A0A087YAE2_POEFO Loading...

Required for meiotic nuclear division 1 homolog

AlphaFold DB , UniProt , Accession A0A087YAE2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 408 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
1M49Very low41.6Very low222 Ų222160.3 Ų160.3100%1.09480%0.799SS**  030.70-148.9176.9173.100113.2
2L42.4Very low40.8Very low130 Ų130155.4 Ų155.468%0.68180%0.803SS**  trans-128.52.1178.3-90.6159.5000114.2T5L2-T5 PolarHBondContact O-OG1 3.22Å
3L39Very low40.2Very low135 Ų135163.1 Ų163.171%0.70782%0.815SS**SBendtrans-90-7171.3-102.999.7000114.5
4R45.2Very low39.8Very low232 Ų232164 Ų16488%0.87582%0.816SS**SBendtrans-82.8-16.2176.8-81.3-171.8174.6-165.1-1.1113.9
5T44.8Very low39.1Very low88 Ų88163.1 Ų163.154%0.5481%0.814SS.*SBendtrans-92.9-23.9-174.545.90000113.4L2 S8L2-T5 PolarHBondContact O-OG1 3.22Å; T5-S8 PolarHBondContact O-OG 3.01Å
6L39.7Very low38.6Very low149 Ų149158.8 Ų158.878%0.7881%0.811SS**THydrogen-bonded Turntrans-85.1-16.6-178.2-120.8124.6000114.6
7W39.9Very low38Very low243 Ų243153.5 Ų153.592%0.9281%0.806SS**THydrogen-bonded Turntrans-89.8-3.8174.5-115.530.6000114.3
8S37Very low37.5Very low92 Ų92151.6 Ų151.664%0.64381%0.807SS**SBendtrans-87.7-4.3-178.468.40000114.8T5T5-S8 PolarHBondContact O-OG 3.01Å
9R42.6Very low37.3Very low227 Ų227155.9 Ų155.986%0.85781%0.811SS**SBendtrans-113.9-2.5-173.2-96.3-172.8167.9-159.9-2.6116.8
10L40.4Very low37Very low164 Ų164154.3 Ų154.386%0.85981%0.81SS**SBendtrans-133.495.2168.7-88.7103.9000109.1
11G37.8Very low36.6Very low81 Ų81153.6 Ų153.684%0.83581%0.812SS**  trans153.915.4172.100000117.5
12A31.9Very low35.5Very low102 Ų102148.4 Ų148.484%0.84380%0.797SS**  trans-106.683167.900000110.2
13R33.6Very low34.8Very low255 Ų255149.6 Ų149.696%0.96280%0.802SS**  trans-129.5106.3147.3-93.2-171172.1-164.8-1.7106.2
14Q34.3Very low34.3Very low176 Ų176148.9 Ų148.982%0.82280%0.803SS**  trans-106.9159.7-178.4-140.6-174.50.800110.5
15L29.4Very low33.3Very low150 Ų150143.1 Ų143.179%0.78580%0.798SS**  trans84135.9161.6-96.979.6000117.1
16A30.7Very low32.4Very low94 Ų94144.1 Ų144.178%0.77781%0.809SS**  cis-166.41568.800000110.9
17G28Very low31.7Very low70 Ų70143.4 Ų143.472%0.72281%0.811SS**  trans154.986.5154.300000117
18S29.8Very low31.1Very low119 Ų119138.7 Ų138.783%0.83281%0.809SS**  trans49132.1137.8-56.50000120.4
19R32.4Very low30.4Very low234 Ų234141.6 Ų141.688%0.88382%0.817SS**  cis-163.11561.5-88.5174.7175.7175.8-1.7106
20P31.5Very low29.6Very low122 Ų122137.4 Ų137.479%0.79282%0.817SS**  trans-93.6144.217734.8-29.7000113
21V29.3Very low28.9Very low140 Ų140137.5 Ų137.585%0.84881%0.813SS**  trans-105.1122.6165.1173.30000108.1
22C26Very low28.2Very low113 Ų113139.2 Ų139.276%0.76481%0.811SS**  trans-70.2131.3176.7-68.40000111.3
23I28.2Very low27.9Very low156 Ų156142.4 Ų142.480%0.881%0.812SS**  trans-101.1115.1159.5-63.5175.1000106.4
24V28.3Very low27.6Very low120 Ų120139.4 Ų139.473%0.72781%0.806SS**  trans-82.5117.3172.7172.90000107.8
25S24.7Very low27.2Very low110 Ų110136.4 Ų136.477%0.76980%0.802SS**  trans-93.2117.6165.4-480000107.9
26S25.6Very low27Very low109 Ų109133.9 Ų133.976%0.76280%0.797SS**  trans-113.5109.3168.3-67.30000109.2
27T25.2Very low26.7Very low135 Ų135136.4 Ų136.483%0.82880%0.797SS**  trans-82.3137.316328.60000109.5
28T25.6Very low26.6Very low144 Ų144140.5 Ų140.588%0.88380%0.803SS**  trans-135.1113.4154.822.80000109.5
29L23.7Very low26.4Very low152 Ų152143.2 Ų143.280%0.79680%0.802SS**  trans-47.6147.9156-106.6102000110.8
30T25.1Very low26Very low140 Ų140137.8 Ų137.886%0.85980%0.801SS**  -162.2149.9122.6-54.50000110
31Q25.8Very low25.8Very low166 Ų166138.4 Ų138.478%0.77680%0.802SS**  trans-77.5152.1-164.2-68.6159.4-45.300116.2
32C23Very low26.2Very low117 Ų117137 Ų13779%0.79180%0.796SS**  44.3122.7125.5-149.50000120.7
33L25.1Very low26.1Very low168 Ų168139 Ų13988%0.8880%0.796SS**  -170.6120.5129.5-101.6147.3000111.3
34K27.2Very low25.9Very low192 Ų192137.4 Ų137.484%0.83579%0.788SS**  trans-94.3149.9158.3-101.1-179176.6178.60108.3
35P27.4Very low25.7Very low114 Ų114138.2 Ų138.274%0.7479%0.788SS**  -138.6128.4114.227.3-9.6000111.2
36S25.3Very low25.5Very low97 Ų97137.3 Ų137.368%0.67878%0.781SS**  73.2108.388.985.70000116.3
37N23.9Very low25.4Very low146 Ų146143.4 Ų143.478%0.78179%0.788SS**  trans50.9122.9139.9-58.8-0.5000121
38N25.6Very low25.3Very low156 Ų156141.7 Ų141.783%0.83478%0.781SS**  -168.8152.8103-90.6-11.2000112.7
39E24.6Very low25.1Very low176 Ų176140.2 Ų140.282%0.82278%0.777SS**  trans-64.6149.6-171.5-64159.512400115.1
40S25.3Very low25.1Very low121 Ų121138.8 Ų138.885%0.84678%0.775SS**  158.7125.4115.149.90000112.3
41T26.8Very low25.1Very low134 Ų134138.6 Ų138.682%0.82277%0.774SS**  trans-100176.3159.244.30000108.8
42P37.6Very low24.9Very low110 Ų110136 Ų13671%0.71477%0.77SS**  cis-132.3-170.2-29.326.4-3.2000111.4
43M23.5Very low25Very low156 Ų156141.2 Ų141.277%0.76877%0.773SS**  trans124.1121.8144.4-71.9-87.8-143.700116.9
44I24Very low25Very low122 Ų122138.2 Ų138.263%0.62676%0.761SS**  87.9121.6127.9-70.6174.3000119.9
45N23.7Very low24.8Very low137 Ų137137.4 Ų137.473%0.73376%0.758SS**  trans90.4114142.9-74.9-2.9000123.2
46S21.8Very low24.7Very low91 Ų91143.2 Ų143.264%0.63677%0.767SS**  74139115.678.30000121.5
47W23.3Very low24.6Very low237 Ų237144 Ų14490%0.89876%0.763SS**  trans87.5102.1154.3-74.7-25.2000119.7
48S22.2Very low24.6Very low99 Ų99144.8 Ų144.869%0.69277%0.767SS**  23.6122.2120.858.20000118.3
49S22.9Very low24.5Very low114 Ų114141.4 Ų141.480%0.79776%0.756SS**  -174.2131.4116.336.90000111.9
50T22.9Very low24.5Very low122 Ų122143.1 Ų143.175%0.74876%0.761SS**  trans-1129.2141.2-41.10000116.8
51T25.6Very low24.5Very low135 Ų135143.8 Ų143.883%0.82876%0.755SS**  trans-160.9115134.1-71.10000111.3
52T22Very low24.4Very low113 Ų113146.6 Ų146.669%0.69376%0.759SS**  trans-30.7134.4152-42.20000115.5
53R24.1Very low23.7Very low226 Ų226149.3 Ų149.385%0.85376%0.762SS**  179116.3123.5-107.9-178.3170.6179.9-3115.1
54T25.1Very low23.7Very low104 Ų104148.3 Ų148.364%0.63877%0.769SS**  55.8109.6127.251.90000121.1
55F23Very low23.6Very low175 Ų175151 Ų15177%0.76878%0.781SS**  35.3119.3116.8-76.5-82.8000119.3L57F55-L57 HydrophobicContact CD1-CD1 3.91Å; F55-L57 HydrophobicContact CE1-CD1 4.25Å
56Y24.8Very low23.7Very low237 Ų237153.4 Ų153.493%0.92979%0.787SS**  trans-131.2116.2132-96.8-85.2000109.8
57L23.6Very low23.7Very low112 Ų112155.9 Ų155.959%0.58679%0.793SS**  trans-64.1146.1160-102.681.1000109.3F55F55-L57 HydrophobicContact CD1-CD1 3.91Å; F55-L57 HydrophobicContact CE1-CD1 4.25Å
58N24.6Very low24Very low163 Ų163150.4 Ų150.487%0.87279%0.788SS**  trans-143.8100137-107.7-11.9000109.5
59S23.4Very low24.1Very low85 Ų85151.7 Ų151.759%0.59479%0.792SS**  trans-80.2129.2164.823.60000108.9
60F24.8Very low24.5Very low213 Ų213151.8 Ų151.893%0.93479%0.79SS**  trans-112.9118152.4-106.1-86.8000107.9
61N24Very low24.6Very low135 Ų135152 Ų15272%0.72279%0.791SS**  trans-100.1132-175.3-148.6-4.7000107.2
62Q26.3Very low24.8Very low193 Ų193153.3 Ų153.390%0.90279%0.793SS**  trans-149.7106.1152.4-154.4162.221.900110
63Q22.9Very low24.9Very low167 Ų167157 Ų15778%0.7880%0.8SS**  trans-76.8142.1167.3-75.4170.1-33.500110.1
64C23.4Very low25Very low135 Ų135153.2 Ų153.291%0.91280%0.795SS**  trans-153.9126.1140.3-93.70000109.7
65M21.5Very low24.9Very low179 Ų179153.2 Ų153.288%0.88280%0.798SS**  trans-68.9137.8173-74.6-83.9-147.700111.4
66H25.3Very low25Very low186 Ų186151.8 Ų151.886%0.86180%0.799SS**  trans173.6123.4132-100.8-69.5000111.5
67N22.9Very low25.1Very low144 Ų144147.3 Ų147.377%0.7779%0.786SS**  trans-86.8151.8153.2-103.9-5.2000107.9
68P29.4Very low25.1Very low122 Ų122145.5 Ų145.579%0.79279%0.787SS**  -140.2174.56132.1-9.6000117
69T23.9Very low25.2Very low125 Ų125145.9 Ų145.977%0.76778%0.776SS**  trans-52-176.3-177.251.40000117.6
70P31.8Very low25.3Very low117 Ų117151.4 Ų151.476%0.7679%0.79SS**  -125.3142.8-57.134.8-19.5000110.8
71T24.3Very low25.6Very low125 Ų125150.2 Ų150.277%0.76778%0.781SS**  trans-133.5121.6170.446.50000111.9F73T71-F73 PolarHBondContact O-N 3.46Å
72N29.2Very low25.8Very low163 Ų163147.4 Ų147.487%0.87277%0.772SS**  trans-40.1113171.6-68.3-43.4000112.6
73F23.9Very low26.3Very low191 Ų191142.4 Ų142.484%0.83876%0.758SS**  trans-117102.2155.9-94.5-86.8000108.5T71 C75T71-F73 PolarHBondContact O-N 3.46Å; F73-C75 PolarHBondContact O-N 3.41Å
74I26.2Very low26.8Very low147 Ų147139.8 Ų139.875%0.75475%0.75SS**  trans-62.998.8165.9-65.1170.3000106.6N76I74-N76 PolarHBondContact O-N 2.91Å
75C24.3Very low27.7Very low104 Ų104138.2 Ų138.270%0.70373%0.731SS**  trans-9191.7166.1-170.70000107.7F73 Q77F73-C75 PolarHBondContact O-N 3.41Å; C75-Q77 VanDerWaalsContact C-N 3.26Å; C75-Q77 PolarHBondContact O-N 3.1Å
76N25.3Very low28.4Very low145 Ų145131.1 Ų131.178%0.77570%0.698SS**  trans-66.385.8167.8-91.7-11.8000109.4I74 A78I74-N76 PolarHBondContact O-N 2.91Å; N76-A78 VanDerWaalsContact C-N 3.33Å; N76-A78 PolarHBondContact O-N 2.87Å
77Q25.9Very low28.9Very low142 Ų142127.7 Ų127.766%0.66468%0.682SS**  trans-89.678.1154.3-77.9-172.34.200108.6C75 R79C75-Q77 VanDerWaalsContact C-N 3.26Å; C75-Q77 PolarHBondContact O-N 3.1Å; Q77-R79 PolarHBondContact O-N 3.46Å
78A24Very low29.6Very low74 Ų74123.5 Ų123.561%0.61266%0.664SS**  trans-68.587.5162.600000108.3N76 F80N76-A78 VanDerWaalsContact C-N 3.33Å; N76-A78 PolarHBondContact O-N 2.87Å; A78-F80 PolarHBondContact O-N 3.2Å
79R27.2Very low30.2Very low171 Ų171119.7 Ų119.765%0.64564%0.639SS**  trans-73.6107.5162.2-69.5-173.6-167.1171.65.7106.9Q77 Y81Q77-R79 PolarHBondContact O-N 3.46Å; R79-Y81 VanDerWaalsContact C-N 3.25Å; R79-Y81 HydrophobicContact CB-CD2 3.92Å; R79-Y81 HydrophobicContact CB-CE2 3.85Å; R79-Y81 PolarHBondContact O-N 2.98Å
80F25.4Very low30.9Very low201 Ų201118.4 Ų118.488%0.88263%0.627SS**  trans-65.284.4171.3-74.3-88.9000109.8A78A78-F80 PolarHBondContact O-N 3.2Å
81Y31.3Very low31Very low189 Ų189119.3 Ų119.374%0.74162%0.618SS**  trans-86.9103.9159.2-77.2-83000107.6R79 S83R79-Y81 VanDerWaalsContact C-N 3.25Å; R79-Y81 HydrophobicContact CB-CD2 3.92Å; R79-Y81 HydrophobicContact CB-CE2 3.85Å; R79-Y81 PolarHBondContact O-N 2.98Å; Y81-S83 PolarHBondContact O-N 3.08Å
82S27.1Very low31.4Very low75 Ų75119 Ų11952%0.52462%0.618SS.*  trans-77.2103.7171.6-173.40000108.9N84S82-N84 PolarHBondContact O-N 2.89Å; S82-N84 VanDerWaalsContact O-N 3.16Å
83S36.7Very low31.6Very low89 Ų89117.6 Ų117.662%0.62262%0.616SS**THydrogen-bonded Turntrans-66.3-4.9176.943.70000114.4Y81Y81-S83 PolarHBondContact O-N 3.08Å
84N34.2Very low32.1Very low112 Ų112115.9 Ų115.960%0.59962%0.615SS**THydrogen-bonded Turntrans-84.5-13.5-176.4-77.4-45.3000114.7S82S82-N84 PolarHBondContact O-N 2.89Å; S82-N84 VanDerWaalsContact O-N 3.16Å
85I42.3Very low32.4Very low101 Ų101117.9 Ų117.952%0.51862%0.618SS.*THydrogen-bonded Turntrans-80.1-32.9-174.6-64.2173.2000111.8S88I85-S88 PolarHBondContact O-OG 3.19Å; I85-S88 VanDerWaalsContact O-OG 3.13Å
86V35.7Very low32.7Very low31 Ų31119 Ų11919%0.18862%0.624CS.*THydrogen-bonded Turntrans-83.5-21.8-175.3-167.30000112.5S88 V89V86-S88 PolarHBondContact O-N 3.22Å; V86-S88 VanDerWaalsContact O-N 3.13Å; V86-V89 PolarHBondContact O-N 3.11Å
87Q36.7Very low32.9Very low113 Ų113118.1 Ų118.153%0.52862%0.623SS.*Hα-helixtrans-58-26.9175.1-105.7-176.1300113.9
88S37.9Very low33.5Very low57 Ų57119.5 Ų119.540%0.39963%0.634SS.*Hα-helixtrans-79.7-20-177.7660000113.9I85 V86I85-S88 PolarHBondContact O-OG 3.19Å; I85-S88 VanDerWaalsContact O-OG 3.13Å; V86-S88 PolarHBondContact O-N 3.22Å; V86-S88 VanDerWaalsContact O-N 3.13Å
89V40.8Very low34Very low42 Ų42121.4 Ų121.426%0.25564%0.638SS.*Hα-helixtrans-84.9-27-175.2-170.60000111.5V86 E314 T317 L318V86-V89 PolarHBondContact O-N 3.11Å; V89-E314 HydrophobicContact CG2-CG 4.25Å; V89-T317 HydrophobicContact CG2-CG2 4.3Å; V89-L318 HydrophobicContact CG1-CD2 4.44Å
90L39.5Very low34.2Very low98 Ų98118.1 Ų118.151%0.51364%0.638SS.*Hα-helixtrans-108.7-3.8-174.3-65.8172.4000114.9
91K33.9Very low34.6Very low135 Ų135114.8 Ų114.859%0.58764%0.637SS**SBendtrans-114.3119.9174.4-77.6-176.3178.4177.40111.6T93K91-T93 PolarHBondContact O-N 3.13Å
92P31.8Very low35Very low118 Ų118112.3 Ų112.377%0.76664%0.641SS**  trans-70.810316928.2-29.6000108.6L94P92-L94 PolarHBondContact O-N 3.07Å
93T34.3Very low35.4Very low134 Ų134111.8 Ų111.882%0.82265%0.648SS**  trans-8587.1174.1-44.70000108.8K91K91-T93 PolarHBondContact O-N 3.13Å
94L34.3Very low35.4Very low156 Ų156117.9 Ų117.982%0.81766%0.663SS**  trans-106.6118.5171.4-82.3161.4000109.9P92P92-L94 PolarHBondContact O-N 3.07Å
95K32.8Very low35.8Very low189 Ų189123 Ų12382%0.82267%0.674SS**  trans-68.2144157.5-74.5-178.3178.6178.70108.6V97K95-V97 PolarHBondContact O-N 3.32Å; K95-V97 VanDerWaalsContact O-N 3.15Å
96P29.1Very low35.7Very low127 Ų127123.2 Ų123.283%0.82568%0.682SS**  trans-76109.6-170.129.1-31.2000110.7
97V30.5Very low36.2Very low126 Ų126124.9 Ų124.976%0.76469%0.694SS**  trans-93.4118.2153.7176.70000106.1K95 V99K95-V97 PolarHBondContact O-N 3.32Å; K95-V97 VanDerWaalsContact O-N 3.15Å; V97-V99 HydrophobicContact CG1-CG2 4.16Å; V97-V99 PolarHBondContact O-N 3.35Å; V97-V99 VanDerWaalsContact O-N 3.09Å
98I38Very low36.8Very low171 Ų171126.5 Ų126.588%0.87770%0.699SS**  trans-63.2108.2179.1-64.6162.1000108.2
99V33.6Very low37.2Very low115 Ų115125.3 Ų125.370%0.69770%0.696SS**  trans-135140.7168.1-175.50000106.8V97V97-V99 HydrophobicContact CG1-CG2 4.16Å; V97-V99 PolarHBondContact O-N 3.35Å; V97-V99 VanDerWaalsContact O-N 3.09Å
100P31.4Very low37.4Very low101 Ų101125.1 Ų125.166%0.65670%0.695SS**  trans-65.2159.4-166.8-14.428.1000113.2T102P100-T102 PolarHBondContact O-N 3.24Å; P100-T102 VanDerWaalsContact O-N 3.08Å
101P35.5Very low37.8Very low131 Ų131132.5 Ų132.585%0.85172%0.717SS**  trans-74.8106.5-165.231-31.9000110.5
102T38.8Very low38.6Very low137 Ų137130.6 Ų130.684%0.8472%0.716SS**  trans-94.8125.3158.750.40000107.6P100P100-T102 PolarHBondContact O-N 3.24Å; P100-T102 VanDerWaalsContact O-N 3.08Å
103G35.7Very low39.5Very low64 Ų64133.8 Ų133.866%0.6672%0.718SS**  trans-52.3139.6-168.400000113.6R105G103-R105 PolarHBondContact O-N 3.04Å
104K36.8Very low40.8Very low217 Ų217128 Ų12894%0.94368%0.681SS**  trans-56106168.1-66.7-177178.3-176.10107.7
105R42Very low41.9Very low219 Ų219121.9 Ų121.983%0.82665%0.651SS**PPolyproline II helixtrans-69.6139.4171.3-71179.6-179.5167.3-0.3107.5G103G103-R105 PolarHBondContact O-N 3.04Å
106P40.5Very low43.1Very low106 Ų106113.4 Ų113.469%0.68862%0.616SS**PPolyproline II helixtrans-56.5152.2171.625.7-33000109.4K108P106-K108 PolarHBondContact O-N 3.44Å
107P46.8Very low44.8Very low66 Ų66111.8 Ų111.843%0.42959%0.593SS.*PPolyproline II helixtrans-49.9127.4174.819.4-29.8000109G109P107-G109 PolarHBondContact O-N 3.39Å; P107-G109 VanDerWaalsContact O-N 3.1Å
108K48Very low46Very low147 Ų147109.2 Ų109.264%0.63958%0.581SS**  trans-66.2114.2175.7-73.1179.9-165.8157.10106.6P106 E286P106-K108 PolarHBondContact O-N 3.44Å; K108-E286 IonicContact NZ-OE1 2.79Å; K108-E286 PolarHBondContact NZ-OE1 3.06Å; K108-E286 IonicContact NZ-OE2 3.87Å
109G47.8Very low46.9Very low33 Ų33104.6 Ų104.634%0.3456%0.558SS.*  trans-60.1163.7176.800000112.7P107 W224P107-G109 PolarHBondContact O-N 3.39Å; P107-G109 VanDerWaalsContact O-N 3.1Å; G109-W224 VanDerWaalsContact CA-NE1 3.3Å
110P44.4Very low48.1Very low37 Ų37106.5 Ų106.524%0.2456%0.559CS.*  trans-62.8142.7-175.722.5-28.5000110.1T112 E225P110-T112 PolarHBondContact O-N 2.67Å; P110-T112 VanDerWaalsContact O-N 3.14Å; P110-E225 VanDerWaalsContact CD-OE1 3.22Å; P110-E225 WeakPolarHBondContact CD-OE1 3.42Å
111R48.8Very low49.3Very low254 Ų254103 Ų10396%0.95854%0.536SS*.SBendtrans-71.4-4.8-177.6-142.6170.9-177.1152.6-2112.9
112T49.4Very low50.2Low94 Ų9499.7 Ų99.758%0.57752%0.516SS*.SBendtrans-118.8120.3178.739.50000109.6P110 Q114P110-T112 PolarHBondContact O-N 2.67Å; P110-T112 VanDerWaalsContact O-N 3.14Å; T112-Q114 PolarHBondContact O-N 3.27Å
113K52.1Low50.9Low186 Ų186102.4 Ų102.481%0.80952%0.517SS*.  trans-62.5124170.9-66.4-174.6177.1-1740108.2
114Q61.4Low51.6Low11 Ų11108.4 Ų108.45%0.05152%0.524CS..  trans-55.5136172.2-73159.5-55.500109.1T112 S116 R117 S118 E227T112-Q114 PolarHBondContact O-N 3.27Å; Q114-S116 WeakPolarHBondContact CB-OG 3.36Å; Q114-S116 PolarHBondContact O-N 3.42Å; Q114-R117 HydrophobicContact CB-CG 4.37Å; Q114-R117 PolarHBondContact O-N 2.85Å; Q114-S118 PolarHBondContact O-N 2.9Å; Q114-S118 PolarHBondContact O-OG 3.32Å; Q114-E227 VanDerWaalsContact CG-OE1 3.29Å; Q114-E227 WeakPolarHBondContact CG-OE1 3.19Å; Q114-E227 PolarHBondContact NE2-OE1 2.52Å
115P56.2Low52.6Low29 Ų29103.4 Ų103.419%0.18850%0.504CS..Hα-helixtrans-55.2-36-177.7-26.133.8000113.6S118 N119 F351P115-S118 WeakPolarHBondContact CA-OG 3.47Å; P115-S118 PolarHBondContact O-N 2.96Å; P115-S118 PolarHBondContact O-OG 3.06Å; P115-N119 PolarHBondContact O-N 3.46Å; P115-N119 PolarHBondContact O-ND2 3.11Å; P115-F351 HydrophobicContact CB-CZ 4.48Å
116S58.6Low53.5Low11 Ų1196.2 Ų96.28%0.07748%0.482CS..Hα-helixtrans-54.8-50.7172.750.40000112Q114 S118 N119 E227 E228Q114-S116 WeakPolarHBondContact CB-OG 3.36Å; Q114-S116 PolarHBondContact O-N 3.42Å; S116-S118 VanDerWaalsContact C-N 3.29Å; S116-S118 PolarHBondContact O-N 2.93Å; S116-N119 PolarHBondContact O-N 3.42Å; S116-E227 WeakPolarHBondContact CB-OE2 3.42Å; S116-E227 PolarHBondContact OG-OE2 3.41Å; S116-E228 WeakPolarHBondContact CB-O 3.31Å
117R64.3Low54.6Low92 Ų9298.9 Ų98.935%0.34749%0.486SS..Hα-helixtrans-70.2-21-178.9-66.8-177.7171.5170.7-8.2113.9Q114 W224 N226Q114-R117 HydrophobicContact CB-CG 4.37Å; Q114-R117 PolarHBondContact O-N 2.85Å; R117-W224 VanDerWaalsContact CZ-O 3.27Å; R117-W224 PolarHBondContact NH1-O 2.93Å; R117-W224 PolarHBondContact NH2-O 3.06Å; R117-N226 PolarHBondContact NH2-O 3.16Å; R117-N226 PolarHBondContact NH2-OD1 3.27Å
118S56Low55.9Low72 Ų72101.9 Ų101.950%0.50350%0.498SS..Hα-helixtrans-82.7-20.7174.4440000114.3Q114 P115 S116Q114-S118 PolarHBondContact O-N 2.9Å; Q114-S118 PolarHBondContact O-OG 3.32Å; P115-S118 WeakPolarHBondContact CA-OG 3.47Å; P115-S118 PolarHBondContact O-N 2.96Å; P115-S118 PolarHBondContact O-OG 3.06Å; S116-S118 VanDerWaalsContact C-N 3.29Å; S116-S118 PolarHBondContact O-N 2.93Å
119N57.9Low57.6Low74 Ų7495.6 Ų95.640%0.39647%0.471SS..  trans-104.242.7-176.8-68.5-30.3000111.8P115 S116 P121P115-N119 PolarHBondContact O-N 3.46Å; P115-N119 PolarHBondContact O-ND2 3.11Å; S116-N119 PolarHBondContact O-N 3.42Å; N119-P121 WeakPolarHBondContact O-CD 3.14Å
120Q58Low59.6Low156 Ų15694.2 Ų94.273%0.72946%0.456SS*.PPolyproline II helixtrans-67.9127174.3-78-173.7-9.300110.2
121P57.1Low61.9Low26 Ų2696.4 Ų96.417%0.16946%0.463CS..PPolyproline II helixtrans-69.5169.6177.624-26.8000111.7N119 E125 M129 N230N119-P121 WeakPolarHBondContact O-CD 3.14Å; P121-E125 HydrophobicContact CB-CB 4.3Å; P121-M129 HydrophobicContact CB-CE 3.49Å; P121-M129 VanDerWaalsContact CB-CE 3.49Å; P121-M129 HydrophobicContact CB-SD 4.38Å; P121-M129 HydrophobicContact CG-CE 3.06Å; P121-M129 HydrophobicContact CG-SD 4.02Å; P121-N230 WeakPolarHBondContact CD-ND2 3.37Å; P121-N230 WeakPolarHBondContact CG-ND2 3.27Å
122S53.8Low64Low62 Ų6284.3 Ų84.343%0.43442%0.417SS..PPolyproline II helixtrans-68.9149.4179.170.30000110.9K124 E125 D126S122-K124 PolarHBondContact O-N 3.36Å; S122-E125 PolarHBondContact N-OE2 3.39Å; S122-E125 PolarHBondContact O-N 3.1Å; S122-E125 VanDerWaalsContact OG-CD 3.24Å; S122-E125 PolarHBondContact OG-OE2 3.06Å; S122-D126 PolarHBondContact O-N 2.95Å
123K53.4Low66.1Low195 Ų19580.5 Ų80.585%0.84839%0.394SS*.THydrogen-bonded Turntrans-53-19.4-177.5-70.5-173.7176.9-175.10115.7
124K51.2Low68.1Low189 Ų18971.7 Ų71.782%0.82236%0.355SS*.THydrogen-bonded Turntrans-87.5-27.7178.1-77.2-173.1174.1-174.20113.3S122S122-K124 PolarHBondContact O-N 3.36Å
125E57.5Low69.6Low112 Ų11271.5 Ų71.552%0.52335%0.354SS..THydrogen-bonded Turntrans-80.4-31.4177.4-68.3160.9155.600110.1P121 S122 E127 D128 M129P121-E125 HydrophobicContact CB-CB 4.3Å; S122-E125 PolarHBondContact N-OE2 3.39Å; S122-E125 PolarHBondContact O-N 3.1Å; S122-E125 VanDerWaalsContact OG-CD 3.24Å; S122-E125 PolarHBondContact OG-OE2 3.06Å; E125-E127 VanDerWaalsContact C-N 3.27Å; E125-E127 PolarHBondContact O-N 3.49Å; E125-D128 PolarHBondContact O-N 3Å; E125-M129 HydrophobicContact CB-CE 3.86Å; E125-M129 VanDerWaalsContact O-CE 3.26Å; E125-M129 WeakPolarHBondContact O-CE 2.89Å; E125-M129 PolarHBondContact O-N 3.08Å
126D61.2Low71.3Confident68 Ų6870.1 Ų70.136%0.36435%0.345SS..THydrogen-bonded Turntrans-57.7-31.7179.9-117.11.7000114S122 D128 M129 N230S122-D126 PolarHBondContact O-N 2.95Å; D126-D128 PolarHBondContact O-N 2.91Å; D126-M129 HydrophobicContact CB-CE 4.46Å; D126-M129 PolarHBondContact O-N 3.06Å; D126-N230 PolarHBondContact OD1-ND2 3.38Å
127E63.4Low73Confident163 Ų16369.9 Ų69.976%0.76234%0.343SS*.THydrogen-bonded Turntrans-64.8-26.7-178.2-75-159.9165.900113.1E125 K177E125-E127 VanDerWaalsContact C-N 3.27Å; E125-E127 PolarHBondContact O-N 3.49Å; E127-K177 VanDerWaalsContact C-NZ 3.29Å; E127-K177 PolarHBondContact O-NZ 2.54Å
128D73.3Confident74.4Confident128 Ų12865.5 Ų65.568%0.68433%0.327SS*.THydrogen-bonded Turntrans-100.9-17-178.7-66.9-21.9000112.8E125 D126 K177E125-D128 PolarHBondContact O-N 3Å; D126-D128 PolarHBondContact O-N 2.91Å; D128-K177 PolarHBondContact O-NZ 3.01Å
129M83.9Confident75.9Confident15 Ų1563 Ų637%0.07431%0.308CS..  trans-80.4132.8-179.3-73.2179.6-64.600114.8P121 E125 D126 K177 N230 T232P121-M129 HydrophobicContact CB-CE 3.49Å; P121-M129 VanDerWaalsContact CB-CE 3.49Å; P121-M129 HydrophobicContact CB-SD 4.38Å; P121-M129 HydrophobicContact CG-CE 3.06Å; P121-M129 HydrophobicContact CG-SD 4.02Å; E125-M129 HydrophobicContact CB-CE 3.86Å; E125-M129 VanDerWaalsContact O-CE 3.26Å; E125-M129 WeakPolarHBondContact O-CE 2.89Å; E125-M129 PolarHBondContact O-N 3.08Å; D126-M129 HydrophobicContact CB-CE 4.46Å; D126-M129 PolarHBondContact O-N 3.06Å; M129-K177 VanDerWaalsContact N-NZ 3.11Å; M129-K177 WeakPolarHBondContact O-CE 3.23Å; M129-K177 PolarHBondContact O-NZ 3.08Å; M129-N230 HydrophobicContact CB-CB 4.07Å; M129-N230 HydrophobicContact CE-CB 4.42Å; M129-N230 HydrophobicContact CG-CB 4.45Å; M129-N230 HydrophobicContact SD-CB 3.81Å; M129-T232 HydrophobicContact CG-CG2 3.62Å
130M90.8Very high77.5Confident4 Ų463.4 Ų63.42%0.0231%0.307CS..EExtended strand (participates in β ladder)trans-80.3163.7170.7-68.1167-78.800110.6K177 D179 D180 N230 Y231 V233M130-K177 HydrophobicContact CG-CB 3.94Å; M130-K177 HydrophobicContact CG-CD 3.78Å; M130-K177 HydrophobicContact CG-CG 4.07Å; M130-K177 HydrophobicContact SD-CB 4.49Å; M130-D179 HydrophobicContact CE-CB 3.95Å; M130-D179 HydrophobicContact SD-CB 3.98Å; M130-D180 HydrophobicContact CE-CB 4.21Å; M130-D180 HydrophobicContact SD-CB 3.41Å; M130-D180 WeakPolarHBondContact SD-CB 3.33Å; M130-N230 CarbonylContact O-C 3.55Å; M130-N230 WeakPolarHBondContact O-CA 3.05Å; M130-Y231 HydrophobicContact CB-CD1 3.73Å; M130-Y231 HydrophobicContact CB-CD2 4.19Å; M130-Y231 HydrophobicContact CB-CE1 3.34Å; M130-Y231 HydrophobicContact CB-CE2 3.85Å; M130-Y231 HydrophobicContact CB-CG 4.14Å; M130-Y231 VanDerWaalsContact CB-CZ 3.44Å; M130-Y231 HydrophobicContact CE-CD2 4.05Å; M130-Y231 HydrophobicContact CE-CE2 3.69Å; M130-Y231 HydrophobicContact CG-CE2 4.49Å; M130-Y231 PolarHBondContact N-O 2.95Å; M130-Y231 WeakPolarHBondContact O-CD1 3.39Å; M130-Y231 PolarHBondContact O-N 3.4Å; M130-Y231 HydrophobicContact SD-CE2 3.85Å; M130-V233 HydrophobicContact CE-CB 4.45Å; M130-V233 HydrophobicContact CE-CG2 3.79Å
131Q90.7Very high79.3Confident83 Ų8356.1 Ų56.139%0.38827%0.273SS..EExtended strand (participates in β ladder)trans-118135.4-174-60.4-170.4-36.600111.8I133 N196 E228Q131-I133 HydrophobicContact CB-CD1 4.25Å; Q131-I133 HydrophobicContact CB-CG1 4.32Å; Q131-N196 PolarHBondContact O-N 2.83Å; Q131-E228 VanDerWaalsContact CD-OE1 3.23Å; Q131-E228 PolarHBondContact NE2-OE1 2.58Å
132C93.2Very high81.1Confident0 Ų059.1 Ų59.10%029%0.285CS..EExtended strand (participates in β ladder)trans-112.4115.4167.5176.10000108.1V193 F194 W195 E228 I229 Y231 F245C132-V193 WeakPolarHBondContact SG-CG1 3.47Å; C132-F194 CarbonylContact C-O 3.55Å; C132-F194 VanDerWaalsContact CA-O 3.32Å; C132-F194 WeakPolarHBondContact CA-O 3.45Å; C132-W195 HydrophobicContact CB-CD2 4.08Å; C132-W195 HydrophobicContact CB-CE3 3.99Å; C132-W195 HydrophobicContact CB-CH2 4.18Å; C132-W195 HydrophobicContact CB-CZ2 4.26Å; C132-W195 HydrophobicContact CB-CZ3 4.04Å; C132-W195 WeakPolarHBondContact SG-CZ2 3.49Å; C132-E228 WeakPolarHBondContact O-CA 3.29Å; C132-I229 WeakPolarHBondContact CB-O 3.26Å; C132-I229 PolarHBondContact N-O 2.64Å; C132-I229 PolarHBondContact O-N 3.07Å; C132-Y231 HydrophobicContact CB-CD1 4.22Å; C132-F245 HydrophobicContact CB-CD2 4.42Å; C132-F245 HydrophobicContact CB-CE2 4.29Å
133I93.2Very high83Confident15 Ų1557.1 Ų57.18%0.07727%0.269CS..EExtended strand (participates in β ladder)trans-123.7124.7-174.7-56.9162.8000109.7Q131 F135 V193 F194 M202 E227 E228Q131-I133 HydrophobicContact CB-CD1 4.25Å; Q131-I133 HydrophobicContact CB-CG1 4.32Å; I133-F135 HydrophobicContact CB-CE2 4.25Å; I133-F135 HydrophobicContact CG2-CD2 4.11Å; I133-F135 HydrophobicContact CG2-CE1 4.35Å; I133-F135 HydrophobicContact CG2-CE2 3.35Å; I133-F135 HydrophobicContact CG2-CZ 3.5Å; I133-F135 VanDerWaalsContact CG2-CZ 3.5Å; I133-V193 CarbonylContact O-C 3.56Å; I133-V193 WeakPolarHBondContact O-CA 3.11Å; I133-F194 PolarHBondContact N-O 3.05Å; I133-F194 PolarHBondContact O-N 3.21Å; I133-M202 HydrophobicContact CD1-CE 3.77Å; I133-E227 CarbonylContact C-O 3.59Å; I133-E227 WeakPolarHBondContact CA-O 3.33Å; I133-E228 HydrophobicContact CG1-CB 4.22Å; I133-E228 HydrophobicContact CG1-CG 3.87Å
