1162.50110.4
61D40Very low40.9Very low151 Ų151152.4 Ų152.481%0.80781%0.806SS**  trans-69.3151172.1-79.3-41.2000113.7
62A42.8Very low42.3Very low103 Ų103155.5 Ų155.585%0.85181%0.809SS**  trans52.2115.4137.900000120.3
63G36.2Very low43Very low67 Ų67155.1 Ų155.169%0.69181%0.807SS**  trans137.181.7136.800000115.2
64F36.3Very low43.4Very low210 Ų210153.2 Ų153.292%0.92180%0.802SS**  trans-145.985.1143.1-136.1-93.4000109.9
65L38.4Very low44Very low148 Ų148148.6 Ų148.678%0.77579%0.794SS**  trans-59.1147167.5-73.3168000110.5
66L43Very low44.4Very low167 Ų167151 Ų15187%0.87479%0.793SS**  trans80.682.2158.8-60.5158.4000117.2
67S41.8Very low44.2Very low111 Ų111148.7 Ų148.778%0.77679%0.794SS**SBendtrans-151.4126.9133-158.70000111.9
68L40.2Very low44.5Very low136 Ų136147.2 Ų147.271%0.71280%0.798SS**  trans78.559.5168.5-92.868.9000118.3E70L68-E70 HydrophobicContact CG-CB 4.39Å; L68-E70 PolarHBondContact O-N 3.08Å
69L42Very low45.3Very low176 Ų176141.9 Ų141.992%0.92178%0.779SS**  trans-60.469.1135.6-147.898.5000110.2
70E50.7Low45.3Very low146 Ų146141 Ų14168%0.68277%0.769SS**  trans-150.974.2168.9-162.8167-147.600109.6L68L68-E70 HydrophobicContact CG-CB 4.39Å; L68-E70 PolarHBondContact O-N 3.08Å
71Q47Very low45.8Very low192 Ų192135.5 Ų135.590%0.89775%0.749SS**  trans165.675.4141-89.7158.5-17.700110.5
72E58.6Low47Very low165 Ų165135.6 Ų135.677%0.77175%0.745SS**  trans-79.3125.2152.2-68.3-177.9167.600108.2
73N47.1Very low48.1Very low139 Ų139137.2 Ų137.274%0.74374%0.735SS**  159.7131.4120.6-85.4-67.2000114.2
74L48.2Very low49.5Very low155 Ų155137 Ų13781%0.81272%0.718SS**  trans80.299.1145.2-104.765.8000122.3
75A50.3Low51.4Low82 Ų82133.1 Ų133.168%0.67870%0.702SS**  47.4121.2119.500000121.1
76K45.8Very low53.3Low189 Ų189129 Ų12982%0.82269%0.69SS**  174.8114.5114.9-93149.7-173.7172.60111.2
77S37.9Very low55Low99 Ų99125.8 Ų125.869%0.69267%0.672SS**  trans-73126.5160.1164.90000108.7G79S77-G79 VanDerWaalsContact C-N 3.26Å; S77-G79 PolarHBondContact O-N 3.38Å; S77-G79 VanDerWaalsContact O-N 3.13Å
78P52.3Low56.8Low126 Ų126128 Ų12882%0.81867%0.668SS**THydrogen-bonded Turntrans-87.937.6-170.237.3-36.7000113.5
79G52.1Low58.9Low39 Ų39127.4 Ų127.440%0.40267%0.665SS.*THydrogen-bonded Turntrans-114.9-25.1178.300000114.8S77S77-G79 VanDerWaalsContact C-N 3.26Å; S77-G79 PolarHBondContact O-N 3.38Å; S77-G79 VanDerWaalsContact O-N 3.13Å
80Y52.2Low60.9Low156 Ų156126 Ų12661%0.61265%0.651SS**Hα-helixtrans-77.1-28-168.3-172.9-112.8000113.9L84Y80-L84 HydrophobicContact CD1-CD1 3.61Å; Y80-L84 HydrophobicContact CD1-CG 4.33Å; Y80-L84 HydrophobicContact CE1-CD1 3.2Å; Y80-L84 HydrophobicContact CE1-CG 4.07Å; Y80-L84 HydrophobicContact CE2-CD1 4.37Å; Y80-L84 HydrophobicContact CE2-CG 4.4Å; Y80-L84 HydrophobicContact CG-CD1 4.36Å; Y80-L84 VanDerWaalsContact O-CG 3.29Å; Y80-L84 WeakPolarHBondContact O-CG 3.37Å; Y80-L84 PolarHBondContact O-N 3.25Å
81N58.4Low62.3Low89 Ų89124.2 Ų124.248%0.47665%0.646SS.*Hα-helixtrans-77.1-34.1-173-63.5-34.5000112.8L84 E85N81-L84 PolarHBondContact O-N 2.92Å; N81-E85 WeakPolarHBondContact O-CB 2.96Å; N81-E85 VanDerWaalsContact O-CG 3.28Å; N81-E85 WeakPolarHBondContact O-CG 3.48Å; N81-E85 PolarHBondContact O-N 2.92Å
82Q65.8Low63.9Low153 Ų153122.7 Ų122.772%0.71563%0.632SS**Hα-helixtrans-75.2-34.4-175.5-157.2163.212.100112.1A86Q82-A86 PolarHBondContact O-N 3.44Å; Q82-A86 VanDerWaalsContact O-N 3.1Å
83E65.1Low64.9Low136 Ų136117.3 Ų117.364%0.63662%0.615SS**Hα-helixtrans-70.8-38.9173.3-64.6-176.9172.700111.7E85 A86 I87E83-E85 VanDerWaalsContact C-N 3.35Å; E83-A86 PolarHBondContact O-N 3.41Å; E83-I87 WeakPolarHBondContact O-CD1 3.39Å; E83-I87 VanDerWaalsContact O-CG1 3.23Å; E83-I87 WeakPolarHBondContact O-CG1 3.42Å; E83-I87 PolarHBondContact O-N 2.75Å
84L66.6Low65.9Low64 Ų64116.4 Ų116.434%0.33561%0.608SS.*Hα-helixtrans-65.8-36.3174.5-75.7-176.3000113Y80 N81 I87 K88Y80-L84 HydrophobicContact CD1-CD1 3.61Å; Y80-L84 HydrophobicContact CD1-CG 4.33Å; Y80-L84 HydrophobicContact CE1-CD1 3.2Å; Y80-L84 HydrophobicContact CE1-CG 4.07Å; Y80-L84 HydrophobicContact CE2-CD1 4.37Å; Y80-L84 HydrophobicContact CE2-CG 4.4Å; Y80-L84 HydrophobicContact CG-CD1 4.36Å; Y80-L84 VanDerWaalsContact O-CG 3.29Å; Y80-L84 WeakPolarHBondContact O-CG 3.37Å; Y80-L84 PolarHBondContact O-N 3.25Å; N81-L84 PolarHBondContact O-N 2.92Å; L84-I87 PolarHBondContact O-N 2.99Å; L84-K88 WeakPolarHBondContact O-CB 3.41Å; L84-K88 WeakPolarHBondContact O-CG 3.32Å; L84-K88 PolarHBondContact O-N 2.78Å
85E76.7Confident67Low128 Ų128115.6 Ų115.660%0.59860%0.601SS**Hα-helixtrans-65.7-42.6174.1-77174.5-173.900111.2N81 E83 I87 K88 L89N81-E85 WeakPolarHBondContact O-CB 2.96Å; N81-E85 VanDerWaalsContact O-CG 3.28Å; N81-E85 WeakPolarHBondContact O-CG 3.48Å; N81-E85 PolarHBondContact O-N 2.92Å; E83-E85 VanDerWaalsContact C-N 3.35Å; E85-I87 VanDerWaalsContact C-N 3.34Å; E85-I87 PolarHBondContact O-N 3.41Å; E85-K88 PolarHBondContact O-N 3.23Å; E85-L89 WeakPolarHBondContact O-CB 3.26Å; E85-L89 PolarHBondContact O-N 3.23Å
86A77.9Confident67.6Low62 Ų62116.3 Ų116.351%0.51259%0.59SS.*Hα-helixtrans-62.9-40.2175.400000112.3Q82 E83 L89 K90Q82-A86 PolarHBondContact O-N 3.44Å; Q82-A86 VanDerWaalsContact O-N 3.1Å; E83-A86 PolarHBondContact O-N 3.41Å; A86-L89 PolarHBondContact O-N 2.77Å; A86-K90 WeakPolarHBondContact O-CB 3.4Å; A86-K90 PolarHBondContact O-N 3.28Å
87I79Confident68.3Low98 Ų98111 Ų11150%0.50358%0.581SS.*Hα-helixtrans-67.2-43.6176.8-68163.7000111E83 L84 E85 L89 K90 L91E83-I87 WeakPolarHBondContact O-CD1 3.39Å; E83-I87 VanDerWaalsContact O-CG1 3.23Å; E83-I87 WeakPolarHBondContact O-CG1 3.42Å; E83-I87 PolarHBondContact O-N 2.75Å; L84-I87 PolarHBondContact O-N 2.99Å; E85-I87 VanDerWaalsContact C-N 3.34Å; E85-I87 PolarHBondContact O-N 3.41Å; I87-L89 VanDerWaalsContact C-N 3.34Å; I87-L89 PolarHBondContact O-N 2.86Å; I87-K90 PolarHBondContact O-N 3.19Å; I87-L91 HydrophobicContact CG2-CD1 4.27Å; I87-L91 PolarHBondContact O-N 3.11Å
88K79.9Confident69Low158 Ų158114.9 Ų114.969%0.68759%0.588SS**Hα-helixtrans-60.1-43.4175.3-84.1-179.11761790112.1L84 E85 K90 L91 W92L84-K88 WeakPolarHBondContact O-CB 3.41Å; L84-K88 WeakPolarHBondContact O-CG 3.32Å; L84-K88 PolarHBondContact O-N 2.78Å; E85-K88 PolarHBondContact O-N 3.23Å; K88-K90 VanDerWaalsContact C-N 3.34Å; K88-K90 PolarHBondContact O-N 2.65Å; K88-L91 PolarHBondContact O-N 2.97Å; K88-W92 PolarHBondContact O-N 3.44Å
89L83.9Confident68.6Low123 Ų123113.6 Ų113.664%0.64458%0.578SS**Hα-helixtrans-67.7-36.8-178.4-153.8151.9000111.4E85 A86 I87 A93E85-L89 WeakPolarHBondContact O-CB 3.26Å; E85-L89 PolarHBondContact O-N 3.23Å; A86-L89 PolarHBondContact O-N 2.77Å; I87-L89 VanDerWaalsContact C-N 3.34Å; I87-L89 PolarHBondContact O-N 2.86Å; L89-A93 WeakPolarHBondContact O-CB 3.36Å; L89-A93 PolarHBondContact O-N 3.48Å
90K83.8Confident67.8Low146 Ų146119 Ų11964%0.63560%0.597SS**Hα-helixtrans-69.6-37.7175.7-171.1148.9-177.81680113.2A86 I87 K88 A93 M94A86-K90 WeakPolarHBondContact O-CB 3.4Å; A86-K90 PolarHBondContact O-N 3.28Å; I87-K90 PolarHBondContact O-N 3.19Å; K88-K90 VanDerWaalsContact C-N 3.34Å; K88-K90 PolarHBondContact O-N 2.65Å; K90-A93 PolarHBondContact O-N 3Å; K90-M94 HydrophobicContact CG-SD 4.39Å; K90-M94 WeakPolarHBondContact O-CG 3.42Å; K90-M94 PolarHBondContact O-N 3.23Å
91L80.1Confident67.2Low109 Ų109116.6 Ų116.657%0.57160%0.601SS**Hα-helixtrans-64.2-45.5173.8-91.3163.1000111.9I87 K88 A93 M94 E95I87-L91 HydrophobicContact CG2-CD1 4.27Å; I87-L91 PolarHBondContact O-N 3.11Å; K88-L91 PolarHBondContact O-N 2.97Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.07Å; L91-M94 PolarHBondContact O-N 2.95Å; L91-E95 WeakPolarHBondContact O-CB 3.4Å; L91-E95 PolarHBondContact O-N 3.33Å
92W80.7Confident66.7Low160 Ų160121.3 Ų121.361%0.60662%0.62SS**Hα-helixtrans-59.8-43.7176.3-171.979.6000111.6K88 M94 E95 H96K88-W92 PolarHBondContact O-N 3.44Å; W92-M94 VanDerWaalsContact C-N 3.34Å; W92-M94 PolarHBondContact O-N 3.09Å; W92-E95 PolarHBondContact O-N 3.44Å; W92-H96 AromaticContact CD1-CD2 3.56Å; W92-H96 AromaticContact CD1-NE2 3.42Å; W92-H96 AromaticContact CD2-CD2 3.49Å; W92-H96 VanDerWaalsContact CD2-CD2 3.49Å; W92-H96 AromaticContact CE2-CD2 3.16Å; W92-H96 AromaticContact CE2-NE2 3.29Å; W92-H96 VanDerWaalsContact CE2-NE2 3.29Å; W92-H96 AromaticContact CG-CD2 3.75Å; W92-H96 AromaticContact CZ2-CD2 3.55Å; W92-H96 AromaticContact CZ2-NE2 3.72Å; W92-H96 AromaticContact NE1-CD2 3.23Å; W92-H96 PolarHBondContact NE1-CD2 2.89Å; W92-H96 AromaticContact NE1-NE2 2.89Å; W92-H96 PolarHBondContact NE1-NE2 3.15Å; W92-H96 PolarHBondContact O-CD2 3.07Å; W92-H96 PolarHBondContact O-N 3.08Å; W92-H96 VanDerWaalsContact O-N 3.08Å
93A79.3Confident65.1Low52 Ų52121.9 Ų121.943%0.4362%0.622SS.*Hα-helixtrans-64.9-34.517700000113.4L89 K90 L91 A97L89-A93 WeakPolarHBondContact O-CB 3.36Å; L89-A93 PolarHBondContact O-N 3.48Å; K90-A93 PolarHBondContact O-N 3Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.07Å; A93-A97 WeakPolarHBondContact O-CB 3.34Å; A93-A97 PolarHBondContact O-N 3.28Å
94M68.4Low63.9Low120 Ų120120.1 Ų120.159%0.59162%0.623SS**Hα-helixtrans-72.2-42.1174.9-74.4173.560.400111.9K90 L91 W92 H96 A97K90-M94 HydrophobicContact CG-SD 4.39Å; K90-M94 WeakPolarHBondContact O-CG 3.42Å; K90-M94 PolarHBondContact O-N 3.23Å; L91-M94 PolarHBondContact O-N 2.95Å; W92-M94 VanDerWaalsContact C-N 3.34Å; W92-M94 PolarHBondContact O-N 3.09Å; M94-H96 VanDerWaalsContact C-N 3.31Å; M94-H96 PolarHBondContact O-N 3.32Å; M94-A97 PolarHBondContact O-N 2.91Å
95E70.9Confident62.4Low139 Ų139127.5 Ų127.565%0.6565%0.648SS**Hα-helixtrans-64.6-35.2-179.6-173.4170.7-158.100112.4L91 W92 T99L91-E95 WeakPolarHBondContact O-CB 3.4Å; L91-E95 PolarHBondContact O-N 3.33Å; W92-E95 PolarHBondContact O-N 3.44Å; E95-T99 PolarHBondContact O-OG1 3.37Å
96H63.8Low60.5Low97 Ų97127.7 Ų127.745%0.44966%0.658SS.*THydrogen-bonded Turntrans-87.1-7.3178-70.4-59.4000114.9W92 M94W92-H96 AromaticContact CD1-CD2 3.56Å; W92-H96 AromaticContact CD1-NE2 3.42Å; W92-H96 AromaticContact CD2-CD2 3.49Å; W92-H96 VanDerWaalsContact CD2-CD2 3.49Å; W92-H96 AromaticContact CE2-CD2 3.16Å; W92-H96 AromaticContact CE2-NE2 3.29Å; W92-H96 VanDerWaalsContact CE2-NE2 3.29Å; W92-H96 AromaticContact CG-CD2 3.75Å; W92-H96 AromaticContact CZ2-CD2 3.55Å; W92-H96 AromaticContact CZ2-NE2 3.72Å; W92-H96 AromaticContact NE1-CD2 3.23Å; W92-H96 PolarHBondContact NE1-CD2 2.89Å; W92-H96 AromaticContact NE1-NE2 2.89Å; W92-H96 PolarHBondContact NE1-NE2 3.15Å; W92-H96 PolarHBondContact O-CD2 3.07Å; W92-H96 PolarHBondContact O-N 3.08Å; W92-H96 VanDerWaalsContact O-N 3.08Å; M94-H96 VanDerWaalsContact C-N 3.31Å; M94-H96 PolarHBondContact O-N 3.32Å
97A58.7Low58.4Low78 Ų78131.7 Ų131.765%0.64567%0.666SS**THydrogen-bonded Turntrans-85.1-19.3175.300000113A93 M94A93-A97 WeakPolarHBondContact O-CB 3.34Å; A93-A97 PolarHBondContact O-N 3.28Å; M94-A97 PolarHBondContact O-N 2.91Å
98E53.6Low56.8Low179 Ų179137.3 Ų137.384%0.83668%0.681SS**SBendtrans-94.4-5.5178.4-73.8-173167.200114L100E98-L100 PolarHBondContact O-N 3.42Å; E98-L100 VanDerWaalsContact O-N 3.15Å
99T44Very low54.5Low100 Ų100139.8 Ų139.861%0.61369%0.691SS**  trans-87.876.9170.8-0.40000109.9E95 P101E95-T99 PolarHBondContact O-OG1 3.37Å; T99-P101 WeakPolarHBondContact O-CD 3.39Å
100L34.4Very low52.6Low153 Ų153138.5 Ų138.580%0.80170%0.698SS**  trans-59126.6161-75.4173000108.3E98 E102E98-L100 PolarHBondContact O-N 3.42Å; E98-L100 VanDerWaalsContact O-N 3.15Å; L100-E102 PolarHBondContact O-N 3.14Å
101P40.9Very low50Low105 Ų105138.3 Ų138.368%0.68271%0.71SS**  trans-67.7118.4165.226.8-29.7000108.2T99 Q103T99-P101 WeakPolarHBondContact O-CD 3.39Å; P101-Q103 PolarHBondContact O-N 3.36Å
102E47.1Very low48.3Very low188 Ų188141.8 Ų141.888%0.87972%0.723SS**  trans-43.8111.9161.9-73.7-79.3149.200109.2L100L100-E102 PolarHBondContact O-N 3.14Å
103Q33.3Very low46.2Very low164 Ų164142.8 Ų142.877%0.76673%0.734SS**PPolyproline II helixtrans-84.8128.8170.4-79.3-85.5-18.600108.5P101P101-Q103 PolarHBondContact O-N 3.36Å
104P38.6Very low44.2Very low100 Ų100150.2 Ų150.265%0.64976%0.757SS**PPolyproline II helixtrans-67.3136.4-179.727-31.9000111.2V106P104-V106 PolarHBondContact O-N 3.33Å
105Y36.3Very low42.3Very low218 Ų218148.1 Ų148.186%0.85577%0.766SS**PPolyproline II helixtrans-53.5122.116867-79.3000111
106V35.4Very low40.6Very low133 Ų133146 Ų14681%0.80677%0.772SS**  trans-147.8115.1152-174.60000110.7P104P104-V106 PolarHBondContact O-N 3.33Å
107Q35.2Very low39.2Very low146 Ų146150 Ų15068%0.68279%0.791SS**  trans20.4116.2147.4-133.774.2-200121.3
108R45.2Very low38.2Very low216 Ų216153 Ų15382%0.81580%0.801SS**  trans8130.6138.8-56.4173.2-177.3154.11.9117.3
109K31.2Very low37.5Very low209 Ų209148.3 Ų148.391%0.90980%0.801SS**  -158.6141.5117-74.5-140.4178.4-179.50111.1
110A43.1Very low37.7Very low96 Ų96152.7 Ų152.779%0.79381%0.814SS**  trans-77.7145.717500000111.6
111T30.2Very low38Very low143 Ų143152.7 Ų152.788%0.87781%0.814SS**  trans-161.4132.5149.730.50000108.6
112E44.2Very low37.9Very low182 Ų182154.8 Ų154.885%0.8582%0.819SS**  trans-60.9156.5174.4-72169.9115.600112.1
113E37Very low37.7Very low180 Ų180150.9 Ų150.984%0.84181%0.812SS**  165.7127.1112.2-83.6179.5-147.800112.7
114K36.6Very low38.5Very low209 Ų209149.4 Ų149.491%0.90982%0.817SS**  trans21.6131.3153.7-63.4177.4178.8171.30121.5
115G29.1Very low39.1Very low75 Ų75152.8 Ų152.877%0.77382%0.824SS**  trans158.592.114800000116.8
116A35.5Very low39.6Very low94 Ų94150.2 Ų150.278%0.77782%0.824SS**  trans38.4129.313900000123.1
117E33.7Very low39.8Very low181 Ų181151.5 Ų151.585%0.84682%0.823SS**  trans93.6110135-74.2-175.917800122.8
118V38.3Very low40.1Very low143 Ų143148.7 Ų148.787%0.86783%0.832SS**  trans61.398.5133.4-163.20000119
119G37.7Very low39.7Very low80 Ų80142.8 Ų142.883%0.82582%0.824SS**  trans-168.529.6161.300000112.9L121G119-L121 PolarHBondContact O-N 3.27Å
120Q48.1Very low40.4Very low191 Ų191140.2 Ų140.289%0.89381%0.813SS**  trans-83.793.9168.8-77177.87.200108.4
121L41.4Very low40.6Very low153 Ų153144 Ų14480%0.80181%0.811SS**  trans-145.2110.7151.8-86-174000110.5G119G119-L121 PolarHBondContact O-N 3.27Å
122L38.4Very low41.8Very low150 Ų150142 Ų14279%0.78580%0.801SS**  trans85.275.5145-52.4164.8000116.6
123S43.3Very low42.8Very low105 Ų105134.1 Ų134.173%0.73477%0.769SS**  trans-50129140.3-540000109.8E125S123-E125 VanDerWaalsContact C-N 3.29Å; S123-E125 PolarHBondContact O-N 3.06Å
124P49.3Very low44.9Very low134 Ų134129.9 Ų129.987%0.8776%0.755SS**  trans-87.276.5166.333.2-28.9000109
125E51.9Low47Very low170 Ų170125 Ų12579%0.79474%0.744SS**  trans-100.6132.1149.5-68.6-166161.900107.4S123S123-E125 VanDerWaalsContact C-N 3.29Å; S123-E125 PolarHBondContact O-N 3.06Å
126I47.1Very low49.5Very low165 Ų165129.2 Ų129.285%0.84674%0.742SS**SBendtrans87.471.9174.3-42.6160.4000115.6
127M38.9Very low51.8Low160 Ų160128.6 Ų128.679%0.78872%0.723SS**  -163107.5120.9-163.680.268.600106.8C129M127-C129 PolarHBondContact O-N 3Å
128G42.1Very low54.3Low86 Ų86125 Ų12589%0.88770%0.704SS**  trans-67.770.6-176.500000113.1F130G128-F130 PolarHBondContact O-N 3.33Å
129C37.1Very low56.6Low93 Ų93119.8 Ų119.863%0.62867%0.672SS**  trans-82.966.2157.7-47.70000106.8M127 F131M127-C129 PolarHBondContact O-N 3Å; C129-F131 PolarHBondContact O-N 3.21Å
130F45.2Very low59Low155 Ų155121.2 Ų121.268%0.6866%0.658SS**  trans-61.8107.5169.5-153.6-92.1000105.6G128G128-F130 PolarHBondContact O-N 3.33Å
131F47Very low61Low175 Ų175113.3 Ų113.377%0.76863%0.625SS**  trans-49134.8177.2-67.9-87000107.5C129 G133C129-F131 PolarHBondContact O-N 3.21Å; F131-G133 VanDerWaalsContact C-N 3.35Å; F131-G133 PolarHBondContact O-N 2.93Å
132P56.8Low63.4Low101 Ų101107.3 Ų107.366%0.65659%0.594SS**  trans-59.1107.3177.123.7-30.6000106.7
133G64.9Low65.9Low17 Ų17104.1 Ų104.118%0.17558%0.575CS.*  trans-49.2157.3176.900000110.5F131 E137 K138F131-G133 VanDerWaalsContact C-N 3.35Å; F131-G133 PolarHBondContact O-N 2.93Å; G133-E137 WeakPolarHBondContact CA-OE2 3.37Å; G133-K138 VanDerWaalsContact O-CE 3.32Å; G133-K138 WeakPolarHBondContact O-CE 3.29Å
134T80Confident68.4Low90 Ų90102.9 Ų102.955%0.55255%0.554SS**  trans-48.5151.2174.9650000109.7K136 E137 K138T134-K136 PolarHBondContact O-N 3.38Å; T134-E137 WeakPolarHBondContact O-CB 3.28Å; T134-E137 PolarHBondContact O-N 2.77Å; T134-K138 PolarHBondContact O-N 2.88Å
135P80.3Confident70.6Confident106 Ų10696.5 Ų96.569%0.68851%0.512SS*.Hα-helixtrans-53.2-28.5-176.218.9-32.4000113.5V139P135-V139 WeakPolarHBondContact O-CG2 3.46Å; P135-V139 PolarHBondContact O-N 3.17Å
136K81.6Confident72.7Confident165 Ų16588.4 Ų88.472%0.71748%0.475SS*.Hα-helixtrans-65.9-46.3173.3-66.6-178.1176.3179.70112.6T134 K138 V139 E140T134-K136 PolarHBondContact O-N 3.38Å; K136-K138 VanDerWaalsContact C-N 3.3Å; K136-K138 PolarHBondContact O-N 3.26Å; K136-V139 WeakPolarHBondContact O-CB 3.29Å; K136-V139 PolarHBondContact O-N 2.94Å; K136-V139 VanDerWaalsContact O-N 3.13Å; K136-E140 PolarHBondContact O-N 2.77Å
137E85.4Confident75Confident81 Ų8183.7 Ų83.738%0.37945%0.447SS..Hα-helixtrans-63.4-36.5179.6-169.5-179174.800112G133 T134 V139 E140 A141G133-E137 WeakPolarHBondContact CA-OE2 3.37Å; T134-E137 WeakPolarHBondContact O-CB 3.28Å; T134-E137 PolarHBondContact O-N 2.77Å; E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 2.84Å; E137-E140 PolarHBondContact O-N 2.94Å; E137-A141 WeakPolarHBondContact O-CB 3.27Å; E137-A141 PolarHBondContact O-N 3.21Å
138K85Confident77.7Confident106 Ų10676 Ų7646%0.46141%0.409SS..Hα-helixtrans-62.7-40.4174.2-64.1-171.2178.9-1670112.3G133 T134 K136 A141 D142G133-K138 VanDerWaalsContact O-CE 3.32Å; G133-K138 WeakPolarHBondContact O-CE 3.29Å; T134-K138 PolarHBondContact O-N 2.88Å; K136-K138 VanDerWaalsContact C-N 3.3Å; K136-K138 PolarHBondContact O-N 3.26Å; K138-A141 PolarHBondContact O-N 2.83Å; K138-D142 WeakPolarHBondContact O-CB 3.41Å; K138-D142 PolarHBondContact O-N 2.83Å