134A94.3Very high84.9Confident0 Ų052.4 Ų52.40%026%0.258CS..EExtended strand (participates in β ladder)trans-111.2137.4179.200000111.8V192 V193 N226 E227 L267 V272A134-V192 CarbonylContact C-O 3.58Å; A134-V192 WeakPolarHBondContact CA-O 3.49Å; A134-V193 HydrophobicContact CB-CG1 4.37Å; A134-V193 HydrophobicContact CB-CG2 3.94Å; A134-N226 WeakPolarHBondContact O-CA 3.43Å; A134-E227 HydrophobicContact CB-CB 4.46Å; A134-E227 PolarHBondContact N-O 3.05Å; A134-E227 PolarHBondContact O-N 3.15Å; A134-L267 HydrophobicContact CB-CB 4.01Å; A134-V272 HydrophobicContact CB-CG2 3.68Å
135F93.3Very high87Confident7 Ų746.2 Ų46.23%0.03124%0.236CC..EExtended strand (participates in β ladder)trans-127.1148.3175.7-59.9-89000110.5I133 T137 S191 V192 F194 M202 V222 H223 N226I133-F135 HydrophobicContact CB-CE2 4.25Å; I133-F135 HydrophobicContact CG2-CD2 4.11Å; I133-F135 HydrophobicContact CG2-CE1 4.35Å; I133-F135 HydrophobicContact CG2-CE2 3.35Å; I133-F135 HydrophobicContact CG2-CZ 3.5Å; I133-F135 VanDerWaalsContact CG2-CZ 3.5Å; F135-T137 HydrophobicContact CB-CG2 4.03Å; F135-S191 CarbonylContact O-C 3.58Å; F135-S191 WeakPolarHBondContact O-CA 3.38Å; F135-S191 WeakPolarHBondContact O-CB 3.3Å; F135-V192 HydrophobicContact CB-CG1 3.96Å; F135-V192 HydrophobicContact CD2-CG1 4.46Å; F135-V192 PolarHBondContact N-O 3.05Å; F135-V192 PolarHBondContact O-N 3.46Å; F135-F194 AromaticContact CD2-CD2 3.74Å; F135-F194 HydrophobicContact CD2-CD2 3.74Å; F135-F194 AromaticContact CD2-CE2 3.57Å; F135-F194 HydrophobicContact CD2-CE2 3.57Å; F135-F194 AromaticContact CE2-CD2 3.75Å; F135-F194 HydrophobicContact CE2-CD2 3.75Å; F135-F194 AromaticContact CE2-CE2 3.8Å; F135-F194 HydrophobicContact CE2-CE2 3.8Å; F135-M202 HydrophobicContact CE2-CG 4.48Å; F135-M202 HydrophobicContact CE2-SD 3.7Å; F135-M202 HydrophobicContact CZ-SD 3.95Å; F135-V222 HydrophobicContact CB-CG1 4.23Å; F135-V222 HydrophobicContact CD1-CG1 4.08Å; F135-H223 AromaticContact CE1-ND1 3.86Å; F135-N226 HydrophobicContact CD1-CB 3.59Å; F135-N226 HydrophobicContact CE1-CB 3.52Å; F135-N226 HydrophobicContact CG-CB 4.44Å; F135-N226 HydrophobicContact CZ-CB 4.34Å
136A92.9Very high88.8Confident0 Ų040.9 Ų40.90%021%0.212CC..EExtended strand (participates in β ladder)trans-115.6107.5167.300000107.2Y217 V222 V272 K273 I276A136-Y217 HydrophobicContact CB-CE2 4.31Å; A136-Y217 WeakPolarHBondContact O-CD2 2.95Å; A136-V222 WeakPolarHBondContact O-CG2 3.39Å; A136-V272 HydrophobicContact CB-CB 4.05Å; A136-V272 HydrophobicContact CB-CG1 3.46Å; A136-V272 VanDerWaalsContact CB-CG1 3.46Å; A136-V272 VanDerWaalsContact N-CG1 3.3Å; A136-K273 HydrophobicContact CB-CD 3.84Å; A136-K273 HydrophobicContact CB-CG 4.27Å; A136-I276 HydrophobicContact CB-CG1 4.07Å
137T94.2Very high90.4Very high6 Ų638.5 Ų38.54%0.03720%0.2CC..  trans-104.3-24.6-169.472.20000113.4F135 Y141 G190 V192 L206 L209 E213 Y217 V222F135-T137 HydrophobicContact CB-CG2 4.03Å; T137-Y141 WeakPolarHBondContact OG1-CE1 3.44Å; T137-Y141 VanDerWaalsContact OG1-CZ 3.25Å; T137-Y141 PolarHBondContact OG1-OH 3.11Å; T137-G190 PolarHBondContact N-O 2.91Å; T137-G190 VanDerWaalsContact N-O 3.09Å; T137-V192 HydrophobicContact CG2-CG1 4.29Å; T137-L206 HydrophobicContact CG2-CD2 4.06Å; T137-L209 HydrophobicContact CG2-CD2 4.19Å; T137-E213 WeakPolarHBondContact CB-OE1 3.26Å; T137-E213 PolarHBondContact OG1-OE1 3.43Å; T137-Y217 PolarHBondContact O-N 3.27Å; T137-V222 HydrophobicContact CG2-CG1 3.86Å
138A93.2Very high91.9Very high0 Ų036.5 Ų36.50%019%0.191CC..EExtended strand (participates in β ladder)trans-154.5166.3-179.500000112Q140 Y141 G190 E213 Q215 K273A138-Q140 VanDerWaalsContact C-N 3.27Å; A138-Q140 PolarHBondContact O-N 3.08Å; A138-Y141 HydrophobicContact CB-CD1 4.4Å; A138-Y141 HydrophobicContact CB-CE1 4.05Å; A138-G190 PolarHBondContact N-O 3.03Å; A138-G190 CarbonylContact O-C 3.56Å; A138-G190 VanDerWaalsContact O-CA 3.22Å; A138-G190 WeakPolarHBondContact O-CA 3.21Å; A138-E213 HydrophobicContact CB-CB 3.61Å; A138-E213 HydrophobicContact CB-CG 3.57Å; A138-Q215 CarbonylContact C-O 3.47Å; A138-Q215 VanDerWaalsContact CA-O 3.3Å; A138-Q215 WeakPolarHBondContact CA-O 3.33Å; A138-K273 PolarHBondContact O-NZ 3.47Å
139D88.3Confident92.9Very high20 Ų2032.4 Ų32.411%0.10717%0.169CC..EExtended strand (participates in β ladder)trans-61.6-33.7177.4-84.6-16.2000114.1E189 I214 Q215 Y217 R325D139-E189 CarbonylContact C-O 3.28Å; D139-E189 CarbonylContact O-C 3.58Å; D139-I214 PolarHBondContact N-O 3.22Å; D139-I214 VanDerWaalsContact N-O 3.15Å; D139-Q215 HydrophobicContact CB-CB 4.11Å; D139-Q215 PolarHBondContact N-O 3.31Å; D139-Q215 PolarHBondContact OD2-OE1 2.99Å; D139-Y217 WeakPolarHBondContact OD1-CE1 3.47Å; D139-Y217 VanDerWaalsContact OD1-CZ 3.27Å; D139-Y217 PolarHBondContact OD1-OH 3.34Å; D139-R325 PolarHBondContact O-NH2 3.24Å
140Q91Very high93.5Very high82 Ų8231.8 Ų31.838%0.38317%0.165SC..EExtended strand (participates in β ladder)trans-152.2158.9177.4-60.9-178.734.100111.5A138 R188 I214A138-Q140 VanDerWaalsContact C-N 3.27Å; A138-Q140 PolarHBondContact O-N 3.08Å; Q140-R188 CarbonylContact C-O 3.52Å; Q140-R188 WeakPolarHBondContact CA-O 3.46Å; Q140-R188 WeakPolarHBondContact CB-O 3.17Å; Q140-I214 HydrophobicContact CB-CB 4.19Å; Q140-I214 HydrophobicContact CB-CD1 4.31Å; Q140-I214 PolarHBondContact N-O 2.73Å; Q140-I214 WeakPolarHBondContact O-CB 2.9Å; Q140-I214 PolarHBondContact O-N 3.36Å
141Y94.6Very high93.6Very high4 Ų435.4 Ų35.42%0.01618%0.184CC..EExtended strand (participates in β ladder)trans-111.9148.2167.4-59.2-31.9000111.8T137 A138 L143 F186 F187 R188 G190 S191 V192 L209 E213T137-Y141 WeakPolarHBondContact OG1-CE1 3.44Å; T137-Y141 VanDerWaalsContact OG1-CZ 3.25Å; T137-Y141 PolarHBondContact OG1-OH 3.11Å; A138-Y141 HydrophobicContact CB-CD1 4.4Å; A138-Y141 HydrophobicContact CB-CE1 4.05Å; Y141-L143 HydrophobicContact CD2-CD2 4.42Å; Y141-L143 PolarHBondContact O-N 3.32Å; Y141-F186 HydrophobicContact CD2-CB 4.46Å; Y141-F187 WeakPolarHBondContact CD2-O 3.44Å; Y141-R188 PolarHBondContact N-O 3.14Å; Y141-G190 VanDerWaalsContact CE1-CA 3.49Å; Y141-G190 VanDerWaalsContact CE2-C 3.5Å; Y141-G190 VanDerWaalsContact CZ-CA 3.43Å; Y141-G190 PolarHBondContact OH-O 3.24Å; Y141-S191 WeakPolarHBondContact CE2-O 3.37Å; Y141-S191 PolarHBondContact OH-N 2.94Å; Y141-V192 HydrophobicContact CE2-CB 4.47Å; Y141-L209 HydrophobicContact CD1-CD1 4.03Å; Y141-L209 HydrophobicContact CD1-CG 4.44Å; Y141-L209 HydrophobicContact CD2-CD1 4.1Å; Y141-L209 HydrophobicContact CE1-CD1 3.98Å; Y141-L209 HydrophobicContact CE1-CD2 4.01Å; Y141-L209 HydrophobicContact CE1-CG 3.98Å; Y141-L209 HydrophobicContact CE2-CD1 4.03Å; Y141-L209 HydrophobicContact CE2-CD2 4.13Å; Y141-L209 HydrophobicContact CG-CD1 4.12Å; Y141-L209 WeakPolarHBondContact OH-CD2 3.4Å; Y141-E213 HydrophobicContact CD1-CG 3.98Å; Y141-E213 HydrophobicContact CE1-CG 3.77Å
142H95.3Very high93.8Very high89 Ų8936.4 Ų36.441%0.41219%0.192SC..  trans-89.282.8166.2-165-83.6000110.4T145 L146 H212 I214H142-T145 VanDerWaalsContact ND1-CG2 3.28Å; H142-T145 WeakPolarHBondContact ND1-CG2 3.48Å; H142-T145 PolarHBondContact ND1-OG1 2.97Å; H142-T145 PolarHBondContact O-N 3.17Å; H142-T145 PolarHBondContact O-OG1 3.06Å; H142-L146 PolarHBondContact O-N 3.34Å; H142-H212 PolarHBondContact N-O 3.07Å; H142-H212 VanDerWaalsContact N-O 3.08Å; H142-I214 HydrophobicContact CB-CD1 4.5Å
143L93.9Very high93.8Very high20 Ų2040.8 Ų40.811%0.10521%0.212CC..Hα-helixtrans-54.6-42.1-173.3-60.6-176.1000115.2Y141 T145 L146 S147 L168 F186 R188Y141-L143 HydrophobicContact CD2-CD2 4.42Å; Y141-L143 PolarHBondContact O-N 3.32Å; L143-T145 VanDerWaalsContact C-N 3.34Å; L143-T145 PolarHBondContact O-N 3.19Å; L143-L146 HydrophobicContact CD2-CD2 4.39Å; L143-L146 WeakPolarHBondContact O-CB 3.41Å; L143-L146 PolarHBondContact O-N 3.34Å; L143-L146 VanDerWaalsContact O-N 3.17Å; L143-S147 PolarHBondContact O-N 2.89Å; L143-L168 HydrophobicContact CD1-CB 4.39Å; L143-L168 HydrophobicContact CD2-CB 4.22Å; L143-F186 HydrophobicContact CD2-CB 4Å; L143-R188 HydrophobicContact CD1-CB 3.83Å; L143-R188 HydrophobicContact CG-CB 4.23Å
144P93.4Very high93.7Very high95 Ų9543.5 Ų43.562%0.61724%0.244SC*.Hα-helixtrans-63.8-36.9-176.9-25.135.4000113.9H148P144-H148 PolarHBondContact O-N 2.81Å
145T95.1Very high93.7Very high59 Ų5944 Ų4436%0.36225%0.246SC..Hα-helixtrans-74.6-35176.449.40000111.3H142 L143 D149 H212H142-T145 VanDerWaalsContact ND1-CG2 3.28Å; H142-T145 WeakPolarHBondContact ND1-CG2 3.48Å; H142-T145 PolarHBondContact ND1-OG1 2.97Å; H142-T145 PolarHBondContact O-N 3.17Å; H142-T145 PolarHBondContact O-OG1 3.06Å; L143-T145 VanDerWaalsContact C-N 3.34Å; L143-T145 PolarHBondContact O-N 3.19Å; T145-D149 PolarHBondContact O-N 3.32Å; T145-D149 VanDerWaalsContact O-N 3.08Å; T145-H212 PolarHBondContact OG1-ND1 2.87Å
146L95.6Very high93.7Very high1 Ų150.2 Ų50.21%0.00528%0.276CS..Hα-helixtrans-66.3-45.9177.9177.965.3000111.2H142 L143 H148 D149 L150 L168 F186 L209 H212H142-L146 PolarHBondContact O-N 3.34Å; L143-L146 HydrophobicContact CD2-CD2 4.39Å; L143-L146 WeakPolarHBondContact O-CB 3.41Å; L143-L146 PolarHBondContact O-N 3.34Å; L143-L146 VanDerWaalsContact O-N 3.17Å; L146-H148 PolarHBondContact O-N 3.26Å; L146-D149 PolarHBondContact O-N 3.01Å; L146-L150 HydrophobicContact CD1-CD1 3.88Å; L146-L150 HydrophobicContact CD1-CG 4.02Å; L146-L150 HydrophobicContact CD2-CD1 4.45Å; L146-L150 HydrophobicContact CG-CD1 3.76Å; L146-L150 HydrophobicContact CG-CG 4.3Å; L146-L150 WeakPolarHBondContact O-CB 3.26Å; L146-L150 VanDerWaalsContact O-CG 3.25Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 3.01Å; L146-L168 HydrophobicContact CD2-CD2 4.31Å; L146-L168 HydrophobicContact CG-CD2 4.29Å; L146-F186 HydrophobicContact CD2-CB 4.12Å; L146-F186 HydrophobicContact CD2-CD1 3.65Å; L146-F186 HydrophobicContact CD2-CD2 4.47Å; L146-F186 HydrophobicContact CD2-CE1 4.09Å; L146-F186 HydrophobicContact CD2-CG 3.83Å; L146-L209 HydrophobicContact CD1-CD1 3.9Å; L146-L209 HydrophobicContact CD2-CD1 3.53Å; L146-L209 HydrophobicContact CG-CD1 4.37Å; L146-H212 HydrophobicContact CB-CB 4.16Å; L146-H212 HydrophobicContact CD1-CB 4.35Å
147S94.8Very high93.7Very high18 Ų1854 Ų5413%0.12629%0.293CS..Hα-helixtrans-55-50.9175.1153.80000110.8L143 D149 L150 I151 E157L143-S147 PolarHBondContact O-N 2.89Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.46Å; S147-L150 PolarHBondContact O-N 2.85Å; S147-I151 VanDerWaalsContact O-CG1 3.26Å; S147-I151 WeakPolarHBondContact O-CG1 3.28Å; S147-I151 PolarHBondContact O-N 3.14Å; S147-E157 PolarHBondContact OG-OE2 3.4Å
148H94.9Very high93.7Very high121 Ų12156.1 Ų56.156%0.5630%0.304SS*.Hα-helixtrans-58.9-42.7178.7-179.1-88.7000112.8P144 L146 N152P144-H148 PolarHBondContact O-N 2.81Å; L146-H148 PolarHBondContact O-N 3.26Å; H148-N152 PolarHBondContact CE1-ND2 3.49Å; H148-N152 PolarHBondContact ND1-ND2 3.05Å; H148-N152 VanDerWaalsContact ND1-ND2 3.19Å; H148-N152 PolarHBondContact O-N 2.85Å; H148-N152 VanDerWaalsContact O-N 3.13Å; H148-N152 PolarHBondContact O-ND2 2.78Å
149D95.2Very high93.5Very high42 Ų4263.2 Ų63.223%0.22534%0.342CS..Hα-helixtrans-68.8-39.9179.5-161.848.8000112.5T145 L146 S147 N152 H153 H212T145-D149 PolarHBondContact O-N 3.32Å; T145-D149 VanDerWaalsContact O-N 3.08Å; L146-D149 PolarHBondContact O-N 3.01Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.46Å; D149-N152 PolarHBondContact O-N 2.83Å; D149-H153 PolarHBondContact O-CD2 2.82Å; D149-H153 PolarHBondContact O-N 2.71Å; D149-H153 VanDerWaalsContact O-N 3.14Å; D149-H212 IonicContact OD2-NE2 3.03Å
150L94.7Very high93.5Very high1 Ų164 Ų641%0.00535%0.346CS..Hα-helixtrans-64.2-44.4175.3-69.8172.5000111.5L146 S147 N152 H153 G154 F155 L168 I170 F186 L208L146-L150 HydrophobicContact CD1-CD1 3.88Å; L146-L150 HydrophobicContact CD1-CG 4.02Å; L146-L150 HydrophobicContact CD2-CD1 4.45Å; L146-L150 HydrophobicContact CG-CD1 3.76Å; L146-L150 HydrophobicContact CG-CG 4.3Å; L146-L150 WeakPolarHBondContact O-CB 3.26Å; L146-L150 VanDerWaalsContact O-CG 3.25Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 3.01Å; S147-L150 PolarHBondContact O-N 2.85Å; L150-N152 VanDerWaalsContact C-N 3.28Å; L150-N152 PolarHBondContact O-N 2.9Å; L150-H153 CarbonylContact O-C 3.52Å; L150-H153 WeakPolarHBondContact O-CA 3.5Å; L150-H153 PolarHBondContact O-N 3.35Å; L150-G154 PolarHBondContact O-N 3.45Å; L150-F155 HydrophobicContact CB-CB 4.14Å; L150-F155 HydrophobicContact CB-CD2 4.06Å; L150-F155 HydrophobicContact CB-CG 4.4Å; L150-F155 HydrophobicContact CD2-CD2 3.73Å; L150-F155 HydrophobicContact CD2-CE2 3.87Å; L150-F155 HydrophobicContact CD2-CG 4.41Å; L150-F155 WeakPolarHBondContact O-CB 3.25Å; L150-F155 VanDerWaalsContact O-CD2 3.28Å; L150-F155 WeakPolarHBondContact O-CD2 3.42Å; L150-F155 PolarHBondContact O-N 2.85Å; L150-F155 VanDerWaalsContact O-N 3.14Å; L150-L168 HydrophobicContact CD1-CD2 4.33Å; L150-I170 HydrophobicContact CB-CD1 4.33Å; L150-I170 HydrophobicContact CD1-CD1 4.25Å; L150-I170 HydrophobicContact CD1-CG1 3.91Å; L150-F186 HydrophobicContact CD1-CD2 4.25Å; L150-F186 HydrophobicContact CD1-CE1 4.49Å; L150-F186 HydrophobicContact CD1-CE2 3.52Å; L150-F186 HydrophobicContact CD1-CZ 3.65Å; L150-L208 HydrophobicContact CD2-CD1 4.07Å
151I94.7Very high93.4Very high81 Ų8162 Ų6242%0.41534%0.34SS..Hα-helixtrans-59.8-41.3176.6-67.5164.7000110.8S147 H153 G154 E157S147-I151 VanDerWaalsContact O-CG1 3.26Å; S147-I151 WeakPolarHBondContact O-CG1 3.28Å; S147-I151 PolarHBondContact O-N 3.14Å; I151-H153 PolarHBondContact O-N 3.29Å; I151-G154 PolarHBondContact O-N 2.89Å; I151-E157 HydrophobicContact CD1-CB 4.48Å
152N94.6Very high92.8Very high103 Ų10373.5 Ų73.555%0.55138%0.383SS*.Hα-helixtrans-63-26.6175.4-67.9-28.2000113.1H148 D149 L150 G154H148-N152 PolarHBondContact CE1-ND2 3.49Å; H148-N152 PolarHBondContact ND1-ND2 3.05Å; H148-N152 VanDerWaalsContact ND1-ND2 3.19Å; H148-N152 PolarHBondContact O-N 2.85Å; H148-N152 VanDerWaalsContact O-N 3.13Å; H148-N152 PolarHBondContact O-ND2 2.78Å; D149-N152 PolarHBondContact O-N 2.83Å; L150-N152 VanDerWaalsContact C-N 3.28Å; L150-N152 PolarHBondContact O-N 2.9Å; N152-G154 VanDerWaalsContact C-N 3.3Å
153H92.6Very high92.2Very high92 Ų9273.3 Ų73.343%0.42639%0.385SS..THydrogen-bonded Turntrans-87.98.4176.3-86.3-67.2000114.3D149 L150 I151 F155 L208D149-H153 PolarHBondContact O-CD2 2.82Å; D149-H153 PolarHBondContact O-N 2.71Å; D149-H153 VanDerWaalsContact O-N 3.14Å; L150-H153 CarbonylContact O-C 3.52Å; L150-H153 WeakPolarHBondContact O-CA 3.5Å; L150-H153 PolarHBondContact O-N 3.35Å; I151-H153 PolarHBondContact O-N 3.29Å; H153-F155 HydrophobicContact CB-CD2 3.96Å; H153-F155 HydrophobicContact CB-CE2 4.03Å; H153-L208 HydrophobicContact CB-CD1 4.3Å
154G90.6Very high91.7Very high72 Ų7272.7 Ų72.774%0.74238%0.383SS*.THydrogen-bonded Turntrans87.413.417400000114.5L150 I151 N152L150-G154 PolarHBondContact O-N 3.45Å; I151-G154 PolarHBondContact O-N 2.89Å; N152-G154 VanDerWaalsContact C-N 3.3Å
155F93.9Very high90.9Very high10 Ų1072.6 Ų72.64%0.04439%0.385CS..  trans-82.6151.1173.4-67.7-78.9000111.3L150 H153 I170 E201 V205 L208L150-F155 HydrophobicContact CB-CB 4.14Å; L150-F155 HydrophobicContact CB-CD2 4.06Å; L150-F155 HydrophobicContact CB-CG 4.4Å; L150-F155 HydrophobicContact CD2-CD2 3.73Å; L150-F155 HydrophobicContact CD2-CE2 3.87Å; L150-F155 HydrophobicContact CD2-CG 4.41Å; L150-F155 WeakPolarHBondContact O-CB 3.25Å; L150-F155 VanDerWaalsContact O-CD2 3.28Å; L150-F155 WeakPolarHBondContact O-CD2 3.42Å; L150-F155 PolarHBondContact O-N 2.85Å; L150-F155 VanDerWaalsContact O-N 3.14Å; H153-F155 HydrophobicContact CB-CD2 3.96Å; H153-F155 HydrophobicContact CB-CE2 4.03Å; F155-I170 HydrophobicContact CB-CG2 3.52Å; F155-I170 HydrophobicContact CD1-CG2 3.78Å; F155-I170 HydrophobicContact CG-CG2 3.92Å; F155-E201 HydrophobicContact CE1-CG 4.14Å; F155-E201 WeakPolarHBondContact CE1-OE1 3.32Å; F155-E201 HydrophobicContact CZ-CG 4.26Å; F155-E201 WeakPolarHBondContact CZ-OE1 3.4Å; F155-V205 HydrophobicContact CE1-CG2 3.94Å; F155-V205 HydrophobicContact CE2-CG2 4.24Å; F155-V205 HydrophobicContact CZ-CG2 3.49Å; F155-V205 VanDerWaalsContact CZ-CG2 3.49Å; F155-L208 HydrophobicContact CE2-CD1 4.21Å
156Q93.9Very high90.5Very high139 Ų13973 Ų7365%0.6539%0.385SS*.EExtended strand (participates in β ladder)trans-110127.6-178.5-165.317819.100110.7I170 S171Q156-I170 CarbonylContact O-C 3.55Å; Q156-I170 WeakPolarHBondContact O-CA 3.28Å; Q156-S171 PolarHBondContact N-O 2.82Å; Q156-S171 PolarHBondContact O-N 2.7Å; Q156-S171 PolarHBondContact O-OG 3.39Å
157E94Very high90.4Very high79 Ų7973.9 Ų73.937%0.36939%0.39SS..EExtended strand (participates in β ladder)trans-81.9137.4177.2-174.5168.5174.700111S147 I151 L168 V169 I170S147-E157 PolarHBondContact OG-OE2 3.4Å; I151-E157 HydrophobicContact CD1-CB 4.48Å; E157-L168 VanDerWaalsContact CD-CD1 3.44Å; E157-L168 HydrophobicContact CG-CD1 3.79Å; E157-L168 VanDerWaalsContact OE1-CD1 3.29Å; E157-L168 WeakPolarHBondContact OE1-CD1 3.44Å; E157-V169 WeakPolarHBondContact CA-O 3.38Å; E157-I170 HydrophobicContact CB-CD1 4.06Å; E157-I170 HydrophobicContact CG-CD1 4.48Å
158I92.8Very high90.4Very high50 Ų5073.4 Ų73.426%0.25639%0.386SS..EExtended strand (participates in β ladder)trans-109.3123.1174.6-63.2171.3000108.1L160 V169 L183I158-L160 PolarHBondContact O-N 2.69Å; I158-V169 HydrophobicContact CB-CB 4.21Å; I158-V169 HydrophobicContact CB-CG1 4.09Å; I158-V169 HydrophobicContact CD1-CG1 4.29Å; I158-V169 PolarHBondContact N-O 3.35Å; I158-L183 HydrophobicContact CD1-CD2 3.45Å; I158-L183 VanDerWaalsContact CD1-CD2 3.45Å
159D89.8Confident90.4Very high149 Ų14967.7 Ų67.780%0.79736%0.36SS*.PPolyproline II helixtrans-70.3124.9178.1-72.4-37.4000111.2
160L88.6Confident90.4Very high37 Ų3765.7 Ų65.719%0.19435%0.349CS..PPolyproline II helixtrans-95.7160.6168.8-73.9-176.8000111.7I158 A164 V167 V169 V257 L258 F261I158-L160 PolarHBondContact O-N 2.69Å; L160-A164 HydrophobicContact CB-CB 4.09Å; L160-A164 HydrophobicContact CD1-CB 4.02Å; L160-V167 HydrophobicContact CD1-CB 4.31Å; L160-V167 HydrophobicContact CD1-CG1 4.26Å; L160-V169 HydrophobicContact CD1-CG2 3.36Å; L160-V169 HydrophobicContact CD2-CG2 4.11Å; L160-V169 HydrophobicContact CG-CG2 3.61Å; L160-V257 HydrophobicContact CD2-CG1 3.98Å; L160-L258 HydrophobicContact CD2-CD2 4.09Å; L160-F261 HydrophobicContact CD1-CD2 3.97Å; L160-F261 HydrophobicContact CD1-CE2 4.13Å
161P87.8Confident90.4Very high40 Ų4066.7 Ų66.726%0.2636%0.356SS..PPolyproline II helixtrans-51.3146.2168.7-28.437.9000112.8D163 A164 L258 F334P161-D163 VanDerWaalsContact C-OD1 3.23Å; P161-D163 WeakPolarHBondContact CB-OD1 3.49Å; P161-D163 PolarHBondContact O-N 2.95Å; P161-D163 VanDerWaalsContact O-N 3.1Å; P161-A164 WeakPolarHBondContact O-CB 3.4Å; P161-A164 PolarHBondContact O-N 2.94Å; P161-L258 HydrophobicContact CG-CD2 4.24Å; P161-F334 HydrophobicContact CB-CE2 4.43Å
162R82.3Confident90.2Very high245 Ų24563.8 Ų63.893%0.92534%0.342SS*.G310 helixtrans-60.2-27-171.1-65.2-175.4-174.7-130.6-0.4114.1A164R162-A164 PolarHBondContact O-N 3.07Å
163D83.4Confident89.9Confident85 Ų8568.2 Ų68.246%0.45536%0.359SS..G310 helixtrans-65.4-20.9173.844-32.1000113P161 S165 F334 R338P161-D163 VanDerWaalsContact C-OD1 3.23Å; P161-D163 WeakPolarHBondContact CB-OD1 3.49Å; P161-D163 PolarHBondContact O-N 2.95Å; P161-D163 VanDerWaalsContact O-N 3.1Å; D163-S165 PolarHBondContact O-N 3.21Å; D163-F334 HydrophobicContact CB-CD2 4.03Å; D163-F334 WeakPolarHBondContact OD2-CD2 3.35Å; D163-F334 WeakPolarHBondContact OD2-CE2 3.32Å; D163-R338 IonicContact OD2-NH2 3.95Å
164A82.8Confident89.7Confident8 Ų867.2 Ų67.27%0.06636%0.357CS..G310 helixtrans-96.336.5176.700000113.9L160 P161 R162 N166 V167 F261 F334L160-A164 HydrophobicContact CB-CB 4.09Å; L160-A164 HydrophobicContact CD1-CB 4.02Å; P161-A164 WeakPolarHBondContact O-CB 3.4Å; P161-A164 PolarHBondContact O-N 2.94Å; R162-A164 PolarHBondContact O-N 3.07Å; A164-N166 PolarHBondContact O-N 3.42Å; A164-V167 PolarHBondContact O-N 2.79Å; A164-F261 HydrophobicContact CB-CE2 4.4Å; A164-F261 HydrophobicContact CB-CZ 4.2Å; A164-F334 HydrophobicContact CB-CD2 4.15Å; A164-F334 HydrophobicContact CB-CE2 4.01Å
165S78Confident89.7Confident93 Ų9365.6 Ų65.665%0.6534%0.337SS*.THydrogen-bonded Turntrans-65.2-10.6-172.8640000117D163 V167D163-S165 PolarHBondContact O-N 3.21Å; S165-V167 VanDerWaalsContact C-N 3.32Å
166N86.3Confident89.4Confident68 Ų6868 Ų6836%0.36436%0.358SS..THydrogen-bonded Turntrans-90.86.3179.9-66.4-32.5000113.2A164 R188A164-N166 PolarHBondContact O-N 3.42Å; N166-R188 HydrophobicContact CB-CB 4.26Å; N166-R188 WeakPolarHBondContact O-CB 3.2Å; N166-R188 PolarHBondContact O-N 3.35Å
167V92Very high89.2Confident18 Ų1863.7 Ų63.711%0.10934%0.337CS..EExtended strand (participates in β ladder)trans-132136.7-175.7-177.90000111L160 A164 S165 V169 F185 F186 F187 F261L160-V167 HydrophobicContact CD1-CB 4.31Å; L160-V167 HydrophobicContact CD1-CG1 4.26Å; A164-V167 PolarHBondContact O-N 2.79Å; S165-V167 VanDerWaalsContact C-N 3.32Å; V167-V169 HydrophobicContact CG1-CG2 4.19Å; V167-F185 HydrophobicContact CG1-CB 4.39Å; V167-F185 HydrophobicContact CG1-CD1 4.14Å; V167-F186 WeakPolarHBondContact CA-O 3.45Å; V167-F187 HydrophobicContact CG1-CE1 4.38Å; V167-F187 HydrophobicContact CG1-CZ 4.37Å; V167-F187 HydrophobicContact CG2-CD1 3.32Å; V167-F187 HydrophobicContact CG2-CE1 3.42Å; V167-F187 VanDerWaalsContact CG2-CE1 3.42Å; V167-F187 HydrophobicContact CG2-CG 4.04Å; V167-F187 HydrophobicContact CG2-CZ 4.21Å; V167-F261 HydrophobicContact CB-CE2 3.85Å; V167-F261 HydrophobicContact CG1-CD2 4.2Å; V167-F261 HydrophobicContact CG1-CE2 3.99Å; V167-F261 HydrophobicContact CG2-CE2 3.6Å; V167-F261 HydrophobicContact CG2-CZ 4.34Å
168L94.6Very high88.8Confident8 Ų867 Ų674%0.04236%0.363CS..EExtended strand (participates in β ladder)trans-108.2128.2171.2167.767000108.3L143 L146 L150 E157 I170 F186L143-L168 HydrophobicContact CD1-CB 4.39Å; L143-L168 HydrophobicContact CD2-CB 4.22Å; L146-L168 HydrophobicContact CD2-CD2 4.31Å; L146-L168 HydrophobicContact CG-CD2 4.29Å; L150-L168 HydrophobicContact CD1-CD2 4.33Å; E157-L168 VanDerWaalsContact CD-CD1 3.44Å; E157-L168 HydrophobicContact CG-CD1 3.79Å; E157-L168 VanDerWaalsContact OE1-CD1 3.29Å; E157-L168 WeakPolarHBondContact OE1-CD1 3.44Å; L168-I170 HydrophobicContact CD1-CD1 4.16Å; L168-I170 HydrophobicContact CD1-CG1 4.33Å; L168-I170 HydrophobicContact CD2-CG1 4.35Å; L168-I170 HydrophobicContact CG-CD1 4.36Å; L168-I170 HydrophobicContact CG-CG1 4.05Å; L168-F186 HydrophobicContact CB-CB 4.22Å; L168-F186 HydrophobicContact CD2-CD2 4.21Å; L168-F186 HydrophobicContact CG-CD2 4.29Å; L168-F186 PolarHBondContact N-O 2.84Å; L168-F186 PolarHBondContact O-N 3.08Å
169V95.6Very high88.4Confident1 Ų170.1 Ų70.11%0.00638%0.38CS..EExtended strand (participates in β ladder)trans-112.8130179.2-171.90000109.7E157 I158 L160 V167 L183 I184 F185 V257E157-V169 WeakPolarHBondContact CA-O 3.38Å; I158-V169 HydrophobicContact CB-CB 4.21Å; I158-V169 HydrophobicContact CB-CG1 4.09Å; I158-V169 HydrophobicContact CD1-CG1 4.29Å; I158-V169 PolarHBondContact N-O 3.35Å; L160-V169 HydrophobicContact CD1-CG2 3.36Å; L160-V169 HydrophobicContact CD2-CG2 4.11Å; L160-V169 HydrophobicContact CG-CG2 3.61Å; V167-V169 HydrophobicContact CG1-CG2 4.19Å; V169-L183 HydrophobicContact CG1-CD2 4.49Å; V169-I184 WeakPolarHBondContact CA-O 3.23Å; V169-F185 HydrophobicContact CB-CD1 4.44Å; V169-F185 HydrophobicContact CB-CE1 4.42Å; V169-F185 HydrophobicContact CG1-CD1 4.21Å; V169-F185 HydrophobicContact CG1-CE1 3.89Å; V169-F185 HydrophobicContact CG1-CZ 4.26Å; V169-F185 HydrophobicContact CG2-CD1 3.54Å; V169-F185 HydrophobicContact CG2-CE1 3.6Å; V169-V257 HydrophobicContact CG1-CG1 4.45Å
170I95.4Very high88.3Confident0 Ų064.3 Ų64.30%035%0.349CS..EExtended strand (participates in β ladder)trans-129.9130.1-176.2-65.9-73.3000108.7L150 F155 Q156 E157 L168 I184 F186L150-I170 HydrophobicContact CB-CD1 4.33Å; L150-I170 HydrophobicContact CD1-CD1 4.25Å; L150-I170 HydrophobicContact CD1-CG1 3.91Å; F155-I170 HydrophobicContact CB-CG2 3.52Å; F155-I170 HydrophobicContact CD1-CG2 3.78Å; F155-I170 HydrophobicContact CG-CG2 3.92Å; Q156-I170 CarbonylContact O-C 3.55Å; Q156-I170 WeakPolarHBondContact O-CA 3.28Å; E157-I170 HydrophobicContact CB-CD1 4.06Å; E157-I170 HydrophobicContact CG-CD1 4.48Å; L168-I170 HydrophobicContact CD1-CD1 4.16Å; L168-I170 HydrophobicContact CD1-CG1 4.33Å; L168-I170 HydrophobicContact CD2-CG1 4.35Å; L168-I170 HydrophobicContact CG-CD1 4.36Å; L168-I170 HydrophobicContact CG-CG1 4.05Å; I170-I184 HydrophobicContact CB-CB 4.41Å; I170-I184 PolarHBondContact N-O 3.27Å; I170-I184 PolarHBondContact O-N 2.8Å; I170-F186 HydrophobicContact CB-CE2 4.11Å; I170-F186 HydrophobicContact CG1-CD2 4.21Å; I170-F186 HydrophobicContact CG1-CE2 3.87Å
171S93.9Very high88.3Confident22 Ų2267.4 Ų67.415%0.15437%0.366CS..EExtended strand (participates in β ladder)trans-96.3153.5167.658.10000111.7Q156 A182Q156-S171 PolarHBondContact N-O 2.82Å; Q156-S171 PolarHBondContact O-N 2.7Å; Q156-S171 PolarHBondContact O-OG 3.39Å; S171-A182 WeakPolarHBondContact CA-O 3.34Å
172T91.3Very high88.6Confident21 Ų2165.6 Ų65.613%0.12935%0.354CS..EExtended strand (participates in β ladder)trans-135.7148.3172.9-174.50000110.1N174 A182 V197T172-N174 PolarHBondContact O-N 3.14Å; T172-N174 PolarHBondContact OG1-N 3.05Å; T172-A182 HydrophobicContact CG2-CB 3.4Å; T172-A182 VanDerWaalsContact CG2-CB 3.4Å; T172-A182 PolarHBondContact N-O 2.88Å; T172-A182 WeakPolarHBondContact O-CB 3.32Å; T172-V197 HydrophobicContact CG2-CG1 4.41Å; T172-V197 HydrophobicContact CG2-CG2 4.47Å