139V87.1Confident80.3Confident32 Ų3272 Ų7219%0.19437%0.368CS..Hα-helixtrans-65.7-43.6176.71720000110.1P135 K136 E137 A141 D142 H143 T221 F223P135-V139 WeakPolarHBondContact O-CG2 3.46Å; P135-V139 PolarHBondContact O-N 3.17Å; K136-V139 WeakPolarHBondContact O-CB 3.29Å; K136-V139 PolarHBondContact O-N 2.94Å; K136-V139 VanDerWaalsContact O-N 3.13Å; E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 2.84Å; V139-A141 PolarHBondContact O-N 3.49Å; V139-D142 WeakPolarHBondContact O-CB 3.28Å; V139-D142 PolarHBondContact O-N 3.15Å; V139-H143 VanDerWaalsContact CG1-NE2 3.33Å; V139-H143 WeakPolarHBondContact CG1-NE2 3.45Å; V139-H143 PolarHBondContact O-CD2 3.12Å; V139-H143 PolarHBondContact O-N 3.22Å; V139-T221 HydrophobicContact CG1-CG2 4.17Å; V139-F223 HydrophobicContact CG1-CE1 3.93Å; V139-F223 HydrophobicContact CG1-CZ 3.7Å; V139-F223 HydrophobicContact CG2-CD1 4.45Å; V139-F223 HydrophobicContact CG2-CE1 3.8Å; V139-F223 HydrophobicContact CG2-CZ 4.31Å
140E89.1Confident83.1Confident111 Ų11172 Ų7252%0.51936%0.361SS..Hα-helixtrans-64.9-37.9175.6-70175.8-17100113.2K136 E137 H143 R144K136-E140 PolarHBondContact O-N 2.77Å; E137-E140 PolarHBondContact O-N 2.94Å; E140-H143 PolarHBondContact O-N 3.41Å; E140-R144 WeakPolarHBondContact O-CG 3.27Å; E140-R144 PolarHBondContact O-N 2.87Å; E140-R144 VanDerWaalsContact O-N 3.15Å; E140-R144 PolarHBondContact O-NE 2.86Å
141A89.8Confident85.4Confident24 Ų2464.8 Ų64.820%0.19833%0.33CS..Hα-helixtrans-64.8-42172.600000110.7E137 K138 V139 H143 R144 S145E137-A141 WeakPolarHBondContact O-CB 3.27Å; E137-A141 PolarHBondContact O-N 3.21Å; K138-A141 PolarHBondContact O-N 2.83Å; V139-A141 PolarHBondContact O-N 3.49Å; A141-H143 VanDerWaalsContact C-N 3.33Å; A141-H143 PolarHBondContact O-N 3.29Å; A141-R144 CarbonylContact O-C 3.37Å; A141-R144 PolarHBondContact O-N 3.45Å; A141-R144 VanDerWaalsContact O-N 3.13Å; A141-S145 WeakPolarHBondContact O-CB 3.48Å; A141-S145 PolarHBondContact O-N 3.13Å; A141-S145 PolarHBondContact O-OG 2.83Å
142D90.8Very high87.7Confident28 Ų2857.7 Ų57.715%0.1530%0.3CS..Hα-helixtrans-61.9-39.1175.5-75.5-7.5000112K138 V139 R144 S145 K219 T221K138-D142 WeakPolarHBondContact O-CB 3.41Å; K138-D142 PolarHBondContact O-N 2.83Å; V139-D142 WeakPolarHBondContact O-CB 3.28Å; V139-D142 PolarHBondContact O-N 3.15Å; D142-R144 VanDerWaalsContact C-N 3.28Å; D142-R144 PolarHBondContact O-N 2.98Å; D142-S145 WeakPolarHBondContact O-CB 3.38Å; D142-S145 PolarHBondContact O-N 3.23Å; D142-S145 VanDerWaalsContact O-N 3.1Å; D142-K219 HydrophobicContact CB-CD 4.3Å; D142-K219 WeakPolarHBondContact OD1-CE 3.49Å; D142-K219 IonicContact OD1-NZ 3.69Å; D142-K219 PolarHBondContact OD1-NZ 2.79Å; D142-T221 HydrophobicContact CB-CG2 3.66Å
143H92.2Very high89.4Confident83 Ų8359.7 Ų59.738%0.38430%0.296SS..Hα-helixtrans-66.7-27.9174.5-72-59.6000113.6V139 E140 A141 S145V139-H143 VanDerWaalsContact CG1-NE2 3.33Å; V139-H143 WeakPolarHBondContact CG1-NE2 3.45Å; V139-H143 PolarHBondContact O-CD2 3.12Å; V139-H143 PolarHBondContact O-N 3.22Å; E140-H143 PolarHBondContact O-N 3.41Å; A141-H143 VanDerWaalsContact C-N 3.33Å; A141-H143 PolarHBondContact O-N 3.29Å; H143-S145 VanDerWaalsContact C-N 3.3Å
144R94.3Very high90.6Very high79 Ų7961.1 Ų61.130%0.29831%0.31SS..THydrogen-bonded Turntrans-91.99.6173.3-67.1-179.8-77.9170.6-5.5112.9E140 A141 D142 F192 A193 Q195 V198E140-R144 WeakPolarHBondContact O-CG 3.27Å; E140-R144 PolarHBondContact O-N 2.87Å; E140-R144 VanDerWaalsContact O-N 3.15Å; E140-R144 PolarHBondContact O-NE 2.86Å; A141-R144 CarbonylContact O-C 3.37Å; A141-R144 PolarHBondContact O-N 3.45Å; A141-R144 VanDerWaalsContact O-N 3.13Å; D142-R144 VanDerWaalsContact C-N 3.28Å; D142-R144 PolarHBondContact O-N 2.98Å; R144-F192 PolarHBondContact O-N 3.42Å; R144-A193 WeakPolarHBondContact CD-O 3.16Å; R144-A193 PolarHBondContact NH1-O 3.2Å; R144-Q195 HydrophobicContact CG-CB 4.29Å; R144-V198 WeakPolarHBondContact O-CG2 3.11Å
145S95Very high91Very high0 Ų057.3 Ų57.30%029%0.289CS..EExtended strand (participates in β ladder)trans-107.6151.4-178-65.30000113.2A141 D142 H143 I190 E191 K219A141-S145 WeakPolarHBondContact O-CB 3.48Å; A141-S145 PolarHBondContact O-N 3.13Å; A141-S145 PolarHBondContact O-OG 2.83Å; D142-S145 WeakPolarHBondContact O-CB 3.38Å; D142-S145 PolarHBondContact O-N 3.23Å; D142-S145 VanDerWaalsContact O-N 3.1Å; H143-S145 VanDerWaalsContact C-N 3.3Å; S145-I190 CarbonylContact C-O 3.58Å; S145-I190 WeakPolarHBondContact CA-O 3.4Å; S145-E191 WeakPolarHBondContact OG-CG 2.98Å; S145-K219 WeakPolarHBondContact O-CB 3.28Å; S145-K219 PolarHBondContact O-N 2.82Å
146V96.2Very high91.7Very high0 Ų054.5 Ų54.50%027%0.271CS..EExtended strand (participates in β ladder)trans-119.8140.5175.61740000109.8V148 Y189 I190 F192 V198 A201 V216 L217V146-V148 HydrophobicContact CG1-CG2 4.16Å; V146-Y189 WeakPolarHBondContact O-CA 3.39Å; V146-I190 PolarHBondContact N-O 3.35Å; V146-I190 PolarHBondContact O-N 2.86Å; V146-F192 HydrophobicContact CB-CE2 4Å; V146-F192 HydrophobicContact CG2-CD2 4.06Å; V146-F192 HydrophobicContact CG2-CE2 3.62Å; V146-V198 HydrophobicContact CG2-CB 4.03Å; V146-V198 HydrophobicContact CG2-CG1 3.6Å; V146-V198 HydrophobicContact CG2-CG2 4.15Å; V146-A201 HydrophobicContact CG2-CB 4.06Å; V146-V216 HydrophobicContact CG1-CG1 3.19Å; V146-L217 CarbonylContact C-O 3.55Å; V146-L217 WeakPolarHBondContact CG1-O 3.23Å
147Y96.5Very high92.2Very high65 Ų6548.6 Ų48.626%0.25525%0.254SS..EExtended strand (participates in β ladder)trans-89.1126.9165.1170.1-96.8000109.8Y187 Y189 V216 L217Y147-Y187 HydrophobicContact CE2-CD2 4.15Å; Y147-Y187 HydrophobicContact CE2-CG 4.03Å; Y147-Y189 HydrophobicContact CD2-CD1 4.37Å; Y147-Y189 AromaticContact CD2-CE1 3.7Å; Y147-Y189 HydrophobicContact CD2-CE1 3.7Å; Y147-Y189 HydrophobicContact CG-CE1 4.4Å; Y147-V216 WeakPolarHBondContact O-CA 3.46Å; Y147-L217 WeakPolarHBondContact CA-O 3.5Å; Y147-L217 HydrophobicContact CD1-CB 4.23Å; Y147-L217 HydrophobicContact CD1-CD1 4.42Å; Y147-L217 PolarHBondContact N-O 2.72Å; Y147-L217 PolarHBondContact O-N 3.1Å
148V96Very high92.6Very high0 Ų048.1 Ų48.10%026%0.264CS..EExtended strand (participates in β ladder)trans-116.6113.7173.3-170.80000108.3V146 V151 F164 Y187 A188 I190 I214 K215V146-V148 HydrophobicContact CG1-CG2 4.16Å; V148-V151 HydrophobicContact CB-CG2 4.15Å; V148-V151 HydrophobicContact CG1-CG2 3.57Å; V148-F164 HydrophobicContact CG1-CE2 4.29Å; V148-F164 HydrophobicContact CG1-CZ 4.2Å; V148-F164 HydrophobicContact CG2-CE2 3.88Å; V148-F164 HydrophobicContact CG2-CZ 3.77Å; V148-Y187 CarbonylContact O-C 3.55Å; V148-Y187 WeakPolarHBondContact O-CA 3.38Å; V148-Y187 VanDerWaalsContact O-CB 3.31Å; V148-Y187 WeakPolarHBondContact O-CB 3.34Å; V148-A188 PolarHBondContact N-O 2.89Å; V148-A188 PolarHBondContact O-N 3.09Å; V148-I190 HydrophobicContact CG2-CD1 3.85Å; V148-I190 HydrophobicContact CG2-CG1 4.27Å; V148-I214 HydrophobicContact CG1-CB 4.23Å; V148-I214 HydrophobicContact CG1-CD1 4.1Å; V148-I214 HydrophobicContact CG1-CG2 4.49Å; V148-K215 CarbonylContact C-O 3.57Å; V148-K215 WeakPolarHBondContact CA-O 3.43Å
149G95.8Very high93.1Very high2 Ų246.6 Ų46.62%0.02126%0.258CS..EExtended strand (participates in β ladder)trans-103.9163.2177.700000112.9V151 I214 K215G149-V151 PolarHBondContact O-N 2.98Å; G149-I214 WeakPolarHBondContact O-CA 3.46Å; G149-K215 PolarHBondContact N-O 2.93Å; G149-K215 PolarHBondContact O-N 3.35Å
150N95.4Very high93.4Very high91 Ų9145 Ų4549%0.48725%0.249SC..SBendtrans59.232.6-178.1-160.140.2000113.8G186 V213N150-G186 PolarHBondContact N-O 2.94Å; N150-V213 PolarHBondContact ND2-O 3.46Å
151V94.5Very high93.7Very high4 Ų446.4 Ų46.42%0.02425%0.249CC..  trans-70.4142.6174.5-176.10000109.2V148 G149 L160 G186 F209V148-V151 HydrophobicContact CB-CG2 4.15Å; V148-V151 HydrophobicContact CG1-CG2 3.57Å; G149-V151 PolarHBondContact O-N 2.98Å; V151-L160 HydrophobicContact CG1-CD1 4.33Å; V151-L160 HydrophobicContact CG1-CD2 4.12Å; V151-L160 HydrophobicContact CG2-CD2 4.47Å; V151-G186 PolarHBondContact N-O 3.5Å; V151-G186 WeakPolarHBondContact O-CA 3.46Å; V151-F209 HydrophobicContact CG1-CD1 4.4Å; V151-F209 HydrophobicContact CG1-CE1 4.1Å
152D94.4Very high93.9Very high27 Ų2748.7 Ų48.714%0.14427%0.268CS..  trans-60.5142.8174.8-174.762.3000111.9G154 G155 R210 R212D152-G154 PolarHBondContact O-N 2.94Å; D152-G154 WeakPolarHBondContact OD2-CA 3.15Å; D152-G154 PolarHBondContact OD2-N 2.63Å; D152-G155 PolarHBondContact O-N 3.1Å; D152-R210 HydrophobicContact CB-CB 4.17Å; D152-R210 IonicContact OD2-CZ 3.89Å; D152-R210 IonicContact OD2-NE 2.98Å; D152-R210 IonicContact OD2-NH2 3.18Å; D152-R212 IonicContact OD1-CZ 3Å; D152-R212 IonicContact OD1-NE 2.63Å; D152-R212 PolarHBondContact OD1-NE 2.73Å; D152-R212 IonicContact OD1-NH1 3.21Å; D152-R212 IonicContact OD1-NH2 3.52Å; D152-R212 PolarHBondContact OD1-NH2 3.17Å
153Y92.6Very high94.1Very high143 Ų14350.3 Ų50.356%0.56127%0.272SS*.THydrogen-bonded Turntrans-67.1-26.4-178.6-62-59.9000112.7G155 P184Y153-G155 VanDerWaalsContact C-N 3.3Å; Y153-P184 HydrophobicContact CD1-CB 4.4Å; Y153-P184 HydrophobicContact CD1-CG 4.04Å; Y153-P184 WeakPolarHBondContact CD1-O 3.4Å; Y153-P184 WeakPolarHBondContact CE1-O 3.46Å; Y153-P184 HydrophobicContact CG-CG 4.5Å; Y153-P184 WeakPolarHBondContact O-CG 3.43Å
154G90.8Very high94.3Very high47 Ų4746.3 Ų46.349%0.48525%0.254SS..THydrogen-bonded Turntrans-86.10.4172.500000113.7D152 S156 R210D152-G154 PolarHBondContact O-N 2.94Å; D152-G154 WeakPolarHBondContact OD2-CA 3.15Å; D152-G154 PolarHBondContact OD2-N 2.63Å; G154-S156 PolarHBondContact O-N 3.05Å; G154-R210 VanDerWaalsContact C-NH1 3.29Å; G154-R210 PolarHBondContact O-NH1 2.92Å
155G89.1Confident94.3Very high10 Ų1046.1 Ų46.110%0.10327%0.265CS..  trans-65.6125.2-176.800000112.1D152 Y153 I175D152-G155 PolarHBondContact O-N 3.1Å; Y153-G155 VanDerWaalsContact C-N 3.3Å; G155-I175 WeakPolarHBondContact O-CD1 3.44Å
156S93.4Very high94.2Very high46 Ų4651.3 Ų51.332%0.32230%0.298SS..  trans-90154.7177.172.70000111.7G154 A158 E159 L160G154-S156 PolarHBondContact O-N 3.05Å; S156-A158 PolarHBondContact O-N 3.45Å; S156-E159 PolarHBondContact N-OE2 3.43Å; S156-E159 PolarHBondContact O-N 3.24Å; S156-E159 VanDerWaalsContact OG-CG 3.27Å; S156-E159 WeakPolarHBondContact OG-CG 3.2Å; S156-E159 PolarHBondContact OG-N 2.82Å; S156-E159 PolarHBondContact OG-OE1 3.06Å; S156-L160 PolarHBondContact O-N 3.13Å
157A92.4Very high94.1Very high42 Ų4252.1 Ų52.135%0.34730%0.304SS..Hα-helixtrans-61.8-30.2174.900000112.1R161 V173 I175A157-R161 WeakPolarHBondContact O-CB 3.36Å; A157-R161 PolarHBondContact O-N 3.15Å; A157-V173 HydrophobicContact CB-CB 4.2Å; A157-V173 HydrophobicContact CB-CG1 3.9Å; A157-I175 HydrophobicContact CB-CD1 4.15Å
158A94.4Very high94Very high71 Ų7150 Ų5059%0.58730%0.302SS*.Hα-helixtrans-66.7-41.8176.600000112.2S156 R161 A162S156-A158 PolarHBondContact O-N 3.45Å; A158-R161 WeakPolarHBondContact O-CB 3.44Å; A158-R161 PolarHBondContact O-N 2.9Å; A158-A162 PolarHBondContact O-N 3.42Å
159E94.8Very high94Very high73 Ų7356.7 Ų56.734%0.34133%0.333SS..Hα-helixtrans-65.1-43.7176.3-73.6163.8-160.300111.8S156 R161 A162 Y163 F209 R210S156-E159 PolarHBondContact N-OE2 3.43Å; S156-E159 PolarHBondContact O-N 3.24Å; S156-E159 VanDerWaalsContact OG-CG 3.27Å; S156-E159 WeakPolarHBondContact OG-CG 3.2Å; S156-E159 PolarHBondContact OG-N 2.82Å; S156-E159 PolarHBondContact OG-OE1 3.06Å; E159-R161 VanDerWaalsContact C-N 3.28Å; E159-R161 PolarHBondContact O-N 3.45Å; E159-A162 PolarHBondContact O-N 2.93Å; E159-Y163 WeakPolarHBondContact O-CB 3.49Å; E159-Y163 PolarHBondContact O-N 2.82Å; E159-F209 HydrophobicContact CB-CE2 4.04Å; E159-F209 HydrophobicContact CB-CZ 3.82Å; E159-R210 IonicContact OE1-NH1 2.75Å; E159-R210 PolarHBondContact OE1-NH1 3.33Å; E159-R210 WeakPolarHBondContact OE2-CD 3.44Å; E159-R210 IonicContact OE2-CZ 3.98Å; E159-R210 IonicContact OE2-NE 3.72Å; E159-R210 IonicContact OE2-NH1 3.84Å; E159-R210 PolarHBondContact OE2-NH1 3.39Å
160L94.1Very high93.9Very high0 Ų057 Ų570%033%0.334CS..Hα-helixtrans-60.5-41.6174-70.4173.7000110.9V151 S156 A162 Y163 F164 V173 I175 A188 I190 F209V151-L160 HydrophobicContact CG1-CD1 4.33Å; V151-L160 HydrophobicContact CG1-CD2 4.12Å; V151-L160 HydrophobicContact CG2-CD2 4.47Å; S156-L160 PolarHBondContact O-N 3.13Å; L160-A162 PolarHBondContact O-N 3.46Å; L160-Y163 PolarHBondContact O-N 2.77Å; L160-F164 HydrophobicContact CD2-CE2 4.3Å; L160-F164 VanDerWaalsContact O-CD2 3.29Å; L160-F164 WeakPolarHBondContact O-CD2 3.24Å; L160-F164 PolarHBondContact O-N 3.22Å; L160-V173 HydrophobicContact CB-CG1 4.29Å; L160-V173 HydrophobicContact CD1-CG1 4.11Å; L160-I175 HydrophobicContact CD1-CD1 4.17Å; L160-I175 HydrophobicContact CD1-CG1 4.13Å; L160-A188 HydrophobicContact CD1-CB 3.74Å; L160-I190 HydrophobicContact CB-CD1 4.43Å; L160-F209 HydrophobicContact CD2-CE1 4.24Å; L160-F209 HydrophobicContact CD2-CE2 4.36Å; L160-F209 HydrophobicContact CD2-CZ 4.09Å; L160-F209 HydrophobicContact CG-CZ 4.46Å
161R95.1Very high93.9Very high139 Ų13958.7 Ų58.753%0.52534%0.339SS..Hα-helixtrans-61.4-44.9177-165.1-179.2-171.6170.14.9111.8A157 A158 E159 Y163 S165 I170 V173A157-R161 WeakPolarHBondContact O-CB 3.36Å; A157-R161 PolarHBondContact O-N 3.15Å; A158-R161 WeakPolarHBondContact O-CB 3.44Å; A158-R161 PolarHBondContact O-N 2.9Å; E159-R161 VanDerWaalsContact C-N 3.28Å; E159-R161 PolarHBondContact O-N 3.45Å; R161-Y163 VanDerWaalsContact C-N 3.33Å; R161-Y163 PolarHBondContact O-N 3.43Å; R161-S165 WeakPolarHBondContact O-CB 3.26Å; R161-S165 PolarHBondContact O-N 2.64Å; R161-I170 HydrophobicContact CB-CD1 4.3Å; R161-I170 HydrophobicContact CG-CB 4.26Å; R161-I170 HydrophobicContact CG-CD1 3.74Å; R161-I170 HydrophobicContact CG-CG2 4.4Å; R161-I170 PolarHBondContact NH2-O 2.83Å; R161-I170 WeakPolarHBondContact O-CD1 3.33Å; R161-V173 HydrophobicContact CB-CG2 4.41Å
162A94.9Very high93.8Very high72 Ų7264.6 Ų64.660%0.59536%0.361SS*.Hα-helixtrans-63.4-40.6176.900000111.8A158 E159 L160 S165A158-A162 PolarHBondContact O-N 3.42Å; E159-A162 PolarHBondContact O-N 2.93Å; L160-A162 PolarHBondContact O-N 3.46Å; A162-S165 WeakPolarHBondContact O-CB 3.49Å; A162-S165 PolarHBondContact O-N 2.63Å
163Y94.6Very high93.8Very high62 Ų6264.8 Ų64.824%0.24336%0.363CS..Hα-helixtrans-64.3-41.5-179.8-170.4-97.4000113.2E159 L160 R161 P166 L204 S207 F209 I214E159-Y163 WeakPolarHBondContact O-CB 3.49Å; E159-Y163 PolarHBondContact O-N 2.82Å; L160-Y163 PolarHBondContact O-N 2.77Å; R161-Y163 VanDerWaalsContact C-N 3.33Å; R161-Y163 PolarHBondContact O-N 3.43Å; Y163-P166 VanDerWaalsContact O-CD 3.32Å; Y163-P166 WeakPolarHBondContact O-CD 3.44Å; Y163-L204 HydrophobicContact CE1-CD1 4.37Å; Y163-S207 WeakPolarHBondContact OH-CB 3.16Å; Y163-S207 PolarHBondContact OH-OG 2.87Å; Y163-F209 HydrophobicContact CD2-CD2 4.06Å; Y163-F209 HydrophobicContact CG-CD2 4.17Å; Y163-I214 HydrophobicContact CD1-CD1 4.34Å; Y163-I214 HydrophobicContact CE1-CD1 3.73Å
164F95.2Very high93.9Very high0 Ų059.9 Ų59.90%035%0.348CS..Hα-helixtrans-94.3-2-179.1-71.2-76000114V148 L160 P166 C167 I170 I190 F192 A201 I214 V216V148-F164 HydrophobicContact CG1-CE2 4.29Å; V148-F164 HydrophobicContact CG1-CZ 4.2Å; V148-F164 HydrophobicContact CG2-CE2 3.88Å; V148-F164 HydrophobicContact CG2-CZ 3.77Å; L160-F164 HydrophobicContact CD2-CE2 4.3Å; L160-F164 VanDerWaalsContact O-CD2 3.29Å; L160-F164 WeakPolarHBondContact O-CD2 3.24Å; L160-F164 PolarHBondContact O-N 3.22Å; F164-P166 VanDerWaalsContact C-N 3.34Å; F164-C167 WeakPolarHBondContact O-CB 3.11Å; F164-C167 PolarHBondContact O-N 3.5Å; F164-C167 VanDerWaalsContact O-N 3.08Å; F164-I170 HydrophobicContact CB-CD1 3.8Å; F164-I190 HydrophobicContact CB-CD1 4.41Å; F164-I190 HydrophobicContact CD2-CD1 3.21Å; F164-I190 HydrophobicContact CE2-CD1 3.53Å; F164-I190 HydrophobicContact CG-CD1 3.89Å; F164-I190 HydrophobicContact CZ-CD1 4.41Å; F164-F192 HydrophobicContact CB-CE1 4.28Å; F164-F192 HydrophobicContact CB-CZ 4.05Å; F164-F192 HydrophobicContact CD1-CZ 4.43Å; F164-F192 HydrophobicContact CG-CZ 4.44Å; F164-A201 HydrophobicContact CD1-CB 4.07Å; F164-A201 HydrophobicContact CE1-CB 4.26Å; F164-I214 HydrophobicContact CE2-CD1 4.4Å; F164-I214 HydrophobicContact CZ-CD1 3.84Å; F164-V216 HydrophobicContact CE1-CG1 4.36Å; F164-V216 HydrophobicContact CE1-CG2 4.16Å; F164-V216 HydrophobicContact CZ-CG2 3.98Å
165S94.7Very high94.1Very high75 Ų7560.1 Ų60.152%0.52434%0.338SS..THydrogen-bonded Turntrans-52.9-38.4173.5-167.90000114.9R161 A162 C167 G168R161-S165 WeakPolarHBondContact O-CB 3.26Å; R161-S165 PolarHBondContact O-N 2.64Å; A162-S165 WeakPolarHBondContact O-CB 3.49Å; A162-S165 PolarHBondContact O-N 2.63Å; S165-C167 VanDerWaalsContact C-N 3.26Å; S165-C167 PolarHBondContact O-N 3.46Å; S165-G168 PolarHBondContact O-N 2.95Å
166P94.1Very high94.2Very high108 Ų10862.8 Ų62.870%0.70135%0.349SS*.THydrogen-bonded Turntrans-70.3-20.6177.826.7-35.1000113.6Y163 F164Y163-P166 VanDerWaalsContact O-CD 3.32Å; Y163-P166 WeakPolarHBondContact O-CD 3.44Å; F164-P166 VanDerWaalsContact C-N 3.34Å
167C93.3Very high94.1Very high18 Ų1863.4 Ų63.412%0.12235%0.353CS..THydrogen-bonded Turntrans-77.9-26.5176.8-55.80000112.3F164 S165 S197 A200 A201 L204F164-C167 WeakPolarHBondContact O-CB 3.11Å; F164-C167 PolarHBondContact O-N 3.5Å; F164-C167 VanDerWaalsContact O-N 3.08Å; S165-C167 VanDerWaalsContact C-N 3.26Å; S165-C167 PolarHBondContact O-N 3.46Å; C167-S197 WeakPolarHBondContact O-CA 3.31Å; C167-S197 WeakPolarHBondContact O-CB 3.31Å; C167-S197 PolarHBondContact O-OG 3.13Å; C167-A200 HydrophobicContact CB-CB 4.1Å; C167-A201 HydrophobicContact CB-CB 4.24Å; C167-L204 WeakPolarHBondContact SG-CD1 3.32Å
168G94.2Very high94.2Very high21 Ų2164.2 Ų64.222%0.21635%0.352CS..  trans155.4-172.9174.400000114.6S165S165-G168 PolarHBondContact O-N 2.95Å
169E95.3Very high94Very high139 Ų13970.2 Ų70.265%0.6536%0.364SS*.  trans-75.6127.3-178.1-173.9174.1-170.300111.8F192 A193E169-F192 WeakPolarHBondContact O-CA 3.15Å; E169-A193 HydrophobicContact CB-CB 4.09Å; E169-A193 HydrophobicContact CG-CB 4.36Å; E169-A193 PolarHBondContact O-N 3.36Å