173E87.6Confident89.3Confident195 Ų19554.2 Ų54.291%0.91131%0.312SS*.SBendtrans-75.7-14.8174.8-59.3-179.717600111.9A175E173-A175 VanDerWaalsContact C-N 3.29Å; E173-A175 PolarHBondContact O-N 3.47Å
174N89.3Confident89.9Confident72 Ų7250.2 Ų50.239%0.38529%0.29SS..  trans-86.163.5-174.7-70.1-16.9000112.4T172 Q198 E201T172-N174 PolarHBondContact O-N 3.14Å; T172-N174 PolarHBondContact OG1-N 3.05Å; N174-Q198 PolarHBondContact O-N 2.93Å; N174-E201 HydrophobicContact CB-CB 4.18Å; N174-E201 HydrophobicContact CB-CG 4.13Å; N174-E201 PolarHBondContact ND2-OE2 2.87Å
175A90.3Very high90.6Very high37 Ų3749.8 Ų49.831%0.30629%0.287SS..BIsolated β-bridgetrans-72.4145.3175.800000113.2E173 K177 A182 N196E173-A175 VanDerWaalsContact C-N 3.29Å; E173-A175 PolarHBondContact O-N 3.47Å; A175-K177 WeakPolarHBondContact CB-O 3.37Å; A175-A182 HydrophobicContact CB-CB 3.88Å; A175-N196 CarbonylContact C-O 3.52Å; A175-N196 VanDerWaalsContact CA-O 3.29Å; A175-N196 WeakPolarHBondContact CA-O 3.38Å
176A88.6Confident91.4Very high60 Ų6045.4 Ų45.450%0.49626%0.256SS..SBendtrans-76.6-38.3177.900000111.7N196A176-N196 WeakPolarHBondContact CB-OD1 3.25Å; A176-N196 PolarHBondContact N-O 3.19Å; A176-N196 PolarHBondContact N-OD1 3.47Å
177K88.3Confident91.7Very high49 Ų4942.1 Ų42.121%0.21324%0.239CC..SBendtrans-126.4158173.6-55.2-160.1-174.3-171.50110.9E127 D128 M129 M130 A175 D179 N196E127-K177 VanDerWaalsContact C-NZ 3.29Å; E127-K177 PolarHBondContact O-NZ 2.54Å; D128-K177 PolarHBondContact O-NZ 3.01Å; M129-K177 VanDerWaalsContact N-NZ 3.11Å; M129-K177 WeakPolarHBondContact O-CE 3.23Å; M129-K177 PolarHBondContact O-NZ 3.08Å; M130-K177 HydrophobicContact CG-CB 3.94Å; M130-K177 HydrophobicContact CG-CD 3.78Å; M130-K177 HydrophobicContact CG-CG 4.07Å; M130-K177 HydrophobicContact SD-CB 4.49Å; A175-K177 WeakPolarHBondContact CB-O 3.37Å; K177-D179 VanDerWaalsContact C-N 3.33Å; K177-N196 PolarHBondContact N-OD1 2.88Å; K177-N196 PolarHBondContact O-ND2 2.87Å
178V85.6Confident91.7Very high150 Ų15047.4 Ų47.491%0.90926%0.257SS*.THydrogen-bonded Turntrans-83.1-14.1-174-171.20000112.1D180V178-D180 VanDerWaalsContact C-N 3.3Å; V178-D180 PolarHBondContact O-N 2.87Å
179D84.6Confident91.4Very high115 Ų11548.6 Ų48.662%0.61526%0.262SS*.THydrogen-bonded Turntrans-74.1-14.7-172.2-53.3-74.4000114.7M130 K177M130-D179 HydrophobicContact CE-CB 3.95Å; M130-D179 HydrophobicContact SD-CB 3.98Å; K177-D179 VanDerWaalsContact C-N 3.33Å
180D87.8Confident91.2Very high27 Ų2748.6 Ų48.614%0.14426%0.262CS..SBendtrans-152.9159.5-178.5-167.420000111.6M130 V178 N196 Y231 V233 K260M130-D180 HydrophobicContact CE-CB 4.21Å; M130-D180 HydrophobicContact SD-CB 3.41Å; M130-D180 WeakPolarHBondContact SD-CB 3.33Å; V178-D180 VanDerWaalsContact C-N 3.3Å; V178-D180 PolarHBondContact O-N 2.87Å; D180-N196 PolarHBondContact O-ND2 2.86Å; D180-Y231 HydrophobicContact CB-CE2 4.46Å; D180-Y231 WeakPolarHBondContact OD2-CE2 3.41Å; D180-Y231 PolarHBondContact OD2-OH 3.25Å; D180-V233 HydrophobicContact CB-CG2 4.43Å; D180-K260 IonicContact OD1-NZ 2.7Å; D180-K260 PolarHBondContact OD1-NZ 2.95Å; D180-K260 VanDerWaalsContact OD2-CE 3.23Å; D180-K260 WeakPolarHBondContact OD2-CE 3.43Å; D180-K260 IonicContact OD2-NZ 2.82Å; D180-K260 PolarHBondContact OD2-NZ 3.43Å
181D90Very high91Very high102 Ų10248.6 Ų48.655%0.54526%0.262SS..  trans-77.8149.1177-67.3-38.5000111.9L183D181-L183 PolarHBondContact O-N 3.35Å
182A94.1Very high91.1Very high1 Ų147.5 Ų47.51%0.00825%0.254CS..EExtended strand (participates in β ladder)trans-85.7115.6177.600000111.3S171 T172 A175 W195 N196 V197S171-A182 WeakPolarHBondContact CA-O 3.34Å; T172-A182 HydrophobicContact CG2-CB 3.4Å; T172-A182 VanDerWaalsContact CG2-CB 3.4Å; T172-A182 PolarHBondContact N-O 2.88Å; T172-A182 WeakPolarHBondContact O-CB 3.32Å; A175-A182 HydrophobicContact CB-CB 3.88Å; A182-W195 WeakPolarHBondContact CA-O 3.47Å; A182-N196 WeakPolarHBondContact CB-O 3.33Å; A182-V197 HydrophobicContact CB-CG2 4.17Å
183L95.6Very high91.4Very high7 Ų746.5 Ų46.54%0.03725%0.248CC..EExtended strand (participates in β ladder)trans-124.2143.3-174.8-68.4169.9000111.3I158 V169 D181 F185 W195 V257 K260I158-L183 HydrophobicContact CD1-CD2 3.45Å; I158-L183 VanDerWaalsContact CD1-CD2 3.45Å; V169-L183 HydrophobicContact CG1-CD2 4.49Å; D181-L183 PolarHBondContact O-N 3.35Å; L183-F185 HydrophobicContact CB-CE2 4.18Å; L183-W195 HydrophobicContact CB-CB 4.22Å; L183-W195 PolarHBondContact N-O 3.47Å; L183-W195 PolarHBondContact O-N 2.9Å; L183-V257 HydrophobicContact CD1-CG2 4.11Å; L183-K260 HydrophobicContact CD1-CD 3.61Å
184I96.8Very high91.8Very high0 Ų037.3 Ų37.30%021%0.205CC..EExtended strand (participates in β ladder)trans-129.5124.8179.9-47.8176.5000108.8V169 I170 F186 V192 V193 F194 V197 V205V169-I184 WeakPolarHBondContact CA-O 3.23Å; I170-I184 HydrophobicContact CB-CB 4.41Å; I170-I184 PolarHBondContact N-O 3.27Å; I170-I184 PolarHBondContact O-N 2.8Å; I184-F186 HydrophobicContact CB-CE2 3.96Å; I184-F186 HydrophobicContact CB-CZ 4.37Å; I184-F186 HydrophobicContact CG2-CD2 4.05Å; I184-F186 HydrophobicContact CG2-CE1 4.1Å; I184-F186 HydrophobicContact CG2-CE2 3.42Å; I184-F186 VanDerWaalsContact CG2-CE2 3.42Å; I184-F186 HydrophobicContact CG2-CZ 3.47Å; I184-F186 VanDerWaalsContact CG2-CZ 3.47Å; I184-V192 HydrophobicContact CG2-CG2 3.63Å; I184-V193 CarbonylContact C-O 3.58Å; I184-V193 VanDerWaalsContact CA-O 3.32Å; I184-V193 WeakPolarHBondContact CA-O 3.29Å; I184-F194 HydrophobicContact CB-CD1 4.5Å; I184-F194 HydrophobicContact CD1-CD1 4.03Å; I184-F194 HydrophobicContact CD1-CE1 4.03Å; I184-F194 HydrophobicContact CG1-CD1 3.93Å; I184-F194 HydrophobicContact CG1-CE1 4.32Å; I184-F194 HydrophobicContact CG2-CD1 3.87Å; I184-F194 HydrophobicContact CG2-CE1 3.8Å; I184-V197 HydrophobicContact CD1-CG2 4.33Å; I184-V197 HydrophobicContact CG1-CG2 3.84Å; I184-V205 HydrophobicContact CD1-CG1 4.4Å; I184-V205 HydrophobicContact CD1-CG2 3.88Å
185F96.3Very high92.1Very high0 Ų033.9 Ų33.90%019%0.187CC..EExtended strand (participates in β ladder)trans-107.9118.8176.2-64.4-93000109.3V167 V169 L183 F187 V192 V193 W195 V257 K260 F261 S264V167-F185 HydrophobicContact CG1-CB 4.39Å; V167-F185 HydrophobicContact CG1-CD1 4.14Å; V169-F185 HydrophobicContact CB-CD1 4.44Å; V169-F185 HydrophobicContact CB-CE1 4.42Å; V169-F185 HydrophobicContact CG1-CD1 4.21Å; V169-F185 HydrophobicContact CG1-CE1 3.89Å; V169-F185 HydrophobicContact CG1-CZ 4.26Å; V169-F185 HydrophobicContact CG2-CD1 3.54Å; V169-F185 HydrophobicContact CG2-CE1 3.6Å; L183-F185 HydrophobicContact CB-CE2 4.18Å; F185-F187 HydrophobicContact CB-CD2 4.32Å; F185-F187 HydrophobicContact CB-CE2 3.59Å; F185-F187 HydrophobicContact CB-CZ 4.25Å; F185-V192 CarbonylContact O-C 3.48Å; F185-V192 VanDerWaalsContact O-CA 3.25Å; F185-V192 WeakPolarHBondContact O-CA 3.46Å; F185-V193 HydrophobicContact CB-CB 4.34Å; F185-V193 PolarHBondContact N-O 2.83Å; F185-V193 PolarHBondContact O-N 3.42Å; F185-W195 AromaticContact CD2-CD1 3.6Å; F185-W195 AromaticContact CD2-NE1 3.7Å; F185-W195 AromaticContact CE2-CD1 3.54Å; F185-W195 HydrophobicContact CE2-CG 4.42Å; F185-W195 AromaticContact CE2-NE1 3.64Å; F185-V257 HydrophobicContact CE1-CG1 4.39Å; F185-V257 HydrophobicContact CZ-CG1 4.35Å; F185-K260 HydrophobicContact CE2-CB 3.98Å; F185-K260 HydrophobicContact CZ-CB 3.87Å; F185-F261 HydrophobicContact CD1-CB 4.47Å; F185-F261 HydrophobicContact CD1-CD2 4.21Å; F185-F261 HydrophobicContact CE1-CB 3.83Å; F185-F261 HydrophobicContact CE1-CD2 4.28Å; F185-F261 HydrophobicContact CZ-CB 4.4Å; F185-S264 WeakPolarHBondContact CD2-OG 3.38Å
186F95.7Very high92.3Very high0 Ų032.3 Ų32.30%017%0.173CC..EExtended strand (participates in β ladder)trans-104.5117.4172.9-58.2-90.9000109.7Y141 L143 L146 L150 V167 L168 I170 I184 V192 V205 L209Y141-F186 HydrophobicContact CD2-CB 4.46Å; L143-F186 HydrophobicContact CD2-CB 4Å; L146-F186 HydrophobicContact CD2-CB 4.12Å; L146-F186 HydrophobicContact CD2-CD1 3.65Å; L146-F186 HydrophobicContact CD2-CD2 4.47Å; L146-F186 HydrophobicContact CD2-CE1 4.09Å; L146-F186 HydrophobicContact CD2-CG 3.83Å; L150-F186 HydrophobicContact CD1-CD2 4.25Å; L150-F186 HydrophobicContact CD1-CE1 4.49Å; L150-F186 HydrophobicContact CD1-CE2 3.52Å; L150-F186 HydrophobicContact CD1-CZ 3.65Å; V167-F186 WeakPolarHBondContact CA-O 3.45Å; L168-F186 HydrophobicContact CB-CB 4.22Å; L168-F186 HydrophobicContact CD2-CD2 4.21Å; L168-F186 HydrophobicContact CG-CD2 4.29Å; L168-F186 PolarHBondContact N-O 2.84Å; L168-F186 PolarHBondContact O-N 3.08Å; I170-F186 HydrophobicContact CB-CE2 4.11Å; I170-F186 HydrophobicContact CG1-CD2 4.21Å; I170-F186 HydrophobicContact CG1-CE2 3.87Å; I184-F186 HydrophobicContact CB-CE2 3.96Å; I184-F186 HydrophobicContact CB-CZ 4.37Å; I184-F186 HydrophobicContact CG2-CD2 4.05Å; I184-F186 HydrophobicContact CG2-CE1 4.1Å; I184-F186 HydrophobicContact CG2-CE2 3.42Å; I184-F186 VanDerWaalsContact CG2-CE2 3.42Å; I184-F186 HydrophobicContact CG2-CZ 3.47Å; I184-F186 VanDerWaalsContact CG2-CZ 3.47Å; F186-V192 HydrophobicContact CD1-CB 4.03Å; F186-V192 HydrophobicContact CD1-CG2 3.6Å; F186-V192 HydrophobicContact CE1-CB 4.36Å; F186-V192 HydrophobicContact CE1-CG2 3.59Å; F186-V192 HydrophobicContact CG-CG2 4.3Å; F186-V192 HydrophobicContact CZ-CG2 4.28Å; F186-V205 HydrophobicContact CE1-CG1 3.78Å; F186-V205 HydrophobicContact CZ-CG1 3.5Å; F186-L209 HydrophobicContact CD1-CD1 3.94Å; F186-L209 HydrophobicContact CE1-CD1 4.03Å; F186-L209 HydrophobicContact CE1-CD2 4.41Å
187F93.6Very high92.6Very high0 Ų030 Ų300%015%0.153CC..EExtended strand (participates in β ladder)trans-93.4133.2177.8-67.7-99.1000109.1Y141 V167 F185 E189 G190 S191 V193 F261 N265 C268Y141-F187 WeakPolarHBondContact CD2-O 3.44Å; V167-F187 HydrophobicContact CG1-CE1 4.38Å; V167-F187 HydrophobicContact CG1-CZ 4.37Å; V167-F187 HydrophobicContact CG2-CD1 3.32Å; V167-F187 HydrophobicContact CG2-CE1 3.42Å; V167-F187 VanDerWaalsContact CG2-CE1 3.42Å; V167-F187 HydrophobicContact CG2-CG 4.04Å; V167-F187 HydrophobicContact CG2-CZ 4.21Å; F185-F187 HydrophobicContact CB-CD2 4.32Å; F185-F187 HydrophobicContact CB-CE2 3.59Å; F185-F187 HydrophobicContact CB-CZ 4.25Å; F187-E189 PolarHBondContact O-N 3.27Å; F187-G190 PolarHBondContact O-N 3.23Å; F187-S191 WeakPolarHBondContact CB-O 3.07Å; F187-S191 PolarHBondContact N-O 2.86Å; F187-V193 HydrophobicContact CE2-CG2 3.98Å; F187-F261 HydrophobicContact CE1-CE2 4.36Å; F187-N265 HydrophobicContact CE1-CB 3.96Å; F187-N265 WeakPolarHBondContact CE1-OD1 3.22Å; F187-N265 HydrophobicContact CZ-CB 4.22Å; F187-C268 HydrophobicContact CD1-CB 4.32Å; F187-C268 HydrophobicContact CD2-CB 3.73Å; F187-C268 WeakPolarHBondContact CD2-SG 3.43Å; F187-C268 HydrophobicContact CE1-CB 4.49Å; F187-C268 HydrophobicContact CE2-CB 3.92Å; F187-C268 WeakPolarHBondContact CE2-SG 3.2Å; F187-C268 HydrophobicContact CG-CB 3.95Å; F187-C268 HydrophobicContact CZ-CB 4.31Å
188R91.2Very high92.8Very high129 Ų12931.7 Ų31.749%0.48716%0.162SC..THydrogen-bonded Turntrans-53.8-28177-177.9177.5173.7172.60.7112.1Q140 Y141 L143 N166 G190Q140-R188 CarbonylContact C-O 3.52Å; Q140-R188 WeakPolarHBondContact CA-O 3.46Å; Q140-R188 WeakPolarHBondContact CB-O 3.17Å; Y141-R188 PolarHBondContact N-O 3.14Å; L143-R188 HydrophobicContact CD1-CB 3.83Å; L143-R188 HydrophobicContact CG-CB 4.23Å; N166-R188 HydrophobicContact CB-CB 4.26Å; N166-R188 WeakPolarHBondContact O-CB 3.2Å; N166-R188 PolarHBondContact O-N 3.35Å; R188-G190 PolarHBondContact O-N 2.93Å
189E87.3Confident93.1Very high33 Ų3330.3 Ų30.315%0.15415%0.145CC..THydrogen-bonded Turntrans-64.7-0.4175.5-6875.8-153.200114.1D139 F187 L269 K273D139-E189 CarbonylContact C-O 3.28Å; D139-E189 CarbonylContact O-C 3.58Å; F187-E189 PolarHBondContact O-N 3.27Å; E189-L269 HydrophobicContact CB-CD2 3.8Å; E189-L269 HydrophobicContact CG-CD2 3.54Å; E189-K273 WeakPolarHBondContact O-CE 3.02Å; E189-K273 PolarHBondContact O-NZ 3.31Å
190G91.3Very high93.5Very high0 Ų032.6 Ų32.60%015%0.15CC..THydrogen-bonded Turntrans81.737.5174.800000112.9T137 A138 Y141 F187 R188 K273T137-G190 PolarHBondContact N-O 2.91Å; T137-G190 VanDerWaalsContact N-O 3.09Å; A138-G190 PolarHBondContact N-O 3.03Å; A138-G190 CarbonylContact O-C 3.56Å; A138-G190 VanDerWaalsContact O-CA 3.22Å; A138-G190 WeakPolarHBondContact O-CA 3.21Å; Y141-G190 VanDerWaalsContact CE1-CA 3.49Å; Y141-G190 VanDerWaalsContact CE2-C 3.5Å; Y141-G190 VanDerWaalsContact CZ-CA 3.43Å; Y141-G190 PolarHBondContact OH-O 3.24Å; F187-G190 PolarHBondContact O-N 3.23Å; R188-G190 PolarHBondContact O-N 2.93Å; G190-K273 WeakPolarHBondContact O-CE 3.46Å; G190-K273 PolarHBondContact O-NZ 3.26Å; G190-K273 VanDerWaalsContact O-NZ 3.12Å
191S92.8Very high93.8Very high0 Ų032.1 Ų32.10%015%0.147CC..EExtended strand (participates in β ladder)trans-129.3147.7173.8-55.80000110.6F135 Y141 F187 C268 K273F135-S191 CarbonylContact O-C 3.58Å; F135-S191 WeakPolarHBondContact O-CA 3.38Å; F135-S191 WeakPolarHBondContact O-CB 3.3Å; Y141-S191 WeakPolarHBondContact CE2-O 3.37Å; Y141-S191 PolarHBondContact OH-N 2.94Å; F187-S191 WeakPolarHBondContact CB-O 3.07Å; F187-S191 PolarHBondContact N-O 2.86Å; S191-C268 WeakPolarHBondContact CB-SG 3.13Å; S191-C268 PolarHBondContact OG-O 3.13Å; S191-K273 VanDerWaalsContact OG-CE 3.28Å; S191-K273 WeakPolarHBondContact OG-CE 3.37Å; S191-K273 WeakPolarHBondContact OG-CG 3.24Å
192V95.8Very high94.1Very high0 Ų028 Ų280%012%0.124CC..EExtended strand (participates in β ladder)trans-131138.3179.9590000110.3A134 F135 T137 Y141 I184 F185 F186 F194 L206 L209A134-V192 CarbonylContact C-O 3.58Å; A134-V192 WeakPolarHBondContact CA-O 3.49Å; F135-V192 HydrophobicContact CB-CG1 3.96Å; F135-V192 HydrophobicContact CD2-CG1 4.46Å; F135-V192 PolarHBondContact N-O 3.05Å; F135-V192 PolarHBondContact O-N 3.46Å; T137-V192 HydrophobicContact CG2-CG1 4.29Å; Y141-V192 HydrophobicContact CE2-CB 4.47Å; I184-V192 HydrophobicContact CG2-CG2 3.63Å; F185-V192 CarbonylContact O-C 3.48Å; F185-V192 VanDerWaalsContact O-CA 3.25Å; F185-V192 WeakPolarHBondContact O-CA 3.46Å; F186-V192 HydrophobicContact CD1-CB 4.03Å; F186-V192 HydrophobicContact CD1-CG2 3.6Å; F186-V192 HydrophobicContact CE1-CB 4.36Å; F186-V192 HydrophobicContact CE1-CG2 3.59Å; F186-V192 HydrophobicContact CG-CG2 4.3Å; F186-V192 HydrophobicContact CZ-CG2 4.28Å; V192-F194 HydrophobicContact CB-CE2 4.33Å; V192-F194 HydrophobicContact CG1-CE2 3.67Å; V192-F194 HydrophobicContact CG1-CZ 4.08Å; V192-F194 HydrophobicContact CG2-CD2 4.34Å; V192-F194 HydrophobicContact CG2-CE1 4.2Å; V192-F194 HydrophobicContact CG2-CE2 3.74Å; V192-F194 HydrophobicContact CG2-CZ 3.66Å; V192-L206 HydrophobicContact CG1-CD2 4.17Å; V192-L209 HydrophobicContact CB-CD2 4.37Å; V192-L209 HydrophobicContact CG1-CD2 4.04Å
193V96.3Very high94.1Very high0 Ų033 Ų330%015%0.146CC..EExtended strand (participates in β ladder)trans-119.7132.3173.9-167.90000109.9C132 I133 A134 I184 F185 F187 C268C132-V193 WeakPolarHBondContact SG-CG1 3.47Å; I133-V193 CarbonylContact O-C 3.56Å; I133-V193 WeakPolarHBondContact O-CA 3.11Å; A134-V193 HydrophobicContact CB-CG1 4.37Å; A134-V193 HydrophobicContact CB-CG2 3.94Å; I184-V193 CarbonylContact C-O 3.58Å; I184-V193 VanDerWaalsContact CA-O 3.32Å; I184-V193 WeakPolarHBondContact CA-O 3.29Å; F185-V193 HydrophobicContact CB-CB 4.34Å; F185-V193 PolarHBondContact N-O 2.83Å; F185-V193 PolarHBondContact O-N 3.42Å; F187-V193 HydrophobicContact CE2-CG2 3.98Å; V193-C268 HydrophobicContact CG2-CB 4.46Å; V193-C268 WeakPolarHBondContact CG2-SG 3.48Å
194F96.1Very high94Very high2 Ų236.3 Ų36.31%0.00916%0.16CC..EExtended strand (participates in β ladder)trans-109.3125.5176.4-60-86.7000109.5C132 I133 F135 I184 V192 V197 M202 V205 L206C132-F194 CarbonylContact C-O 3.55Å; C132-F194 VanDerWaalsContact CA-O 3.32Å; C132-F194 WeakPolarHBondContact CA-O 3.45Å; I133-F194 PolarHBondContact N-O 3.05Å; I133-F194 PolarHBondContact O-N 3.21Å; F135-F194 AromaticContact CD2-CD2 3.74Å; F135-F194 HydrophobicContact CD2-CD2 3.74Å; F135-F194 AromaticContact CD2-CE2 3.57Å; F135-F194 HydrophobicContact CD2-CE2 3.57Å; F135-F194 AromaticContact CE2-CD2 3.75Å; F135-F194 HydrophobicContact CE2-CD2 3.75Å; F135-F194 AromaticContact CE2-CE2 3.8Å; F135-F194 HydrophobicContact CE2-CE2 3.8Å; I184-F194 HydrophobicContact CB-CD1 4.5Å; I184-F194 HydrophobicContact CD1-CD1 4.03Å; I184-F194 HydrophobicContact CD1-CE1 4.03Å; I184-F194 HydrophobicContact CG1-CD1 3.93Å; I184-F194 HydrophobicContact CG1-CE1 4.32Å; I184-F194 HydrophobicContact CG2-CD1 3.87Å; I184-F194 HydrophobicContact CG2-CE1 3.8Å; V192-F194 HydrophobicContact CB-CE2 4.33Å; V192-F194 HydrophobicContact CG1-CE2 3.67Å; V192-F194 HydrophobicContact CG1-CZ 4.08Å; V192-F194 HydrophobicContact CG2-CD2 4.34Å; V192-F194 HydrophobicContact CG2-CE1 4.2Å; V192-F194 HydrophobicContact CG2-CE2 3.74Å; V192-F194 HydrophobicContact CG2-CZ 3.66Å; F194-V197 HydrophobicContact CB-CB 4.19Å; F194-V197 HydrophobicContact CB-CG2 3.99Å; F194-V197 HydrophobicContact CD1-CB 4.25Å; F194-V197 HydrophobicContact CD1-CG1 4.32Å; F194-V197 HydrophobicContact CD1-CG2 4.07Å; F194-M202 HydrophobicContact CB-CE 4Å; F194-M202 HydrophobicContact CD1-CB 4.36Å; F194-M202 HydrophobicContact CD1-CG 3.92Å; F194-M202 HydrophobicContact CD2-CE 4.35Å; F194-M202 HydrophobicContact CD2-CG 3.85Å; F194-M202 HydrophobicContact CD2-SD 4.24Å; F194-M202 HydrophobicContact CE1-CB 4.36Å; F194-M202 HydrophobicContact CE1-CG 3.85Å; F194-M202 HydrophobicContact CE2-CG 3.77Å; F194-M202 HydrophobicContact CG-CE 4.13Å; F194-M202 HydrophobicContact CG-CG 3.92Å; F194-M202 HydrophobicContact CG-SD 4.49Å; F194-M202 HydrophobicContact CZ-CG 3.78Å; F194-V205 HydrophobicContact CE1-CB 4.02Å; F194-V205 HydrophobicContact CE1-CG1 3.77Å; F194-V205 HydrophobicContact CZ-CB 4.41Å; F194-V205 HydrophobicContact CZ-CG1 4.01Å; F194-L206 HydrophobicContact CE2-CD2 4.19Å; F194-L206 HydrophobicContact CE2-CG 4.44Å; F194-L206 HydrophobicContact CZ-CD2 4.11Å; F194-L206 HydrophobicContact CZ-CG 4.14Å
195W96Very high93.9Very high0 Ų036.3 Ų36.30%016%0.16CC..EExtended strand (participates in β ladder)trans-111.3120.6172.9-69.977.9000109.4C132 A182 L183 F185 V197 Y231 F245 L247 K260 F263 S264C132-W195 HydrophobicContact CB-CD2 4.08Å; C132-W195 HydrophobicContact CB-CE3 3.99Å; C132-W195 HydrophobicContact CB-CH2 4.18Å; C132-W195 HydrophobicContact CB-CZ2 4.26Å; C132-W195 HydrophobicContact CB-CZ3 4.04Å; C132-W195 WeakPolarHBondContact SG-CZ2 3.49Å; A182-W195 WeakPolarHBondContact CA-O 3.47Å; L183-W195 HydrophobicContact CB-CB 4.22Å; L183-W195 PolarHBondContact N-O 3.47Å; L183-W195 PolarHBondContact O-N 2.9Å; F185-W195 AromaticContact CD2-CD1 3.6Å; F185-W195 AromaticContact CD2-NE1 3.7Å; F185-W195 AromaticContact CE2-CD1 3.54Å; F185-W195 HydrophobicContact CE2-CG 4.42Å; F185-W195 AromaticContact CE2-NE1 3.64Å; W195-V197 WeakPolarHBondContact O-CG2 3.44Å; W195-V197 PolarHBondContact O-N 3.02Å; W195-Y231 AromaticContact CE3-CD1 3.98Å; W195-Y231 HydrophobicContact CE3-CD1 3.98Å; W195-Y231 AromaticContact CE3-CE1 3.6Å; W195-Y231 HydrophobicContact CE3-CE1 3.6Å; W195-Y231 HydrophobicContact CE3-CE2 4.24Å; W195-Y231 HydrophobicContact CE3-CG 4.42Å; W195-Y231 AromaticContact CE3-CZ 3.72Å; W195-Y231 AromaticContact CZ3-CD1 4Å; W195-Y231 HydrophobicContact CZ3-CD1 4Å; W195-Y231 HydrophobicContact CZ3-CD2 4.34Å; W195-Y231 HydrophobicContact CZ3-CE1 4.09Å; W195-Y231 HydrophobicContact CZ3-CE2 4.43Å; W195-Y231 HydrophobicContact CZ3-CG 4.1Å; W195-F245 AromaticContact CH2-CD2 3.61Å; W195-F245 HydrophobicContact CH2-CD2 3.61Å; W195-F245 AromaticContact CH2-CE2 3.91Å; W195-F245 HydrophobicContact CH2-CE2 3.91Å; W195-F245 HydrophobicContact CH2-CG 4.47Å; W195-F245 HydrophobicContact CZ2-CE2 4.46Å; W195-F245 HydrophobicContact CZ3-CD2 4.06Å; W195-L247 HydrophobicContact CZ3-CD1 4.17Å; W195-K260 HydrophobicContact CD2-CB 4.35Å; W195-K260 HydrophobicContact CD2-CD 4.31Å; W195-K260 HydrophobicContact CD2-CG 4.14Å; W195-K260 HydrophobicContact CE3-CD 4.3Å; W195-K260 HydrophobicContact CE3-CG 4.06Å; W195-K260 HydrophobicContact CH2-CG 4.3Å; W195-K260 HydrophobicContact CZ2-CB 4.16Å; W195-K260 HydrophobicContact CZ2-CG 4.36Å; W195-K260 HydrophobicContact CZ3-CG 4.15Å; W195-F263 HydrophobicContact CH2-CB 3.87Å; W195-F263 HydrophobicContact CH2-CD2 4.05Å; W195-F263 HydrophobicContact CH2-CG 4.26Å; W195-F263 HydrophobicContact CZ2-CB 3.73Å; W195-S264 PolarHBondContact NE1-OG 3.38Å
196N94.6Very high93.8Very high3 Ų337.5 Ų37.52%0.01617%0.166CC..SBendtrans50.432.7177.2-165.430000114.6Q131 A175 A176 K177 D180 A182 Y231Q131-N196 PolarHBondContact O-N 2.83Å; A175-N196 CarbonylContact C-O 3.52Å; A175-N196 VanDerWaalsContact CA-O 3.29Å; A175-N196 WeakPolarHBondContact CA-O 3.38Å; A176-N196 WeakPolarHBondContact CB-OD1 3.25Å; A176-N196 PolarHBondContact N-O 3.19Å; A176-N196 PolarHBondContact N-OD1 3.47Å; K177-N196 PolarHBondContact N-OD1 2.88Å; K177-N196 PolarHBondContact O-ND2 2.87Å; D180-N196 PolarHBondContact O-ND2 2.86Å; A182-N196 WeakPolarHBondContact CB-O 3.33Å; N196-Y231 VanDerWaalsContact CB-OH 3.3Å; N196-Y231 WeakPolarHBondContact CB-OH 3.2Å
197V94.7Very high93.8Very high11 Ų1145.8 Ų45.87%0.06720%0.197CC..BIsolated β-bridgetrans-92.3133.6-179.8-176.10000110.2T172 A182 I184 F194 W195 E201 M202T172-V197 HydrophobicContact CG2-CG1 4.41Å; T172-V197 HydrophobicContact CG2-CG2 4.47Å; A182-V197 HydrophobicContact CB-CG2 4.17Å; I184-V197 HydrophobicContact CD1-CG2 4.33Å; I184-V197 HydrophobicContact CG1-CG2 3.84Å; F194-V197 HydrophobicContact CB-CB 4.19Å; F194-V197 HydrophobicContact CB-CG2 3.99Å; F194-V197 HydrophobicContact CD1-CB 4.25Å; F194-V197 HydrophobicContact CD1-CG1 4.32Å; F194-V197 HydrophobicContact CD1-CG2 4.07Å; W195-V197 WeakPolarHBondContact O-CG2 3.44Å; W195-V197 PolarHBondContact O-N 3.02Å; V197-E201 HydrophobicContact CG1-CB 3.89Å; V197-E201 HydrophobicContact CG1-CG 4.37Å; V197-M202 HydrophobicContact CG1-CB 4.37Å
198Q93.9Very high93.8Very high86 Ų8646.9 Ų46.940%0.40220%0.203SC..  trans-62140.4175-167.3-17957.600111.6N174 K200 E201 M202N174-Q198 PolarHBondContact O-N 2.93Å; Q198-K200 PolarHBondContact O-N 3.05Å; Q198-E201 PolarHBondContact O-N 2.81Å; Q198-M202 PolarHBondContact O-N 2.83Å
199E91.6Very high93.9Very high121 Ų12140.7 Ų40.757%0.56518%0.18SC*.Hα-helixtrans-57.1-30.7-175.7-161.4-173.6160.500113.9K203E199-K203 WeakPolarHBondContact O-CG 3.32Å; E199-K203 PolarHBondContact O-N 3.02Å; E199-K203 VanDerWaalsContact OE1-CE 3.24Å; E199-K203 WeakPolarHBondContact OE1-CE 3.45Å; E199-K203 IonicContact OE1-NZ 3.75Å; E199-K203 PolarHBondContact OE1-NZ 3.3Å
200K93.1Very high94.3Very high163 Ų16344.6 Ų44.671%0.70920%0.198SC*.Hα-helixtrans-65.6-44.5174.6-69.1-179.7-178.1173.40111.9Q198 K203 K204Q198-K200 PolarHBondContact O-N 3.05Å; K200-K203 PolarHBondContact O-N 2.67Å; K200-K204 PolarHBondContact O-N 3.23Å; K200-K204 VanDerWaalsContact O-N 3.14Å
201E94.2Very high94.4Very high17 Ų1751.7 Ų51.78%0.07923%0.231CC..Hα-helixtrans-70.1-40.3179-158.965.8-159.100110.3F155 N174 V197 Q198 K203 K204 V205F155-E201 HydrophobicContact CE1-CG 4.14Å; F155-E201 WeakPolarHBondContact CE1-OE1 3.32Å; F155-E201 HydrophobicContact CZ-CG 4.26Å; F155-E201 WeakPolarHBondContact CZ-OE1 3.4Å; N174-E201 HydrophobicContact CB-CB 4.18Å; N174-E201 HydrophobicContact CB-CG 4.13Å; N174-E201 PolarHBondContact ND2-OE2 2.87Å; V197-E201 HydrophobicContact CG1-CB 3.89Å; V197-E201 HydrophobicContact CG1-CG 4.37Å; Q198-E201 PolarHBondContact O-N 2.81Å; E201-K203 PolarHBondContact O-N 2.77Å; E201-K204 WeakPolarHBondContact O-CB 3.46Å; E201-K204 PolarHBondContact O-N 3.5Å; E201-K204 VanDerWaalsContact O-N 3.09Å; E201-K204 IonicContact OE1-NZ 3.61Å; E201-K204 PolarHBondContact OE1-NZ 3.06Å; E201-V205 WeakPolarHBondContact O-CG2 3.3Å; E201-V205 PolarHBondContact O-N 3.42Å
202M94.4Very high94.5Very high16 Ų1653 Ų538%0.07924%0.237CC..Hα-helixtrans-55.9-47.5173.6-173.6-169.2-60.200112I133 F135 F194 V197 Q198 K204 V205 L206I133-M202 HydrophobicContact CD1-CE 3.77Å; F135-M202 HydrophobicContact CE2-CG 4.48Å; F135-M202 HydrophobicContact CE2-SD 3.7Å; F135-M202 HydrophobicContact CZ-SD 3.95Å; F194-M202 HydrophobicContact CB-CE 4Å; F194-M202 HydrophobicContact CD1-CB 4.36Å; F194-M202 HydrophobicContact CD1-CG 3.92Å; F194-M202 HydrophobicContact CD2-CE 4.35Å; F194-M202 HydrophobicContact CD2-CG 3.85Å; F194-M202 HydrophobicContact CD2-SD 4.24Å; F194-M202 HydrophobicContact CE1-CB 4.36Å; F194-M202 HydrophobicContact CE1-CG 3.85Å; F194-M202 HydrophobicContact CE2-CG 3.77Å; F194-M202 HydrophobicContact CG-CE 4.13Å; F194-M202 HydrophobicContact CG-CG 3.92Å; F194-M202 HydrophobicContact CG-SD 4.49Å; F194-M202 HydrophobicContact CZ-CG 3.78Å; V197-M202 HydrophobicContact CG1-CB 4.37Å; Q198-M202 PolarHBondContact O-N 2.83Å; M202-K204 VanDerWaalsContact C-N 3.31Å; M202-K204 PolarHBondContact O-N 3.44Å; M202-V205 PolarHBondContact O-N 2.86Å; M202-L206 HydrophobicContact CG-CD1 4.31Å; M202-L206 WeakPolarHBondContact O-CG 3.49Å; M202-L206 PolarHBondContact O-N 3.27Å
203K94Very high94.5Very high105 Ų10554.7 Ų54.746%0.45725%0.245SC..Hα-helixtrans-63.3-35.4176.3-75.1171.6-175.7163.20112.8E199 K200 E201 R207E199-K203 WeakPolarHBondContact O-CG 3.32Å; E199-K203 PolarHBondContact O-N 3.02Å; E199-K203 VanDerWaalsContact OE1-CE 3.24Å; E199-K203 WeakPolarHBondContact OE1-CE 3.45Å; E199-K203 IonicContact OE1-NZ 3.75Å; E199-K203 PolarHBondContact OE1-NZ 3.3Å; K200-K203 PolarHBondContact O-N 2.67Å; E201-K203 PolarHBondContact O-N 2.77Å; K203-R207 WeakPolarHBondContact O-CG 3.27Å; K203-R207 PolarHBondContact O-N 2.99Å