170I95.6Very high93.9Very high8 Ų876.1 Ų76.14%0.04139%0.389CS..EExtended strand (participates in β ladder)trans-102.1122-176.7-61.8164.7000109.5R161 F164 V173 I190 F192R161-I170 HydrophobicContact CB-CD1 4.3Å; R161-I170 HydrophobicContact CG-CB 4.26Å; R161-I170 HydrophobicContact CG-CD1 3.74Å; R161-I170 HydrophobicContact CG-CG2 4.4Å; R161-I170 PolarHBondContact NH2-O 2.83Å; R161-I170 WeakPolarHBondContact O-CD1 3.33Å; F164-I170 HydrophobicContact CB-CD1 3.8Å; I170-V173 HydrophobicContact CG2-CG2 3.68Å; I170-I190 HydrophobicContact CD1-CG2 4.32Å; I170-I190 HydrophobicContact CG1-CG2 4.07Å; I170-I190 HydrophobicContact CG2-CG2 3.75Å; I170-F192 HydrophobicContact CD1-CE1 4.21Å; I170-F192 HydrophobicContact CG1-CD1 3.77Å; I170-F192 HydrophobicContact CG1-CE1 3.54Å; I170-F192 HydrophobicContact CG1-CZ 4.41Å
171H94.1Very high93.8Very high128 Ų12879 Ų7959%0.59341%0.409SS*.EExtended strand (participates in β ladder)trans-78.8-50173.2-101-95.2000111.5E191H171-E191 HydrophobicContact CB-CB 4.43Å; H171-E191 PolarHBondContact N-O 3.06Å
172R92.2Very high93.5Very high127 Ų12774.9 Ų74.948%0.47941%0.41SS..EExtended strand (participates in β ladder)trans-148.6141.2-172.3-172.7-178.1175.5170.54.4111.7T174 I190 E191R172-T174 PolarHBondContact NE-OG1 3.31Å; R172-I190 WeakPolarHBondContact O-CA 3.29Å; R172-E191 HydrophobicContact CB-CB 4.07Å; R172-E191 WeakPolarHBondContact CB-OE2 3.33Å; R172-E191 WeakPolarHBondContact CD-OE2 3.48Å; R172-E191 PolarHBondContact N-O 3.38Å; R172-E191 PolarHBondContact O-N 2.94Å
173V95.3Very high93.2Very high31 Ų3177.5 Ų77.519%0.18841%0.41CS..EExtended strand (participates in β ladder)trans-119.2126.2170.5-178.40000108.1A157 L160 R161 I170 I190A157-V173 HydrophobicContact CB-CB 4.2Å; A157-V173 HydrophobicContact CB-CG1 3.9Å; L160-V173 HydrophobicContact CB-CG1 4.29Å; L160-V173 HydrophobicContact CD1-CG1 4.11Å; R161-V173 HydrophobicContact CB-CG2 4.41Å; I170-V173 HydrophobicContact CG2-CG2 3.68Å; V173-I190 HydrophobicContact CG1-CG1 4.36Å; V173-I190 HydrophobicContact CG2-CG1 4.43Å; V173-I190 HydrophobicContact CG2-CG2 4.4Å
174T94.1Very high93.2Very high41 Ų4176.1 Ų76.125%0.25241%0.408SS..EExtended strand (participates in β ladder)trans-125107.8179.4-560000109.5R172 A188 Y189R172-T174 PolarHBondContact NE-OG1 3.31Å; T174-A188 CarbonylContact O-C 3.59Å; T174-A188 VanDerWaalsContact O-CA 3.31Å; T174-A188 WeakPolarHBondContact O-CA 3.44Å; T174-Y189 PolarHBondContact N-O 3.2Å; T174-Y189 PolarHBondContact O-N 3.29Å
175I94.4Very high93Very high51 Ų5181.9 Ų81.926%0.26243%0.433SS..EExtended strand (participates in β ladder)trans-86.6126.2172.9-57.3177.6000107.8G155 A157 L160 P184 A188G155-I175 WeakPolarHBondContact O-CD1 3.44Å; A157-I175 HydrophobicContact CB-CD1 4.15Å; L160-I175 HydrophobicContact CD1-CD1 4.17Å; L160-I175 HydrophobicContact CD1-CG1 4.13Å; I175-P184 HydrophobicContact CG2-CB 4.37Å; I175-A188 HydrophobicContact CG1-CB 4.15Å
176L92Very high93Very high67 Ų6778.7 Ų78.735%0.35141%0.413SS..EExtended strand (participates in β ladder)trans-86.8120.5178.4-157.681.7000110.7K185 Y187L176-K185 WeakPolarHBondContact O-CB 3.4Å; L176-K185 PolarHBondContact O-N 2.89Å; L176-Y187 HydrophobicContact CB-CD2 3.82Å; L176-Y187 HydrophobicContact CB-CE2 3.38Å; L176-Y187 HydrophobicContact CD2-CE2 3.37Å; L176-Y187 VanDerWaalsContact CD2-CZ 3.43Å; L176-Y187 WeakPolarHBondContact CD2-OH 3.17Å; L176-Y187 HydrophobicContact CG-CE2 3.96Å; L176-Y187 PolarHBondContact N-O 2.98Å; L176-Y187 VanDerWaalsContact N-O 3.13Å
177C92.2Very high93Very high59 Ų5975.3 Ų75.340%0.39939%0.386SS..EExtended strand (participates in β ladder)trans-100.1149.4170-56.50000110.6H183C177-H183 WeakPolarHBondContact CA-O 3.32Å
178D93Very high93.1Very high59 Ų5974.4 Ų74.432%0.31638%0.38SS..PPolyproline II helixtrans-64.8136.3168.6175.535.9000110F180 S181 G182 H183D178-F180 VanDerWaalsContact C-N 3.32Å; D178-F180 PolarHBondContact O-N 2.87Å; D178-S181 WeakPolarHBondContact CB-OG 3.47Å; D178-S181 WeakPolarHBondContact OD2-CB 3.45Å; D178-S181 PolarHBondContact OD2-N 3.01Å; D178-S181 VanDerWaalsContact OD2-N 3.09Å; D178-S181 PolarHBondContact OD2-OG 3.35Å; D178-G182 WeakPolarHBondContact O-CA 3.09Å; D178-G182 PolarHBondContact O-N 3.08Å; D178-H183 PolarHBondContact N-O 3.36Å
179K91.8Very high93.2Very high197 Ų19776.6 Ų76.686%0.85738%0.382SS*.THydrogen-bonded Turntrans-74.7-24.9-172.5-61.9-178.3-179.8-172.80112.6
180F91.7Very high93.2Very high197 Ų19770 Ų7086%0.86435%0.351SS*.THydrogen-bonded Turntrans-91.3-49.5-177.2-57.8-77.2000111.4D178D178-F180 VanDerWaalsContact C-N 3.32Å; D178-F180 PolarHBondContact O-N 2.87Å
181S91.4Very high93.2Very high60 Ų6071.5 Ų71.542%0.4236%0.358SS..THydrogen-bonded Turntrans-87.8-16.5-177.865.90000113.7D178 H183D178-S181 WeakPolarHBondContact CB-OG 3.47Å; D178-S181 WeakPolarHBondContact OD2-CB 3.45Å; D178-S181 PolarHBondContact OD2-N 3.01Å; D178-S181 VanDerWaalsContact OD2-N 3.09Å; D178-S181 PolarHBondContact OD2-OG 3.35Å; S181-H183 WeakPolarHBondContact CB-ND1 3.36Å; S181-H183 PolarHBondContact O-N 3.26Å; S181-H183 PolarHBondContact O-ND1 3.42Å; S181-H183 PolarHBondContact OG-N 2.91Å
182G89.7Confident93.3Very high52 Ų5265.6 Ų65.654%0.53633%0.331SS..  trans68.2-2.7-171.400000113.9D178D178-G182 WeakPolarHBondContact O-CA 3.09Å; D178-G182 PolarHBondContact O-N 3.08Å
183H89.4Confident93.4Very high128 Ų12860.9 Ų60.959%0.59332%0.319SS*.  trans-74.6139.3-177.3-71.168.4000110.1C177 D178 S181 K185C177-H183 WeakPolarHBondContact CA-O 3.32Å; D178-H183 PolarHBondContact N-O 3.36Å; S181-H183 WeakPolarHBondContact CB-ND1 3.36Å; S181-H183 PolarHBondContact O-N 3.26Å; S181-H183 PolarHBondContact O-ND1 3.42Å; S181-H183 PolarHBondContact OG-N 2.91Å; H183-K185 PolarHBondContact O-N 3.23Å
184P92.7Very high93.3Very high33 Ų3361.7 Ų61.721%0.21433%0.326CS..EExtended strand (participates in β ladder)trans-62.7136.817719.8-24.6000109.9Y153 I175 G186Y153-P184 HydrophobicContact CD1-CB 4.4Å; Y153-P184 HydrophobicContact CD1-CG 4.04Å; Y153-P184 WeakPolarHBondContact CD1-O 3.4Å; Y153-P184 WeakPolarHBondContact CE1-O 3.46Å; Y153-P184 HydrophobicContact CG-CG 4.5Å; Y153-P184 WeakPolarHBondContact O-CG 3.43Å; I175-P184 HydrophobicContact CG2-CB 4.37Å; P184-G186 PolarHBondContact O-N 3.31Å
185K92.3Very high93.3Very high120 Ų12065 Ų6552%0.52234%0.339SS..EExtended strand (participates in β ladder)trans-82.41.4-175.7-155.1166.7159-160.80113.2L176 H183 Y187L176-K185 WeakPolarHBondContact O-CB 3.4Å; L176-K185 PolarHBondContact O-N 2.89Å; H183-K185 PolarHBondContact O-N 3.23Å; K185-Y187 HydrophobicContact CB-CD1 3.9Å; K185-Y187 HydrophobicContact CB-CE1 3.53Å; K185-Y187 HydrophobicContact CD-CD1 4.44Å; K185-Y187 HydrophobicContact CD-CE1 3.34Å; K185-Y187 VanDerWaalsContact CD-OH 3.29Å; K185-Y187 WeakPolarHBondContact CD-OH 3.36Å; K185-Y187 WeakPolarHBondContact CE-OH 3.44Å; K185-Y187 HydrophobicContact CG-CD1 4Å; K185-Y187 HydrophobicContact CG-CE1 3.33Å; K185-Y187 PolarHBondContact NZ-OH 2.85Å
186G93.5Very high93.3Very high9 Ų968 Ų689%0.09336%0.355CS..EExtended strand (participates in β ladder)trans78.323.7-179.700000113.7N150 V151 P184N150-G186 PolarHBondContact N-O 2.94Å; V151-G186 PolarHBondContact N-O 3.5Å; V151-G186 WeakPolarHBondContact O-CA 3.46Å; P184-G186 PolarHBondContact O-N 3.31Å
187Y94.6Very high93.4Very high36 Ų3665.4 Ų65.414%0.14134%0.343CS..EExtended strand (participates in β ladder)trans-145.4153.5172.258.9-99000112.8Y147 V148 L176 K185 Y189Y147-Y187 HydrophobicContact CE2-CD2 4.15Å; Y147-Y187 HydrophobicContact CE2-CG 4.03Å; V148-Y187 CarbonylContact O-C 3.55Å; V148-Y187 WeakPolarHBondContact O-CA 3.38Å; V148-Y187 VanDerWaalsContact O-CB 3.31Å; V148-Y187 WeakPolarHBondContact O-CB 3.34Å; L176-Y187 HydrophobicContact CB-CD2 3.82Å; L176-Y187 HydrophobicContact CB-CE2 3.38Å; L176-Y187 HydrophobicContact CD2-CE2 3.37Å; L176-Y187 VanDerWaalsContact CD2-CZ 3.43Å; L176-Y187 WeakPolarHBondContact CD2-OH 3.17Å; L176-Y187 HydrophobicContact CG-CE2 3.96Å; L176-Y187 PolarHBondContact N-O 2.98Å; L176-Y187 VanDerWaalsContact N-O 3.13Å; K185-Y187 HydrophobicContact CB-CD1 3.9Å; K185-Y187 HydrophobicContact CB-CE1 3.53Å; K185-Y187 HydrophobicContact CD-CD1 4.44Å; K185-Y187 HydrophobicContact CD-CE1 3.34Å; K185-Y187 VanDerWaalsContact CD-OH 3.29Å; K185-Y187 WeakPolarHBondContact CD-OH 3.36Å; K185-Y187 WeakPolarHBondContact CE-OH 3.44Å; K185-Y187 HydrophobicContact CG-CD1 4Å; K185-Y187 HydrophobicContact CG-CE1 3.33Å; K185-Y187 PolarHBondContact NZ-OH 2.85Å; Y187-Y189 HydrophobicContact CD2-CE2 4.38Å; Y187-Y189 HydrophobicContact CE2-CE2 4.32Å
188A95.4Very high93.6Very high0 Ų063 Ų630%033%0.327CS..EExtended strand (participates in β ladder)trans-137.4155.9-178.400000111.1V148 L160 T174 I175V148-A188 PolarHBondContact N-O 2.89Å; V148-A188 PolarHBondContact O-N 3.09Å; L160-A188 HydrophobicContact CD1-CB 3.74Å; T174-A188 CarbonylContact O-C 3.59Å; T174-A188 VanDerWaalsContact O-CA 3.31Å; T174-A188 WeakPolarHBondContact O-CA 3.44Å; I175-A188 HydrophobicContact CG1-CB 4.15Å
189Y95.8Very high93.7Very high67 Ų6766 Ų6626%0.26334%0.338SS..EExtended strand (participates in β ladder)trans-112.5135.7167.8-62.9-74.7000109.4V146 Y147 T174 Y187 K219V146-Y189 WeakPolarHBondContact O-CA 3.39Å; Y147-Y189 HydrophobicContact CD2-CD1 4.37Å; Y147-Y189 AromaticContact CD2-CE1 3.7Å; Y147-Y189 HydrophobicContact CD2-CE1 3.7Å; Y147-Y189 HydrophobicContact CG-CE1 4.4Å; T174-Y189 PolarHBondContact N-O 3.2Å; T174-Y189 PolarHBondContact O-N 3.29Å; Y187-Y189 HydrophobicContact CD2-CE2 4.38Å; Y187-Y189 HydrophobicContact CE2-CE2 4.32Å; Y189-K219 HydrophobicContact CD1-CD 3.89Å; Y189-K219 HydrophobicContact CD1-CG 3.98Å; Y189-K219 HydrophobicContact CE1-CD 4.29Å; Y189-K219 HydrophobicContact CE1-CG 4.01Å
190I95.8Very high93.8Very high0 Ų058.1 Ų58.10%031%0.31CS..EExtended strand (participates in β ladder)trans-122.2119.4178.2-56.7179.9000107.6S145 V146 V148 L160 F164 I170 R172 V173 F192S145-I190 CarbonylContact C-O 3.58Å; S145-I190 WeakPolarHBondContact CA-O 3.4Å; V146-I190 PolarHBondContact N-O 3.35Å; V146-I190 PolarHBondContact O-N 2.86Å; V148-I190 HydrophobicContact CG2-CD1 3.85Å; V148-I190 HydrophobicContact CG2-CG1 4.27Å; L160-I190 HydrophobicContact CB-CD1 4.43Å; F164-I190 HydrophobicContact CB-CD1 4.41Å; F164-I190 HydrophobicContact CD2-CD1 3.21Å; F164-I190 HydrophobicContact CE2-CD1 3.53Å; F164-I190 HydrophobicContact CG-CD1 3.89Å; F164-I190 HydrophobicContact CZ-CD1 4.41Å; I170-I190 HydrophobicContact CD1-CG2 4.32Å; I170-I190 HydrophobicContact CG1-CG2 4.07Å; I170-I190 HydrophobicContact CG2-CG2 3.75Å; R172-I190 WeakPolarHBondContact O-CA 3.29Å; V173-I190 HydrophobicContact CG1-CG1 4.36Å; V173-I190 HydrophobicContact CG2-CG1 4.43Å; V173-I190 HydrophobicContact CG2-CG2 4.4Å; I190-F192 HydrophobicContact CB-CE2 4.16Å; I190-F192 HydrophobicContact CB-CZ 4.46Å; I190-F192 HydrophobicContact CG2-CD2 4.23Å; I190-F192 HydrophobicContact CG2-CE1 4.18Å; I190-F192 HydrophobicContact CG2-CE2 3.72Å; I190-F192 HydrophobicContact CG2-CZ 3.7Å
191E95.5Very high94Very high39 Ų3948.7 Ų48.718%0.18227%0.269CS..EExtended strand (participates in β ladder)trans-93.6119.7174.2-74.9162.6-155.200108.6S145 H171 R172S145-E191 WeakPolarHBondContact OG-CG 2.98Å; H171-E191 HydrophobicContact CB-CB 4.43Å; H171-E191 PolarHBondContact N-O 3.06Å; R172-E191 HydrophobicContact CB-CB 4.07Å; R172-E191 WeakPolarHBondContact CB-OE2 3.33Å; R172-E191 WeakPolarHBondContact CD-OE2 3.48Å; R172-E191 PolarHBondContact N-O 3.38Å; R172-E191 PolarHBondContact O-N 2.94Å
192F96.4Very high94.2Very high4 Ų448 Ų482%0.01826%0.261CS..EExtended strand (participates in β ladder)trans-96.1160.1175.6-66.9-84.7000111.5R144 V146 F164 E169 I170 I190 S194 V198 A201R144-F192 PolarHBondContact O-N 3.42Å; V146-F192 HydrophobicContact CB-CE2 4Å; V146-F192 HydrophobicContact CG2-CD2 4.06Å; V146-F192 HydrophobicContact CG2-CE2 3.62Å; F164-F192 HydrophobicContact CB-CE1 4.28Å; F164-F192 HydrophobicContact CB-CZ 4.05Å; F164-F192 HydrophobicContact CD1-CZ 4.43Å; F164-F192 HydrophobicContact CG-CZ 4.44Å; E169-F192 WeakPolarHBondContact O-CA 3.15Å; I170-F192 HydrophobicContact CD1-CE1 4.21Å; I170-F192 HydrophobicContact CG1-CD1 3.77Å; I170-F192 HydrophobicContact CG1-CE1 3.54Å; I170-F192 HydrophobicContact CG1-CZ 4.41Å; I190-F192 HydrophobicContact CB-CE2 4.16Å; I190-F192 HydrophobicContact CB-CZ 4.46Å; I190-F192 HydrophobicContact CG2-CD2 4.23Å; I190-F192 HydrophobicContact CG2-CE1 4.18Å; I190-F192 HydrophobicContact CG2-CE2 3.72Å; I190-F192 HydrophobicContact CG2-CZ 3.7Å; F192-S194 VanDerWaalsContact C-N 3.34Å; F192-V198 HydrophobicContact CD2-CG2 4.23Å; F192-A201 HydrophobicContact CE2-CB 4.01Å; F192-A201 HydrophobicContact CZ-CB 3.9Å
193A94.3Very high94.4Very high28 Ų2852.8 Ų52.823%0.23127%0.27CS..SBendtrans-66.5-38.1172.300000112R144 E169R144-A193 WeakPolarHBondContact CD-O 3.16Å; R144-A193 PolarHBondContact NH1-O 3.2Å; E169-A193 HydrophobicContact CB-CB 4.09Å; E169-A193 HydrophobicContact CG-CB 4.36Å; E169-A193 PolarHBondContact O-N 3.36Å
194S93.8Very high94.6Very high48 Ų4849.5 Ų49.534%0.33626%0.256SS..SBendtrans-121.3148.7-174.1-178.50000112.3F192 N196 S197F192-S194 VanDerWaalsContact C-N 3.34Å; S194-N196 VanDerWaalsContact C-N 3.29Å; S194-N196 PolarHBondContact OG-N 3.03Å; S194-S197 PolarHBondContact O-N 3.05Å
195Q93Very high94.7Very high111 Ų11151.6 Ų51.652%0.51927%0.266SS..Hα-helixtrans-70.7-25.7173.4-168.3173.67.600112.3R144 S197 V198 Q199R144-Q195 HydrophobicContact CG-CB 4.29Å; Q195-S197 PolarHBondContact O-N 3.43Å; Q195-V198 VanDerWaalsContact O-CB 3.26Å; Q195-V198 WeakPolarHBondContact O-CB 3.43Å; Q195-V198 PolarHBondContact O-N 3.12Å; Q195-V198 VanDerWaalsContact O-N 3.12Å; Q195-Q199 PolarHBondContact O-N 3.04Å
196N94.5Very high94.8Very high114 Ų11453 Ų5361%0.6128%0.275SS*.Hα-helixtrans-64.3-34.7176.4-64.9-10.7000111.1S194 V198 Q199 A200S194-N196 VanDerWaalsContact C-N 3.29Å; S194-N196 PolarHBondContact OG-N 3.03Å; N196-V198 PolarHBondContact O-N 3.39Å; N196-Q199 WeakPolarHBondContact O-CB 3.36Å; N196-Q199 PolarHBondContact O-N 3.47Å; N196-Q199 VanDerWaalsContact O-N 3.14Å; N196-A200 PolarHBondContact O-N 3.23Å; N196-A200 VanDerWaalsContact O-N 3.15Å
197S95.3Very high94.8Very high13 Ų1353.7 Ų53.79%0.09128%0.278CS..Hα-helixtrans-65.5-28.5176.2-55.50000112.7C167 S194 Q195 A201C167-S197 WeakPolarHBondContact O-CA 3.31Å; C167-S197 WeakPolarHBondContact O-CB 3.31Å; C167-S197 PolarHBondContact O-OG 3.13Å; S194-S197 PolarHBondContact O-N 3.05Å; Q195-S197 PolarHBondContact O-N 3.43Å; S197-A201 VanDerWaalsContact O-CB 3.27Å; S197-A201 WeakPolarHBondContact O-CB 3.45Å; S197-A201 PolarHBondContact O-N 3.49Å
198V95.1Very high94.8Very high9 Ų956.7 Ų56.76%0.05530%0.3CS..Hα-helixtrans-63.6-44172.7178.70000110.2R144 V146 F192 Q195 N196 A201 V202 P218R144-V198 WeakPolarHBondContact O-CG2 3.11Å; V146-V198 HydrophobicContact CG2-CB 4.03Å; V146-V198 HydrophobicContact CG2-CG1 3.6Å; V146-V198 HydrophobicContact CG2-CG2 4.15Å; F192-V198 HydrophobicContact CD2-CG2 4.23Å; Q195-V198 VanDerWaalsContact O-CB 3.26Å; Q195-V198 WeakPolarHBondContact O-CB 3.43Å; Q195-V198 PolarHBondContact O-N 3.12Å; Q195-V198 VanDerWaalsContact O-N 3.12Å; N196-V198 PolarHBondContact O-N 3.39Å; V198-A201 PolarHBondContact O-N 3.45Å; V198-V202 VanDerWaalsContact O-CG2 3.24Å; V198-V202 WeakPolarHBondContact O-CG2 3.41Å; V198-V202 PolarHBondContact O-N 3.26Å; V198-P218 HydrophobicContact CG1-CB 4.21Å
199Q94.9Very high94.7Very high121 Ų12157.3 Ų57.357%0.56530%0.303SS*.Hα-helixtrans-64.4-47.8179.2-64178.7-9.500110.9Q195 N196 A201 V202 E203Q195-Q199 PolarHBondContact O-N 3.04Å; N196-Q199 WeakPolarHBondContact O-CB 3.36Å; N196-Q199 PolarHBondContact O-N 3.47Å; N196-Q199 VanDerWaalsContact O-N 3.14Å; Q199-A201 VanDerWaalsContact C-N 3.28Å; Q199-A201 PolarHBondContact O-N 3.25Å; Q199-V202 WeakPolarHBondContact O-CB 3.4Å; Q199-V202 PolarHBondContact O-N 2.72Å; Q199-V202 VanDerWaalsContact O-N 3.09Å; Q199-E203 PolarHBondContact O-N 2.77Å; Q199-E203 VanDerWaalsContact O-N 3.08Å
200A95.3Very high94.4Very high31 Ų3160.1 Ų60.126%0.25631%0.313SS..Hα-helixtrans-61.2-34.7175.800000112.9C167 N196 E203C167-A200 HydrophobicContact CB-CB 4.1Å; N196-A200 PolarHBondContact O-N 3.23Å; N196-A200 VanDerWaalsContact O-N 3.15Å; A200-E203 PolarHBondContact O-N 3.44Å
201A95.4Very high94.3Very high0 Ų063.8 Ų63.80%035%0.351CS..Hα-helixtrans-70.5-36.3174.900000112V146 F164 C167 F192 S197 V198 Q199 E203 L204 V216V146-A201 HydrophobicContact CG2-CB 4.06Å; F164-A201 HydrophobicContact CD1-CB 4.07Å; F164-A201 HydrophobicContact CE1-CB 4.26Å; C167-A201 HydrophobicContact CB-CB 4.24Å; F192-A201 HydrophobicContact CE2-CB 4.01Å; F192-A201 HydrophobicContact CZ-CB 3.9Å; S197-A201 VanDerWaalsContact O-CB 3.27Å; S197-A201 WeakPolarHBondContact O-CB 3.45Å; S197-A201 PolarHBondContact O-N 3.49Å; V198-A201 PolarHBondContact O-N 3.45Å; Q199-A201 VanDerWaalsContact C-N 3.28Å; Q199-A201 PolarHBondContact O-N 3.25Å; A201-E203 VanDerWaalsContact C-N 3.26Å; A201-E203 PolarHBondContact O-N 3.45Å; A201-L204 WeakPolarHBondContact O-CB 3.4Å; A201-L204 PolarHBondContact O-N 3.39Å; A201-L204 VanDerWaalsContact O-N 3.07Å; A201-V216 VanDerWaalsContact O-CG1 3.27Å; A201-V216 WeakPolarHBondContact O-CG1 3.33Å
202V95.4Very high94.2Very high44 Ų4466 Ų6627%0.26736%0.357SS..Hα-helixtrans-65.1-31.2175.1171.60000111.3V198 Q199 L204 D205V198-V202 VanDerWaalsContact O-CG2 3.24Å; V198-V202 WeakPolarHBondContact O-CG2 3.41Å; V198-V202 PolarHBondContact O-N 3.26Å; Q199-V202 WeakPolarHBondContact O-CB 3.4Å; Q199-V202 PolarHBondContact O-N 2.72Å; Q199-V202 VanDerWaalsContact O-N 3.09Å; V202-L204 PolarHBondContact O-N 2.99Å; V202-D205 VanDerWaalsContact O-CB 3.28Å; V202-D205 WeakPolarHBondContact O-CB 3.4Å; V202-D205 PolarHBondContact O-N 3.02Å; V202-D205 VanDerWaalsContact O-N 3.07Å