204K94.3Very high94.4Very high76 Ų7658 Ų5833%0.3326%0.262SS..Hα-helixtrans-65.8-46.9175.1174.9-175.5160.8-151.40110.5K200 E201 M202 R207 L208K200-K204 PolarHBondContact O-N 3.23Å; K200-K204 VanDerWaalsContact O-N 3.14Å; E201-K204 WeakPolarHBondContact O-CB 3.46Å; E201-K204 PolarHBondContact O-N 3.5Å; E201-K204 VanDerWaalsContact O-N 3.09Å; E201-K204 IonicContact OE1-NZ 3.61Å; E201-K204 PolarHBondContact OE1-NZ 3.06Å; M202-K204 VanDerWaalsContact C-N 3.31Å; M202-K204 PolarHBondContact O-N 3.44Å; K204-R207 PolarHBondContact O-N 2.86Å; K204-L208 PolarHBondContact O-N 3.34Å; K204-L208 VanDerWaalsContact O-N 3.16Å
205V95.3Very high94.1Very high1 Ų161 Ų611%0.00628%0.276CS..Hα-helixtrans-62.1-44.9178.2170.90000111.5F155 I184 F186 F194 E201 M202 R207 L208 L209F155-V205 HydrophobicContact CE1-CG2 3.94Å; F155-V205 HydrophobicContact CE2-CG2 4.24Å; F155-V205 HydrophobicContact CZ-CG2 3.49Å; F155-V205 VanDerWaalsContact CZ-CG2 3.49Å; I184-V205 HydrophobicContact CD1-CG1 4.4Å; I184-V205 HydrophobicContact CD1-CG2 3.88Å; F186-V205 HydrophobicContact CE1-CG1 3.78Å; F186-V205 HydrophobicContact CZ-CG1 3.5Å; F194-V205 HydrophobicContact CE1-CB 4.02Å; F194-V205 HydrophobicContact CE1-CG1 3.77Å; F194-V205 HydrophobicContact CZ-CB 4.41Å; F194-V205 HydrophobicContact CZ-CG1 4.01Å; E201-V205 WeakPolarHBondContact O-CG2 3.3Å; E201-V205 PolarHBondContact O-N 3.42Å; M202-V205 PolarHBondContact O-N 2.86Å; V205-R207 VanDerWaalsContact C-N 3.27Å; V205-R207 PolarHBondContact O-N 3.18Å; V205-L208 PolarHBondContact O-N 3.03Å; V205-L208 VanDerWaalsContact O-N 3.12Å; V205-L209 WeakPolarHBondContact O-CB 3.3Å; V205-L209 PolarHBondContact O-N 3.46Å
206L94.4Very high94Very high25 Ų2564.7 Ų64.713%0.13130%0.3CS..Hα-helixtrans-59.1-37.3177-72.2172.5000112.3T137 V192 F194 M202 L209 E210T137-L206 HydrophobicContact CG2-CD2 4.06Å; V192-L206 HydrophobicContact CG1-CD2 4.17Å; F194-L206 HydrophobicContact CE2-CD2 4.19Å; F194-L206 HydrophobicContact CE2-CG 4.44Å; F194-L206 HydrophobicContact CZ-CD2 4.11Å; F194-L206 HydrophobicContact CZ-CG 4.14Å; M202-L206 HydrophobicContact CG-CD1 4.31Å; M202-L206 WeakPolarHBondContact O-CG 3.49Å; M202-L206 PolarHBondContact O-N 3.27Å; L206-L209 HydrophobicContact CD2-CD2 4.38Å; L206-L209 WeakPolarHBondContact O-CB 3.1Å; L206-L209 PolarHBondContact O-N 2.88Å; L206-E210 PolarHBondContact O-N 3.06Å
207R94.1Very high93.8Very high173 Ų17365.6 Ų65.665%0.65330%0.303SS*.Hα-helixtrans-68.8-35175.5-71.3173.8-174.3179.52.5113.6K203 K204 V205 L209 H211K203-R207 WeakPolarHBondContact O-CG 3.27Å; K203-R207 PolarHBondContact O-N 2.99Å; K204-R207 PolarHBondContact O-N 2.86Å; V205-R207 VanDerWaalsContact C-N 3.27Å; V205-R207 PolarHBondContact O-N 3.18Å; R207-L209 VanDerWaalsContact C-N 3.33Å; R207-H211 PolarHBondContact O-ND1 2.72Å
208L94.1Very high93.5Very high23 Ų2371.5 Ų71.512%0.1233%0.33CS..Hα-helixtrans-67.5-42.2174.2-65169.9000109.6L150 H153 F155 K204 V205 E210 H211 H212L150-L208 HydrophobicContact CD2-CD1 4.07Å; H153-L208 HydrophobicContact CB-CD1 4.3Å; F155-L208 HydrophobicContact CE2-CD1 4.21Å; K204-L208 PolarHBondContact O-N 3.34Å; K204-L208 VanDerWaalsContact O-N 3.16Å; V205-L208 PolarHBondContact O-N 3.03Å; V205-L208 VanDerWaalsContact O-N 3.12Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 3.14Å; L208-H211 PolarHBondContact O-N 3.36Å; L208-H212 PolarHBondContact O-CD2 2.92Å
209L94.6Very high93.2Very high0 Ų071.7 Ų71.70%034%0.337CS..Hα-helixtrans-57.5-37.9-179.4-166.461.2000113.1T137 Y141 L146 F186 V192 V205 L206 R207 H211 H212 E213T137-L209 HydrophobicContact CG2-CD2 4.19Å; Y141-L209 HydrophobicContact CD1-CD1 4.03Å; Y141-L209 HydrophobicContact CD1-CG 4.44Å; Y141-L209 HydrophobicContact CD2-CD1 4.1Å; Y141-L209 HydrophobicContact CE1-CD1 3.98Å; Y141-L209 HydrophobicContact CE1-CD2 4.01Å; Y141-L209 HydrophobicContact CE1-CG 3.98Å; Y141-L209 HydrophobicContact CE2-CD1 4.03Å; Y141-L209 HydrophobicContact CE2-CD2 4.13Å; Y141-L209 HydrophobicContact CG-CD1 4.12Å; Y141-L209 WeakPolarHBondContact OH-CD2 3.4Å; L146-L209 HydrophobicContact CD1-CD1 3.9Å; L146-L209 HydrophobicContact CD2-CD1 3.53Å; L146-L209 HydrophobicContact CG-CD1 4.37Å; F186-L209 HydrophobicContact CD1-CD1 3.94Å; F186-L209 HydrophobicContact CE1-CD1 4.03Å; F186-L209 HydrophobicContact CE1-CD2 4.41Å; V192-L209 HydrophobicContact CB-CD2 4.37Å; V192-L209 HydrophobicContact CG1-CD2 4.04Å; V205-L209 WeakPolarHBondContact O-CB 3.3Å; V205-L209 PolarHBondContact O-N 3.46Å; L206-L209 HydrophobicContact CD2-CD2 4.38Å; L206-L209 WeakPolarHBondContact O-CB 3.1Å; L206-L209 PolarHBondContact O-N 2.88Å; R207-L209 VanDerWaalsContact C-N 3.33Å; L209-H211 PolarHBondContact O-N 3.4Å; L209-H212 PolarHBondContact O-N 3.17Å; L209-E213 HydrophobicContact CG-CG 4.29Å; L209-E213 WeakPolarHBondContact O-CG 3.31Å; L209-E213 PolarHBondContact O-N 2.83Å
210E93.8Very high92.9Very high114 Ų11468.2 Ų68.253%0.53333%0.329SS..G310 helixtrans-48.7-32.2178.3-72.8176.5-171.300113.8L206 L208 H212L206-E210 PolarHBondContact O-N 3.06Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 3.14Å; E210-H212 VanDerWaalsContact C-N 3.32Å
211H94.1Very high92.5Very high149 Ų14961.7 Ų61.769%0.6930%0.302SS*.G310 helixtrans-79.5-15.2-179-61.682.6000113.6R207 L208 L209R207-H211 PolarHBondContact O-ND1 2.72Å; L208-H211 PolarHBondContact O-N 3.36Å; L209-H211 PolarHBondContact O-N 3.4Å
212H95.5Very high92.1Very high28 Ų2861.4 Ų61.413%0.1330%0.301CS..G310 helixtrans-113.85.8-175.7-58-67.7000112.8H142 T145 L146 D149 L208 L209 E210H142-H212 PolarHBondContact N-O 3.07Å; H142-H212 VanDerWaalsContact N-O 3.08Å; T145-H212 PolarHBondContact OG1-ND1 2.87Å; L146-H212 HydrophobicContact CB-CB 4.16Å; L146-H212 HydrophobicContact CD1-CB 4.35Å; D149-H212 IonicContact OD2-NE2 3.03Å; L208-H212 PolarHBondContact O-CD2 2.92Å; L209-H212 PolarHBondContact O-N 3.17Å; E210-H212 VanDerWaalsContact C-N 3.32Å
213E95.2Very high91.7Very high35 Ų3565.4 Ų65.416%0.16432%0.319CS..EExtended strand (participates in β ladder)trans-80.7129.9179.4-79.4175.3179.100112.4T137 A138 Y141 L209 P216T137-E213 WeakPolarHBondContact CB-OE1 3.26Å; T137-E213 PolarHBondContact OG1-OE1 3.43Å; A138-E213 HydrophobicContact CB-CB 3.61Å; A138-E213 HydrophobicContact CB-CG 3.57Å; Y141-E213 HydrophobicContact CD1-CG 3.98Å; Y141-E213 HydrophobicContact CE1-CG 3.77Å; L209-E213 HydrophobicContact CG-CG 4.29Å; L209-E213 WeakPolarHBondContact O-CG 3.31Å; L209-E213 PolarHBondContact O-N 2.83Å; E213-P216 HydrophobicContact CB-CB 4.21Å; E213-P216 VanDerWaalsContact OE2-CB 3.27Å; E213-P216 WeakPolarHBondContact OE2-CB 3.48Å
214I93.6Very high91.2Very high70 Ų7066.4 Ų66.436%0.35932%0.32SS..EExtended strand (participates in β ladder)trans-103.7112.1172.1-57172.2000107.3D139 Q140 H142D139-I214 PolarHBondContact N-O 3.22Å; D139-I214 VanDerWaalsContact N-O 3.15Å; Q140-I214 HydrophobicContact CB-CB 4.19Å; Q140-I214 HydrophobicContact CB-CD1 4.31Å; Q140-I214 PolarHBondContact N-O 2.73Å; Q140-I214 WeakPolarHBondContact O-CB 2.9Å; Q140-I214 PolarHBondContact O-N 3.36Å; H142-I214 HydrophobicContact CB-CD1 4.5Å
215Q90.4Very high90.7Very high64 Ų6462.9 Ų62.930%0.29931%0.305SS..EExtended strand (participates in β ladder)trans60.173.4-173.6-51.8-175.457.700112.3A138 D139A138-Q215 CarbonylContact C-O 3.47Å; A138-Q215 VanDerWaalsContact CA-O 3.3Å; A138-Q215 WeakPolarHBondContact CA-O 3.33Å; D139-Q215 HydrophobicContact CB-CB 4.11Å; D139-Q215 PolarHBondContact N-O 3.31Å; D139-Q215 PolarHBondContact OD2-OE1 2.99Å
216P93.4Very high90.4Very high78 Ų7864 Ų6451%0.50631%0.311SS..EExtended strand (participates in β ladder)trans-66.4147.3179.530.2-36.9000111.8E213E213-P216 HydrophobicContact CB-CB 4.21Å; E213-P216 VanDerWaalsContact OE2-CB 3.27Å; E213-P216 WeakPolarHBondContact OE2-CB 3.48Å
217Y90.5Very high90.1Very high22 Ų2262.8 Ų62.89%0.08631%0.305CS..PPolyproline II helixtrans-88.5165.8174.1-57.8-26.4000111.3A136 T137 D139 V219 K273 I276A136-Y217 HydrophobicContact CB-CE2 4.31Å; A136-Y217 WeakPolarHBondContact O-CD2 2.95Å; T137-Y217 PolarHBondContact O-N 3.27Å; D139-Y217 WeakPolarHBondContact OD1-CE1 3.47Å; D139-Y217 VanDerWaalsContact OD1-CZ 3.27Å; D139-Y217 PolarHBondContact OD1-OH 3.34Å; Y217-V219 PolarHBondContact O-N 3.12Å; Y217-K273 HydrophobicContact CE2-CD 4.39Å; Y217-K273 PolarHBondContact OH-NZ 3.41Å; Y217-I276 HydrophobicContact CD2-CD1 4.2Å; Y217-I276 HydrophobicContact CD2-CG1 4.02Å; Y217-I276 HydrophobicContact CD2-CG2 3.87Å; Y217-I276 HydrophobicContact CE1-CG2 4.42Å; Y217-I276 HydrophobicContact CE2-CB 4.16Å; Y217-I276 HydrophobicContact CE2-CG1 3.95Å; Y217-I276 HydrophobicContact CE2-CG2 3.64Å; Y217-I276 HydrophobicContact CG-CG2 4.34Å
218E88.9Confident89.9Confident136 Ų13658.1 Ų58.164%0.63629%0.29SS*.PPolyproline II helixtrans-67125.2176.8-174.517717500110.7A220 L221 V222E218-A220 HydrophobicContact CG-CB 4.34Å; E218-A220 PolarHBondContact O-N 3.16Å; E218-A220 VanDerWaalsContact O-N 3.09Å; E218-L221 HydrophobicContact CB-CB 4.25Å; E218-L221 WeakPolarHBondContact O-CA 3.44Å; E218-L221 VanDerWaalsContact O-CB 3.31Å; E218-L221 WeakPolarHBondContact O-CB 3.29Å; E218-L221 PolarHBondContact O-N 3.31Å; E218-V222 WeakPolarHBondContact O-CG2 3.37Å; E218-V222 PolarHBondContact O-N 3.25Å
219V87.5Confident89.7Confident89 Ų8957.2 Ų57.254%0.53929%0.285SS..Hα-helixtrans-50.8-39.7-177.5177.50000112.7Y217 L221 V222 H223Y217-V219 PolarHBondContact O-N 3.12Å; V219-L221 VanDerWaalsContact C-N 3.35Å; V219-L221 PolarHBondContact O-N 3.26Å; V219-V222 PolarHBondContact O-N 2.92Å; V219-H223 PolarHBondContact O-CD2 2.87Å; V219-H223 PolarHBondContact O-N 3.28Å
220A85.1Confident89.5Confident48 Ų4857.9 Ų57.940%0.39729%0.289SS..Hα-helixtrans-63.2-40.6176.900000112.3E218 W224E218-A220 HydrophobicContact CG-CB 4.34Å; E218-A220 PolarHBondContact O-N 3.16Å; E218-A220 VanDerWaalsContact O-N 3.09Å; A220-W224 WeakPolarHBondContact O-CB 3.39Å; A220-W224 PolarHBondContact O-N 3.48Å
221L85.5Confident89.4Confident27 Ų2752.4 Ų52.414%0.14126%0.263CS..Hα-helixtrans-68-43.1176.4-178.566.1000111E218 V219 H223 W224 E225 I276 V279E218-L221 HydrophobicContact CB-CB 4.25Å; E218-L221 WeakPolarHBondContact O-CA 3.44Å; E218-L221 VanDerWaalsContact O-CB 3.31Å; E218-L221 WeakPolarHBondContact O-CB 3.29Å; E218-L221 PolarHBondContact O-N 3.31Å; V219-L221 VanDerWaalsContact C-N 3.35Å; V219-L221 PolarHBondContact O-N 3.26Å; L221-H223 PolarHBondContact O-N 3.14Å; L221-W224 PolarHBondContact O-N 3.06Å; L221-W224 VanDerWaalsContact O-N 3.17Å; L221-E225 HydrophobicContact CD1-CG 3.74Å; L221-E225 HydrophobicContact CG-CG 4.36Å; L221-E225 WeakPolarHBondContact O-CB 3.47Å; L221-E225 PolarHBondContact O-N 3.41Å; L221-I276 HydrophobicContact CD1-CD1 4.41Å; L221-I276 HydrophobicContact CD2-CD1 3.8Å; L221-I276 HydrophobicContact CD2-CG2 4.26Å; L221-I276 HydrophobicContact CG-CD1 3.66Å; L221-V279 HydrophobicContact CD1-CB 4.26Å; L221-V279 HydrophobicContact CD1-CG1 3.88Å; L221-V279 HydrophobicContact CD1-CG2 4.15Å
222V86Confident89.3Confident11 Ų1147.7 Ų47.77%0.06725%0.245CC..Hα-helixtrans-56.9-49.4178.3175.30000111.5F135 A136 T137 E218 V219 W224 N226F135-V222 HydrophobicContact CB-CG1 4.23Å; F135-V222 HydrophobicContact CD1-CG1 4.08Å; A136-V222 WeakPolarHBondContact O-CG2 3.39Å; T137-V222 HydrophobicContact CG2-CG1 3.86Å; E218-V222 WeakPolarHBondContact O-CG2 3.37Å; E218-V222 PolarHBondContact O-N 3.25Å; V219-V222 PolarHBondContact O-N 2.92Å; V222-W224 VanDerWaalsContact C-N 3.34Å; V222-N226 PolarHBondContact O-N 3.09Å
223H85.8Confident89Confident99 Ų9949 Ų4946%0.45826%0.255SS..Hα-helixtrans-69.9-32.7177.6-73.9-62.6000112.6F135 V219 L221 N226F135-H223 AromaticContact CE1-ND1 3.86Å; V219-H223 PolarHBondContact O-CD2 2.87Å; V219-H223 PolarHBondContact O-N 3.28Å; L221-H223 PolarHBondContact O-N 3.14Å; H223-N226 PolarHBondContact O-OD1 3.39Å; H223-N226 VanDerWaalsContact O-OD1 3.12Å
224W82.4Confident88.5Confident126 Ų12648.4 Ų48.448%0.47726%0.258SS..Hα-helixtrans-72.7-34.8-178.8-174.4-88.4000112.9G109 R117 A220 L221 V222G109-W224 VanDerWaalsContact CA-NE1 3.3Å; R117-W224 VanDerWaalsContact CZ-O 3.27Å; R117-W224 PolarHBondContact NH1-O 2.93Å; R117-W224 PolarHBondContact NH2-O 3.06Å; A220-W224 WeakPolarHBondContact O-CB 3.39Å; A220-W224 PolarHBondContact O-N 3.48Å; L221-W224 PolarHBondContact O-N 3.06Å; L221-W224 VanDerWaalsContact O-N 3.17Å; V222-W224 VanDerWaalsContact C-N 3.34Å
225E85.1Confident87.9Confident3 Ų353.4 Ų53.41%0.01428%0.28CS..SBendtrans-96.88.8-178.7-63.5-57.9153.900113.8P110 L221 A275 I276 V279P110-E225 VanDerWaalsContact CD-OE1 3.22Å; P110-E225 WeakPolarHBondContact CD-OE1 3.42Å; L221-E225 HydrophobicContact CD1-CG 3.74Å; L221-E225 HydrophobicContact CG-CG 4.36Å; L221-E225 WeakPolarHBondContact O-CB 3.47Å; L221-E225 PolarHBondContact O-N 3.41Å; E225-A275 HydrophobicContact CB-CB 4.17Å; E225-A275 HydrophobicContact CG-CB 4.38Å; E225-I276 HydrophobicContact CB-CD1 4.01Å; E225-I276 HydrophobicContact CG-CD1 4.15Å; E225-V279 HydrophobicContact CG-CG2 4.46Å
226N88.1Confident87.6Confident24 Ų2452.4 Ų52.413%0.12829%0.287CS..  trans-59.9150.7176.481.3-31.8000112R117 A134 F135 V222 H223R117-N226 PolarHBondContact NH2-O 3.16Å; R117-N226 PolarHBondContact NH2-OD1 3.27Å; A134-N226 WeakPolarHBondContact O-CA 3.43Å; F135-N226 HydrophobicContact CD1-CB 3.59Å; F135-N226 HydrophobicContact CE1-CB 3.52Å; F135-N226 HydrophobicContact CG-CB 4.44Å; F135-N226 HydrophobicContact CZ-CB 4.34Å; V222-N226 PolarHBondContact O-N 3.09Å; H223-N226 PolarHBondContact O-OD1 3.39Å; H223-N226 VanDerWaalsContact O-OD1 3.12Å
227E88.8Confident87.2Confident0 Ų055.5 Ų55.50%030%0.3CS..EExtended strand (participates in β ladder)trans-113130.5176-71.5-77.4-174.300109Q114 S116 I133 A134 L267 A271 V272Q114-E227 VanDerWaalsContact CG-OE1 3.29Å; Q114-E227 WeakPolarHBondContact CG-OE1 3.19Å; Q114-E227 PolarHBondContact NE2-OE1 2.52Å; S116-E227 WeakPolarHBondContact CB-OE2 3.42Å; S116-E227 PolarHBondContact OG-OE2 3.41Å; I133-E227 CarbonylContact C-O 3.59Å; I133-E227 WeakPolarHBondContact CA-O 3.33Å; A134-E227 HydrophobicContact CB-CB 4.46Å; A134-E227 PolarHBondContact N-O 3.05Å; A134-E227 PolarHBondContact O-N 3.15Å; E227-L267 HydrophobicContact CB-CD2 4.45Å; E227-A271 HydrophobicContact CG-CB 3.95Å; E227-V272 HydrophobicContact CB-CG2 3.82Å; E227-V272 HydrophobicContact CG-CG2 3.65Å
228E89.1Confident87.3Confident75 Ų7555.1 Ų55.135%0.3530%0.299SS..EExtended strand (participates in β ladder)trans-128.8125.7-177.3177.5173.2178.400109S116 Q131 C132 I133S116-E228 WeakPolarHBondContact CB-O 3.31Å; Q131-E228 VanDerWaalsContact CD-OE1 3.23Å; Q131-E228 PolarHBondContact NE2-OE1 2.58Å; C132-E228 WeakPolarHBondContact O-CA 3.29Å; I133-E228 HydrophobicContact CG1-CB 4.22Å; I133-E228 HydrophobicContact CG1-CG 3.87Å
229I89.8Confident87.3Confident3 Ų352.5 Ų52.52%0.01529%0.286CS..EExtended strand (participates in β ladder)trans-130.4130.5178.4-64.6-177.5000108.8C132 G243 F245 L267 F351C132-I229 WeakPolarHBondContact CB-O 3.26Å; C132-I229 PolarHBondContact N-O 2.64Å; C132-I229 PolarHBondContact O-N 3.07Å; I229-G243 WeakPolarHBondContact CG2-O 3.19Å; I229-F245 HydrophobicContact CB-CD2 4.29Å; I229-F245 HydrophobicContact CB-CE2 3.81Å; I229-F245 HydrophobicContact CB-CZ 4.18Å; I229-F245 HydrophobicContact CD1-CE1 4.15Å; I229-F245 HydrophobicContact CD1-CE2 4.03Å; I229-F245 HydrophobicContact CD1-CZ 3.52Å; I229-F245 HydrophobicContact CG1-CZ 4.43Å; I229-F245 HydrophobicContact CG2-CD1 4.23Å; I229-F245 HydrophobicContact CG2-CD2 3.6Å; I229-F245 HydrophobicContact CG2-CE1 4.14Å; I229-F245 HydrophobicContact CG2-CE2 3.51Å; I229-F245 HydrophobicContact CG2-CG 3.98Å; I229-F245 HydrophobicContact CG2-CZ 3.8Å; I229-L267 HydrophobicContact CD1-CD1 4.48Å; I229-L267 HydrophobicContact CD1-CD2 3.58Å; I229-L267 HydrophobicContact CG1-CD2 4.4Å; I229-F351 HydrophobicContact CD1-CE1 4.2Å
230N91.1Very high87.4Confident14 Ų1449.7 Ų49.78%0.07527%0.268CS..EExtended strand (participates in β ladder)trans-79.1147.9175.2-73.5-19.4000110.6P121 D126 M129 M130 N244 F245P121-N230 WeakPolarHBondContact CD-ND2 3.37Å; P121-N230 WeakPolarHBondContact CG-ND2 3.27Å; D126-N230 PolarHBondContact OD1-ND2 3.38Å; M129-N230 HydrophobicContact CB-CB 4.07Å; M129-N230 HydrophobicContact CE-CB 4.42Å; M129-N230 HydrophobicContact CG-CB 4.45Å; M129-N230 HydrophobicContact SD-CB 3.81Å; M130-N230 CarbonylContact O-C 3.55Å; M130-N230 WeakPolarHBondContact O-CA 3.05Å; N230-N244 CarbonylContact O-C 3.41Å; N230-N244 VanDerWaalsContact O-CA 3.24Å; N230-N244 WeakPolarHBondContact O-CA 3.32Å; N230-N244 WeakPolarHBondContact O-CB 3.49Å; N230-F245 PolarHBondContact O-N 2.96Å
231Y91.9Very high87.4Confident0 Ų051.1 Ų51.10%027%0.266CS..EExtended strand (participates in β ladder)trans-144.4158.6176.179.4-87000113.6M130 C132 D180 W195 N196 F245 L247M130-Y231 HydrophobicContact CB-CD1 3.73Å; M130-Y231 HydrophobicContact CB-CD2 4.19Å; M130-Y231 HydrophobicContact CB-CE1 3.34Å; M130-Y231 HydrophobicContact CB-CE2 3.85Å; M130-Y231 HydrophobicContact CB-CG 4.14Å; M130-Y231 VanDerWaalsContact CB-CZ 3.44Å; M130-Y231 HydrophobicContact CE-CD2 4.05Å; M130-Y231 HydrophobicContact CE-CE2 3.69Å; M130-Y231 HydrophobicContact CG-CE2 4.49Å; M130-Y231 PolarHBondContact N-O 2.95Å; M130-Y231 WeakPolarHBondContact O-CD1 3.39Å; M130-Y231 PolarHBondContact O-N 3.4Å; M130-Y231 HydrophobicContact SD-CE2 3.85Å; C132-Y231 HydrophobicContact CB-CD1 4.22Å; D180-Y231 HydrophobicContact CB-CE2 4.46Å; D180-Y231 WeakPolarHBondContact OD2-CE2 3.41Å; D180-Y231 PolarHBondContact OD2-OH 3.25Å; W195-Y231 AromaticContact CE3-CD1 3.98Å; W195-Y231 HydrophobicContact CE3-CD1 3.98Å; W195-Y231 AromaticContact CE3-CE1 3.6Å; W195-Y231 HydrophobicContact CE3-CE1 3.6Å; W195-Y231 HydrophobicContact CE3-CE2 4.24Å; W195-Y231 HydrophobicContact CE3-CG 4.42Å; W195-Y231 AromaticContact CE3-CZ 3.72Å; W195-Y231 AromaticContact CZ3-CD1 4Å; W195-Y231 HydrophobicContact CZ3-CD1 4Å; W195-Y231 HydrophobicContact CZ3-CD2 4.34Å; W195-Y231 HydrophobicContact CZ3-CE1 4.09Å; W195-Y231 HydrophobicContact CZ3-CE2 4.43Å; W195-Y231 HydrophobicContact CZ3-CG 4.1Å; N196-Y231 VanDerWaalsContact CB-OH 3.3Å; N196-Y231 WeakPolarHBondContact CB-OH 3.2Å; Y231-F245 CarbonylContact C-O 3.57Å; Y231-F245 WeakPolarHBondContact CA-O 3.41Å; Y231-F245 VanDerWaalsContact CB-O 3.25Å; Y231-F245 WeakPolarHBondContact CB-O 3.45Å; Y231-L247 HydrophobicContact CD2-CD1 3.69Å; Y231-L247 HydrophobicContact CD2-CG 4.05Å; Y231-L247 HydrophobicContact CE2-CD1 3.63Å; Y231-L247 HydrophobicContact CE2-CG 4.47Å
232T91.1Very high87.1Confident50 Ų5060.3 Ų60.331%0.30730%0.299SS..EExtended strand (participates in β ladder)trans-132.3158173.258.50000110.2M129 F245 I246 L247M129-T232 HydrophobicContact CG-CG2 3.62Å; T232-F245 PolarHBondContact N-O 3.3Å; T232-I246 WeakPolarHBondContact O-CA 3.06Å; T232-L247 PolarHBondContact O-N 2.55Å
233V89.2Confident86.9Confident54 Ų5460.1 Ų60.133%0.32730%0.299SS..EExtended strand (participates in β ladder)trans-99.8133.1167.5178.30000107.3M130 D180 L247M130-V233 HydrophobicContact CE-CB 4.45Å; M130-V233 HydrophobicContact CE-CG2 3.79Å; D180-V233 HydrophobicContact CB-CG2 4.43Å; V233-L247 CarbonylContact C-O 3.54Å; V233-L247 WeakPolarHBondContact CA-O 3.15Å; V233-L247 HydrophobicContact CG2-CB 4.26Å
234G85.5Confident87Confident23 Ų2357.1 Ų57.124%0.23729%0.286CS..EExtended strand (participates in β ladder)trans-155.8-179.4-175.500000113.9L247 Y249G234-L247 PolarHBondContact N-O 3.15Å; G234-Y249 PolarHBondContact O-N 2.82Å; G234-Y249 VanDerWaalsContact O-N 3.08Å
235E80.5Confident87.4Confident175 Ų17551.1 Ų51.182%0.81826%0.263SS*.SBendtrans-77140.1178.4-67-176.9178.400112.1Y249E235-Y249 HydrophobicContact CG-CD1 4.33Å; E235-Y249 HydrophobicContact CG-CE1 4.4Å
236G84.2Confident87.7Confident44 Ų4452.6 Ų52.645%0.45427%0.271SS..SBendtrans101.1-168.2177.200000113.7S248G236-S248 WeakPolarHBondContact O-CB 3.21Å; G236-S248 PolarHBondContact O-OG 2.83Å
237N86.1Confident87.8Confident143 Ų14351.8 Ų51.877%0.76527%0.267SS*.SBendtrans-78.6147.3-175.8-63-9.7000111.7K239N237-K239 PolarHBondContact O-N 2.97Å
238T90.9Very high87.8Confident13 Ų1352.7 Ų52.78%0.0827%0.273CS..  trans-58132.9174.9-66.20000111.6I246 L247 S248 E259 F263 L344T238-I246 CarbonylContact C-O 3.59Å; T238-I246 WeakPolarHBondContact CA-O 3.3Å; T238-L247 HydrophobicContact CG2-CD2 3.86Å; T238-S248 PolarHBondContact OG1-N 2.84Å; T238-E259 VanDerWaalsContact CB-CD 3.49Å; T238-E259 WeakPolarHBondContact CB-OE1 3.28Å; T238-E259 WeakPolarHBondContact CB-OE2 3.42Å; T238-E259 HydrophobicContact CG2-CB 4.38Å; T238-E259 VanDerWaalsContact OG1-CD 3.28Å; T238-E259 PolarHBondContact OG1-OE1 3.07Å; T238-E259 PolarHBondContact OG1-OE2 2.86Å; T238-F263 HydrophobicContact CG2-CE2 3.46Å; T238-F263 VanDerWaalsContact CG2-CE2 3.46Å; T238-F263 HydrophobicContact CG2-CZ 3.77Å; T238-L344 HydrophobicContact CG2-CD1 3.8Å; T238-L344 HydrophobicContact CG2-CD2 4.08Å; T238-L344 WeakPolarHBondContact O-CD2 3.49Å
239K90.6Very high87.3Confident82 Ų8256.2 Ų56.236%0.35728%0.284SS..EExtended strand (participates in β ladder)trans-156.9158.1-17657.6177.4168.1156.50112.3N237 E241 I246N237-K239 PolarHBondContact O-N 2.97Å; K239-E241 WeakPolarHBondContact CE-OE2 3.45Å; K239-E241 IonicContact NZ-OE2 2.8Å; K239-E241 PolarHBondContact NZ-OE2 3.12Å; K239-I246 HydrophobicContact CG-CB 4.07Å; K239-I246 HydrophobicContact CG-CD1 4.3Å; K239-I246 PolarHBondContact N-O 3.09Å; K239-I246 PolarHBondContact O-N 3.44Å
240L88.4Confident86.8Confident29 Ų2961.7 Ų61.715%0.15231%0.314CS..EExtended strand (participates in β ladder)trans-98.9116.3166.8174.859.4000108.6N244 F245 F263 F351L240-N244 WeakPolarHBondContact CD1-O 3.36Å; L240-F245 HydrophobicContact CB-CD1 4.38Å; L240-F245 HydrophobicContact CD1-CD1 3.65Å; L240-F245 HydrophobicContact CD1-CE1 3.79Å; L240-F245 HydrophobicContact CD2-CE1 4.43Å; L240-F245 HydrophobicContact CG-CD1 4.48Å; L240-F263 HydrophobicContact CB-CE1 4.46Å; L240-F351 HydrophobicContact CD2-CB 3.44Å; L240-F351 VanDerWaalsContact CD2-CB 3.44Å; L240-F351 HydrophobicContact CD2-CD1 4.1Å; L240-F351 HydrophobicContact CD2-CD2 4.5Å; L240-F351 HydrophobicContact CD2-CG 3.77Å
241E85.1Confident86.2Confident79 Ų7963.9 Ų63.937%0.36932%0.324SS..EExtended strand (participates in β ladder)trans-131.8126-178.6-176.2165.2-159.800110.4K239 G243 N244 I246K239-E241 WeakPolarHBondContact CE-OE2 3.45Å; K239-E241 IonicContact NZ-OE2 2.8Å; K239-E241 PolarHBondContact NZ-OE2 3.12Å; E241-G243 PolarHBondContact O-N 3.47Å; E241-N244 PolarHBondContact N-O 2.97Å; E241-N244 PolarHBondContact O-N 2.56Å; E241-I246 HydrophobicContact CB-CD1 3.83Å
242R80.3Confident85.9Confident220 Ų22068.5 Ų68.583%0.8335%0.349SS*.THydrogen-bonded Turntrans53.224.8179.2-58.8177-174-158.91.2114.9
243G81.4Confident85.6Confident6 Ų673.1 Ų73.16%0.06237%0.367CS..THydrogen-bonded Turntrans905.4179.100000115.6I229 E241I229-G243 WeakPolarHBondContact CG2-O 3.19Å; E241-G243 PolarHBondContact O-N 3.47Å
244N87.6Confident85.5Confident36 Ų3677.7 Ų77.719%0.19339%0.385CS..EExtended strand (participates in β ladder)trans-111.8144.7172.6-60.1-33.9000110.4N230 L240 E241N230-N244 CarbonylContact O-C 3.41Å; N230-N244 VanDerWaalsContact O-CA 3.24Å; N230-N244 WeakPolarHBondContact O-CA 3.32Å; N230-N244 WeakPolarHBondContact O-CB 3.49Å; L240-N244 WeakPolarHBondContact CD1-O 3.36Å; E241-N244 PolarHBondContact N-O 2.97Å; E241-N244 PolarHBondContact O-N 2.56Å
245F90.8Very high85.6Confident0 Ų080.2 Ų80.20%039%0.39CS..EExtended strand (participates in β ladder)trans-79.6137170-51.2-47.9000109.8C132 W195 I229 N230 Y231 T232 L240 F263 L267 T348C132-F245 HydrophobicContact CB-CD2 4.42Å; C132-F245 HydrophobicContact CB-CE2 4.29Å; W195-F245 AromaticContact CH2-CD2 3.61Å; W195-F245 HydrophobicContact CH2-CD2 3.61Å; W195-F245 AromaticContact CH2-CE2 3.91Å; W195-F245 HydrophobicContact CH2-CE2 3.91Å; W195-F245 HydrophobicContact CH2-CG 4.47Å; W195-F245 HydrophobicContact CZ2-CE2 4.46Å; W195-F245 HydrophobicContact CZ3-CD2 4.06Å; I229-F245 HydrophobicContact CB-CD2 4.29Å; I229-F245 HydrophobicContact CB-CE2 3.81Å; I229-F245 HydrophobicContact CB-CZ 4.18Å; I229-F245 HydrophobicContact CD1-CE1 4.15Å; I229-F245 HydrophobicContact CD1-CE2 4.03Å; I229-F245 HydrophobicContact CD1-CZ 3.52Å; I229-F245 HydrophobicContact CG1-CZ 4.43Å; I229-F245 HydrophobicContact CG2-CD1 4.23Å; I229-F245 HydrophobicContact CG2-CD2 3.6Å; I229-F245 HydrophobicContact CG2-CE1 4.14Å; I229-F245 HydrophobicContact CG2-CE2 3.51Å; I229-F245 HydrophobicContact CG2-CG 3.98Å; I229-F245 HydrophobicContact CG2-CZ 3.8Å; N230-F245 PolarHBondContact O-N 2.96Å; Y231-F245 CarbonylContact C-O 3.57Å; Y231-F245 WeakPolarHBondContact CA-O 3.41Å; Y231-F245 VanDerWaalsContact CB-O 3.25Å; Y231-F245 WeakPolarHBondContact CB-O 3.45Å; T232-F245 PolarHBondContact N-O 3.3Å; L240-F245 HydrophobicContact CB-CD1 4.38Å; L240-F245 HydrophobicContact CD1-CD1 3.65Å; L240-F245 HydrophobicContact CD1-CE1 3.79Å; L240-F245 HydrophobicContact CD2-CE1 4.43Å; L240-F245 HydrophobicContact CG-CD1 4.48Å; F245-F263 AromaticContact CD1-CD1 3.56Å; F245-F263 HydrophobicContact CD1-CD1 3.56Å; F245-F263 AromaticContact CD1-CE1 3.49Å; F245-F263 HydrophobicContact CD1-CE1 3.49Å; F245-F263 VanDerWaalsContact CD1-CE1 3.49Å; F245-F263 HydrophobicContact CD1-CG 4.14Å; F245-F263 AromaticContact CD1-CZ 3.98Å; F245-F263 HydrophobicContact CD1-CZ 3.98Å; F245-F263 HydrophobicContact CD2-CG 4.47Å; F245-F263 HydrophobicContact CE1-CB 4.46Å; F245-F263 AromaticContact CE1-CD1 3.31Å; F245-F263 HydrophobicContact CE1-CD1 3.31Å; F245-F263 AromaticContact CE1-CE1 3.64Å; F245-F263 HydrophobicContact CE1-CE1 3.64Å; F245-F263 HydrophobicContact CE1-CG 4.02Å; F245-F263 HydrophobicContact CE2-CB 4.17Å; F245-F263 HydrophobicContact CE2-CD1 4.41Å; F245-F263 HydrophobicContact CE2-CG 4.34Å; F245-F263 HydrophobicContact CG-CD1 4.23Å; F245-F263 HydrophobicContact CG-CE1 4.28Å; F245-F263 HydrophobicContact CG-CG 4.37Å; F245-F263 HydrophobicContact CG-CZ 4.43Å; F245-F263 HydrophobicContact CZ-CB 4.07Å; F245-F263 AromaticContact CZ-CD1 3.77Å; F245-F263 HydrophobicContact CZ-CD1 3.77Å; F245-F263 HydrophobicContact CZ-CG 4.11Å; F245-L267 HydrophobicContact CE2-CD1 3.98Å; F245-L267 HydrophobicContact CZ-CD1 4.03Å; F245-T348 HydrophobicContact CE1-CG2 4.18Å; F245-T348 HydrophobicContact CZ-CG2 4.24Å
246I90.8Very high86.1Confident34 Ų3473.1 Ų73.117%0.17436%0.361CS..EExtended strand (participates in β ladder)trans-118.1111.2171.8-58.6172.1000105.1T232 T238 K239 E241T232-I246 WeakPolarHBondContact O-CA 3.06Å; T238-I246 CarbonylContact C-O 3.59Å; T238-I246 WeakPolarHBondContact CA-O 3.3Å; K239-I246 HydrophobicContact CG-CB 4.07Å; K239-I246 HydrophobicContact CG-CD1 4.3Å; K239-I246 PolarHBondContact N-O 3.09Å; K239-I246 PolarHBondContact O-N 3.44Å; E241-I246 HydrophobicContact CB-CD1 3.83Å
247L90.6Very high86.5Confident8 Ų871.8 Ų71.84%0.04234%0.344CS..EExtended strand (participates in β ladder)trans-91.7143.1177-57.7-176.4000109.6W195 Y231 T232 V233 G234 T238 K260 F263W195-L247 HydrophobicContact CZ3-CD1 4.17Å; Y231-L247 HydrophobicContact CD2-CD1 3.69Å; Y231-L247 HydrophobicContact CD2-CG 4.05Å; Y231-L247 HydrophobicContact CE2-CD1 3.63Å; Y231-L247 HydrophobicContact CE2-CG 4.47Å; T232-L247 PolarHBondContact O-N 2.55Å; V233-L247 CarbonylContact C-O 3.54Å; V233-L247 WeakPolarHBondContact CA-O 3.15Å; V233-L247 HydrophobicContact CG2-CB 4.26Å; G234-L247 PolarHBondContact N-O 3.15Å; T238-L247 HydrophobicContact CG2-CD2 3.86Å; L247-K260 HydrophobicContact CD1-CD 4.43Å; L247-K260 VanDerWaalsContact CD1-CE 3.48Å; L247-K260 HydrophobicContact CD1-CG 4.15Å; L247-F263 HydrophobicContact CD2-CD2 4.31Å; L247-F263 HydrophobicContact CD2-CE2 3.88Å
248S88.6Confident86.8Confident18 Ų1865.9 Ų65.913%0.12631%0.313CS..EExtended strand (participates in β ladder)trans-73.8139.4174.6-1700000111.6G236 T238G236-S248 WeakPolarHBondContact O-CB 3.21Å; G236-S248 PolarHBondContact O-OG 2.83Å; T238-S248 PolarHBondContact OG1-N 2.84Å
249Y79.3Confident86.9Confident149 Ų14966.1 Ų66.158%0.58431%0.313SS*.SBendtrans-80.5-25.1175.1104.2-88.3000113.6G234 E235 M251G234-Y249 PolarHBondContact O-N 2.82Å; G234-Y249 VanDerWaalsContact O-N 3.08Å; E235-Y249 HydrophobicContact CG-CD1 4.33Å; E235-Y249 HydrophobicContact CG-CE1 4.4Å; Y249-M251 PolarHBondContact O-N 2.9Å
250D78.1Confident87Confident119 Ų11962.6 Ų62.664%0.63630%0.298SS*.SBendtrans-101.545.7-167.5-163.819.7000111.9
251M79Confident87.3Confident60 Ų6061.6 Ų61.630%0.29629%0.292SS..SBendtrans-121.7148.8-174.7-61.6-59.8-67.300111.6Y249 E255Y249-M251 PolarHBondContact O-N 2.9Å; M251-E255 HydrophobicContact CE-CB 4.04Å; M251-E255 HydrophobicContact CE-CG 3.45Å; M251-E255 VanDerWaalsContact CE-CG 3.45Å; M251-E255 WeakPolarHBondContact CE-OE2 3Å
252D85.9Confident87.6Confident96 Ų9657.8 Ų57.851%0.51328%0.275SS..  trans-61.8146.8169.7-177.667000110.5Q254 E255 A256D252-Q254 PolarHBondContact O-N 3.29Å; D252-Q254 VanDerWaalsContact OD2-CB 3.31Å; D252-Q254 WeakPolarHBondContact OD2-CB 3.48Å; D252-Q254 PolarHBondContact OD2-N 2.9Å; D252-E255 PolarHBondContact O-N 3.49Å; D252-E255 VanDerWaalsContact O-N 3.08Å; D252-A256 PolarHBondContact O-N 2.87Å
253Q84.2Confident88.2Confident148 Ų14847.3 Ų47.369%0.69224%0.235SC*.Hα-helixtrans-57.1-36.5-178.2-71.6-174.8-38.400112.3V257Q253-V257 VanDerWaalsContact O-CG2 3.3Å; Q253-V257 WeakPolarHBondContact O-CG2 3.4Å; Q253-V257 PolarHBondContact O-N 2.86Å; Q253-V257 VanDerWaalsContact O-N 3.11Å
254Q86.9Confident88.8Confident150 Ų15047 Ų4770%0.70123%0.232SC*.Hα-helixtrans-68.7-41.2178.7-62.6-175.4-26.700111.5D252 V257 L258D252-Q254 PolarHBondContact O-N 3.29Å; D252-Q254 VanDerWaalsContact OD2-CB 3.31Å; D252-Q254 WeakPolarHBondContact OD2-CB 3.48Å; D252-Q254 PolarHBondContact OD2-N 2.9Å; Q254-V257 PolarHBondContact O-N 2.82Å; Q254-L258 WeakPolarHBondContact O-CG 3.36Å; Q254-L258 PolarHBondContact O-N 2.85Å
255E88.6Confident89Confident75 Ų7545.8 Ų45.835%0.3523%0.225SC..Hα-helixtrans-68.3-40.1179.1-164.7161.5-165.100111.3M251 D252 V257 L258 E259M251-E255 HydrophobicContact CE-CB 4.04Å; M251-E255 HydrophobicContact CE-CG 3.45Å; M251-E255 VanDerWaalsContact CE-CG 3.45Å; M251-E255 WeakPolarHBondContact CE-OE2 3Å; D252-E255 PolarHBondContact O-N 3.49Å; D252-E255 VanDerWaalsContact O-N 3.08Å; E255-V257 VanDerWaalsContact C-N 3.33Å; E255-V257 PolarHBondContact O-N 2.67Å; E255-L258 PolarHBondContact O-N 3.41Å; E255-L258 VanDerWaalsContact O-N 3.1Å; E255-E259 WeakPolarHBondContact O-CG 3.22Å; E255-E259 PolarHBondContact O-N 2.81Å
256A90Very high88.9Confident26 Ų2645.8 Ų45.822%0.21523%0.225CC..Hα-helixtrans-59.6-40.8173.800000112.5D252 E259 K260D252-A256 PolarHBondContact O-N 2.87Å; A256-E259 PolarHBondContact O-N 3.47Å; A256-K260 WeakPolarHBondContact O-CG 3.36Å; A256-K260 PolarHBondContact O-N 3.41Å
257V92.7Very high88.8Confident16 Ų1644.1 Ų44.110%0.09722%0.217CC..Hα-helixtrans-64.8-39.8174.5171.40000111.2L160 V169 L183 F185 Q253 Q254 E255 K260 F261L160-V257 HydrophobicContact CD2-CG1 3.98Å; V169-V257 HydrophobicContact CG1-CG1 4.45Å; L183-V257 HydrophobicContact CD1-CG2 4.11Å; F185-V257 HydrophobicContact CE1-CG1 4.39Å; F185-V257 HydrophobicContact CZ-CG1 4.35Å; Q253-V257 VanDerWaalsContact O-CG2 3.3Å; Q253-V257 WeakPolarHBondContact O-CG2 3.4Å; Q253-V257 PolarHBondContact O-N 2.86Å; Q253-V257 VanDerWaalsContact O-N 3.11Å; Q254-V257 PolarHBondContact O-N 2.82Å; E255-V257 VanDerWaalsContact C-N 3.33Å; E255-V257 PolarHBondContact O-N 2.67Å; V257-K260 PolarHBondContact O-N 3.19Å; V257-F261 VanDerWaalsContact O-CB 3.32Å; V257-F261 WeakPolarHBondContact O-CB 3.18Å; V257-F261 PolarHBondContact O-N 2.68Å
258L92.9Very high88.5Confident20 Ų2043.8 Ų43.811%0.10522%0.215CC..Hα-helixtrans-68.5-35.7178.3-70-178.5000113.1L160 P161 Q254 E255 F261 A262 F334 L341L160-L258 HydrophobicContact CD2-CD2 4.09Å; P161-L258 HydrophobicContact CG-CD2 4.24Å; Q254-L258 WeakPolarHBondContact O-CG 3.36Å; Q254-L258 PolarHBondContact O-N 2.85Å; E255-L258 PolarHBondContact O-N 3.41Å; E255-L258 VanDerWaalsContact O-N 3.1Å; L258-F261 WeakPolarHBondContact O-CB 3.42Å; L258-F261 PolarHBondContact O-N 3.25Å; L258-A262 PolarHBondContact O-N 2.82Å; L258-F334 HydrophobicContact CD2-CZ 4.01Å; L258-L341 HydrophobicContact CB-CD1 3.99Å; L258-L341 HydrophobicContact CB-CD2 4.34Å
259E92.8Very high87.7Confident17 Ų1743.5 Ų43.58%0.07921%0.212CC..Hα-helixtrans-66.8-46.5172.9-69.7-173.3149.300111.4T238 E255 A256 F261 A262 F263 L341 L344T238-E259 VanDerWaalsContact CB-CD 3.49Å; T238-E259 WeakPolarHBondContact CB-OE1 3.28Å; T238-E259 WeakPolarHBondContact CB-OE2 3.42Å; T238-E259 HydrophobicContact CG2-CB 4.38Å; T238-E259 VanDerWaalsContact OG1-CD 3.28Å; T238-E259 PolarHBondContact OG1-OE1 3.07Å; T238-E259 PolarHBondContact OG1-OE2 2.86Å; E255-E259 WeakPolarHBondContact O-CG 3.22Å; E255-E259 PolarHBondContact O-N 2.81Å; A256-E259 PolarHBondContact O-N 3.47Å; E259-F261 PolarHBondContact O-N 3.12Å; E259-A262 WeakPolarHBondContact O-CB 3.32Å; E259-A262 PolarHBondContact O-N 3Å; E259-F263 WeakPolarHBondContact O-CD2 3.3Å; E259-F263 PolarHBondContact O-N 3.32Å; E259-F263 VanDerWaalsContact O-N 3.14Å; E259-L341 HydrophobicContact CB-CD2 4.45Å; E259-L341 HydrophobicContact CG-CD2 3.83Å; E259-L344 HydrophobicContact CB-CD1 4.08Å; E259-L344 HydrophobicContact CG-CD1 3.89Å
260K94Very high87.3Confident8 Ų836.6 Ų36.64%0.03519%0.186CC..Hα-helixtrans-59.3-37.2172.7-71.9174.4-175.5169.40111.6D180 L183 F185 W195 L247 A256 V257 S264D180-K260 IonicContact OD1-NZ 2.7Å; D180-K260 PolarHBondContact OD1-NZ 2.95Å; D180-K260 VanDerWaalsContact OD2-CE 3.23Å; D180-K260 WeakPolarHBondContact OD2-CE 3.43Å; D180-K260 IonicContact OD2-NZ 2.82Å; D180-K260 PolarHBondContact OD2-NZ 3.43Å; L183-K260 HydrophobicContact CD1-CD 3.61Å; F185-K260 HydrophobicContact CE2-CB 3.98Å; F185-K260 HydrophobicContact CZ-CB 3.87Å; W195-K260 HydrophobicContact CD2-CB 4.35Å; W195-K260 HydrophobicContact CD2-CD 4.31Å; W195-K260 HydrophobicContact CD2-CG 4.14Å; W195-K260 HydrophobicContact CE3-CD 4.3Å; W195-K260 HydrophobicContact CE3-CG 4.06Å; W195-K260 HydrophobicContact CH2-CG 4.3Å; W195-K260 HydrophobicContact CZ2-CB 4.16Å; W195-K260 HydrophobicContact CZ2-CG 4.36Å; W195-K260 HydrophobicContact CZ3-CG 4.15Å; L247-K260 HydrophobicContact CD1-CD 4.43Å; L247-K260 VanDerWaalsContact CD1-CE 3.48Å; L247-K260 HydrophobicContact CD1-CG 4.15Å; A256-K260 WeakPolarHBondContact O-CG 3.36Å; A256-K260 PolarHBondContact O-N 3.41Å; V257-K260 PolarHBondContact O-N 3.19Å; K260-S264 VanDerWaalsContact O-CB 3.26Å; K260-S264 WeakPolarHBondContact O-CB 3.35Å; K260-S264 PolarHBondContact O-N 2.9Å; K260-S264 PolarHBondContact O-OG 3.01Å
261F93.3Very high87.3Confident8 Ų831 Ų314%0.03516%0.155CC..Hα-helixtrans-61.4-45.4172.6171-93000111.5L160 A164 V167 F185 F187 V257 L258 E259 F263 S264 N265 F334L160-F261 HydrophobicContact CD1-CD2 3.97Å; L160-F261 HydrophobicContact CD1-CE2 4.13Å; A164-F261 HydrophobicContact CB-CE2 4.4Å; A164-F261 HydrophobicContact CB-CZ 4.2Å; V167-F261 HydrophobicContact CB-CE2 3.85Å; V167-F261 HydrophobicContact CG1-CD2 4.2Å; V167-F261 HydrophobicContact CG1-CE2 3.99Å; V167-F261 HydrophobicContact CG2-CE2 3.6Å; V167-F261 HydrophobicContact CG2-CZ 4.34Å; F185-F261 HydrophobicContact CD1-CB 4.47Å; F185-F261 HydrophobicContact CD1-CD2 4.21Å; F185-F261 HydrophobicContact CE1-CB 3.83Å; F185-F261 HydrophobicContact CE1-CD2 4.28Å; F185-F261 HydrophobicContact CZ-CB 4.4Å; F187-F261 HydrophobicContact CE1-CE2 4.36Å; V257-F261 VanDerWaalsContact O-CB 3.32Å; V257-F261 WeakPolarHBondContact O-CB 3.18Å; V257-F261 PolarHBondContact O-N 2.68Å; L258-F261 WeakPolarHBondContact O-CB 3.42Å; L258-F261 PolarHBondContact O-N 3.25Å; E259-F261 PolarHBondContact O-N 3.12Å; F261-F263 PolarHBondContact O-N 3.14Å; F261-S264 PolarHBondContact O-N 3.01Å; F261-N265 VanDerWaalsContact O-CB 3.23Å; F261-N265 WeakPolarHBondContact O-CB 3.47Å; F261-N265 PolarHBondContact O-N 3Å; F261-F334 HydrophobicContact CD1-CD1 4.43Å; F261-F334 AromaticContact CD1-CE1 3.87Å; F261-F334 HydrophobicContact CD1-CE1 3.87Å; F261-F334 HydrophobicContact CD1-CZ 4.34Å; F261-F334 AromaticContact CE1-CD1 3.74Å; F261-F334 HydrophobicContact CE1-CD1 3.74Å; F261-F334 AromaticContact CE1-CE1 3.6Å; F261-F334 HydrophobicContact CE1-CE1 3.6Å; F261-F334 HydrophobicContact CE1-CG 4.38Å; F261-F334 HydrophobicContact CE1-CZ 4.14Å
262A92.4Very high87.6Confident0 Ų028.1 Ų28.10%014%0.142CC..Hα-helixtrans-59.4-45179.200000112.3L258 E259 A266 Y335 L341 L344L258-A262 PolarHBondContact O-N 2.82Å; E259-A262 WeakPolarHBondContact O-CB 3.32Å; E259-A262 PolarHBondContact O-N 3Å; A262-A266 PolarHBondContact O-N 3.38Å; A262-Y335 HydrophobicContact CB-CE1 4.03Å; A262-L341 HydrophobicContact CB-CB 4.26Å; A262-L341 HydrophobicContact CB-CD2 4.37Å; A262-L344 HydrophobicContact CB-CB 4.36Å
263F93.2Very high87.6Confident0 Ų023.6 Ų23.60%012%0.117CC..Hα-helixtrans-63.8-45.8173.3-69.8-59.7000112.5W195 T238 L240 F245 L247 E259 F261 N265 A266 L267 L344 T348W195-F263 HydrophobicContact CH2-CB 3.87Å; W195-F263 HydrophobicContact CH2-CD2 4.05Å; W195-F263 HydrophobicContact CH2-CG 4.26Å; W195-F263 HydrophobicContact CZ2-CB 3.73Å; T238-F263 HydrophobicContact CG2-CE2 3.46Å; T238-F263 VanDerWaalsContact CG2-CE2 3.46Å; T238-F263 HydrophobicContact CG2-CZ 3.77Å; L240-F263 HydrophobicContact CB-CE1 4.46Å; F245-F263 AromaticContact CD1-CD1 3.56Å; F245-F263 HydrophobicContact CD1-CD1 3.56Å; F245-F263 AromaticContact CD1-CE1 3.49Å; F245-F263 HydrophobicContact CD1-CE1 3.49Å; F245-F263 VanDerWaalsContact CD1-CE1 3.49Å; F245-F263 HydrophobicContact CD1-CG 4.14Å; F245-F263 AromaticContact CD1-CZ 3.98Å; F245-F263 HydrophobicContact CD1-CZ 3.98Å; F245-F263 HydrophobicContact CD2-CG 4.47Å; F245-F263 HydrophobicContact CE1-CB 4.46Å; F245-F263 AromaticContact CE1-CD1 3.31Å; F245-F263 HydrophobicContact CE1-CD1 3.31Å; F245-F263 AromaticContact CE1-CE1 3.64Å; F245-F263 HydrophobicContact CE1-CE1 3.64Å; F245-F263 HydrophobicContact CE1-CG 4.02Å; F245-F263 HydrophobicContact CE2-CB 4.17Å; F245-F263 HydrophobicContact CE2-CD1 4.41Å; F245-F263 HydrophobicContact CE2-CG 4.34Å; F245-F263 HydrophobicContact CG-CD1 4.23Å; F245-F263 HydrophobicContact CG-CE1 4.28Å; F245-F263 HydrophobicContact CG-CG 4.37Å; F245-F263 HydrophobicContact CG-CZ 4.43Å; F245-F263 HydrophobicContact CZ-CB 4.07Å; F245-F263 AromaticContact CZ-CD1 3.77Å; F245-F263 HydrophobicContact CZ-CD1 3.77Å; F245-F263 HydrophobicContact CZ-CG 4.11Å; L247-F263 HydrophobicContact CD2-CD2 4.31Å; L247-F263 HydrophobicContact CD2-CE2 3.88Å; E259-F263 WeakPolarHBondContact O-CD2 3.3Å; E259-F263 PolarHBondContact O-N 3.32Å; E259-F263 VanDerWaalsContact O-N 3.14Å; F261-F263 PolarHBondContact O-N 3.14Å; F263-N265 VanDerWaalsContact C-N 3.31Å; F263-N265 PolarHBondContact O-N 3.01Å; F263-A266 PolarHBondContact O-N 2.9Å; F263-L267 WeakPolarHBondContact O-CG 3.45Å; F263-L267 PolarHBondContact O-N 3.35Å; F263-L344 HydrophobicContact CE1-CB 4.26Å; F263-L344 HydrophobicContact CE1-CD2 4.35Å; F263-L344 HydrophobicContact CE2-CD1 4.21Å; F263-L344 HydrophobicContact CZ-CB 4.27Å; F263-L344 HydrophobicContact CZ-CD1 4.24Å; F263-L344 HydrophobicContact CZ-CD2 3.82Å; F263-L344 HydrophobicContact CZ-CG 4.33Å; F263-T348 HydrophobicContact CD1-CG2 4.41Å; F263-T348 WeakPolarHBondContact CD1-OG1 3.5Å; F263-T348 WeakPolarHBondContact CE1-OG1 3.46Å
264S93.8Very high87.7Confident0 Ų016.9 Ų16.90%09%0.086CC..Hα-helixtrans-61.6-41.1-179.8-60.40000112F185 W195 K260 F261 L267 C268F185-S264 WeakPolarHBondContact CD2-OG 3.38Å; W195-S264 PolarHBondContact NE1-OG 3.38Å; K260-S264 VanDerWaalsContact O-CB 3.26Å; K260-S264 WeakPolarHBondContact O-CB 3.35Å; K260-S264 PolarHBondContact O-N 2.9Å; K260-S264 PolarHBondContact O-OG 3.01Å; F261-S264 PolarHBondContact O-N 3.01Å; S264-L267 PolarHBondContact O-N 2.99Å; S264-C268 VanDerWaalsContact O-CB 3.31Å; S264-C268 WeakPolarHBondContact O-CB 3.03Å; S264-C268 PolarHBondContact O-N 3.27Å
265N90.8Very high87.7Confident9 Ų99.8 Ų9.85%0.0485%0.053CC..Hα-helixtrans-62.7-46.4179.1-166.333.1000110.5F187 F261 F263 L267 C268 L269 Y335 Y345F187-N265 HydrophobicContact CE1-CB 3.96Å; F187-N265 WeakPolarHBondContact CE1-OD1 3.22Å; F187-N265 HydrophobicContact CZ-CB 4.22Å; F261-N265 VanDerWaalsContact O-CB 3.23Å; F261-N265 WeakPolarHBondContact O-CB 3.47Å; F261-N265 PolarHBondContact O-N 3Å; F263-N265 VanDerWaalsContact C-N 3.31Å; F263-N265 PolarHBondContact O-N 3.01Å; N265-L267 PolarHBondContact O-N 2.83Å; N265-C268 PolarHBondContact O-N 3.42Å; N265-L269 VanDerWaalsContact O-CB 3.29Å; N265-L269 WeakPolarHBondContact O-CB 3.24Å; N265-L269 PolarHBondContact O-N 3.21Å; N265-L269 WeakPolarHBondContact OD1-CD1 3.25Å; N265-L269 WeakPolarHBondContact OD1-CG 3.5Å; N265-Y335 WeakPolarHBondContact CB-OH 3.42Å; N265-Y335 PolarHBondContact ND2-OH 3.01Å; N265-Y345 HydrophobicContact CB-CD2 4.43Å; N265-Y345 HydrophobicContact CB-CE2 4.36Å
266A88.6Confident87.6Confident0 Ų06.7 Ų6.70%04%0.039CC..Iπ-helixtrans-60.1-42.6174.500000112.2A262 F263 S270 Y345 T348A262-A266 PolarHBondContact O-N 3.38Å; F263-A266 PolarHBondContact O-N 2.9Å; A266-S270 VanDerWaalsContact O-CB 3.24Å; A266-S270 WeakPolarHBondContact O-CB 3.07Å; A266-S270 PolarHBondContact O-N 3.19Å; A266-Y345 HydrophobicContact CB-CD2 3.72Å; A266-Y345 HydrophobicContact CB-CE2 3.87Å; A266-Y345 HydrophobicContact CB-CG 4.5Å; A266-T348 HydrophobicContact CB-CG2 3.57Å
267L89Confident87.4Confident0 Ų06.4 Ų6.40%03%0.032CC..Iπ-helixtrans-66.6-48.2178.8-71.7168.5000112.8A134 E227 I229 F245 F263 S264 N265 A271 V272 L352A134-L267 HydrophobicContact CB-CB 4.01Å; E227-L267 HydrophobicContact CB-CD2 4.45Å; I229-L267 HydrophobicContact CD1-CD1 4.48Å; I229-L267 HydrophobicContact CD1-CD2 3.58Å; I229-L267 HydrophobicContact CG1-CD2 4.4Å; F245-L267 HydrophobicContact CE2-CD1 3.98Å; F245-L267 HydrophobicContact CZ-CD1 4.03Å; F263-L267 WeakPolarHBondContact O-CG 3.45Å; F263-L267 PolarHBondContact O-N 3.35Å; S264-L267 PolarHBondContact O-N 2.99Å; N265-L267 PolarHBondContact O-N 2.83Å; L267-A271 WeakPolarHBondContact O-CA 3.2Å; L267-A271 WeakPolarHBondContact O-CB 3.44Å; L267-A271 PolarHBondContact O-N 3.01Å; L267-A271 VanDerWaalsContact O-N 3.12Å; L267-V272 PolarHBondContact O-N 3.4Å; L267-V272 VanDerWaalsContact O-N 3.14Å; L267-L352 HydrophobicContact CD2-CD1 3.83Å; L267-L352 HydrophobicContact CD2-CD2 4.41Å
268C84.6Confident87.2Confident0 Ų06.7 Ų6.70%03%0.032CC..Iπ-helixtrans-67.1-55.1-175.5-90.60000113.2F187 S191 V193 S264 N265F187-C268 HydrophobicContact CD1-CB 4.32Å; F187-C268 HydrophobicContact CD2-CB 3.73Å; F187-C268 WeakPolarHBondContact CD2-SG 3.43Å; F187-C268 HydrophobicContact CE1-CB 4.49Å; F187-C268 HydrophobicContact CE2-CB 3.92Å; F187-C268 WeakPolarHBondContact CE2-SG 3.2Å; F187-C268 HydrophobicContact CG-CB 3.95Å; F187-C268 HydrophobicContact CZ-CB 4.31Å; S191-C268 WeakPolarHBondContact CB-SG 3.13Å; S191-C268 PolarHBondContact OG-O 3.13Å; V193-C268 HydrophobicContact CG2-CB 4.46Å; V193-C268 WeakPolarHBondContact CG2-SG 3.48Å; S264-C268 VanDerWaalsContact O-CB 3.31Å; S264-C268 WeakPolarHBondContact O-CB 3.03Å; S264-C268 PolarHBondContact O-N 3.27Å; N265-C268 PolarHBondContact O-N 3.42Å
269L71.6Confident87Confident13 Ų136.6 Ų6.67%0.0683%0.033CC..Iπ-helixtrans-74.4-43.5-170.8-72.3-169.4000110.7E189 N265 L328E189-L269 HydrophobicContact CB-CD2 3.8Å; E189-L269 HydrophobicContact CG-CD2 3.54Å; N265-L269 VanDerWaalsContact O-CB 3.29Å; N265-L269 WeakPolarHBondContact O-CB 3.24Å; N265-L269 PolarHBondContact O-N 3.21Å; N265-L269 WeakPolarHBondContact OD1-CD1 3.25Å; N265-L269 WeakPolarHBondContact OD1-CG 3.5Å; L269-L328 HydrophobicContact CB-CD1 4.36Å; L269-L328 HydrophobicContact CB-CD2 3.48Å; L269-L328 VanDerWaalsContact CB-CD2 3.48Å; L269-L328 HydrophobicContact CB-CG 3.89Å; L269-L328 HydrophobicContact CD1-CD1 3.83Å; L269-L328 HydrophobicContact CD1-CD2 4.46Å; L269-L328 HydrophobicContact CD1-CG 4.01Å; L269-L328 HydrophobicContact CD2-CD1 4.08Å; L269-L328 HydrophobicContact CD2-CD2 4.26Å; L269-L328 HydrophobicContact CG-CD1 4.31Å; L269-L328 HydrophobicContact CG-CD2 4.26Å; L269-L328 HydrophobicContact CG-CG 4.36Å; L269-L328 WeakPolarHBondContact O-CD2 3.48Å
270S70.1Confident86.9Confident4 Ų46.9 Ų6.93%0.0284%0.038CC..Iπ-helixtrans-97.3-33.2-170.2-62.20000114A266 L274 I354A266-S270 VanDerWaalsContact O-CB 3.24Å; A266-S270 WeakPolarHBondContact O-CB 3.07Å; A266-S270 PolarHBondContact O-N 3.19Å; S270-L274 WeakPolarHBondContact O-CB 3.38Å; S270-I354 VanDerWaalsContact O-CD1 3.25Å; S270-I354 WeakPolarHBondContact O-CD1 3.1Å
271A78.9Confident86.7Confident0 Ų06.5 Ų6.50%04%0.036CC..Iπ-helixtrans-94.2-63.7-170.200000112.5E227 L267 A275 L352 I354 R357E227-A271 HydrophobicContact CG-CB 3.95Å; L267-A271 WeakPolarHBondContact O-CA 3.2Å; L267-A271 WeakPolarHBondContact O-CB 3.44Å; L267-A271 PolarHBondContact O-N 3.01Å; L267-A271 VanDerWaalsContact O-N 3.12Å; A271-A275 PolarHBondContact O-N 2.88Å; A271-A275 VanDerWaalsContact O-N 3.13Å; A271-L352 HydrophobicContact CB-CD1 3.86Å; A271-L352 HydrophobicContact CB-CD2 4.39Å; A271-I354 HydrophobicContact CB-CD1 4.35Å; A271-R357 PolarHBondContact O-NH2 3.33Å
272V84.9Confident86.6Confident1 Ų18.6 Ų8.61%0.0065%0.048CC..Iπ-helixtrans-74-41-169.9-166.50000110.7A134 A136 E227 L267 A275 I276A134-V272 HydrophobicContact CB-CG2 3.68Å; A136-V272 HydrophobicContact CB-CB 4.05Å; A136-V272 HydrophobicContact CB-CG1 3.46Å; A136-V272 VanDerWaalsContact CB-CG1 3.46Å; A136-V272 VanDerWaalsContact N-CG1 3.3Å; E227-V272 HydrophobicContact CB-CG2 3.82Å; E227-V272 HydrophobicContact CG-CG2 3.65Å; L267-V272 PolarHBondContact O-N 3.4Å; L267-V272 VanDerWaalsContact O-N 3.14Å; V272-A275 WeakPolarHBondContact O-CB 3.45Å; V272-A275 PolarHBondContact O-N 2.8Å; V272-I276 WeakPolarHBondContact O-CG1 3.34Å; V272-I276 PolarHBondContact O-N 2.98Å
273K86.6Confident86.5Confident1 Ų113.2 Ų13.20%0.0047%0.073CC..Hα-helixtrans-65.3-43.2176.8-80.9-63.2-177.3-164.20113.9A136 A138 E189 G190 S191 Y217 A275 I276 W277A136-K273 HydrophobicContact CB-CD 3.84Å; A136-K273 HydrophobicContact CB-CG 4.27Å; A138-K273 PolarHBondContact O-NZ 3.47Å; E189-K273 WeakPolarHBondContact O-CE 3.02Å; E189-K273 PolarHBondContact O-NZ 3.31Å; G190-K273 WeakPolarHBondContact O-CE 3.46Å; G190-K273 PolarHBondContact O-NZ 3.26Å; G190-K273 VanDerWaalsContact O-NZ 3.12Å; S191-K273 VanDerWaalsContact OG-CE 3.28Å; S191-K273 WeakPolarHBondContact OG-CE 3.37Å; S191-K273 WeakPolarHBondContact OG-CG 3.24Å; Y217-K273 HydrophobicContact CE2-CD 4.39Å; Y217-K273 PolarHBondContact OH-NZ 3.41Å; K273-A275 PolarHBondContact O-N 3.32Å; K273-I276 PolarHBondContact O-N 2.84Å; K273-W277 HydrophobicContact CB-CH2 4.02Å; K273-W277 HydrophobicContact CB-CZ2 4.3Å; K273-W277 HydrophobicContact CB-CZ3 4.32Å; K273-W277 HydrophobicContact CD-CZ2 4.34Å; K273-W277 PolarHBondContact O-N 3.2Å; K273-W277 VanDerWaalsContact O-N 3.12Å
274L85.9Confident86.4Confident7 Ų713.6 Ų13.64%0.0377%0.074CC..Hα-helixtrans-60.5-38.4176.1-174.859.3000111.1S270 I276 W277 E278 I354 R357 V358 V361S270-L274 WeakPolarHBondContact O-CB 3.38Å; L274-I276 PolarHBondContact O-N 3.36Å; L274-W277 PolarHBondContact O-N 3.12Å; L274-E278 HydrophobicContact CG-CG 4.42Å; L274-E278 WeakPolarHBondContact O-CB 3.47Å; L274-E278 VanDerWaalsContact O-CG 3.27Å; L274-E278 WeakPolarHBondContact O-CG 3.32Å; L274-E278 PolarHBondContact O-N 2.98Å; L274-I354 HydrophobicContact CD2-CG2 4.37Å; L274-R357 HydrophobicContact CD2-CB 3.59Å; L274-V358 HydrophobicContact CD1-CG2 3.91Å; L274-V358 HydrophobicContact CD2-CG2 3.55Å; L274-V358 HydrophobicContact CG-CG2 4.4Å; L274-V361 HydrophobicContact CD1-CG2 4.27Å
275A86.8Confident86.3Confident1 Ų115.8 Ų15.81%0.0089%0.088CC..Hα-helixtrans-60.9-44.4176.400000112.3E225 A271 V272 K273 W277 E278 V279E225-A275 HydrophobicContact CB-CB 4.17Å; E225-A275 HydrophobicContact CG-CB 4.38Å; A271-A275 PolarHBondContact O-N 2.88Å; A271-A275 VanDerWaalsContact O-N 3.13Å; V272-A275 WeakPolarHBondContact O-CB 3.45Å; V272-A275 PolarHBondContact O-N 2.8Å; K273-A275 PolarHBondContact O-N 3.32Å; A275-W277 VanDerWaalsContact C-N 3.34Å; A275-W277 PolarHBondContact O-N 3.19Å; A275-E278 WeakPolarHBondContact O-CB 3.48Å; A275-E278 PolarHBondContact O-N 3.22Å; A275-V279 WeakPolarHBondContact O-CG2 3.45Å; A275-V279 PolarHBondContact O-N 3.05Å
276I87.9Confident86.3Confident9 Ų920.1 Ų20.15%0.04611%0.107CC..Hα-helixtrans-60.9-43.4176-59.8-64.4000111.4A136 Y217 L221 E225 V272 K273 L274 V279 A280A136-I276 HydrophobicContact CB-CG1 4.07Å; Y217-I276 HydrophobicContact CD2-CD1 4.2Å; Y217-I276 HydrophobicContact CD2-CG1 4.02Å; Y217-I276 HydrophobicContact CD2-CG2 3.87Å; Y217-I276 HydrophobicContact CE1-CG2 4.42Å; Y217-I276 HydrophobicContact CE2-CB 4.16Å; Y217-I276 HydrophobicContact CE2-CG1 3.95Å; Y217-I276 HydrophobicContact CE2-CG2 3.64Å; Y217-I276 HydrophobicContact CG-CG2 4.34Å; L221-I276 HydrophobicContact CD1-CD1 4.41Å; L221-I276 HydrophobicContact CD2-CD1 3.8Å; L221-I276 HydrophobicContact CD2-CG2 4.26Å; L221-I276 HydrophobicContact CG-CD1 3.66Å; E225-I276 HydrophobicContact CB-CD1 4.01Å; E225-I276 HydrophobicContact CG-CD1 4.15Å; V272-I276 WeakPolarHBondContact O-CG1 3.34Å; V272-I276 PolarHBondContact O-N 2.98Å; K273-I276 PolarHBondContact O-N 2.84Å; L274-I276 PolarHBondContact O-N 3.36Å; I276-V279 PolarHBondContact O-N 2.71Å; I276-A280 PolarHBondContact O-N 3.26Å
277W85.6Confident86.3Confident20 Ų2022.4 Ų22.48%0.07612%0.123CC..Hα-helixtrans-72-32.5178.8-61.8-29.8000113.4K273 L274 A275 V279 A280 L281 I322 R325K273-W277 HydrophobicContact CB-CH2 4.02Å; K273-W277 HydrophobicContact CB-CZ2 4.3Å; K273-W277 HydrophobicContact CB-CZ3 4.32Å; K273-W277 HydrophobicContact CD-CZ2 4.34Å; K273-W277 PolarHBondContact O-N 3.2Å; K273-W277 VanDerWaalsContact O-N 3.12Å; L274-W277 PolarHBondContact O-N 3.12Å; A275-W277 VanDerWaalsContact C-N 3.34Å; A275-W277 PolarHBondContact O-N 3.19Å; W277-V279 VanDerWaalsContact C-N 3.32Å; W277-A280 PolarHBondContact O-N 3.27Å; W277-L281 WeakPolarHBondContact O-CB 3.39Å; W277-L281 PolarHBondContact O-N 3.26Å; W277-I322 HydrophobicContact CB-CD1 4.3Å; W277-I322 HydrophobicContact CB-CG1 4.01Å; W277-I322 HydrophobicContact CD2-CG1 4.37Å; W277-I322 HydrophobicContact CE3-CG1 4.3Å; W277-I322 HydrophobicContact CG-CG1 4.27Å; W277-R325 HydrophobicContact CH2-CB 3.37Å; W277-R325 HydrophobicContact CH2-CG 3.25Å; W277-R325 HydrophobicContact CZ2-CB 4.38Å; W277-R325 HydrophobicContact CZ2-CG 3.83Å; W277-R325 HydrophobicContact CZ3-CB 3.54Å; W277-R325 HydrophobicContact CZ3-CG 3.94Å
278E87.7Confident86.3Confident22 Ų2222.6 Ų22.610%0.10313%0.125CC..Hα-helixtrans-57.8-46.8170.8-79.9169.3166.400110.4L274 A275 L281 D282 R357 V361L274-E278 HydrophobicContact CG-CG 4.42Å; L274-E278 WeakPolarHBondContact O-CB 3.47Å; L274-E278 VanDerWaalsContact O-CG 3.27Å; L274-E278 WeakPolarHBondContact O-CG 3.32Å; L274-E278 PolarHBondContact O-N 2.98Å; A275-E278 WeakPolarHBondContact O-CB 3.48Å; A275-E278 PolarHBondContact O-N 3.22Å; E278-L281 PolarHBondContact O-N 3.42Å; E278-D282 WeakPolarHBondContact O-CB 3.33Å; E278-D282 PolarHBondContact O-N 2.95Å; E278-R357 WeakPolarHBondContact OE1-CB 3.31Å; E278-R357 IonicContact OE1-CZ 3.53Å; E278-R357 IonicContact OE1-NE 3.59Å; E278-R357 PolarHBondContact OE1-NE 3.46Å; E278-R357 IonicContact OE1-NH2 2.77Å; E278-R357 IonicContact OE2-CZ 2.73Å; E278-R357 IonicContact OE2-NE 2.78Å; E278-R357 PolarHBondContact OE2-NE 3.28Å; E278-R357 IonicContact OE2-NH2 2.68Å; E278-R357 PolarHBondContact OE2-NH2 3.11Å; E278-V361 HydrophobicContact CG-CG2 3.4Å; E278-V361 VanDerWaalsContact CG-CG2 3.4Å