203E94.9Very high94.2Very high154 Ų15469.4 Ų69.472%0.7238%0.378SS*.THydrogen-bonded Turntrans-66.4-17.2172.2-66.3172.1-174.800113.6Q199 A200 A201 D205Q199-E203 PolarHBondContact O-N 2.77Å; Q199-E203 VanDerWaalsContact O-N 3.08Å; A200-E203 PolarHBondContact O-N 3.44Å; A201-E203 VanDerWaalsContact C-N 3.26Å; A201-E203 PolarHBondContact O-N 3.45Å; E203-D205 PolarHBondContact O-N 2.99Å
204L92.6Very high94.3Very high58 Ų5868.1 Ų68.130%0.30437%0.368SS..THydrogen-bonded Turntrans-8920.1171.1-62.2-173.8000112.5Y163 C167 A201 V202 S207Y163-L204 HydrophobicContact CE1-CD1 4.37Å; C167-L204 WeakPolarHBondContact SG-CD1 3.32Å; A201-L204 WeakPolarHBondContact O-CB 3.4Å; A201-L204 PolarHBondContact O-N 3.39Å; A201-L204 VanDerWaalsContact O-N 3.07Å; V202-L204 PolarHBondContact O-N 2.99Å; L204-S207 VanDerWaalsContact O-CB 3.28Å; L204-S207 WeakPolarHBondContact O-CB 3.18Å; L204-S207 PolarHBondContact O-OG 3.16Å
205D94.8Very high94.4Very high78 Ų7871.8 Ų71.842%0.41738%0.377SS..THydrogen-bonded Turntrans-61.1150.6170.976.3-71.8000111.4V202 E203 S207 V216V202-D205 VanDerWaalsContact O-CB 3.28Å; V202-D205 WeakPolarHBondContact O-CB 3.4Å; V202-D205 PolarHBondContact O-N 3.02Å; V202-D205 VanDerWaalsContact O-N 3.07Å; E203-D205 PolarHBondContact O-N 2.99Å; D205-S207 PolarHBondContact O-N 3.2Å; D205-V216 HydrophobicContact CB-CB 4.33Å
206E94.1Very high94.6Very high150 Ų15066.6 Ų66.670%0.70135%0.353SS*.THydrogen-bonded Turntrans60.516.2-179.3-55.5-173.3164.900115.3V213 I214E206-V213 HydrophobicContact CB-CG1 4.11Å; E206-V213 WeakPolarHBondContact O-CG1 3.22Å; E206-I214 WeakPolarHBondContact CA-O 3.43Å; E206-I214 PolarHBondContact N-O 3.41Å; E206-I214 VanDerWaalsContact N-O 3.11Å
207S94.1Very high94.6Very high22 Ų2264.6 Ų64.615%0.15434%0.342CS..  trans-77.8159.7174.664.60000112.3Y163 L204 D205 V213 I214Y163-S207 WeakPolarHBondContact OH-CB 3.16Å; Y163-S207 PolarHBondContact OH-OG 2.87Å; L204-S207 VanDerWaalsContact O-CB 3.28Å; L204-S207 WeakPolarHBondContact O-CB 3.18Å; L204-S207 PolarHBondContact O-OG 3.16Å; D205-S207 PolarHBondContact O-N 3.2Å; S207-V213 CarbonylContact O-C 3.51Å; S207-V213 WeakPolarHBondContact O-CA 3.37Å; S207-I214 VanDerWaalsContact O-CG1 3.29Å; S207-I214 WeakPolarHBondContact O-CG1 3.36Å; S207-I214 PolarHBondContact O-N 3.47Å
208T94.1Very high94.6Very high99 Ų9967.5 Ų67.561%0.60736%0.361SS*.EExtended strand (participates in β ladder)trans-97121.3-175.349.90000111.8R212 V213T208-R212 CarbonylContact C-O 3.51Å; T208-R212 WeakPolarHBondContact CA-O 3.37Å; T208-V213 HydrophobicContact CG2-CG2 4.03Å
209F93.3Very high94.5Very high14 Ų1469.3 Ų69.36%0.06137%0.368CS..EExtended strand (participates in β ladder)trans-122.1120.5175.3178.8-99.8000109.6V151 E159 L160 Y163 G211 R212 I214V151-F209 HydrophobicContact CG1-CD1 4.4Å; V151-F209 HydrophobicContact CG1-CE1 4.1Å; E159-F209 HydrophobicContact CB-CE2 4.04Å; E159-F209 HydrophobicContact CB-CZ 3.82Å; L160-F209 HydrophobicContact CD2-CE1 4.24Å; L160-F209 HydrophobicContact CD2-CE2 4.36Å; L160-F209 HydrophobicContact CD2-CZ 4.09Å; L160-F209 HydrophobicContact CG-CZ 4.46Å; Y163-F209 HydrophobicContact CD2-CD2 4.06Å; Y163-F209 HydrophobicContact CG-CD2 4.17Å; F209-G211 PolarHBondContact O-N 3.36Å; F209-G211 VanDerWaalsContact O-N 3.12Å; F209-R212 PolarHBondContact N-O 3.5Å; F209-R212 PolarHBondContact O-N 3.06Å; F209-I214 HydrophobicContact CB-CD1 4.4Å; F209-I214 HydrophobicContact CB-CG1 4.43Å; F209-I214 HydrophobicContact CB-CG2 3.68Å; F209-I214 HydrophobicContact CG-CG2 4.45Å
210R90.5Very high94.2Very high126 Ų12672.5 Ų72.548%0.47538%0.375SS..THydrogen-bonded Turntrans49.836.5-177.5-61-176.170.8156.5-8.5113.8D152 G154 E159 R212D152-R210 HydrophobicContact CB-CB 4.17Å; D152-R210 IonicContact OD2-CZ 3.89Å; D152-R210 IonicContact OD2-NE 2.98Å; D152-R210 IonicContact OD2-NH2 3.18Å; G154-R210 VanDerWaalsContact C-NH1 3.29Å; G154-R210 PolarHBondContact O-NH1 2.92Å; E159-R210 IonicContact OE1-NH1 2.75Å; E159-R210 PolarHBondContact OE1-NH1 3.33Å; E159-R210 WeakPolarHBondContact OE2-CD 3.44Å; E159-R210 IonicContact OE2-CZ 3.98Å; E159-R210 IonicContact OE2-NE 3.72Å; E159-R210 IonicContact OE2-NH1 3.84Å; E159-R210 PolarHBondContact OE2-NH1 3.39Å; R210-R212 VanDerWaalsContact C-N 3.32Å
211G92.3Very high93.7Very high77 Ų7772.1 Ų72.179%0.79437%0.369SS*.THydrogen-bonded Turntrans79.48.4-179.500000115.1F209F209-G211 PolarHBondContact O-N 3.36Å; F209-G211 VanDerWaalsContact O-N 3.12Å
212R94Very high92.8Very high84 Ų8479.4 Ų79.432%0.31741%0.408SS..EExtended strand (participates in β ladder)trans-116141.3172.9-61.5-174.6-174.4-178.84110.5D152 T208 F209 R210 I214D152-R212 IonicContact OD1-CZ 3Å; D152-R212 IonicContact OD1-NE 2.63Å; D152-R212 PolarHBondContact OD1-NE 2.73Å; D152-R212 IonicContact OD1-NH1 3.21Å; D152-R212 IonicContact OD1-NH2 3.52Å; D152-R212 PolarHBondContact OD1-NH2 3.17Å; T208-R212 CarbonylContact C-O 3.51Å; T208-R212 WeakPolarHBondContact CA-O 3.37Å; F209-R212 PolarHBondContact N-O 3.5Å; F209-R212 PolarHBondContact O-N 3.06Å; R210-R212 VanDerWaalsContact C-N 3.32Å; R212-I214 PolarHBondContact O-N 2.94Å
213V96.3Very high91.7Very high77 Ų7781.3 Ų81.347%0.46741%0.413SS..EExtended strand (participates in β ladder)trans-76.6117.3173.8176.70000108.8N150 E206 S207 T208N150-V213 PolarHBondContact ND2-O 3.46Å; E206-V213 HydrophobicContact CB-CG1 4.11Å; E206-V213 WeakPolarHBondContact O-CG1 3.22Å; S207-V213 CarbonylContact O-C 3.51Å; S207-V213 WeakPolarHBondContact O-CA 3.37Å; T208-V213 HydrophobicContact CG2-CG2 4.03Å
214I96.1Very high90.3Very high1 Ų180.3 Ų80.31%0.00542%0.42CS..  trans-87.9150.817955.1163.8000111.1V148 G149 Y163 F164 E206 S207 F209 R212 V216V148-I214 HydrophobicContact CG1-CB 4.23Å; V148-I214 HydrophobicContact CG1-CD1 4.1Å; V148-I214 HydrophobicContact CG1-CG2 4.49Å; G149-I214 WeakPolarHBondContact O-CA 3.46Å; Y163-I214 HydrophobicContact CD1-CD1 4.34Å; Y163-I214 HydrophobicContact CE1-CD1 3.73Å; F164-I214 HydrophobicContact CE2-CD1 4.4Å; F164-I214 HydrophobicContact CZ-CD1 3.84Å; E206-I214 WeakPolarHBondContact CA-O 3.43Å; E206-I214 PolarHBondContact N-O 3.41Å; E206-I214 VanDerWaalsContact N-O 3.11Å; S207-I214 VanDerWaalsContact O-CG1 3.29Å; S207-I214 WeakPolarHBondContact O-CG1 3.36Å; S207-I214 PolarHBondContact O-N 3.47Å; F209-I214 HydrophobicContact CB-CD1 4.4Å; F209-I214 HydrophobicContact CB-CG1 4.43Å; F209-I214 HydrophobicContact CB-CG2 3.68Å; F209-I214 HydrophobicContact CG-CG2 4.45Å; R212-I214 PolarHBondContact O-N 2.94Å; I214-V216 HydrophobicContact CD1-CG2 3.94Å; I214-V216 HydrophobicContact CG1-CG2 4.35Å
215K96.5Very high89Confident124 Ų12481.6 Ų81.654%0.53945%0.447SS..EExtended strand (participates in β ladder)trans-108.6116.6175.3-174.5171.5-171172.70109.7V148 G149 L217V148-K215 CarbonylContact C-O 3.57Å; V148-K215 WeakPolarHBondContact CA-O 3.43Å; G149-K215 PolarHBondContact N-O 2.93Å; G149-K215 PolarHBondContact O-N 3.35Å; K215-L217 HydrophobicContact CD-CD1 4.46Å; K215-L217 HydrophobicContact CG-CG 4.35Å
216V96.6Very high87.6Confident2 Ų283.5 Ų83.51%0.01246%0.456CS..EExtended strand (participates in β ladder)trans-107.3126.1-179.1-167.40000109.3V146 Y147 F164 A201 D205 I214V146-V216 HydrophobicContact CG1-CG1 3.19Å; Y147-V216 WeakPolarHBondContact O-CA 3.46Å; F164-V216 HydrophobicContact CE1-CG1 4.36Å; F164-V216 HydrophobicContact CE1-CG2 4.16Å; F164-V216 HydrophobicContact CZ-CG2 3.98Å; A201-V216 VanDerWaalsContact O-CG1 3.27Å; A201-V216 WeakPolarHBondContact O-CG1 3.33Å; D205-V216 HydrophobicContact CB-CB 4.33Å; I214-V216 HydrophobicContact CD1-CG2 3.94Å; I214-V216 HydrophobicContact CG1-CG2 4.35Å
217L95.7Very high86.1Confident73 Ų7380.6 Ų80.638%0.38245%0.452SS..EExtended strand (participates in β ladder)trans-140.4149.8178.5-67.5176.7000109.9V146 Y147 K215 K219V146-L217 CarbonylContact C-O 3.55Å; V146-L217 WeakPolarHBondContact CG1-O 3.23Å; Y147-L217 WeakPolarHBondContact CA-O 3.5Å; Y147-L217 HydrophobicContact CD1-CB 4.23Å; Y147-L217 HydrophobicContact CD1-CD1 4.42Å; Y147-L217 PolarHBondContact N-O 2.72Å; Y147-L217 PolarHBondContact O-N 3.1Å; K215-L217 HydrophobicContact CD-CD1 4.46Å; K215-L217 HydrophobicContact CG-CG 4.35Å; L217-K219 PolarHBondContact O-N 3.24Å
218P94.8Very high84.5Confident73 Ų7383.9 Ų83.947%0.47448%0.475SS..EExtended strand (participates in β ladder)trans-61140.5170.326.3-32.7000110.6V198V198-P218 HydrophobicContact CG1-CB 4.21Å
219K94Very high82.9Confident47 Ų4781.4 Ų81.420%0.20446%0.46CS..PPolyproline II helixtrans-66.5138.2179.2-173.6-177.9-178.4-172.40109.6D142 S145 Y189 L217D142-K219 HydrophobicContact CB-CD 4.3Å; D142-K219 WeakPolarHBondContact OD1-CE 3.49Å; D142-K219 IonicContact OD1-NZ 3.69Å; D142-K219 PolarHBondContact OD1-NZ 2.79Å; S145-K219 WeakPolarHBondContact O-CB 3.28Å; S145-K219 PolarHBondContact O-N 2.82Å; Y189-K219 HydrophobicContact CD1-CD 3.89Å; Y189-K219 HydrophobicContact CD1-CG 3.98Å; Y189-K219 HydrophobicContact CE1-CD 4.29Å; Y189-K219 HydrophobicContact CE1-CG 4.01Å; L217-K219 PolarHBondContact O-N 3.24Å
220R87.7Confident81.1Confident189 Ų18988.8 Ų88.871%0.71350%0.5SS*.PPolyproline II helixtrans-82.7127.6173.2-67.3-178.7176.2-175.4-4.3109.7