279V89.3Confident86.4Confident18 Ų1827.6 Ų27.611%0.10915%0.148CC..Hα-helixtrans-64.1-43.1176174.40000111.3L221 E225 A275 I276 W277 L281 D282 N283L221-V279 HydrophobicContact CD1-CB 4.26Å; L221-V279 HydrophobicContact CD1-CG1 3.88Å; L221-V279 HydrophobicContact CD1-CG2 4.15Å; E225-V279 HydrophobicContact CG-CG2 4.46Å; A275-V279 WeakPolarHBondContact O-CG2 3.45Å; A275-V279 PolarHBondContact O-N 3.05Å; I276-V279 PolarHBondContact O-N 2.71Å; W277-V279 VanDerWaalsContact C-N 3.32Å; V279-L281 VanDerWaalsContact C-N 3.32Å; V279-L281 PolarHBondContact O-N 2.87Å; V279-D282 PolarHBondContact O-N 3.06Å; V279-N283 WeakPolarHBondContact O-CB 3.24Å; V279-N283 VanDerWaalsContact O-CG 3.24Å; V279-N283 PolarHBondContact O-N 2.7Å; V279-N283 PolarHBondContact O-ND2 3.28Å
280A89Confident87Confident23 Ų2329.9 Ų29.919%0.1917%0.165CC..Hα-helixtrans-61.3-40.9176.900000112.1I276 W277 F284 L318I276-A280 PolarHBondContact O-N 3.26Å; W277-A280 PolarHBondContact O-N 3.27Å; A280-F284 PolarHBondContact O-N 3.21Å; A280-F284 VanDerWaalsContact O-N 3.09Å; A280-L318 HydrophobicContact CB-CD2 3.87Å
281L90.6Very high87.6Confident0 Ų030 Ų300%017%0.165CC..Hα-helixtrans-68.1-43.3175.818057.6000111.9W277 E278 V279 N283 F284 V285 V361 K364 L365W277-L281 WeakPolarHBondContact O-CB 3.39Å; W277-L281 PolarHBondContact O-N 3.26Å; E278-L281 PolarHBondContact O-N 3.42Å; V279-L281 VanDerWaalsContact C-N 3.32Å; V279-L281 PolarHBondContact O-N 2.87Å; L281-N283 VanDerWaalsContact C-N 3.31Å; L281-N283 PolarHBondContact O-N 2.54Å; L281-F284 WeakPolarHBondContact O-CA 3.37Å; L281-F284 WeakPolarHBondContact O-CB 3.44Å; L281-F284 PolarHBondContact O-N 3.4Å; L281-F284 VanDerWaalsContact O-N 3.09Å; L281-V285 HydrophobicContact CD1-CG2 4.33Å; L281-V285 HydrophobicContact CG-CG2 4.43Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 2.89Å; L281-V361 HydrophobicContact CD2-CB 4.45Å; L281-V361 HydrophobicContact CD2-CG1 3.8Å; L281-K364 HydrophobicContact CD2-CB 3.7Å; L281-K364 HydrophobicContact CD2-CD 4.2Å; L281-K364 HydrophobicContact CG-CB 4.4Å; L281-L365 HydrophobicContact CD1-CD2 3.64Å; L281-L365 HydrophobicContact CD1-CG 4.2Å; L281-L365 HydrophobicContact CD2-CD2 4.25Å; L281-L365 HydrophobicContact CD2-CG 3.94Å
282D90.9Very high87.8Confident53 Ų5332.7 Ų32.728%0.28318%0.183SC..Hα-helixtrans-62.6-40.1177.8-79.4-15.1000111.3E278 V279 F284 V285 E286 K364E278-D282 WeakPolarHBondContact O-CB 3.33Å; E278-D282 PolarHBondContact O-N 2.95Å; V279-D282 PolarHBondContact O-N 3.06Å; D282-F284 VanDerWaalsContact C-N 3.31Å; D282-F284 PolarHBondContact O-N 2.85Å; D282-V285 PolarHBondContact O-N 3.13Å; D282-E286 WeakPolarHBondContact O-CG 3.5Å; D282-E286 PolarHBondContact O-N 2.82Å; D282-K364 IonicContact OD1-NZ 3.8Å; D282-K364 PolarHBondContact OD1-NZ 3.41Å; D282-K364 IonicContact OD2-NZ 2.68Å
283N90.8Very high87.8Confident97 Ų9738.2 Ų38.252%0.51921%0.208SC..Hα-helixtrans-61.2-39.7172.1-71.8-28.8000112.1V279 L281 S287V279-N283 WeakPolarHBondContact O-CB 3.24Å; V279-N283 VanDerWaalsContact O-CG 3.24Å; V279-N283 PolarHBondContact O-N 2.7Å; V279-N283 PolarHBondContact O-ND2 3.28Å; L281-N283 VanDerWaalsContact C-N 3.31Å; L281-N283 PolarHBondContact O-N 2.54Å; N283-S287 PolarHBondContact O-N 3.25Å; N283-S287 VanDerWaalsContact O-N 3.12Å
284F91.4Very high87.6Confident8 Ų840.7 Ų40.74%0.03522%0.22CC..Hα-helixtrans-65.3-45.4175.2-179.1-95.8000111.7A280 L281 D282 E286 S287 I288 K311 E314 L315 L318 C368A280-F284 PolarHBondContact O-N 3.21Å; A280-F284 VanDerWaalsContact O-N 3.09Å; L281-F284 WeakPolarHBondContact O-CA 3.37Å; L281-F284 WeakPolarHBondContact O-CB 3.44Å; L281-F284 PolarHBondContact O-N 3.4Å; L281-F284 VanDerWaalsContact O-N 3.09Å; D282-F284 VanDerWaalsContact C-N 3.31Å; D282-F284 PolarHBondContact O-N 2.85Å; F284-E286 PolarHBondContact O-N 3.41Å; F284-S287 WeakPolarHBondContact O-CA 3.48Å; F284-S287 WeakPolarHBondContact O-CB 3.41Å; F284-S287 PolarHBondContact O-N 3.22Å; F284-S287 PolarHBondContact O-OG 3.41Å; F284-I288 HydrophobicContact CD1-CD1 4.24Å; F284-I288 HydrophobicContact CE1-CD1 3.76Å; F284-I288 HydrophobicContact CE1-CG2 4.09Å; F284-I288 HydrophobicContact CE2-CG2 4.41Å; F284-I288 HydrophobicContact CZ-CG2 3.93Å; F284-I288 PolarHBondContact O-N 3Å; F284-K311 HydrophobicContact CE2-CB 4.44Å; F284-K311 HydrophobicContact CE2-CD 3.92Å; F284-K311 WeakPolarHBondContact CE2-O 3.46Å; F284-E314 HydrophobicContact CD2-CB 4.17Å; F284-E314 HydrophobicContact CE2-CB 3.89Å; F284-L315 HydrophobicContact CD1-CD1 4.21Å; F284-L315 HydrophobicContact CE1-CB 3.97Å; F284-L315 HydrophobicContact CE1-CD1 3.78Å; F284-L315 HydrophobicContact CE1-CD2 4.33Å; F284-L315 HydrophobicContact CE1-CG 4.23Å; F284-L315 HydrophobicContact CE2-CB 4.24Å; F284-L315 HydrophobicContact CZ-CB 3.64Å; F284-L315 HydrophobicContact CZ-CD1 4.36Å; F284-L315 HydrophobicContact CZ-CG 4.38Å; F284-L318 HydrophobicContact CB-CD1 3.7Å; F284-L318 HydrophobicContact CD2-CD1 4.26Å; F284-L318 HydrophobicContact CG-CD1 3.93Å; F284-C368 HydrophobicContact CD1-CB 4.42Å; F284-C368 HydrophobicContact CE1-CB 4.01Å
285V91.2Very high87.3Confident46 Ų4644.2 Ų44.228%0.27924%0.239SC..Hα-helixtrans-58-47.6176.2172.30000110.8L281 D282 S287 I288 Q289 C368L281-V285 HydrophobicContact CD1-CG2 4.33Å; L281-V285 HydrophobicContact CG-CG2 4.43Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 2.89Å; D282-V285 PolarHBondContact O-N 3.13Å; V285-S287 PolarHBondContact O-N 3.14Å; V285-I288 VanDerWaalsContact O-CG1 3.32Å; V285-I288 WeakPolarHBondContact O-CG1 3.38Å; V285-I288 PolarHBondContact O-N 3.37Å; V285-I288 VanDerWaalsContact O-N 3.13Å; V285-Q289 WeakPolarHBondContact O-CB 3.42Å; V285-Q289 PolarHBondContact O-N 3.27Å; V285-C368 VanDerWaalsContact CG2-SG 3.54Å
286E90.8Very high87.1Confident99 Ų9953.5 Ų53.546%0.46328%0.279SS..Hα-helixtrans-57.7-37.1175.7-74.3-164.2163.500111.2K108 D282 F284 I288K108-E286 IonicContact NZ-OE1 2.79Å; K108-E286 PolarHBondContact NZ-OE1 3.06Å; K108-E286 IonicContact NZ-OE2 3.87Å; D282-E286 WeakPolarHBondContact O-CG 3.5Å; D282-E286 PolarHBondContact O-N 2.82Å; F284-E286 PolarHBondContact O-N 3.41Å; E286-I288 VanDerWaalsContact C-N 3.32Å; E286-I288 PolarHBondContact O-N 3.08Å
287S89.5Confident87Confident48 Ų4855.8 Ų55.834%0.33630%0.296SS..Hα-helixtrans-67.6-28.2179.387.10000114N283 F284 V285 K311N283-S287 PolarHBondContact O-N 3.25Å; N283-S287 VanDerWaalsContact O-N 3.12Å; F284-S287 WeakPolarHBondContact O-CA 3.48Å; F284-S287 WeakPolarHBondContact O-CB 3.41Å; F284-S287 PolarHBondContact O-N 3.22Å; F284-S287 PolarHBondContact O-OG 3.41Å; V285-S287 PolarHBondContact O-N 3.14Å; S287-K311 PolarHBondContact OG-NZ 3.32Å; S287-K311 VanDerWaalsContact OG-NZ 3.08Å
288I87.4Confident86.5Confident5 Ų558.1 Ų58.13%0.02633%0.326CS..Hα-helixtrans-101.2-12.9-179.568.1177.9000113.5F284 V285 E286 S290 I291 P292 K311 C368 L371F284-I288 HydrophobicContact CD1-CD1 4.24Å; F284-I288 HydrophobicContact CE1-CD1 3.76Å; F284-I288 HydrophobicContact CE1-CG2 4.09Å; F284-I288 HydrophobicContact CE2-CG2 4.41Å; F284-I288 HydrophobicContact CZ-CG2 3.93Å; F284-I288 PolarHBondContact O-N 3Å; V285-I288 VanDerWaalsContact O-CG1 3.32Å; V285-I288 WeakPolarHBondContact O-CG1 3.38Å; V285-I288 PolarHBondContact O-N 3.37Å; V285-I288 VanDerWaalsContact O-N 3.13Å; E286-I288 VanDerWaalsContact C-N 3.32Å; E286-I288 PolarHBondContact O-N 3.08Å; I288-S290 PolarHBondContact O-N 3.1Å; I288-S290 VanDerWaalsContact O-N 3.12Å; I288-I291 HydrophobicContact CB-CD1 4.23Å; I288-I291 WeakPolarHBondContact O-CB 3.42Å; I288-I291 WeakPolarHBondContact O-CG1 3.2Å; I288-I291 PolarHBondContact O-N 3.18Å; I288-P292 WeakPolarHBondContact O-CD 3.35Å; I288-K311 HydrophobicContact CG2-CD 4.28Å; I288-C368 HydrophobicContact CD1-CB 4.13Å; I288-L371 HydrophobicContact CB-CD2 4.29Å; I288-L371 HydrophobicContact CD1-CD2 3.82Å; I288-L371 HydrophobicContact CG1-CD2 4.03Å
289Q86.9Confident86Confident105 Ų10565.3 Ų65.349%0.49135%0.352SS..THydrogen-bonded Turntrans-56.4-33.1-174.7-174.6-175.7-3000113.6V285 I291 P292V285-Q289 WeakPolarHBondContact O-CB 3.42Å; V285-Q289 PolarHBondContact O-N 3.27Å; Q289-I291 PolarHBondContact O-N 3.24Å; Q289-P292 WeakPolarHBondContact O-CD 3.42Å
290S83.9Confident85.1Confident60 Ų6075.1 Ų75.142%0.4239%0.387SS..Hα-helixtrans-65.2-20.617964.50000113.7I288 E293 M294I288-S290 PolarHBondContact O-N 3.1Å; I288-S290 VanDerWaalsContact O-N 3.12Å; S290-E293 PolarHBondContact O-N 3.38Å; S290-M294 VanDerWaalsContact O-CG 3.31Å; S290-M294 WeakPolarHBondContact O-CG 3.49Å; S290-M294 PolarHBondContact O-N 2.98Å
291I84Confident84.3Confident6 Ų675 Ų753%0.03138%0.383CS..Hα-helixtrans-72.4-52.2-171.8-58.1172.5000111.5I288 Q289 E293 M294 L295 I301 L303 M375I288-I291 HydrophobicContact CB-CD1 4.23Å; I288-I291 WeakPolarHBondContact O-CB 3.42Å; I288-I291 WeakPolarHBondContact O-CG1 3.2Å; I288-I291 PolarHBondContact O-N 3.18Å; Q289-I291 PolarHBondContact O-N 3.24Å; I291-E293 PolarHBondContact O-N 2.68Å; I291-M294 PolarHBondContact O-N 2.89Å; I291-L295 HydrophobicContact CG2-CD1 4.36Å; I291-L295 WeakPolarHBondContact O-CG 3.27Å; I291-L295 PolarHBondContact O-N 3.13Å; I291-I301 HydrophobicContact CG2-CD1 3.97Å; I291-L303 HydrophobicContact CD1-CD1 3.53Å; I291-L303 HydrophobicContact CG1-CD1 4Å; I291-M375 HydrophobicContact CD1-CE 3.41Å; I291-M375 VanDerWaalsContact CD1-CE 3.41Å; I291-M375 HydrophobicContact CD1-SD 3.4Å; I291-M375 WeakPolarHBondContact CD1-SD 3.5Å; I291-M375 HydrophobicContact CG2-CG 4.01Å; I291-M375 HydrophobicContact CG2-SD 4.05Å
292P83.1Confident83.4Confident58 Ų5884 Ų8438%0.37742%0.422SS..Hα-helixtrans-53.3-39.9170.1-27.232.3000113.6I288 Q289 L295 K296 L371I288-P292 WeakPolarHBondContact O-CD 3.35Å; Q289-P292 WeakPolarHBondContact O-CD 3.42Å; P292-L295 PolarHBondContact O-N 3.21Å; P292-K296 WeakPolarHBondContact O-CB 3.1Å; P292-K296 PolarHBondContact O-N 3.1Å; P292-L371 HydrophobicContact CG-CD1 3.82Å; P292-L371 HydrophobicContact CG-CD2 3.65Å; P292-L371 HydrophobicContact CG-CG 4.43Å
293E84.5Confident82.7Confident116 Ų11684.1 Ų84.154%0.54242%0.423SS..Hα-helixtrans-65.8-41.8179.7-65.9179.6-17800112S290 I291 K296 S297S290-E293 PolarHBondContact O-N 3.38Å; I291-E293 PolarHBondContact O-N 2.68Å; E293-K296 PolarHBondContact O-N 2.98Å; E293-S297 PolarHBondContact O-N 2.84Å
294M81.4Confident82.3Confident53 Ų5382.1 Ų82.126%0.26142%0.416SS..Hα-helixtrans-62.3-44.8173.8-75-175.869.400111.6S290 I291 S297 G298 R299 R300S290-M294 VanDerWaalsContact O-CG 3.31Å; S290-M294 WeakPolarHBondContact O-CG 3.49Å; S290-M294 PolarHBondContact O-N 2.98Å; I291-M294 PolarHBondContact O-N 2.89Å; M294-S297 PolarHBondContact O-N 3.09Å; M294-S297 VanDerWaalsContact O-N 3.17Å; M294-S297 PolarHBondContact O-OG 3.07Å; M294-G298 PolarHBondContact O-N 3.36Å; M294-R299 PolarHBondContact O-N 3.48Å; M294-R300 WeakPolarHBondContact CE-O 3.29Å
295L80.8Confident81.8Confident82 Ų8284.5 Ų84.543%0.42943%0.434SS..Hα-helixtrans-59.5-45.6176.8-75.8171.8000111.9I291 P292 S297 G298 I301I291-L295 HydrophobicContact CG2-CD1 4.36Å; I291-L295 WeakPolarHBondContact O-CG 3.27Å; I291-L295 PolarHBondContact O-N 3.13Å; P292-L295 PolarHBondContact O-N 3.21Å; L295-S297 PolarHBondContact O-N 3.42Å; L295-G298 PolarHBondContact O-N 2.89Å; L295-I301 HydrophobicContact CD1-CD1 4.19Å; L295-I301 HydrophobicContact CD2-CD1 3.59Å; L295-I301 HydrophobicContact CD2-CG1 4.04Å; L295-I301 HydrophobicContact CG-CD1 3.84Å; L295-I301 HydrophobicContact CG-CG1 4.26Å
296K83.1Confident81.6Confident196 Ų19685.7 Ų85.785%0.85245%0.448SS*.Hα-helixtrans-57.3-37.7175.7-178.7-178.6176.2-178.70112.2P292 E293 G298P292-K296 WeakPolarHBondContact O-CB 3.1Å; P292-K296 PolarHBondContact O-N 3.1Å; E293-K296 PolarHBondContact O-N 2.98Å; K296-G298 PolarHBondContact O-N 3.17Å
297S84.4Confident81.4Confident56 Ų5685.1 Ų85.139%0.39245%0.446SS..THydrogen-bonded Turntrans-78.82.3178.370.60000114.5E293 M294 L295 R299E293-S297 PolarHBondContact O-N 2.84Å; M294-S297 PolarHBondContact O-N 3.09Å; M294-S297 VanDerWaalsContact O-N 3.17Å; M294-S297 PolarHBondContact O-OG 3.07Å; L295-S297 PolarHBondContact O-N 3.42Å; S297-R299 PolarHBondContact O-N 3.04Å; S297-R299 VanDerWaalsContact O-N 3.14Å; S297-R299 WeakPolarHBondContact OG-CG 3.25Å; S297-R299 PolarHBondContact OG-NE 3.45Å
298G76.7Confident81.3Confident69 Ų6983.1 Ų83.171%0.71143%0.432SS*.THydrogen-bonded Turntrans66.110.2-175.700000113.8M294 L295 K296M294-G298 PolarHBondContact O-N 3.36Å; L295-G298 PolarHBondContact O-N 2.89Å; K296-G298 PolarHBondContact O-N 3.17Å
299R76.1Confident81.3Confident174 Ų17488.3 Ų88.366%0.65746%0.457SS*.PPolyproline II helixtrans-78.2137.3-179.6-77.7-172.2-88.9-166.6-5.9109.8M294 S297 I301M294-R299 PolarHBondContact O-N 3.48Å; S297-R299 PolarHBondContact O-N 3.04Å; S297-R299 VanDerWaalsContact O-N 3.14Å; S297-R299 WeakPolarHBondContact OG-CG 3.25Å; S297-R299 PolarHBondContact OG-NE 3.45Å; R299-I301 PolarHBondContact O-N 3.33Å
300R69.9Low81.5Confident224 Ų22488.3 Ų88.385%0.84546%0.457SS*.PPolyproline II helixtrans-60.1124.8173.3-69.8-176.1178.5176.10.4109.5M294 K302M294-R300 WeakPolarHBondContact CE-O 3.29Å; R300-K302 PolarHBondContact O-N 2.89Å
301I72.5Confident81.7Confident20 Ų2087.9 Ų87.910%0.10345%0.448CS..PPolyproline II helixtrans-59.2121.1170.9-58.2169.3000108.2I291 L295 R299 L303I291-I301 HydrophobicContact CG2-CD1 3.97Å; L295-I301 HydrophobicContact CD1-CD1 4.19Å; L295-I301 HydrophobicContact CD2-CD1 3.59Å; L295-I301 HydrophobicContact CD2-CG1 4.04Å; L295-I301 HydrophobicContact CG-CD1 3.84Å; L295-I301 HydrophobicContact CG-CG1 4.26Å; R299-I301 PolarHBondContact O-N 3.33Å; I301-L303 HydrophobicContact CG2-CB 3.79Å; I301-L303 HydrophobicContact CG2-CD1 3.8Å; I301-L303 HydrophobicContact CG2-CG 3.71Å; I301-L303 PolarHBondContact O-N 3.12Å
302K71.3Confident82.1Confident189 Ų18988.3 Ų88.382%0.82245%0.45SS*.  trans-9034.9178.2-64.8-173.2179.9-179.20112.2R300R300-K302 PolarHBondContact O-N 2.89Å
303L76.4Confident82.4Confident56 Ų5687.1 Ų87.129%0.29345%0.448SS..  trans-98.6131.4175.1-65173.5000109I291 I301 E307 V308 M375I291-L303 HydrophobicContact CD1-CD1 3.53Å; I291-L303 HydrophobicContact CG1-CD1 4Å; I301-L303 HydrophobicContact CG2-CB 3.79Å; I301-L303 HydrophobicContact CG2-CD1 3.8Å; I301-L303 HydrophobicContact CG2-CG 3.71Å; I301-L303 PolarHBondContact O-N 3.12Å; L303-E307 HydrophobicContact CD2-CB 4.36Å; L303-V308 HydrophobicContact CB-CG2 3.97Å; L303-V308 HydrophobicContact CD1-CG2 4.4Å; L303-M375 HydrophobicContact CD1-CE 3.78Å
304S82.6Confident82.8Confident54 Ų5482.5 Ų82.538%0.37843%0.427SS..  trans-68.7156.2169.168.30000110.4A306 E307 V308S304-A306 PolarHBondContact O-N 2.96Å; S304-E307 WeakPolarHBondContact CB-OE2 3.21Å; S304-E307 PolarHBondContact N-OE2 3.43Å; S304-E307 PolarHBondContact O-N 2.93Å; S304-E307 VanDerWaalsContact OG-CD 3.28Å; S304-E307 VanDerWaalsContact OG-CG 3.24Å; S304-E307 WeakPolarHBondContact OG-CG 3.48Å; S304-E307 PolarHBondContact OG-N 3.29Å; S304-E307 VanDerWaalsContact OG-N 3.17Å; S304-E307 PolarHBondContact OG-OE2 3.34Å; S304-V308 PolarHBondContact O-N 3.39Å; S304-V308 VanDerWaalsContact O-N 3.16Å
305S82.3Confident83.2Confident59 Ų5980.3 Ų80.341%0.41342%0.416SS..Hα-helixtrans-60-29.5175-173.40000112.5M309S305-M309 WeakPolarHBondContact O-CB 3.26Å; S305-M309 PolarHBondContact O-N 3.29Å; S305-M309 VanDerWaalsContact O-N 3.09Å
306A86.4Confident83.6Confident70 Ų7082.3 Ų82.358%0.57942%0.422SS*.Hα-helixtrans-69-44.4177.200000111.6S304 V308 M309 Q310S304-A306 PolarHBondContact O-N 2.96Å; A306-V308 VanDerWaalsContact C-N 3.34Å; A306-V308 PolarHBondContact O-N 3.48Å; A306-M309 PolarHBondContact O-N 3.41Å; A306-Q310 PolarHBondContact O-N 3.26Å
307E86.8Confident83.8Confident87 Ų8774.2 Ų74.241%0.40739%0.388SS..Hα-helixtrans-63.3-39.5177.3-72.8161.4141.900111.9L303 S304 Q310 K311L303-E307 HydrophobicContact CD2-CB 4.36Å; S304-E307 WeakPolarHBondContact CB-OE2 3.21Å; S304-E307 PolarHBondContact N-OE2 3.43Å; S304-E307 PolarHBondContact O-N 2.93Å; S304-E307 VanDerWaalsContact OG-CD 3.28Å; S304-E307 VanDerWaalsContact OG-CG 3.24Å; S304-E307 WeakPolarHBondContact OG-CG 3.48Å; S304-E307 PolarHBondContact OG-N 3.29Å; S304-E307 VanDerWaalsContact OG-N 3.17Å; S304-E307 PolarHBondContact OG-OE2 3.34Å; E307-Q310 PolarHBondContact O-N 3.42Å; E307-K311 WeakPolarHBondContact O-CG 3.37Å; E307-K311 PolarHBondContact O-N 3.01Å
308V86.7Confident84Confident6 Ų672 Ų724%0.03637%0.372CS..Hα-helixtrans-64.2-43.4174.6174.90000111.1L303 S304 A306 Q310 K311 I312 M375 L379L303-V308 HydrophobicContact CB-CG2 3.97Å; L303-V308 HydrophobicContact CD1-CG2 4.4Å; S304-V308 PolarHBondContact O-N 3.39Å; S304-V308 VanDerWaalsContact O-N 3.16Å; A306-V308 VanDerWaalsContact C-N 3.34Å; A306-V308 PolarHBondContact O-N 3.48Å; V308-Q310 VanDerWaalsContact C-N 3.31Å; V308-Q310 PolarHBondContact O-N 3.49Å; V308-K311 PolarHBondContact O-N 2.84Å; V308-I312 HydrophobicContact CG1-CD1 3.94Å; V308-I312 VanDerWaalsContact O-CG1 3.28Å; V308-I312 WeakPolarHBondContact O-CG1 3.47Å; V308-I312 PolarHBondContact O-N 2.98Å; V308-M375 HydrophobicContact CB-CE 4.24Å; V308-M375 HydrophobicContact CG1-CB 4Å; V308-M375 HydrophobicContact CG1-CE 4Å; V308-M375 HydrophobicContact CG2-CE 3.62Å; V308-L379 HydrophobicContact CB-CD1 3.59Å; V308-L379 HydrophobicContact CG1-CD1 3.77Å; V308-L379 HydrophobicContact CG2-CD1 3.64Å
309M87.3Confident84.4Confident115 Ų11573 Ų7357%0.56735%0.354SS*.Hα-helixtrans-63.9-37176.4-167.867.8106.900112.2S305 A306 I312 G313S305-M309 WeakPolarHBondContact O-CB 3.26Å; S305-M309 PolarHBondContact O-N 3.29Å; S305-M309 VanDerWaalsContact O-N 3.09Å; A306-M309 PolarHBondContact O-N 3.41Å; M309-I312 WeakPolarHBondContact O-CB 3.49Å; M309-I312 PolarHBondContact O-N 3.39Å; M309-I312 HydrophobicContact SD-CD1 4.3Å; M309-G313 PolarHBondContact O-N 3.07Å
310Q90.4Very high84.8Confident105 Ų10570 Ų7049%0.49135%0.348SS..Hα-helixtrans-61.8-47.2173.8-176.8-177.1-14.500111A306 E307 V308 I312 G313 E314A306-Q310 PolarHBondContact O-N 3.26Å; E307-Q310 PolarHBondContact O-N 3.42Å; V308-Q310 VanDerWaalsContact C-N 3.31Å; V308-Q310 PolarHBondContact O-N 3.49Å; Q310-I312 VanDerWaalsContact C-N 3.32Å; Q310-I312 PolarHBondContact O-N 3.31Å; Q310-G313 PolarHBondContact O-N 2.74Å; Q310-G313 VanDerWaalsContact O-N 3.1Å; Q310-E314 WeakPolarHBondContact CG-OE1 3.43Å; Q310-E314 PolarHBondContact NE2-OE1 2.83Å; Q310-E314 WeakPolarHBondContact O-CG 3.45Å; Q310-E314 PolarHBondContact O-N 2.91Å
311K89.9Confident85.3Confident50 Ų5061 Ų6122%0.21732%0.318CS..Hα-helixtrans-62.5-38177.2-69.6-73162.1-161.20112.6F284 S287 I288 E307 V308 E314 L315F284-K311 HydrophobicContact CE2-CB 4.44Å; F284-K311 HydrophobicContact CE2-CD 3.92Å; F284-K311 WeakPolarHBondContact CE2-O 3.46Å; S287-K311 PolarHBondContact OG-NZ 3.32Å; S287-K311 VanDerWaalsContact OG-NZ 3.08Å; I288-K311 HydrophobicContact CG2-CD 4.28Å; E307-K311 WeakPolarHBondContact O-CG 3.37Å; E307-K311 PolarHBondContact O-N 3.01Å; V308-K311 PolarHBondContact O-N 2.84Å; K311-E314 WeakPolarHBondContact CD-OE2 3.31Å; K311-E314 IonicContact NZ-OE1 3.58Å; K311-E314 IonicContact NZ-OE2 4Å; K311-E314 PolarHBondContact NZ-OE2 3.23Å; K311-E314 PolarHBondContact O-N 3.04Å; K311-L315 WeakPolarHBondContact O-CB 3.46Å; K311-L315 PolarHBondContact O-N 3.32Å
312I90.8Very high85.7Confident15 Ų1560.2 Ų60.28%0.07732%0.315CS..Hα-helixtrans-57-50.9170.3-71.6162.8000110.3V308 M309 Q310 L315 F316 T372 R376V308-I312 HydrophobicContact CG1-CD1 3.94Å; V308-I312 VanDerWaalsContact O-CG1 3.28Å; V308-I312 WeakPolarHBondContact O-CG1 3.47Å; V308-I312 PolarHBondContact O-N 2.98Å; M309-I312 WeakPolarHBondContact O-CB 3.49Å; M309-I312 PolarHBondContact O-N 3.39Å; M309-I312 HydrophobicContact SD-CD1 4.3Å; Q310-I312 VanDerWaalsContact C-N 3.32Å; Q310-I312 PolarHBondContact O-N 3.31Å; I312-L315 PolarHBondContact O-N 2.77Å; I312-F316 HydrophobicContact CG2-CD2 3.51Å; I312-F316 HydrophobicContact CG2-CE2 3.52Å; I312-F316 VanDerWaalsContact O-CD2 3.25Å; I312-F316 WeakPolarHBondContact O-CD2 3.46Å; I312-F316 PolarHBondContact O-N 3.46Å; I312-T372 HydrophobicContact CB-CG2 4.11Å; I312-T372 HydrophobicContact CD1-CG2 4.11Å; I312-T372 HydrophobicContact CG1-CG2 3.1Å; I312-R376 HydrophobicContact CD1-CB 4.32Å; I312-R376 HydrophobicContact CD1-CG 4.49Å
313G91.4Very high85.8Confident33 Ų3354.1 Ų54.134%0.3429%0.291SS..Hα-helixtrans-62.6-42-179.700000113.5M309 Q310 F316 T317M309-G313 PolarHBondContact O-N 3.07Å; Q310-G313 PolarHBondContact O-N 2.74Å; Q310-G313 VanDerWaalsContact O-N 3.1Å; G313-F316 PolarHBondContact O-N 3.3Å; G313-T317 WeakPolarHBondContact O-CB 3.4Å; G313-T317 PolarHBondContact O-N 2.87Å; G313-T317 PolarHBondContact O-OG1 2.9Å
314E91Very high85.3Confident19 Ų1956.9 Ų56.99%0.08931%0.305CS..Hα-helixtrans-57.7-48.7173.6-73.2171.3-163.700110.8V89 F284 Q310 K311 T317 L318V89-E314 HydrophobicContact CG2-CG 4.25Å; F284-E314 HydrophobicContact CD2-CB 4.17Å; F284-E314 HydrophobicContact CE2-CB 3.89Å; Q310-E314 WeakPolarHBondContact CG-OE1 3.43Å; Q310-E314 PolarHBondContact NE2-OE1 2.83Å; Q310-E314 WeakPolarHBondContact O-CG 3.45Å; Q310-E314 PolarHBondContact O-N 2.91Å; K311-E314 WeakPolarHBondContact CD-OE2 3.31Å; K311-E314 IonicContact NZ-OE1 3.58Å; K311-E314 IonicContact NZ-OE2 4Å; K311-E314 PolarHBondContact NZ-OE2 3.23Å; K311-E314 PolarHBondContact O-N 3.04Å; E314-T317 PolarHBondContact O-N 3.21Å; E314-L318 PolarHBondContact O-N 3.33Å
315L91.5Very high84.4Confident7 Ų756.4 Ų56.44%0.03730%0.295CS..Hα-helixtrans-63.1-43.7178.3-179.259.3000112.8F284 K311 I312 T317 L318 R319 L365 C368F284-L315 HydrophobicContact CD1-CD1 4.21Å; F284-L315 HydrophobicContact CE1-CB 3.97Å; F284-L315 HydrophobicContact CE1-CD1 3.78Å; F284-L315 HydrophobicContact CE1-CD2 4.33Å; F284-L315 HydrophobicContact CE1-CG 4.23Å; F284-L315 HydrophobicContact CE2-CB 4.24Å; F284-L315 HydrophobicContact CZ-CB 3.64Å; F284-L315 HydrophobicContact CZ-CD1 4.36Å; F284-L315 HydrophobicContact CZ-CG 4.38Å; K311-L315 WeakPolarHBondContact O-CB 3.46Å; K311-L315 PolarHBondContact O-N 3.32Å; I312-L315 PolarHBondContact O-N 2.77Å; L315-T317 VanDerWaalsContact C-N 3.27Å; L315-T317 PolarHBondContact O-N 2.8Å; L315-L318 PolarHBondContact O-N 3.33Å; L315-R319 WeakPolarHBondContact O-CB 3.44Å; L315-R319 PolarHBondContact O-N 2.92Å; L315-L365 HydrophobicContact CD1-CD2 3.87Å; L315-C368 HydrophobicContact CD1-CB 3.66Å; L315-C368 HydrophobicContact CD2-CB 3.94Å; L315-C368 HydrophobicContact CG-CB 4.48Å
316F89.3Confident83.1Confident125 Ų12555.4 Ų55.455%0.54829%0.288SS..Hα-helixtrans-61.8-38176.6-90.2-69.8000111.9I312 G313 H320I312-F316 HydrophobicContact CG2-CD2 3.51Å; I312-F316 HydrophobicContact CG2-CE2 3.52Å; I312-F316 VanDerWaalsContact O-CD2 3.25Å; I312-F316 WeakPolarHBondContact O-CD2 3.46Å; I312-F316 PolarHBondContact O-N 3.46Å; G313-F316 PolarHBondContact O-N 3.3Å; F316-H320 VanDerWaalsContact O-CB 3.3Å; F316-H320 WeakPolarHBondContact O-CB 3.13Å; F316-H320 PolarHBondContact O-N 2.92Å
317T87.3Confident81.7Confident25 Ų2557.6 Ų57.615%0.15329%0.29CS..Hα-helixtrans-65.2-47.9176.3-55.70000110.6V89 G313 E314 L315 R319 H320 C321V89-T317 HydrophobicContact CG2-CG2 4.3Å; G313-T317 WeakPolarHBondContact O-CB 3.4Å; G313-T317 PolarHBondContact O-N 2.87Å; G313-T317 PolarHBondContact O-OG1 2.9Å; E314-T317 PolarHBondContact O-N 3.21Å; L315-T317 VanDerWaalsContact C-N 3.27Å; L315-T317 PolarHBondContact O-N 2.8Å; T317-R319 PolarHBondContact O-N 3.49Å; T317-H320 PolarHBondContact O-N 3.25Å; T317-C321 PolarHBondContact O-N 3Å; T317-C321 PolarHBondContact O-SG 2.97Å
318L87.1Confident80.1Confident11 Ų1155.2 Ų55.26%0.05828%0.28CS..Hα-helixtrans-59.4-46.9176.5-73.5172.4000112V89 A280 F284 E314 L315 H320 C321 I322 L365V89-L318 HydrophobicContact CG1-CD2 4.44Å; A280-L318 HydrophobicContact CB-CD2 3.87Å; F284-L318 HydrophobicContact CB-CD1 3.7Å; F284-L318 HydrophobicContact CD2-CD1 4.26Å; F284-L318 HydrophobicContact CG-CD1 3.93Å; E314-L318 PolarHBondContact O-N 3.33Å; L315-L318 PolarHBondContact O-N 3.33Å; L318-H320 VanDerWaalsContact C-N 3.31Å; L318-H320 PolarHBondContact O-N 3.46Å; L318-C321 PolarHBondContact O-N 3.37Å; L318-I322 WeakPolarHBondContact O-CB 3.45Å; L318-I322 WeakPolarHBondContact O-CG1 3.46Å; L318-I322 PolarHBondContact O-N 2.98Å; L318-L365 HydrophobicContact CB-CD2 4.49Å
319R86.7Confident78.6Confident88 Ų8857.5 Ų57.533%0.33229%0.292SS..Hα-helixtrans-60.3-41.1176.2-177.3175.6176.3161.82.4111.7L315 T317 N323 L365L315-R319 WeakPolarHBondContact O-CB 3.44Å; L315-R319 PolarHBondContact O-N 2.92Å; T317-R319 PolarHBondContact O-N 3.49Å; R319-N323 WeakPolarHBondContact O-CB 3.49Å; R319-N323 VanDerWaalsContact O-CG 3.25Å; R319-N323 PolarHBondContact O-N 3.16Å; R319-L365 HydrophobicContact CB-CD2 4.38Å
320H83.9Confident77.6Confident112 Ų11257.8 Ų57.852%0.51930%0.295SS..Hα-helixtrans-64.6-47176.7-178.566.3000111.5F316 T317 L318 I322 N323 L324F316-H320 VanDerWaalsContact O-CB 3.3Å; F316-H320 WeakPolarHBondContact O-CB 3.13Å; F316-H320 PolarHBondContact O-N 2.92Å; T317-H320 PolarHBondContact O-N 3.25Å; L318-H320 VanDerWaalsContact C-N 3.31Å; L318-H320 PolarHBondContact O-N 3.46Å; H320-I322 VanDerWaalsContact C-N 3.34Å; H320-I322 PolarHBondContact O-N 3.31Å; H320-N323 PolarHBondContact O-N 3.38Å; H320-L324 WeakPolarHBondContact O-CB 3.5Å; H320-L324 PolarHBondContact O-N 3.21Å
321C79.7Confident76.8Confident34 Ų3454.4 Ų54.423%0.2328%0.282CS..Hα-helixtrans-59.7-44.3177.9-68.20000111.8T317 L318 R325T317-C321 PolarHBondContact O-N 3Å; T317-C321 PolarHBondContact O-SG 2.97Å; L318-C321 PolarHBondContact O-N 3.37Å; C321-R325 WeakPolarHBondContact O-CB 3.43Å; C321-R325 WeakPolarHBondContact O-CG 3.25Å
322I80.3Confident76.3Confident5 Ų553.8 Ų53.83%0.02628%0.283CS..Hα-helixtrans-69.8-43.5-179.9-68.8162.1000111.1W277 L318 H320 R325 S326 V361 L365W277-I322 HydrophobicContact CB-CD1 4.3Å; W277-I322 HydrophobicContact CB-CG1 4.01Å; W277-I322 HydrophobicContact CD2-CG1 4.37Å; W277-I322 HydrophobicContact CE3-CG1 4.3Å; W277-I322 HydrophobicContact CG-CG1 4.27Å; L318-I322 WeakPolarHBondContact O-CB 3.45Å; L318-I322 WeakPolarHBondContact O-CG1 3.46Å; L318-I322 PolarHBondContact O-N 2.98Å; H320-I322 VanDerWaalsContact C-N 3.34Å; H320-I322 PolarHBondContact O-N 3.31Å; I322-R325 CarbonylContact O-C 3.53Å; I322-R325 VanDerWaalsContact O-C 3.28Å; I322-R325 PolarHBondContact O-N 3.49Å; I322-S326 PolarHBondContact O-N 3.44Å; I322-V361 HydrophobicContact CD1-CG1 3.68Å; I322-V361 HydrophobicContact CG1-CG1 4.36Å; I322-V361 HydrophobicContact CG2-CG1 3.93Å; I322-L365 HydrophobicContact CB-CD1 4.13Å; I322-L365 HydrophobicContact CD1-CD1 3.73Å; I322-L365 HydrophobicContact CD1-CD2 4.26Å; I322-L365 HydrophobicContact CD1-CG 4.27Å; I322-L365 HydrophobicContact CG2-CD1 3.98Å
323N74.7Confident75.9Confident61 Ų6159.3 Ų59.333%0.32631%0.312SS..Hα-helixtrans-75.4-38.5-177.3-73.93000113.7R319 H320 R325 S326R319-N323 WeakPolarHBondContact O-CB 3.49Å; R319-N323 VanDerWaalsContact O-CG 3.25Å; R319-N323 PolarHBondContact O-N 3.16Å; H320-N323 PolarHBondContact O-N 3.38Å; N323-R325 PolarHBondContact O-N 3.27Å; N323-S326 WeakPolarHBondContact CA-OG 3.34Å; N323-S326 PolarHBondContact O-N 3.03Å; N323-S326 PolarHBondContact O-OG 3.32Å
324L66.1Low75.7Confident113 Ų11358.6 Ų58.659%0.59230%0.3SS*.Hα-helixtrans-60.9-20.3174.5-160.780000111.2H320H320-L324 WeakPolarHBondContact O-CB 3.5Å; H320-L324 PolarHBondContact O-N 3.21Å
325R62.8Low75.5Confident44 Ų4457.7 Ų57.717%0.16630%0.296CS..THydrogen-bonded Turntrans-111.710.5179.7-50.9-98.5-157.9163.83.3111.5D139 W277 C321 I322 N323 L328D139-R325 PolarHBondContact O-NH2 3.24Å; W277-R325 HydrophobicContact CH2-CB 3.37Å; W277-R325 HydrophobicContact CH2-CG 3.25Å; W277-R325 HydrophobicContact CZ2-CB 4.38Å; W277-R325 HydrophobicContact CZ2-CG 3.83Å; W277-R325 HydrophobicContact CZ3-CB 3.54Å; W277-R325 HydrophobicContact CZ3-CG 3.94Å; C321-R325 WeakPolarHBondContact O-CB 3.43Å; C321-R325 WeakPolarHBondContact O-CG 3.25Å; I322-R325 CarbonylContact O-C 3.53Å; I322-R325 VanDerWaalsContact O-C 3.28Å; I322-R325 PolarHBondContact O-N 3.49Å; N323-R325 PolarHBondContact O-N 3.27Å; R325-L328 WeakPolarHBondContact O-CB 3.4Å
326S55.8Low75.3Confident38 Ų3866.4 Ų66.427%0.26633%0.328SS..THydrogen-bonded Turntrans-87.9-22.6169.265.10000111.8I322 N323 L328 L329I322-S326 PolarHBondContact O-N 3.44Å; N323-S326 WeakPolarHBondContact CA-OG 3.34Å; N323-S326 PolarHBondContact O-N 3.03Å; N323-S326 PolarHBondContact O-OG 3.32Å; S326-L328 PolarHBondContact O-N 3.33Å; S326-L328 VanDerWaalsContact O-N 3.14Å; S326-L329 WeakPolarHBondContact O-CB 3.44Å; S326-L329 PolarHBondContact O-N 2.77Å
327D56.5Low75.2Confident116 Ų11668.2 Ų68.262%0.6234%0.344SS*.G310 helixtrans-58.3-19163.6-76.9-7.2000111.8L329 L330D327-L329 PolarHBondContact O-N 3.32Å; D327-L330 WeakPolarHBondContact O-CB 3.47Å; D327-L330 PolarHBondContact O-N 2.77Å
328L52.4Low75.3Confident37 Ų3770.8 Ų70.819%0.19435%0.35CS..G310 helixtrans-69.2-13.9174.4-147.686.5000113.8L269 R325 S326 L330 Y345L269-L328 HydrophobicContact CB-CD1 4.36Å; L269-L328 HydrophobicContact CB-CD2 3.48Å; L269-L328 VanDerWaalsContact CB-CD2 3.48Å; L269-L328 HydrophobicContact CB-CG 3.89Å; L269-L328 HydrophobicContact CD1-CD1 3.83Å; L269-L328 HydrophobicContact CD1-CD2 4.46Å; L269-L328 HydrophobicContact CD1-CG 4.01Å; L269-L328 HydrophobicContact CD2-CD1 4.08Å; L269-L328 HydrophobicContact CD2-CD2 4.26Å; L269-L328 HydrophobicContact CG-CD1 4.31Å; L269-L328 HydrophobicContact CG-CD2 4.26Å; L269-L328 HydrophobicContact CG-CG 4.36Å; L269-L328 WeakPolarHBondContact O-CD2 3.48Å; R325-L328 WeakPolarHBondContact O-CB 3.4Å; S326-L328 PolarHBondContact O-N 3.33Å; S326-L328 VanDerWaalsContact O-N 3.14Å; L328-L330 VanDerWaalsContact C-N 3.29Å; L328-Y345 PolarHBondContact O-OH 3.03Å
329L56.6Low75.3Confident55 Ų5575.9 Ų75.929%0.28837%0.374SS..G310 helixtrans-80.7-13.8172.4-65.1-176.4000112.8S326 D327 I354 V358S326-L329 WeakPolarHBondContact O-CB 3.44Å; S326-L329 PolarHBondContact O-N 2.77Å; D327-L329 PolarHBondContact O-N 3.32Å; L329-I354 HydrophobicContact CD2-CG2 3.41Å; L329-I354 VanDerWaalsContact CD2-CG2 3.41Å; L329-V358 HydrophobicContact CD1-CB 3.92Å; L329-V358 HydrophobicContact CD1-CG1 3.72Å; L329-V358 HydrophobicContact CD1-CG2 3.99Å; L329-V358 HydrophobicContact CD2-CG2 4.02Å; L329-V358 HydrophobicContact CG-CG2 4.4Å
330L66.1Low75.5Confident121 Ų12176.2 Ų76.263%0.63438%0.382SS*.SBendtrans-77.5138.8168.9-60.4171.6000107.9D327 L328 P332D327-L330 WeakPolarHBondContact O-CB 3.47Å; D327-L330 PolarHBondContact O-N 2.77Å; L328-L330 VanDerWaalsContact C-N 3.29Å; L330-P332 WeakPolarHBondContact O-CD 3.4Å; L330-P332 VanDerWaalsContact O-N 3.12Å
331T72.8Confident75.8Confident34 Ų3471.2 Ų71.221%0.20936%0.36CS..PPolyproline II helixtrans-52.9119.4172.2-52.20000108.7Y335 E342T331-Y335 HydrophobicContact CG2-CD2 3.85Å; T331-Y335 HydrophobicContact CG2-CG 4.18Å; T331-E342 HydrophobicContact CG2-CG 3.78Å
332P79.8Confident76.4Confident36 Ų3672.4 Ų72.423%0.23436%0.362CS..PPolyproline II helixtrans-55.8145.5178.9-29.135.6000112.7L330 F334 Y335L330-P332 WeakPolarHBondContact O-CD 3.4Å; L330-P332 VanDerWaalsContact O-N 3.12Å; P332-F334 PolarHBondContact O-N 3.42Å; P332-Y335 HydrophobicContact CB-CD2 3.89Å; P332-Y335 HydrophobicContact CB-CE2 3.92Å; P332-Y335 HydrophobicContact CG-CD2 4.05Å; P332-Y335 HydrophobicContact CG-CE2 3.76Å; P332-Y335 WeakPolarHBondContact O-CD2 3.48Å; P332-Y335 PolarHBondContact O-N 3Å
333D82.3Confident76.9Confident131 Ų13177.3 Ų77.370%0.70138%0.383SS*.G310 helixtrans-53.4-29.5-179.2-69.2-7.1000113.4Y335 W336D333-Y335 PolarHBondContact O-N 2.95Å; D333-W336 VanDerWaalsContact CA-CD1 3.43Å; D333-W336 WeakPolarHBondContact O-CB 3.36Å; D333-W336 PolarHBondContact O-N 3.12Å; D333-W336 VanDerWaalsContact O-N 3.08Å; D333-W336 PolarHBondContact OD1-NE1 3.18Å
334F86.3Confident77.7Confident18 Ų1874.8 Ų74.88%0.07937%0.369CS..G310 helixtrans-49.3-32.1173.6176.5-97.5000114P161 D163 A164 L258 F261 P332 L341P161-F334 HydrophobicContact CB-CE2 4.43Å; D163-F334 HydrophobicContact CB-CD2 4.03Å; D163-F334 WeakPolarHBondContact OD2-CD2 3.35Å; D163-F334 WeakPolarHBondContact OD2-CE2 3.32Å; A164-F334 HydrophobicContact CB-CD2 4.15Å; A164-F334 HydrophobicContact CB-CE2 4.01Å; L258-F334 HydrophobicContact CD2-CZ 4.01Å; F261-F334 HydrophobicContact CD1-CD1 4.43Å; F261-F334 AromaticContact CD1-CE1 3.87Å; F261-F334 HydrophobicContact CD1-CE1 3.87Å; F261-F334 HydrophobicContact CD1-CZ 4.34Å; F261-F334 AromaticContact CE1-CD1 3.74Å; F261-F334 HydrophobicContact CE1-CD1 3.74Å; F261-F334 AromaticContact CE1-CE1 3.6Å; F261-F334 HydrophobicContact CE1-CE1 3.6Å; F261-F334 HydrophobicContact CE1-CG 4.38Å; F261-F334 HydrophobicContact CE1-CZ 4.14Å; P332-F334 PolarHBondContact O-N 3.42Å; F334-L341 HydrophobicContact CE1-CD1 3.94Å; F334-L341 HydrophobicContact CZ-CD1 4.41Å
335Y88.6Confident78.9Confident0 Ų069.6 Ų69.60%034%0.342CS..G310 helixtrans-90.8-7.5-175.6-58-70.2000114.3A262 N265 T331 P332 D333 D337 R338 L341 Y345A262-Y335 HydrophobicContact CB-CE1 4.03Å; N265-Y335 WeakPolarHBondContact CB-OH 3.42Å; N265-Y335 PolarHBondContact ND2-OH 3.01Å; T331-Y335 HydrophobicContact CG2-CD2 3.85Å; T331-Y335 HydrophobicContact CG2-CG 4.18Å; P332-Y335 HydrophobicContact CB-CD2 3.89Å; P332-Y335 HydrophobicContact CB-CE2 3.92Å; P332-Y335 HydrophobicContact CG-CD2 4.05Å; P332-Y335 HydrophobicContact CG-CE2 3.76Å; P332-Y335 WeakPolarHBondContact O-CD2 3.48Å; P332-Y335 PolarHBondContact O-N 3Å; D333-Y335 PolarHBondContact O-N 2.95Å; Y335-D337 VanDerWaalsContact C-N 3.26Å; Y335-D337 PolarHBondContact O-N 2.87Å; Y335-R338 CarbonylContact O-C 3.34Å; Y335-R338 WeakPolarHBondContact O-CA 3.36Å; Y335-R338 PolarHBondContact O-N 3.44Å; Y335-L341 HydrophobicContact CD1-CB 3.6Å; Y335-L341 HydrophobicContact CE1-CB 3.81Å; Y335-Y345 HydrophobicContact CE2-CD2 4.02Å; Y335-Y345 HydrophobicContact CE2-CE2 4.46Å; Y335-Y345 HydrophobicContact CE2-CG 4.1Å
336W86.8Confident80.1Confident191 Ų19170.9 Ų70.972%0.72335%0.352SS*.THydrogen-bonded Turntrans-59.3-36.3-173.6-82.651.1000113.3D333D333-W336 VanDerWaalsContact CA-CD1 3.43Å; D333-W336 WeakPolarHBondContact O-CB 3.36Å; D333-W336 PolarHBondContact O-N 3.12Å; D333-W336 VanDerWaalsContact O-N 3.08Å; D333-W336 PolarHBondContact OD1-NE1 3.18Å
337D86.3Confident81.7Confident163 Ų16374 Ų7487%0.87236%0.361SS*.THydrogen-bonded Turntrans-92.84177.8-62.9-39.3000112.6Y335Y335-D337 VanDerWaalsContact C-N 3.26Å; Y335-D337 PolarHBondContact O-N 2.87Å
338R89.2Confident83.3Confident78 Ų7868.5 Ų68.529%0.29433%0.331SS..  trans-136.167.9-167.6-55.2-179.9-169.7-97.53.8111.9D163 Y335 N340 L341 E342D163-R338 IonicContact OD2-NH2 3.95Å; Y335-R338 CarbonylContact O-C 3.34Å; Y335-R338 WeakPolarHBondContact O-CA 3.36Å; Y335-R338 PolarHBondContact O-N 3.44Å; R338-N340 PolarHBondContact O-N 3.22Å; R338-L341 HydrophobicContact CB-CB 4.29Å; R338-L341 HydrophobicContact CB-CD1 4.1Å; R338-L341 HydrophobicContact CB-CG 4.26Å; R338-L341 HydrophobicContact CG-CD1 4.47Å; R338-L341 PolarHBondContact O-N 3.22Å; R338-E342 PolarHBondContact O-N 3.33Å; R338-E342 VanDerWaalsContact O-N 3.11Å
339E88.8Confident85Confident118 Ų11867.3 Ų67.355%0.55133%0.326SS*.Hα-helixtrans-53.5-32.3-179-66.5-171.1-166.800114.1L341 K343E339-L341 VanDerWaalsContact C-N 3.34Å; E339-K343 WeakPolarHBondContact O-CD 3.41Å; E339-K343 VanDerWaalsContact O-CG 3.26Å; E339-K343 WeakPolarHBondContact O-CG 3.47Å; E339-K343 PolarHBondContact O-N 3.46Å; E339-K343 IonicContact OE2-NZ 3.03Å; E339-K343 PolarHBondContact OE2-NZ 2.92Å
340N89.6Confident86.5Confident95 Ų9571.8 Ų71.851%0.50835%0.346SS..Hα-helixtrans-60.8-48.1-179.2-38.8-12.7000109.9R338 K343 L344R338-N340 PolarHBondContact O-N 3.22Å; N340-K343 PolarHBondContact O-N 3.09Å; N340-L344 PolarHBondContact O-N 3.25Å
341L91.2Very high87.5Confident8 Ų868 Ų684%0.04232%0.324CS..Hα-helixtrans-74.4-36.5-177.4-60.2-176.3000111.3L258 E259 A262 F334 Y335 R338 E339 K343 L344 Y345L258-L341 HydrophobicContact CB-CD1 3.99Å; L258-L341 HydrophobicContact CB-CD2 4.34Å; E259-L341 HydrophobicContact CB-CD2 4.45Å; E259-L341 HydrophobicContact CG-CD2 3.83Å; A262-L341 HydrophobicContact CB-CB 4.26Å; A262-L341 HydrophobicContact CB-CD2 4.37Å; F334-L341 HydrophobicContact CE1-CD1 3.94Å; F334-L341 HydrophobicContact CZ-CD1 4.41Å; Y335-L341 HydrophobicContact CD1-CB 3.6Å; Y335-L341 HydrophobicContact CE1-CB 3.81Å; R338-L341 HydrophobicContact CB-CB 4.29Å; R338-L341 HydrophobicContact CB-CD1 4.1Å; R338-L341 HydrophobicContact CB-CG 4.26Å; R338-L341 HydrophobicContact CG-CD1 4.47Å; R338-L341 PolarHBondContact O-N 3.22Å; E339-L341 VanDerWaalsContact C-N 3.34Å; L341-K343 VanDerWaalsContact C-N 3.33Å; L341-K343 PolarHBondContact O-N 2.98Å; L341-L344 PolarHBondContact O-N 2.98Å; L341-Y345 PolarHBondContact O-N 2.78Å
342E91.2Very high88.1Confident59 Ų5966.4 Ų66.428%0.27631%0.314SS..Hα-helixtrans-55.7-48.7171.7-176.5173.3-157.800111T331 R338 L344 Y345 D346T331-E342 HydrophobicContact CG2-CG 3.78Å; R338-E342 PolarHBondContact O-N 3.33Å; R338-E342 VanDerWaalsContact O-N 3.11Å; E342-L344 VanDerWaalsContact C-N 3.25Å; E342-L344 PolarHBondContact O-N 3.08Å; E342-Y345 PolarHBondContact O-N 3.09Å; E342-Y345 VanDerWaalsContact O-N 3.17Å; E342-D346 WeakPolarHBondContact O-CB 3.45Å; E342-D346 PolarHBondContact O-N 3.22Å
343K91.6Very high88.3Confident108 Ų10867.3 Ų67.347%0.4732%0.321SS..Hα-helixtrans-59.9-34.9178.5-72.7163.2-169.9153.40112.4E339 N340 L341 K347E339-K343 WeakPolarHBondContact O-CD 3.41Å; E339-K343 VanDerWaalsContact O-CG 3.26Å; E339-K343 WeakPolarHBondContact O-CG 3.47Å; E339-K343 PolarHBondContact O-N 3.46Å; E339-K343 IonicContact OE2-NZ 3.03Å; E339-K343 PolarHBondContact OE2-NZ 2.92Å; N340-K343 PolarHBondContact O-N 3.09Å; L341-K343 VanDerWaalsContact C-N 3.33Å; L341-K343 PolarHBondContact O-N 2.98Å; K343-K347 WeakPolarHBondContact O-CB 3.28Å; K343-K347 WeakPolarHBondContact O-CG 3.46Å; K343-K347 PolarHBondContact O-N 2.98Å
344L91.6Very high88.4Confident8 Ų861.1 Ų61.14%0.04229%0.288CS..Hα-helixtrans-71.8-45.2176.1-65179.2000111.5T238 E259 A262 F263 N340 L341 E342 T348T238-L344 HydrophobicContact CG2-CD1 3.8Å; T238-L344 HydrophobicContact CG2-CD2 4.08Å; T238-L344 WeakPolarHBondContact O-CD2 3.49Å; E259-L344 HydrophobicContact CB-CD1 4.08Å; E259-L344 HydrophobicContact CG-CD1 3.89Å; A262-L344 HydrophobicContact CB-CB 4.36Å; F263-L344 HydrophobicContact CE1-CB 4.26Å; F263-L344 HydrophobicContact CE1-CD2 4.35Å; F263-L344 HydrophobicContact CE2-CD1 4.21Å; F263-L344 HydrophobicContact CZ-CB 4.27Å; F263-L344 HydrophobicContact CZ-CD1 4.24Å; F263-L344 HydrophobicContact CZ-CD2 3.82Å; F263-L344 HydrophobicContact CZ-CG 4.33Å; N340-L344 PolarHBondContact O-N 3.25Å; L341-L344 PolarHBondContact O-N 2.98Å; E342-L344 VanDerWaalsContact C-N 3.25Å; E342-L344 PolarHBondContact O-N 3.08Å; L344-T348 WeakPolarHBondContact O-CB 3.38Å; L344-T348 PolarHBondContact O-N 3.09Å; L344-T348 PolarHBondContact O-OG1 3.18Å
345Y90.3Very high88.2Confident4 Ų464.7 Ų64.72%0.01631%0.308CS..Hα-helixtrans-58-53.6176.4179.8-95000111.1N265 A266 L328 Y335 L341 E342 K347 T348 C349N265-Y345 HydrophobicContact CB-CD2 4.43Å; N265-Y345 HydrophobicContact CB-CE2 4.36Å; A266-Y345 HydrophobicContact CB-CD2 3.72Å; A266-Y345 HydrophobicContact CB-CE2 3.87Å; A266-Y345 HydrophobicContact CB-CG 4.5Å; L328-Y345 PolarHBondContact O-OH 3.03Å; Y335-Y345 HydrophobicContact CE2-CD2 4.02Å; Y335-Y345 HydrophobicContact CE2-CE2 4.46Å; Y335-Y345 HydrophobicContact CE2-CG 4.1Å; L341-Y345 PolarHBondContact O-N 2.78Å; E342-Y345 PolarHBondContact O-N 3.09Å; E342-Y345 VanDerWaalsContact O-N 3.17Å; Y345-K347 PolarHBondContact O-N 3.43Å; Y345-T348 WeakPolarHBondContact O-CB 3.49Å; Y345-T348 PolarHBondContact O-N 2.94Å; Y345-C349 PolarHBondContact O-N 3.43Å; Y345-C349 PolarHBondContact O-SG 3.33Å
346D89Confident88Confident70 Ų7074 Ų7437%0.37434%0.343SS..Hα-helixtrans-61.5-43.6-177.9-77.3-9.9000112.6E342 T348 C349 Q350E342-D346 WeakPolarHBondContact O-CB 3.45Å; E342-D346 PolarHBondContact O-N 3.22Å; D346-T348 VanDerWaalsContact C-N 3.26Å; D346-T348 PolarHBondContact O-N 3.29Å; D346-C349 PolarHBondContact O-N 2.84Å; D346-Q350 WeakPolarHBondContact O-CB 3.22Å; D346-Q350 PolarHBondContact O-N 2.85Å
347K90Very high87.9Confident104 Ų10466.3 Ų66.345%0.45231%0.314SS..Hα-helixtrans-60.8-38.6175.4-79.8178.5-179178.40111.6K343 Y345 Q350 F351K343-K347 WeakPolarHBondContact O-CB 3.28Å; K343-K347 WeakPolarHBondContact O-CG 3.46Å; K343-K347 PolarHBondContact O-N 2.98Å; Y345-K347 PolarHBondContact O-N 3.43Å; K347-Q350 PolarHBondContact O-N 3.14Å; K347-F351 WeakPolarHBondContact O-CB 3.34Å; K347-F351 PolarHBondContact O-N 2.91Å
348T89.8Confident87.8Confident0 Ų059 Ų590%028%0.276CS..Hα-helixtrans-69.6-45178.8-53.80000110.9F245 F263 A266 L344 Y345 D346 Q350 F351 L352F245-T348 HydrophobicContact CE1-CG2 4.18Å; F245-T348 HydrophobicContact CZ-CG2 4.24Å; F263-T348 HydrophobicContact CD1-CG2 4.41Å; F263-T348 WeakPolarHBondContact CD1-OG1 3.5Å; F263-T348 WeakPolarHBondContact CE1-OG1 3.46Å; A266-T348 HydrophobicContact CB-CG2 3.57Å; L344-T348 WeakPolarHBondContact O-CB 3.38Å; L344-T348 PolarHBondContact O-N 3.09Å; L344-T348 PolarHBondContact O-OG1 3.18Å; Y345-T348 WeakPolarHBondContact O-CB 3.49Å; Y345-T348 PolarHBondContact O-N 2.94Å; D346-T348 VanDerWaalsContact C-N 3.26Å; D346-T348 PolarHBondContact O-N 3.29Å; T348-Q350 VanDerWaalsContact C-N 3.29Å; T348-Q350 PolarHBondContact O-N 3.23Å; T348-F351 PolarHBondContact O-N 3.23Å; T348-L352 HydrophobicContact CG2-CD1 3.87Å; T348-L352 WeakPolarHBondContact O-CB 3.45Å; T348-L352 WeakPolarHBondContact O-CD1 3.49Å; T348-L352 WeakPolarHBondContact O-CG 3.41Å; T348-L352 PolarHBondContact O-N 2.69Å
349C87.1Confident87.6Confident13 Ų1360.1 Ų60.19%0.08829%0.287CS..Hα-helixtrans-60.4-37.6173-69.90000112.4Y345 D346 S353 I354Y345-C349 PolarHBondContact O-N 3.43Å; Y345-C349 PolarHBondContact O-SG 3.33Å; D346-C349 PolarHBondContact O-N 2.84Å; C349-S353 PolarHBondContact O-N 2.68Å; C349-I354 HydrophobicContact CB-CG1 4.33Å; C349-I354 WeakPolarHBondContact O-CG1 3.48Å; C349-I354 PolarHBondContact O-N 3.38Å; C349-I354 VanDerWaalsContact O-N 3.14Å
350Q87.8Confident87.6Confident149 Ų14957.4 Ų57.470%0.69628%0.279SS*.Hα-helixtrans-67.1-46.4175.3-172.5179.433.700111.7D346 K347 T348 L352 S353D346-Q350 WeakPolarHBondContact O-CB 3.22Å; D346-Q350 PolarHBondContact O-N 2.85Å; K347-Q350 PolarHBondContact O-N 3.14Å; T348-Q350 VanDerWaalsContact C-N 3.29Å; T348-Q350 PolarHBondContact O-N 3.23Å; Q350-L352 VanDerWaalsContact C-N 3.3Å; Q350-L352 PolarHBondContact O-N 3.33Å; Q350-S353 WeakPolarHBondContact O-CA 3.43Å; Q350-S353 PolarHBondContact O-N 3.08Å
351F87.6Confident87.5Confident41 Ų4152.9 Ų52.918%0.1826%0.255CS..Hα-helixtrans-58.4-43.2177.7171.8-106.6000112P115 I229 L240 K347 T348 S353P115-F351 HydrophobicContact CB-CZ 4.48Å; I229-F351 HydrophobicContact CD1-CE1 4.2Å; L240-F351 HydrophobicContact CD2-CB 3.44Å; L240-F351 VanDerWaalsContact CD2-CB 3.44Å; L240-F351 HydrophobicContact CD2-CD1 4.1Å; L240-F351 HydrophobicContact CD2-CD2 4.5Å; L240-F351 HydrophobicContact CD2-CG 3.77Å; K347-F351 WeakPolarHBondContact O-CB 3.34Å; K347-F351 PolarHBondContact O-N 2.91Å; T348-F351 PolarHBondContact O-N 3.23Å; F351-S353 PolarHBondContact O-N 3.42Å
352L85.3Confident87.3Confident0 Ų055 Ų550%027%0.266CS..THydrogen-bonded Turntrans-76.6-1.1177.6-63.4163.9000113.2L267 A271 T348 Q350 I354L267-L352 HydrophobicContact CD2-CD1 3.83Å; L267-L352 HydrophobicContact CD2-CD2 4.41Å; A271-L352 HydrophobicContact CB-CD1 3.86Å; A271-L352 HydrophobicContact CB-CD2 4.39Å; T348-L352 HydrophobicContact CG2-CD1 3.87Å; T348-L352 WeakPolarHBondContact O-CB 3.45Å; T348-L352 WeakPolarHBondContact O-CD1 3.49Å; T348-L352 WeakPolarHBondContact O-CG 3.41Å; T348-L352 PolarHBondContact O-N 2.69Å; Q350-L352 VanDerWaalsContact C-N 3.3Å; Q350-L352 PolarHBondContact O-N 3.33Å; L352-I354 HydrophobicContact CB-CD1 3.49Å; L352-I354 VanDerWaalsContact CB-CD1 3.49Å; L352-I354 HydrophobicContact CB-CG1 3.78Å; L352-I354 PolarHBondContact O-N 2.87Å
353S84.9Confident87.3Confident55 Ų5557.7 Ų57.739%0.38528%0.279SS..THydrogen-bonded Turntrans53.636.4178.8-63.50000113.6C349 Q350 F351 N355 R356 R357C349-S353 PolarHBondContact O-N 2.68Å; Q350-S353 WeakPolarHBondContact O-CA 3.43Å; Q350-S353 PolarHBondContact O-N 3.08Å; F351-S353 PolarHBondContact O-N 3.42Å; S353-N355 PolarHBondContact O-N 2.95Å; S353-R356 PolarHBondContact O-N 3.46Å; S353-R357 PolarHBondContact O-N 3.02Å; S353-R357 VanDerWaalsContact O-N 3.1Å
354I83.3Confident87.2Confident2 Ų255.8 Ų55.81%0.0127%0.27CS..Hα-helixtrans-58.5-48.1-171.2-58.7-54.1000111.6S270 A271 L274 L329 C349 L352 R356 R357 V358S270-I354 VanDerWaalsContact O-CD1 3.25Å; S270-I354 WeakPolarHBondContact O-CD1 3.1Å; A271-I354 HydrophobicContact CB-CD1 4.35Å; L274-I354 HydrophobicContact CD2-CG2 4.37Å; L329-I354 HydrophobicContact CD2-CG2 3.41Å; L329-I354 VanDerWaalsContact CD2-CG2 3.41Å; C349-I354 HydrophobicContact CB-CG1 4.33Å; C349-I354 WeakPolarHBondContact O-CG1 3.48Å; C349-I354 PolarHBondContact O-N 3.38Å; C349-I354 VanDerWaalsContact O-N 3.14Å; L352-I354 HydrophobicContact CB-CD1 3.49Å; L352-I354 VanDerWaalsContact CB-CD1 3.49Å; L352-I354 HydrophobicContact CB-CG1 3.78Å; L352-I354 PolarHBondContact O-N 2.87Å; I354-R356 VanDerWaalsContact C-N 3.27Å; I354-R356 PolarHBondContact O-N 3.47Å; I354-R357 WeakPolarHBondContact O-CB 3.31Å; I354-R357 PolarHBondContact O-N 3.11Å; I354-V358 HydrophobicContact CG2-CG2 4.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.36Å; I354-V358 PolarHBondContact O-N 3.39Å
355N82.4Confident87.1Confident93 Ų9355.6 Ų55.650%0.49727%0.269SS..Hα-helixtrans-57.1-40.8-179.6-71.4-37.4000112.5S353 N359S353-N355 PolarHBondContact O-N 2.95Å; N355-N359 WeakPolarHBondContact O-CB 3.36Å; N355-N359 PolarHBondContact O-N 2.78Å; N355-N359 VanDerWaalsContact O-N 3.08Å; N355-N359 PolarHBondContact O-ND2 3.37Å
356R83.9Confident87.2Confident194 Ų19459.3 Ų59.373%0.73229%0.287SS*.Hα-helixtrans-66.5-44.1177.2-179.6-179.8171.4150.90.6111.1S353 I354 N359 V360S353-R356 PolarHBondContact O-N 3.46Å; I354-R356 VanDerWaalsContact C-N 3.27Å; I354-R356 PolarHBondContact O-N 3.47Å; R356-N359 PolarHBondContact O-N 2.73Å; R356-V360 WeakPolarHBondContact O-CG2 3.25Å; R356-V360 PolarHBondContact O-N 3.17Å; R356-V360 VanDerWaalsContact O-N 3.12Å
357R86.2Confident87.2Confident31 Ų3160.8 Ų60.812%0.11729%0.291CS..Hα-helixtrans-61.5-48.3179.2-73.6175.664.1-171.21.3111.5A271 L274 E278 S353 I354 N359 V360 V361A271-R357 PolarHBondContact O-NH2 3.33Å; L274-R357 HydrophobicContact CD2-CB 3.59Å; E278-R357 WeakPolarHBondContact OE1-CB 3.31Å; E278-R357 IonicContact OE1-CZ 3.53Å; E278-R357 IonicContact OE1-NE 3.59Å; E278-R357 PolarHBondContact OE1-NE 3.46Å; E278-R357 IonicContact OE1-NH2 2.77Å; E278-R357 IonicContact OE2-CZ 2.73Å; E278-R357 IonicContact OE2-NE 2.78Å; E278-R357 PolarHBondContact OE2-NE 3.28Å; E278-R357 IonicContact OE2-NH2 2.68Å; E278-R357 PolarHBondContact OE2-NH2 3.11Å; S353-R357 PolarHBondContact O-N 3.02Å; S353-R357 VanDerWaalsContact O-N 3.1Å; I354-R357 WeakPolarHBondContact O-CB 3.31Å; I354-R357 PolarHBondContact O-N 3.11Å; R357-N359 VanDerWaalsContact C-N 3.32Å; R357-N359 PolarHBondContact O-N 3.44Å; R357-V360 PolarHBondContact O-N 2.94Å; R357-V360 VanDerWaalsContact O-N 3.16Å; R357-V361 WeakPolarHBondContact O-CG2 3.43Å; R357-V361 PolarHBondContact O-N 3.16Å
358V83.6Confident87.3Confident10 Ų1056.1 Ų56.16%0.06127%0.271CS..Hα-helixtrans-60.7-41.2177175.40000111.7L274 L329 I354 V360 V361 N362L274-V358 HydrophobicContact CD1-CG2 3.91Å; L274-V358 HydrophobicContact CD2-CG2 3.55Å; L274-V358 HydrophobicContact CG-CG2 4.4Å; L329-V358 HydrophobicContact CD1-CB 3.92Å; L329-V358 HydrophobicContact CD1-CG1 3.72Å; L329-V358 HydrophobicContact CD1-CG2 3.99Å; L329-V358 HydrophobicContact CD2-CG2 4.02Å; L329-V358 HydrophobicContact CG-CG2 4.4Å; I354-V358 HydrophobicContact CG2-CG2 4.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.36Å; I354-V358 PolarHBondContact O-N 3.39Å; V358-V360 VanDerWaalsContact C-N 3.33Å; V358-V360 PolarHBondContact O-N 2.98Å; V358-V361 PolarHBondContact O-N 3.02Å; V358-N362 WeakPolarHBondContact CG1-ND2 3.36Å; V358-N362 WeakPolarHBondContact O-CB 3.42Å; V358-N362 PolarHBondContact O-N 3.4Å; V358-N362 PolarHBondContact O-ND2 3.24Å
359N85.2Confident87.3Confident101 Ų10157 Ų5754%0.5428%0.277SS..Hα-helixtrans-60.1-42.4176.2-72.4-16.8000112.4N355 R356 R357 N362 E363N355-N359 WeakPolarHBondContact O-CB 3.36Å; N355-N359 PolarHBondContact O-N 2.78Å; N355-N359 VanDerWaalsContact O-N 3.08Å; N355-N359 PolarHBondContact O-ND2 3.37Å; R356-N359 PolarHBondContact O-N 2.73Å; R357-N359 VanDerWaalsContact C-N 3.32Å; R357-N359 PolarHBondContact O-N 3.44Å; N359-N362 PolarHBondContact O-N 3.18Å; N359-E363 WeakPolarHBondContact O-CB 3.49Å; N359-E363 PolarHBondContact O-N 3.1Å
360V88.5Confident87.5Confident60 Ų6060.7 Ų60.736%0.36429%0.293SS..Hα-helixtrans-65-41.2176.4172.40000111.4R356 R357 V358 E363 K364R356-V360 WeakPolarHBondContact O-CG2 3.25Å; R356-V360 PolarHBondContact O-N 3.17Å; R356-V360 VanDerWaalsContact O-N 3.12Å; R357-V360 PolarHBondContact O-N 2.94Å; R357-V360 VanDerWaalsContact O-N 3.16Å; V358-V360 VanDerWaalsContact C-N 3.33Å; V358-V360 PolarHBondContact O-N 2.98Å; V360-E363 PolarHBondContact O-N 3.21Å; V360-K364 HydrophobicContact CG1-CD 4.45Å; V360-K364 WeakPolarHBondContact O-CG 3.24Å; V360-K364 PolarHBondContact O-N 3.46Å
361V87.7Confident87.5Confident1 Ų155 Ų551%0.00627%0.267CS..Hα-helixtrans-62.1-45.1175.8170.60000111L274 E278 L281 I322 R357 V358 K364 L365L274-V361 HydrophobicContact CD1-CG2 4.27Å; E278-V361 HydrophobicContact CG-CG2 3.4Å; E278-V361 VanDerWaalsContact CG-CG2 3.4Å; L281-V361 HydrophobicContact CD2-CB 4.45Å; L281-V361 HydrophobicContact CD2-CG1 3.8Å; I322-V361 HydrophobicContact CD1-CG1 3.68Å; I322-V361 HydrophobicContact CG1-CG1 4.36Å; I322-V361 HydrophobicContact CG2-CG1 3.93Å; R357-V361 WeakPolarHBondContact O-CG2 3.43Å; R357-V361 PolarHBondContact O-N 3.16Å; V358-V361 PolarHBondContact O-N 3.02Å; V361-K364 PolarHBondContact O-N 3.15Å; V361-L365 HydrophobicContact CG1-CD1 4.35Å; V361-L365 WeakPolarHBondContact O-CG 3.5Å; V361-L365 PolarHBondContact O-N 3.05Å
362N87.2Confident87.6Confident53 Ų5353.1 Ų53.128%0.28326%0.259SS..Hα-helixtrans-63.4-41.6177.8-76.4-26000112.3V358 N359 L365 E366V358-N362 WeakPolarHBondContact CG1-ND2 3.36Å; V358-N362 WeakPolarHBondContact O-CB 3.42Å; V358-N362 PolarHBondContact O-N 3.4Å; V358-N362 PolarHBondContact O-ND2 3.24Å; N359-N362 PolarHBondContact O-N 3.18Å; N362-L365 PolarHBondContact O-N 3.04Å; N362-E366 WeakPolarHBondContact O-CB 3.47Å; N362-E366 PolarHBondContact O-N 3.4Å
363E89.9Confident87.7Confident115 Ų11557.3 Ų57.354%0.53728%0.281SS..Hα-helixtrans-62.2-44.7174.9-174.5178.9-175.400111.6N359 V360 L365 E366 H367N359-E363 WeakPolarHBondContact O-CB 3.49Å; N359-E363 PolarHBondContact O-N 3.1Å; V360-E363 PolarHBondContact O-N 3.21Å; E363-L365 PolarHBondContact O-N 3.14Å; E363-E366 PolarHBondContact O-N 3.22Å; E363-H367 PolarHBondContact O-CD2 3.49Å; E363-H367 VanDerWaalsContact O-CD2 3.24Å; E363-H367 PolarHBondContact O-N 3.12Å; E363-H367 IonicContact OE1-NE2 3.46Å