221T84.9Confident79.5Confident22 Ų2292.7 Ų92.714%0.13552%0.515CS..PPolyproline II helixtrans-70.3123.6169.750.70000109.6V139 D142 F223V139-T221 HydrophobicContact CG1-CG2 4.17Å; D142-T221 HydrophobicContact CB-CG2 3.66Å; T221-F223 HydrophobicContact CG2-CE2 4.5Å; T221-F223 PolarHBondContact O-N 3.1Å; T221-F223 WeakPolarHBondContact OG1-CE2 3.29Å
222N75.6Confident77.6Confident153 Ų15392.7 Ų92.782%0.81852%0.515SS*.  trans-87.396.6171.4-107.6-40.1000109P224N222-P224 WeakPolarHBondContact O-CD 3.44Å
223F73.4Confident75.9Confident84 Ų8492 Ų9237%0.36853%0.534SS..  trans-81.3116.2166.7-68.5-75.2000108.6V139 T221 G225 I226V139-F223 HydrophobicContact CG1-CE1 3.93Å; V139-F223 HydrophobicContact CG1-CZ 3.7Å; V139-F223 HydrophobicContact CG2-CD1 4.45Å; V139-F223 HydrophobicContact CG2-CE1 3.8Å; V139-F223 HydrophobicContact CG2-CZ 4.31Å; T221-F223 HydrophobicContact CG2-CE2 4.5Å; T221-F223 PolarHBondContact O-N 3.1Å; T221-F223 WeakPolarHBondContact OG1-CE2 3.29Å; F223-G225 PolarHBondContact O-N 3.32Å; F223-G225 VanDerWaalsContact O-N 3.16Å; F223-I226 HydrophobicContact CB-CD1 3.96Å; F223-I226 HydrophobicContact CB-CG1 3.6Å; F223-I226 HydrophobicContact CD2-CD1 4.38Å; F223-I226 HydrophobicContact CG-CD1 4.31Å; F223-I226 HydrophobicContact CG-CG1 4.47Å; F223-I226 PolarHBondContact O-N 2.95Å
224P64.7Low73.7Confident133 Ų13395.1 Ų95.186%0.86455%0.547SS*.THydrogen-bonded Turntrans-61.9121176.325.6-32.1000109.1N222N222-P224 WeakPolarHBondContact O-CD 3.44Å
225G65.9Low71.4Confident85 Ų85105.3 Ų105.388%0.87659%0.585SS**THydrogen-bonded Turntrans105.3-11.4176.100000116.3F223F223-G225 PolarHBondContact O-N 3.32Å; F223-G225 VanDerWaalsContact O-N 3.16Å
226I64.9Low69.2Low119 Ų119104.3 Ų104.361%0.6159%0.59SS**  trans-132.2105.1172.551.5159.6000110.4F223 S228F223-I226 HydrophobicContact CB-CD1 3.96Å; F223-I226 HydrophobicContact CB-CG1 3.6Å; F223-I226 HydrophobicContact CD2-CD1 4.38Å; F223-I226 HydrophobicContact CG-CD1 4.31Å; F223-I226 HydrophobicContact CG-CG1 4.47Å; F223-I226 PolarHBondContact O-N 2.95Å; I226-S228 PolarHBondContact O-N 3.46Å
227S63Low66.9Low88 Ų88111.8 Ų111.862%0.61562%0.624SS**  trans-67.6103.6170.9161.50000108.8T229S227-T229 PolarHBondContact O-N 2.99Å; S227-T229 PolarHBondContact OG-N 3.23Å; S227-T229 PolarHBondContact OG-O 3.07Å; S227-T229 PolarHBondContact OG-OG1 3.33Å
228S60.1Low64.6Low92 Ų92116.3 Ų116.364%0.64365%0.648SS**  trans-64.3-13.2170.8169.50000112.9I226 D230I226-S228 PolarHBondContact O-N 3.46Å; S228-D230 PolarHBondContact O-N 3.46Å
229T61.5Low62.5Low47 Ų47115.9 Ų115.929%0.28866%0.657SS.*SBendtrans-72.2115.1166.126.40000109.6S227 R231S227-T229 PolarHBondContact O-N 2.99Å; S227-T229 PolarHBondContact OG-N 3.23Å; S227-T229 PolarHBondContact OG-O 3.07Å; S227-T229 PolarHBondContact OG-OG1 3.33Å; T229-R231 PolarHBondContact O-N 3.45Å
230D55.9Low60.5Low169 Ų169119.7 Ų119.790%0.90469%0.689SS**  trans-6045.3158.7-69.6-62.6000112.3S228 G232S228-D230 PolarHBondContact O-N 3.46Å; D230-G232 PolarHBondContact O-N 2.8Å
231R55.7Low58.7Low207 Ų207122.6 Ų122.678%0.78170%0.7SS**  trans-78.776.4160.3-74.1-177.3180160.8-0.2105.7T229 G233T229-R231 PolarHBondContact O-N 3.45Å; R231-G233 PolarHBondContact O-N 3.23Å
232G52.4Low56.6Low78 Ų78125.8 Ų125.880%0.80473%0.729SS**  trans-36.690-174.300000114.2D230D230-G232 PolarHBondContact O-N 2.8Å
233G57.6Low55.2Low68 Ų68127 Ų12770%0.70173%0.73SS**  trans-11547.7-178.100000111.2R231R231-G233 PolarHBondContact O-N 3.23Å
234L50.3Low53.7Low143 Ų143128.3 Ų128.375%0.74975%0.746SS**  trans-160.676.2157.2-141.172.8000110.7T236L234-T236 HydrophobicContact CD2-CG2 3.9Å; L234-T236 HydrophobicContact CG-CG2 3.99Å; L234-T236 PolarHBondContact O-N 3.13Å; L234-T236 VanDerWaalsContact O-N 3.07Å
235R47.8Very low52.5Low215 Ų215131.5 Ų131.581%0.81175%0.747SS**  trans-75.178.4149.2-71.7-175.7-177.8-111.8-0.6106.8H237R235-H237 PolarHBondContact O-N 2.86Å
236T50.7Low51.1Low103 Ų103135.2 Ų135.263%0.63275%0.746SS**  trans-59.687.4151.831.50000106.6L234 L238L234-T236 HydrophobicContact CD2-CG2 3.9Å; L234-T236 HydrophobicContact CG-CG2 3.99Å; L234-T236 PolarHBondContact O-N 3.13Å; L234-T236 VanDerWaalsContact O-N 3.07Å; T236-L238 PolarHBondContact O-N 3.23Å
237H48.1Very low49.7Very low159 Ų159137.9 Ų137.974%0.73676%0.755SS**  trans-68.466.7155.9-80.5-79.8000107.6R235R235-H237 PolarHBondContact O-N 2.86Å
238L48.2Very low48.2Very low169 Ų169138.3 Ų138.389%0.88576%0.758SS**  trans-100.476.3166.7-155.881.5000107T236T236-L238 PolarHBondContact O-N 3.23Å
239G51.3Low47.1Very low63 Ų63138.5 Ų138.565%0.64976%0.76SS**  trans175.760.8-178.400000112.5
240S51.2Low45.9Very low127 Ų127142.7 Ų142.789%0.88878%0.78SS**SBendtrans-172.452.5159.6-76.70000111.5
241R50.6Low45.3Very low250 Ų250142.4 Ų142.494%0.94377%0.773SS**SBendtrans-157.669.8162.4-145178.6-168.5-170.63112.5
242A39.1Very low44.5Very low90 Ų90143.5 Ų143.574%0.74478%0.777SS**  trans-176.196.1153.700000109.1
243Q46.8Very low44.1Very low179 Ų179151.3 Ų151.384%0.83678%0.782SS**  trans-109116.9152.9-77.8-67.9-26.400105.7
244P42.8Very low43.8Very low110 Ų110153.3 Ų153.371%0.71478%0.783SS**  trans-75.4130.6175.229.7-29.3000109.7L246P244-L246 PolarHBondContact O-N 3.48Å
245F38.5Very low43.4Very low201 Ų201158.1 Ų158.188%0.88279%0.791SS**  trans-58.8127.4171.5-65.9-91.3000110.8
246L36.8Very low42.7Very low162 Ų162157.5 Ų157.585%0.84879%0.794SS**  trans-142.5132.7157.2-76.4179.9000111.6P244P244-L246 PolarHBondContact O-N 3.48Å
247H35.9Very low42.6Very low175 Ų175162.6 Ų162.681%0.8180%0.802SS**  trans88.397.3160.5-89.3-87.2000122.2
248S31.5Very low42.6Very low97 Ų97161.2 Ų161.268%0.67881%0.807SS**  -44.9150.212853.60000111.4
249S35.5Very low42.2Very low96 Ų96160.7 Ų160.767%0.67180%0.8SS**  cis-176.6161.114.2410000107.6
250L38.2Very low41.5Very low136 Ų136161.4 Ų161.471%0.71281%0.807SS**  trans99.7112.6152.6-56.5-172.8000120.6
251H43.1Very low41Very low162 Ų162163.4 Ų163.475%0.7580%0.802SS**  trans84.7131.5148.6-50.3-10.5000115.5
252R38.9Very low40.5Very low230 Ų230156.5 Ų156.587%0.86879%0.792SS**  cis-166.7122.822.6-133.7-174.1-157.3-1447.4110.5
253R44.3Very low40.6Very low243 Ų243164 Ų16492%0.91780%0.801SS**  trans62.2153141.1-74.5-156.9166.8-170.6-2.8124.9
254P49.6Very low40Very low110 Ų110158.9 Ų158.971%0.71480%0.797SS**  trans-113.3168.4-15540.9-27.7000114.2
255R42.2Very low39.9Very low243 Ų243166.1 Ų166.192%0.91781%0.81SS**  trans-139.2107.9160.5-71.3-168-175177.42.7113.2
256F33.3Very low39.9Very low202 Ų202159.9 Ų159.989%0.88680%0.802SS**  trans45113.3133.3-84.8-92.6000120.9
257R48.6Very low40.5Very low211 Ų211163.6 Ų163.680%0.79681%0.805SS**  trans-66.3159.1143.5-87.4-174.9175.5-165.5-2110.2
258P48.5Very low40.7Very low129 Ų129164.2 Ų164.284%0.83881%0.805SS**  -123.9150.5120.631.3-21.2000112.7
259H40.6Very low41.6Very low159 Ų159164.3 Ų164.374%0.73681%0.806SS**  trans-85.2135.4175.2-163.465.3000108.3
260G35.7Very low42.5Very low77 Ų77163.7 Ų163.779%0.79480%0.8SS**  trans-149.1117.7175.300000109.6
261Q41.5Very low42.8Very low170 Ų170168.2 Ų168.279%0.79481%0.808SS**  trans-95.7138.2-161.3-164.7170.832.500111.3
262S38.3Very low42.8Very low104 Ų104169.4 Ų169.473%0.72781%0.811SS**  trans46.8127.7144.8-157.80000121.5
263R41.6Very low43Very low247 Ų247163.4 Ų163.493%0.93280%0.804SS**  trans150.5112.2145.6-83.2160.5-170.4-159.94.9105.5
264G34.7Very low43.9Very low72 Ų72155.6 Ų155.674%0.74279%0.785SS**  122.6131.554.200000107
265R40.8Very low44Very low263 Ų263164.9 Ų164.999%0.99281%0.808SS**  trans42.3124.6155.3-61.3-174179.8-111.20.7119.6
266G37.6Very low44.1Very low70 Ų70161 Ų16172%0.72280%0.802SS**  trans162.772.3154.300000115F268G266-F268 PolarHBondContact O-N 2.93Å
267R51.1Low44.6Very low240 Ų240158.8 Ų158.891%0.90680%0.798SS**  trans-71.2104.4158.4-160.4-178.7-149.9-1126.2105.8
268F39.2Very low44.4Very low187 Ų187155.9 Ų155.982%0.8280%0.798SS**  trans-120.6105.2170.8-119.4-87.2000108.1G266G266-F268 PolarHBondContact O-N 2.93Å
269S50.2Low44.2Very low99 Ų99157.5 Ų157.569%0.69280%0.796SS**  trans-80.7133.5159.2-580000107.7
270P54.8Low44.4Very low83 Ų83157.4 Ų157.454%0.53980%0.799SS.*  trans-135.8134.3153.745.1-32.2000107.4
271W44.5Very low45Very low232 Ų232162.7 Ų162.788%0.87980%0.8SS**  -167.6134.550-74.485.4000108.5
272F43.4Very low45.2Very low187 Ų187162.2 Ų162.282%0.8280%0.8SS**  trans-100.6135.3149.9173.3-95000105.6P274F272-P274 HydrophobicContact CE1-CB 4.31Å; F272-P274 HydrophobicContact CE1-CG 4.41Å; F272-P274 HydrophobicContact CZ-CB 4.47Å
273S42.9Very low45.8Very low103 Ų103166.7 Ų166.772%0.7281%0.806SS**  trans-147132.9161.2-163.20000110.1
274P62.6Low46.1Very low79 Ų79160 Ų16051%0.51380%0.795SS.*  trans-90156-175.537.1-33.8000111.5F272F272-P274 HydrophobicContact CE1-CB 4.31Å; F272-P274 HydrophobicContact CE1-CG 4.41Å; F272-P274 HydrophobicContact CZ-CB 4.47Å
275Y51.5Low47.1Very low305 Ų305168 Ų168100%1.19680%0.8SS**  -157.20120.3-90.6-71.3000108.3

Retrieved 275 of 275 residues in 49.1 ms (Link to these results)