364K90.8Very high87.7Confident67 Ų6759.8 Ų59.829%0.29129%0.29SS..Hα-helixtrans-60.4-43.3174.6-75.4178.3179.6-175.90112.3L281 D282 V360 V361 E366 H367 C368L281-K364 HydrophobicContact CD2-CB 3.7Å; L281-K364 HydrophobicContact CD2-CD 4.2Å; L281-K364 HydrophobicContact CG-CB 4.4Å; D282-K364 IonicContact OD1-NZ 3.8Å; D282-K364 PolarHBondContact OD1-NZ 3.41Å; D282-K364 IonicContact OD2-NZ 2.68Å; V360-K364 HydrophobicContact CG1-CD 4.45Å; V360-K364 WeakPolarHBondContact O-CG 3.24Å; V360-K364 PolarHBondContact O-N 3.46Å; V361-K364 PolarHBondContact O-N 3.15Å; K364-E366 VanDerWaalsContact C-N 3.32Å; K364-E366 PolarHBondContact O-N 2.7Å; K364-H367 PolarHBondContact O-N 3.27Å; K364-C368 PolarHBondContact O-N 2.79Å; K364-C368 PolarHBondContact O-SG 3.28Å
365L89.9Confident87.7Confident5 Ų560 Ų603%0.02629%0.291CS..Hα-helixtrans-61.4-41176.3-79.4173.1000111.9L281 L315 L318 R319 I322 V361 N362 E363 C368 T369L281-L365 HydrophobicContact CD1-CD2 3.64Å; L281-L365 HydrophobicContact CD1-CG 4.2Å; L281-L365 HydrophobicContact CD2-CD2 4.25Å; L281-L365 HydrophobicContact CD2-CG 3.94Å; L315-L365 HydrophobicContact CD1-CD2 3.87Å; L318-L365 HydrophobicContact CB-CD2 4.49Å; R319-L365 HydrophobicContact CB-CD2 4.38Å; I322-L365 HydrophobicContact CB-CD1 4.13Å; I322-L365 HydrophobicContact CD1-CD1 3.73Å; I322-L365 HydrophobicContact CD1-CD2 4.26Å; I322-L365 HydrophobicContact CD1-CG 4.27Å; I322-L365 HydrophobicContact CG2-CD1 3.98Å; V361-L365 HydrophobicContact CG1-CD1 4.35Å; V361-L365 WeakPolarHBondContact O-CG 3.5Å; V361-L365 PolarHBondContact O-N 3.05Å; N362-L365 PolarHBondContact O-N 3.04Å; E363-L365 PolarHBondContact O-N 3.14Å; L365-C368 WeakPolarHBondContact O-CB 3.49Å; L365-C368 PolarHBondContact O-N 3.16Å; L365-T369 WeakPolarHBondContact O-CB 3.48Å; L365-T369 PolarHBondContact O-N 3.13Å; L365-T369 PolarHBondContact O-OG1 2.89Å
366E90.9Very high87.8Confident82 Ų8262.2 Ų62.238%0.38329%0.292SS..Hα-helixtrans-64-45.8178.1-177.354.5-146.400110.9N362 E363 K364 C368 T369 Q370N362-E366 WeakPolarHBondContact O-CB 3.47Å; N362-E366 PolarHBondContact O-N 3.4Å; E363-E366 PolarHBondContact O-N 3.22Å; K364-E366 VanDerWaalsContact C-N 3.32Å; K364-E366 PolarHBondContact O-N 2.7Å; E366-C368 VanDerWaalsContact C-N 3.33Å; E366-C368 PolarHBondContact O-N 2.89Å; E366-T369 WeakPolarHBondContact O-CB 3.34Å; E366-T369 PolarHBondContact O-N 3.42Å; E366-T369 VanDerWaalsContact O-N 3.11Å; E366-Q370 WeakPolarHBondContact O-CG 3.38Å; E366-Q370 PolarHBondContact O-N 3.27Å; E366-Q370 PolarHBondContact OE1-NE2 3.05Å
367H90.1Very high87.9Confident101 Ų10155.6 Ų55.647%0.46828%0.276SS..Hα-helixtrans-60.2-41.1173.8-67.3-39.5000113.2E363 K364 T369 Q370 L371E363-H367 PolarHBondContact O-CD2 3.49Å; E363-H367 VanDerWaalsContact O-CD2 3.24Å; E363-H367 PolarHBondContact O-N 3.12Å; E363-H367 IonicContact OE1-NE2 3.46Å; K364-H367 PolarHBondContact O-N 3.27Å; H367-T369 VanDerWaalsContact C-N 3.29Å; H367-T369 PolarHBondContact O-N 2.89Å; H367-Q370 PolarHBondContact O-N 3.21Å; H367-L371 PolarHBondContact O-N 2.9Å
368C90.8Very high87.6Confident5 Ų557 Ų573%0.03428%0.284CS..Hα-helixtrans-61.9-40.2174.5-70.30000111.7F284 V285 I288 L315 K364 L365 E366 L371 T372F284-C368 HydrophobicContact CD1-CB 4.42Å; F284-C368 HydrophobicContact CE1-CB 4.01Å; V285-C368 VanDerWaalsContact CG2-SG 3.54Å; I288-C368 HydrophobicContact CD1-CB 4.13Å; L315-C368 HydrophobicContact CD1-CB 3.66Å; L315-C368 HydrophobicContact CD2-CB 3.94Å; L315-C368 HydrophobicContact CG-CB 4.48Å; K364-C368 PolarHBondContact O-N 2.79Å; K364-C368 PolarHBondContact O-SG 3.28Å; L365-C368 WeakPolarHBondContact O-CB 3.49Å; L365-C368 PolarHBondContact O-N 3.16Å; E366-C368 VanDerWaalsContact C-N 3.33Å; E366-C368 PolarHBondContact O-N 2.89Å; C368-L371 PolarHBondContact O-N 3.28Å; C368-T372 VanDerWaalsContact O-CB 3.31Å; C368-T372 WeakPolarHBondContact O-CB 3.43Å; C368-T372 PolarHBondContact O-N 3.14Å; C368-T372 PolarHBondContact O-OG1 3.22Å
369T91.4Very high87.4Confident18 Ų1857.7 Ų57.711%0.1129%0.286CS..Hα-helixtrans-63.2-49.9178.7-57.40000110L365 E366 H367 L371 T372 D373L365-T369 WeakPolarHBondContact O-CB 3.48Å; L365-T369 PolarHBondContact O-N 3.13Å; L365-T369 PolarHBondContact O-OG1 2.89Å; E366-T369 WeakPolarHBondContact O-CB 3.34Å; E366-T369 PolarHBondContact O-N 3.42Å; E366-T369 VanDerWaalsContact O-N 3.11Å; H367-T369 VanDerWaalsContact C-N 3.29Å; H367-T369 PolarHBondContact O-N 2.89Å; T369-L371 VanDerWaalsContact C-N 3.35Å; T369-L371 PolarHBondContact O-N 3.34Å; T369-T372 PolarHBondContact O-N 3.08Å; T369-T372 VanDerWaalsContact O-N 3.11Å; T369-D373 PolarHBondContact O-N 3.44Å
370Q90.6Very high87.1Confident92 Ų9256.5 Ų56.543%0.4329%0.286SS..Hα-helixtrans-57.6-45.2177.5-68.6169.56.500112.3E366 H367 T372 D373 L374E366-Q370 WeakPolarHBondContact O-CG 3.38Å; E366-Q370 PolarHBondContact O-N 3.27Å; E366-Q370 PolarHBondContact OE1-NE2 3.05Å; H367-Q370 PolarHBondContact O-N 3.21Å; Q370-T372 VanDerWaalsContact C-N 3.33Å; Q370-T372 PolarHBondContact O-N 3.13Å; Q370-D373 PolarHBondContact O-N 3.44Å; Q370-L374 WeakPolarHBondContact O-CG 3.49Å; Q370-L374 PolarHBondContact O-N 3.04Å; Q370-L374 VanDerWaalsContact O-N 3.08Å
371L88.3Confident86.7Confident28 Ų2859.4 Ų59.415%0.14730%0.296CS..Hα-helixtrans-63.5-41.1177.1178.256.1000111.8I288 P292 H367 C368 T369 D373 L374 M375I288-L371 HydrophobicContact CB-CD2 4.29Å; I288-L371 HydrophobicContact CD1-CD2 3.82Å; I288-L371 HydrophobicContact CG1-CD2 4.03Å; P292-L371 HydrophobicContact CG-CD1 3.82Å; P292-L371 HydrophobicContact CG-CD2 3.65Å; P292-L371 HydrophobicContact CG-CG 4.43Å; H367-L371 PolarHBondContact O-N 2.9Å; C368-L371 PolarHBondContact O-N 3.28Å; T369-L371 VanDerWaalsContact C-N 3.35Å; T369-L371 PolarHBondContact O-N 3.34Å; L371-D373 VanDerWaalsContact C-N 3.34Å; L371-L374 WeakPolarHBondContact O-CB 3.33Å; L371-L374 PolarHBondContact O-N 3.31Å; L371-M375 HydrophobicContact CG-SD 4.49Å; L371-M375 WeakPolarHBondContact O-CG 3.49Å; L371-M375 PolarHBondContact O-N 3.21Å; L371-M375 VanDerWaalsContact O-N 3.07Å
372T87.9Confident86.2Confident3 Ų362.6 Ų62.62%0.01831%0.31CS..Hα-helixtrans-68-36.4-179.9-55.70000111.6I312 C368 T369 Q370 M375 R376I312-T372 HydrophobicContact CB-CG2 4.11Å; I312-T372 HydrophobicContact CD1-CG2 4.11Å; I312-T372 HydrophobicContact CG1-CG2 3.1Å; C368-T372 VanDerWaalsContact O-CB 3.31Å; C368-T372 WeakPolarHBondContact O-CB 3.43Å; C368-T372 PolarHBondContact O-N 3.14Å; C368-T372 PolarHBondContact O-OG1 3.22Å; T369-T372 PolarHBondContact O-N 3.08Å; T369-T372 VanDerWaalsContact O-N 3.11Å; Q370-T372 VanDerWaalsContact C-N 3.33Å; Q370-T372 PolarHBondContact O-N 3.13Å; T372-M375 WeakPolarHBondContact O-CB 3.43Å; T372-M375 PolarHBondContact O-N 3.46Å; T372-R376 PolarHBondContact O-N 3.07Å
373D87.4Confident85.7Confident87 Ų8764.4 Ų64.447%0.46532%0.316SS..Hα-helixtrans-65.6-39.2174.2-74.8-27.2000112.1T369 Q370 L371 M375 R376 S377T369-D373 PolarHBondContact O-N 3.44Å; Q370-D373 PolarHBondContact O-N 3.44Å; L371-D373 VanDerWaalsContact C-N 3.34Å; D373-M375 VanDerWaalsContact C-N 3.31Å; D373-M375 PolarHBondContact O-N 3.45Å; D373-R376 WeakPolarHBondContact O-CB 3.5Å; D373-R376 PolarHBondContact O-N 2.93Å; D373-S377 PolarHBondContact O-N 3.07Å; D373-S377 PolarHBondContact O-OG 2.98Å
374L85.6Confident85.4Confident108 Ų10861.6 Ų61.657%0.56531%0.309SS*.Hα-helixtrans-62.1-37.9172.1-69.8171.7000112.3Q370 L371 S377 H378Q370-L374 WeakPolarHBondContact O-CG 3.49Å; Q370-L374 PolarHBondContact O-N 3.04Å; Q370-L374 VanDerWaalsContact O-N 3.08Å; L371-L374 WeakPolarHBondContact O-CB 3.33Å; L371-L374 PolarHBondContact O-N 3.31Å; L374-S377 PolarHBondContact O-OG 3.23Å; L374-H378 PolarHBondContact O-N 2.95Å
375M83.5Confident85.1Confident7 Ų762.7 Ų62.73%0.03432%0.318CS..Hα-helixtrans-66-41.3175.1-67166.356.300111.5I291 L303 V308 L371 T372 D373 L379I291-M375 HydrophobicContact CD1-CE 3.41Å; I291-M375 VanDerWaalsContact CD1-CE 3.41Å; I291-M375 HydrophobicContact CD1-SD 3.4Å; I291-M375 WeakPolarHBondContact CD1-SD 3.5Å; I291-M375 HydrophobicContact CG2-CG 4.01Å; I291-M375 HydrophobicContact CG2-SD 4.05Å; L303-M375 HydrophobicContact CD1-CE 3.78Å; V308-M375 HydrophobicContact CB-CE 4.24Å; V308-M375 HydrophobicContact CG1-CB 4Å; V308-M375 HydrophobicContact CG1-CE 4Å; V308-M375 HydrophobicContact CG2-CE 3.62Å; L371-M375 HydrophobicContact CG-SD 4.49Å; L371-M375 WeakPolarHBondContact O-CG 3.49Å; L371-M375 PolarHBondContact O-N 3.21Å; L371-M375 VanDerWaalsContact O-N 3.07Å; T372-M375 WeakPolarHBondContact O-CB 3.43Å; T372-M375 PolarHBondContact O-N 3.46Å; D373-M375 VanDerWaalsContact C-N 3.31Å; D373-M375 PolarHBondContact O-N 3.45Å; M375-L379 WeakPolarHBondContact O-CG 3.35Å; M375-L379 PolarHBondContact O-N 3.15Å
376R84.8Confident84.9Confident138 Ų13870.9 Ų70.952%0.52135%0.348SS..Hα-helixtrans-64.7-44.8178.5-176.2179.1179.2146.60.7111.9I312 T372 D373 L379 S380I312-R376 HydrophobicContact CD1-CB 4.32Å; I312-R376 HydrophobicContact CD1-CG 4.49Å; T372-R376 PolarHBondContact O-N 3.07Å; D373-R376 WeakPolarHBondContact O-CB 3.5Å; D373-R376 PolarHBondContact O-N 2.93Å; R376-L379 PolarHBondContact O-N 2.99Å; R376-S380 PolarHBondContact O-N 3.12Å
377S84.9Confident84.9Confident55 Ų5571.9 Ų71.939%0.38536%0.356SS..Hα-helixtrans-62.4-44.7179.263.70000111.6D373 L374 L379 S380 E381D373-S377 PolarHBondContact O-N 3.07Å; D373-S377 PolarHBondContact O-OG 2.98Å; L374-S377 PolarHBondContact O-OG 3.23Å; S377-L379 VanDerWaalsContact C-N 3.29Å; S377-L379 PolarHBondContact O-N 2.94Å; S377-S380 WeakPolarHBondContact O-CA 3.32Å; S377-S380 WeakPolarHBondContact O-CB 3.35Å; S377-S380 PolarHBondContact O-N 3.49Å; S377-E381 PolarHBondContact O-N 3.44Å
378H81.3Confident85Confident62 Ų6271.7 Ų71.729%0.28736%0.355SS..Hα-helixtrans-63.2-31.6177.3176.3-113.3000113.4L374 K382L374-H378 PolarHBondContact O-N 2.95Å; H378-K382 VanDerWaalsContact CE1-CE 3.4Å; H378-K382 WeakPolarHBondContact CE1-CE 3.48Å; H378-K382 PolarHBondContact CE1-NZ 3.17Å; H378-K382 PolarHBondContact O-N 3.21Å
379L78.3Confident85.1Confident23 Ų2379.6 Ų79.612%0.1238%0.384CS..Hα-helixtrans-70.3-42.1170.6-73.1175.4000111.9V308 M375 R376 S377 E381 K382 H383V308-L379 HydrophobicContact CB-CD1 3.59Å; V308-L379 HydrophobicContact CG1-CD1 3.77Å; V308-L379 HydrophobicContact CG2-CD1 3.64Å; M375-L379 WeakPolarHBondContact O-CG 3.35Å; M375-L379 PolarHBondContact O-N 3.15Å; R376-L379 PolarHBondContact O-N 2.99Å; S377-L379 VanDerWaalsContact C-N 3.29Å; S377-L379 PolarHBondContact O-N 2.94Å; L379-E381 VanDerWaalsContact C-N 3.32Å; L379-E381 PolarHBondContact O-N 3.04Å; L379-K382 WeakPolarHBondContact O-CB 3.4Å; L379-K382 PolarHBondContact O-N 3.45Å; L379-H383 PolarHBondContact O-CD2 3.47Å; L379-H383 PolarHBondContact O-N 3Å; L379-H383 VanDerWaalsContact O-N 3.08Å
380S80Confident85.2Confident77 Ų7783.8 Ų83.854%0.53840%0.404SS..Hα-helixtrans-59.3-42.5178-169.50000111.9R376 S377 K382 H383 S384R376-S380 PolarHBondContact O-N 3.12Å; S377-S380 WeakPolarHBondContact O-CA 3.32Å; S377-S380 WeakPolarHBondContact O-CB 3.35Å; S377-S380 PolarHBondContact O-N 3.49Å; S380-K382 PolarHBondContact O-N 3.08Å; S380-H383 WeakPolarHBondContact O-CB 3.48Å; S380-H383 PolarHBondContact O-N 3.24Å; S380-H383 VanDerWaalsContact O-N 3.14Å; S380-S384 PolarHBondContact O-N 3.44Å
381E79.8Confident85.4Confident120 Ų12083.9 Ų83.956%0.56141%0.406SS*.Hα-helixtrans-59.6-44.6175.4-73.4177.4179.900112S377 L379 H383 S384 L385S377-E381 PolarHBondContact O-N 3.44Å; L379-E381 VanDerWaalsContact C-N 3.32Å; L379-E381 PolarHBondContact O-N 3.04Å; E381-H383 VanDerWaalsContact C-N 3.27Å; E381-H383 PolarHBondContact O-N 3.46Å; E381-S384 PolarHBondContact O-N 3.05Å; E381-L385 WeakPolarHBondContact O-CB 3.42Å; E381-L385 WeakPolarHBondContact O-CG 3.34Å; E381-L385 PolarHBondContact O-N 3.01Å
382K77.1Confident85.7Confident69 Ų6986.2 Ų86.230%0.342%0.422SS..Hα-helixtrans-61.1-36.8175.4-71.7177.4-179.7175.20112.5H378 L379 S380 R386H378-K382 VanDerWaalsContact CE1-CE 3.4Å; H378-K382 WeakPolarHBondContact CE1-CE 3.48Å; H378-K382 PolarHBondContact CE1-NZ 3.17Å; H378-K382 PolarHBondContact O-N 3.21Å; L379-K382 WeakPolarHBondContact O-CB 3.4Å; L379-K382 PolarHBondContact O-N 3.45Å; S380-K382 PolarHBondContact O-N 3.08Å; K382-R386 WeakPolarHBondContact O-CG 3.28Å; K382-R386 PolarHBondContact O-N 3.27Å; K382-R386 VanDerWaalsContact O-N 3.13Å
383H77.6Confident86.1Confident90 Ų9090.3 Ų90.342%0.41744%0.443SS..Hα-helixtrans-68.1-43.7175.5-78.9-71.2000111.6L379 S380 E381 R386 L387L379-H383 PolarHBondContact O-CD2 3.47Å; L379-H383 PolarHBondContact O-N 3Å; L379-H383 VanDerWaalsContact O-N 3.08Å; S380-H383 WeakPolarHBondContact O-CB 3.48Å; S380-H383 PolarHBondContact O-N 3.24Å; S380-H383 VanDerWaalsContact O-N 3.14Å; E381-H383 VanDerWaalsContact C-N 3.27Å; E381-H383 PolarHBondContact O-N 3.46Å; H383-R386 PolarHBondContact O-N 3.03Å; H383-L387 PolarHBondContact O-N 3.47Å; H383-L387 VanDerWaalsContact O-N 3.14Å
384S83Confident86.5Confident56 Ų5691.2 Ų91.239%0.39245%0.447SS..Hα-helixtrans-58.7-48.9174.5-164.90000111.3S380 E381 R386 L387 E388S380-S384 PolarHBondContact O-N 3.44Å; E381-S384 PolarHBondContact O-N 3.05Å; S384-R386 VanDerWaalsContact C-N 3.29Å; S384-R386 PolarHBondContact O-N 3.21Å; S384-L387 WeakPolarHBondContact O-CB 3.36Å; S384-L387 PolarHBondContact O-N 3.4Å; S384-E388 WeakPolarHBondContact O-CG 3.38Å; S384-E388 PolarHBondContact O-N 3.01Å; S384-E388 PolarHBondContact OG-OE1 3.39Å; S384-E388 VanDerWaalsContact OG-OE1 3.07Å
385L84.1Confident86.9Confident90 Ų9091 Ų9147%0.47145%0.445SS..Hα-helixtrans-59.9-37.4178.9-71.5172.4000112.6E381 E388 W389E381-L385 WeakPolarHBondContact O-CB 3.42Å; E381-L385 WeakPolarHBondContact O-CG 3.34Å; E381-L385 PolarHBondContact O-N 3.01Å; L385-E388 PolarHBondContact O-N 2.98Å; L385-W389 WeakPolarHBondContact O-CB 3.42Å; L385-W389 VanDerWaalsContact O-CD1 3.27Å; L385-W389 PolarHBondContact O-N 3.26Å
386R86Confident87.6Confident178 Ų17894.1 Ų94.167%0.67247%0.465SS*.Hα-helixtrans-65.8-39.5175.3-77178-176.2176.51.8112.2K382 H383 S384 M390K382-R386 WeakPolarHBondContact O-CG 3.28Å; K382-R386 PolarHBondContact O-N 3.27Å; K382-R386 VanDerWaalsContact O-N 3.13Å; H383-R386 PolarHBondContact O-N 3.03Å; S384-R386 VanDerWaalsContact C-N 3.29Å; S384-R386 PolarHBondContact O-N 3.21Å; R386-M390 WeakPolarHBondContact O-CB 3.45Å; R386-M390 PolarHBondContact O-N 3.38Å
387L90.3Very high88.1Confident102 Ų10291.5 Ų91.553%0.53446%0.46SS..Hα-helixtrans-65.6-43.3175.5-68.5173.4000110.8H383 S384 M390 I391H383-L387 PolarHBondContact O-N 3.47Å; H383-L387 VanDerWaalsContact O-N 3.14Å; S384-L387 WeakPolarHBondContact O-CB 3.36Å; S384-L387 PolarHBondContact O-N 3.4Å; L387-M390 HydrophobicContact CD2-CE 4.25Å; L387-M390 WeakPolarHBondContact O-CB 3.43Å; L387-M390 PolarHBondContact O-N 3.34Å; L387-I391 WeakPolarHBondContact O-CG1 3.46Å; L387-I391 PolarHBondContact O-N 2.76Å
388E92.8Very high88.7Confident98 Ų9893.2 Ų93.246%0.45846%0.462SS..Hα-helixtrans-59.8-47.9175.5-71.8167.6-149.400111.5S384 L385 M390 I391 V392S384-E388 WeakPolarHBondContact O-CG 3.38Å; S384-E388 PolarHBondContact O-N 3.01Å; S384-E388 PolarHBondContact OG-OE1 3.39Å; S384-E388 VanDerWaalsContact OG-OE1 3.07Å; L385-E388 PolarHBondContact O-N 2.98Å; E388-M390 VanDerWaalsContact C-N 3.32Å; E388-M390 PolarHBondContact O-N 3.24Å; E388-I391 WeakPolarHBondContact O-CB 3.4Å; E388-I391 PolarHBondContact O-N 3.01Å; E388-I391 VanDerWaalsContact O-N 3.15Å; E388-V392 WeakPolarHBondContact O-CG2 3.39Å; E388-V392 PolarHBondContact O-N 3Å
389W93.2Very high89.3Confident170 Ų17093.7 Ų93.764%0.64447%0.47SS*.Hα-helixtrans-61.1-39.1176.1-92.695.7000112.9L385 I391 V392 I393L385-W389 WeakPolarHBondContact O-CB 3.42Å; L385-W389 VanDerWaalsContact O-CD1 3.27Å; L385-W389 PolarHBondContact O-N 3.26Å; W389-I391 VanDerWaalsContact C-N 3.32Å; W389-I391 PolarHBondContact O-N 2.9Å; W389-V392 PolarHBondContact O-N 3.36Å; W389-I393 HydrophobicContact CE3-CD1 4.47Å; W389-I393 VanDerWaalsContact O-CG1 3.28Å; W389-I393 WeakPolarHBondContact O-CG1 3.38Å; W389-I393 PolarHBondContact O-N 3.3Å
390M93.2Very high90.1Very high106 Ų10697.8 Ų97.852%0.52249%0.489SS..Hα-helixtrans-61.2-41.8175.5-172.8179.275.600111.3R386 L387 E388 I393 L394R386-M390 WeakPolarHBondContact O-CB 3.45Å; R386-M390 PolarHBondContact O-N 3.38Å; L387-M390 HydrophobicContact CD2-CE 4.25Å; L387-M390 WeakPolarHBondContact O-CB 3.43Å; L387-M390 PolarHBondContact O-N 3.34Å; E388-M390 VanDerWaalsContact C-N 3.32Å; E388-M390 PolarHBondContact O-N 3.24Å; M390-I393 PolarHBondContact O-N 3.22Å; M390-L394 HydrophobicContact CG-CD1 4.28Å; M390-L394 VanDerWaalsContact O-CG 3.25Å; M390-L394 WeakPolarHBondContact O-CG 3.31Å; M390-L394 PolarHBondContact O-N 3.09Å
391I94.7Very high90.8Very high94 Ų94100.8 Ų100.848%0.48249%0.493SS..Hα-helixtrans-63.9-46.6176.8-65.6163.7000111L387 E388 W389 I393 L394 I395L387-I391 WeakPolarHBondContact O-CG1 3.46Å; L387-I391 PolarHBondContact O-N 2.76Å; E388-I391 WeakPolarHBondContact O-CB 3.4Å; E388-I391 PolarHBondContact O-N 3.01Å; E388-I391 VanDerWaalsContact O-N 3.15Å; W389-I391 VanDerWaalsContact C-N 3.32Å; W389-I391 PolarHBondContact O-N 2.9Å; I391-I393 VanDerWaalsContact C-N 3.32Å; I391-I393 PolarHBondContact O-N 3.43Å; I391-L394 PolarHBondContact O-N 3.08Å; I391-I395 HydrophobicContact CG2-CD1 3.89Å; I391-I395 WeakPolarHBondContact O-CG1 3.33Å; I391-I395 PolarHBondContact O-N 3.44Å
392V95.2Very high91.5Very high78 Ų7899.4 Ų99.447%0.47349%0.486SS..Hα-helixtrans-60.2-42.4179173.90000111.5E388 W389 I395 T396E388-V392 WeakPolarHBondContact O-CG2 3.39Å; E388-V392 PolarHBondContact O-N 3Å; W389-V392 PolarHBondContact O-N 3.36Å; V392-I395 PolarHBondContact O-N 3Å; V392-T396 WeakPolarHBondContact O-CB 3.35Å; V392-T396 PolarHBondContact O-N 3.02Å; V392-T396 PolarHBondContact O-OG1 3.23Å
393I95.7Very high92.3Very high88 Ų88100.1 Ų100.145%0.45149%0.493SS..Hα-helixtrans-63.4-44.1176.9-69.6166.3000110.9W389 M390 I391 I395 T396 I397W389-I393 HydrophobicContact CE3-CD1 4.47Å; W389-I393 VanDerWaalsContact O-CG1 3.28Å; W389-I393 WeakPolarHBondContact O-CG1 3.38Å; W389-I393 PolarHBondContact O-N 3.3Å; M390-I393 PolarHBondContact O-N 3.22Å; I391-I393 VanDerWaalsContact C-N 3.32Å; I391-I393 PolarHBondContact O-N 3.43Å; I393-I395 PolarHBondContact O-N 3.14Å; I393-T396 PolarHBondContact O-N 3.39Å; I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 HydrophobicContact CG2-CG1 4.49Å; I393-I397 WeakPolarHBondContact O-CG1 3.27Å; I393-I397 PolarHBondContact O-N 2.95Å
394L94.9Very high93Very high106 Ų10698.1 Ų98.156%0.55549%0.492SS*.Hα-helixtrans-60.6-44.3178.6-74168.3000112.1M390 I391 T396 I397 E398M390-L394 HydrophobicContact CG-CD1 4.28Å; M390-L394 VanDerWaalsContact O-CG 3.25Å; M390-L394 WeakPolarHBondContact O-CG 3.31Å; M390-L394 PolarHBondContact O-N 3.09Å; I391-L394 PolarHBondContact O-N 3.08Å; L394-T396 VanDerWaalsContact C-N 3.35Å; L394-I397 PolarHBondContact O-N 3.37Å; L394-E398 PolarHBondContact O-N 3.48Å
395I95.7Very high93.5Very high103 Ų103101.7 Ų101.753%0.52850%0.501SS..Hα-helixtrans-64.1-42.2176.7-65.5168.1000110.7I391 V392 I393 I397 E398 V399I391-I395 HydrophobicContact CG2-CD1 3.89Å; I391-I395 WeakPolarHBondContact O-CG1 3.33Å; I391-I395 PolarHBondContact O-N 3.44Å; V392-I395 PolarHBondContact O-N 3Å; I393-I395 PolarHBondContact O-N 3.14Å; I395-I397 VanDerWaalsContact C-N 3.33Å; I395-I397 PolarHBondContact O-N 2.89Å; I395-E398 PolarHBondContact O-N 2.95Å; I395-V399 HydrophobicContact CG2-CG2 4.42Å; I395-V399 WeakPolarHBondContact O-CG2 3.38Å; I395-V399 PolarHBondContact O-N 3.3Å
396T96.6Very high93.9Very high74 Ų74105.4 Ų105.445%0.45452%0.518SS..Hα-helixtrans-61.5-42.7-179.9-56.50000111.5V392 I393 L394 V399 M400V392-T396 WeakPolarHBondContact O-CB 3.35Å; V392-T396 PolarHBondContact O-N 3.02Å; V392-T396 PolarHBondContact O-OG1 3.23Å; I393-T396 PolarHBondContact O-N 3.39Å; L394-T396 VanDerWaalsContact C-N 3.35Å; T396-V399 PolarHBondContact O-N 2.98Å; T396-M400 VanDerWaalsContact O-CG 3.27Å; T396-M400 WeakPolarHBondContact O-CG 3.46Å; T396-M400 PolarHBondContact O-N 3.23Å
397I96.5Very high94.1Very high82 Ų82103.6 Ų103.642%0.42152%0.52SS..Hα-helixtrans-63.2-43.6177.5-69.2167.6000111.1I393 L394 I395 V399 M400 F401I393-I397 HydrophobicContact CG2-CD1 3.83Å; I393-I397 HydrophobicContact CG2-CG1 4.49Å; I393-I397 WeakPolarHBondContact O-CG1 3.27Å; I393-I397 PolarHBondContact O-N 2.95Å; L394-I397 PolarHBondContact O-N 3.37Å; I395-I397 VanDerWaalsContact C-N 3.33Å; I395-I397 PolarHBondContact O-N 2.89Å; I397-V399 PolarHBondContact O-N 3.43Å; I397-M400 PolarHBondContact O-N 3.34Å; I397-F401 HydrophobicContact CG2-CD2 3.83Å; I397-F401 HydrophobicContact CG2-CE2 3.43Å; I397-F401 VanDerWaalsContact CG2-CE2 3.43Å; I397-F401 HydrophobicContact CG2-CZ 4.24Å; I397-F401 WeakPolarHBondContact O-CD2 3.4Å; I397-F401 PolarHBondContact O-N 2.79Å
398E96Very high93.6Very high91 Ų91109.7 Ų109.743%0.42554%0.542SS..Hα-helixtrans-60.7-46.5178.1-172.370.9-175.400111.5L394 I395 M400 F401 E402L394-E398 PolarHBondContact O-N 3.48Å; I395-E398 PolarHBondContact O-N 2.95Å; E398-M400 VanDerWaalsContact C-N 3.33Å; E398-M400 PolarHBondContact O-N 3.36Å; E398-F401 PolarHBondContact O-N 3.43Å; E398-E402 PolarHBondContact O-N 3.04Å; E398-E402 VanDerWaalsContact O-N 3.08Å
399V95.6Very high93.6Very high73 Ų73110.3 Ų110.344%0.44255%0.547SS..Hα-helixtrans-63-41.2178.1173.60000111.1I395 T396 I397 F401 E402 L403I395-V399 HydrophobicContact CG2-CG2 4.42Å; I395-V399 WeakPolarHBondContact O-CG2 3.38Å; I395-V399 PolarHBondContact O-N 3.3Å; T396-V399 PolarHBondContact O-N 2.98Å; I397-V399 PolarHBondContact O-N 3.43Å; V399-F401 VanDerWaalsContact C-N 3.32Å; V399-F401 PolarHBondContact O-N 3.17Å; V399-E402 PolarHBondContact O-N 3.18Å; V399-L403 HydrophobicContact CG1-CD1 4.02Å; V399-L403 HydrophobicContact CG1-CG 4.36Å; V399-L403 WeakPolarHBondContact O-CB 3.48Å; V399-L403 WeakPolarHBondContact O-CG 3.34Å; V399-L403 PolarHBondContact O-N 3.4Å
400M94.8Very high93.6Very high108 Ų108107.2 Ų107.253%0.53254%0.542SS..Hα-helixtrans-61-39.5175.8-73.9-65.6105.600112.3T396 I397 E398 L403 A404T396-M400 VanDerWaalsContact O-CG 3.27Å; T396-M400 WeakPolarHBondContact O-CG 3.46Å; T396-M400 PolarHBondContact O-N 3.23Å; I397-M400 PolarHBondContact O-N 3.34Å; E398-M400 VanDerWaalsContact C-N 3.33Å; E398-M400 PolarHBondContact O-N 3.36Å; M400-L403 HydrophobicContact CE-CD1 3.69Å; M400-L403 PolarHBondContact O-N 3.18Å; M400-A404 WeakPolarHBondContact O-CB 3.49Å; M400-A404 PolarHBondContact O-N 3.44Å
401F95.1Very high93.6Very high140 Ų140107.2 Ų107.261%0.61454%0.543SS*.Hα-helixtrans-67.3-42.2176.6-76.4-47000113I397 E398 V399 L403 A404 K405I397-F401 HydrophobicContact CG2-CD2 3.83Å; I397-F401 HydrophobicContact CG2-CE2 3.43Å; I397-F401 VanDerWaalsContact CG2-CE2 3.43Å; I397-F401 HydrophobicContact CG2-CZ 4.24Å; I397-F401 WeakPolarHBondContact O-CD2 3.4Å; I397-F401 PolarHBondContact O-N 2.79Å; E398-F401 PolarHBondContact O-N 3.43Å; V399-F401 VanDerWaalsContact C-N 3.32Å; V399-F401 PolarHBondContact O-N 3.17Å; F401-L403 VanDerWaalsContact C-N 3.34Å; F401-A404 PolarHBondContact O-N 2.91Å; F401-K405 WeakPolarHBondContact O-CB 3.35Å; F401-K405 PolarHBondContact O-N 2.99Å
402E93.6Very high93.6Very high91 Ų91108 Ų10843%0.42555%0.546SS..Hα-helixtrans-66-37.3176-76.5-66.7173.400111.8E398 V399 K405 M406E398-E402 PolarHBondContact O-N 3.04Å; E398-E402 VanDerWaalsContact O-N 3.08Å; V399-E402 PolarHBondContact O-N 3.18Å; E402-K405 PolarHBondContact O-N 2.96Å; E402-M406 PolarHBondContact O-N 3.09Å
403L93.6Very high93.5Very high85 Ų85109.9 Ų109.945%0.44555%0.551SS.*Hα-helixtrans-66.5-43.6173.5-71.8175.3000112.3V399 M400 F401 K405 M406 I407V399-L403 HydrophobicContact CG1-CD1 4.02Å; V399-L403 HydrophobicContact CG1-CG 4.36Å; V399-L403 WeakPolarHBondContact O-CB 3.48Å; V399-L403 WeakPolarHBondContact O-CG 3.34Å; V399-L403 PolarHBondContact O-N 3.4Å; M400-L403 HydrophobicContact CE-CD1 3.69Å; M400-L403 PolarHBondContact O-N 3.18Å; F401-L403 VanDerWaalsContact C-N 3.34Å; L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 3.34Å; L403-M406 PolarHBondContact O-N 3.14Å; L403-M406 VanDerWaalsContact O-N 3.14Å; L403-I407 WeakPolarHBondContact O-CG1 3.49Å; L403-I407 PolarHBondContact O-N 2.98Å; L403-I407 VanDerWaalsContact O-N 3.09Å
404A92.6Very high93.3Very high48 Ų48111.3 Ų111.340%0.39756%0.557SS.*Hα-helixtrans-59.7-40176.700000111.6M400 F401 I407 F408M400-A404 WeakPolarHBondContact O-CB 3.49Å; M400-A404 PolarHBondContact O-N 3.44Å; F401-A404 PolarHBondContact O-N 2.91Å; A404-I407 PolarHBondContact O-N 3.28Å; A404-F408 PolarHBondContact O-N 3.34Å
405K92.8Very high93.2Very high130 Ų130111.7 Ų111.757%0.56556%0.558SS**Hα-helixtrans-71.4-25.2176.3-173.5-175.5171.7-163.30114F401 E402 L403F401-K405 WeakPolarHBondContact O-CB 3.35Å; F401-K405 PolarHBondContact O-N 2.99Å; E402-K405 PolarHBondContact O-N 2.96Å; L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 3.34Å
406M92.1Very high93Very high169 Ų169112.4 Ų112.483%0.83356%0.56SS**Hα-helixtrans-75.9-31.4172.5-92.9-112.8-169.500112E402 L403E402-M406 PolarHBondContact O-N 3.09Å; L403-M406 PolarHBondContact O-N 3.14Å; L403-M406 VanDerWaalsContact O-N 3.14Å
407I91.4Very high92.7Very high139 Ų139115.6 Ų115.671%0.71357%0.569SS**Hα-helixtrans-87.8-39.6-174.8-67.5167.4000112.1L403 A404L403-I407 WeakPolarHBondContact O-CG1 3.49Å; L403-I407 PolarHBondContact O-N 2.98Å; L403-I407 VanDerWaalsContact O-N 3.09Å; A404-I407 PolarHBondContact O-N 3.28Å
408F78.6Confident92.4Very high231 Ų231118.6 Ų118.6100%1.01358%0.582SS**  trans-98.20174.6-80.4-87.5000110.9A404A404-F408 PolarHBondContact O-N 3.34Å

Retrieved 408 of 408 residues in 145.4 ms (Link to these results)