A0A087XHB8_POEFO Loading...

Taxilin gamma

AlphaFold DB , UniProt , Accession A0A087XHB8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 428 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
1G36Very low42.4Very low123 Ų123150.4 Ų150.4100%1.26886%0.862SS**  0151.6000000108.2
2L42.2Very low42.1Very low185 Ų185147.7 Ų147.797%0.96985%0.85SS**  trans65.3142.1-163.8-47.8172000111.7
3C40Very low42.7Very low126 Ų126146.2 Ų146.285%0.85185%0.849SS**  cis-135.8164.91.4-164.70000110.6
4G39.5Very low42.2Very low57 Ų57141.5 Ų141.559%0.58885%0.847SS**  trans-111.1-151.9164.700000111
5P67.1Low41.9Very low121 Ų121146.9 Ų146.979%0.78685%0.847SS**  -127.9-141.2-58.238.7-24.7000110.6
6E39.2Very low42Very low183 Ų183146.8 Ų146.886%0.85584%0.836SS**  trans75.6154.2178.4-53.1-175.8142.700114.7
7E40.4Very low41.5Very low176 Ų176148 Ų14882%0.82284%0.84SS**  cis-139.3156.913.9-164.7-179.8-154.100111.8
8E47.8Very low41.6Very low187 Ų187145.7 Ų145.787%0.87483%0.834SS**  trans-111.7132.3177.9179.4-179.6-13200111.1
9R42.6Very low41.6Very low238 Ų238144.9 Ų144.990%0.89884%0.835SS**  trans-157.6140.2170.3-144.5170.3-175.2177.42.5112.5
10G35.6Very low41.3Very low64 Ų64143.4 Ų143.466%0.6683%0.833SS**  trans-133.2-161.7-174.600000115.1
11E36.3Very low40.8Very low194 Ų194143.1 Ų143.191%0.90783%0.829SS**  trans67.5154.4176.8-42.7-166.3124.900115.6
12T38.7Very low41.1Very low118 Ų118144.7 Ų144.772%0.72481%0.807SS**  cis-133.5156.14.350.30000111.9
13P49.3Very low40.5Very low129 Ų129139.3 Ų139.384%0.83880%0.796SS**PPolyproline II helixtrans-76.1132163.5-12.729.4000112
14G36.1Very low40.3Very low80 Ų80143.1 Ų143.183%0.82580%0.802SS**PPolyproline II helixtrans-79.4145.9173.300000113
15R38.2Very low40Very low223 Ų223144.7 Ų144.784%0.84281%0.809SS**PPolyproline II helixtrans-101.6163.3-168.2-175.7170.7172.2-157.5-7.8113.8
16E42.6Very low38.4Very low144 Ų144147.7 Ų147.767%0.67381%0.813SS**  trans-37.2149.2167.5-46.9152.5120.700115.2
17D34.3Very low38.3Very low168 Ų168146.1 Ų146.190%0.89881%0.81SS**  trans-144132.5150.2-114.4-32.3000109.8
18S42.4Very low38.1Very low106 Ų106144.7 Ų144.774%0.74181%0.807SS**  trans-129.5138.8175.4-68.10000109.6
19P42.1Very low38Very low131 Ų131141.7 Ų141.785%0.85180%0.804SS**  trans-108.795.31639.911.4000111.7
20S36.3Very low37.5Very low114 Ų114133.6 Ų133.680%0.79780%0.795SS**  trans-43.4153.4130.3-65.50000110.7
21D31.3Very low37.5Very low138 Ų138134.1 Ų134.174%0.73880%0.8SS**  cis-169.9-165.2-1.1171.232.4000105.8
22L40.4Very low37.5Very low156 Ų156131.9 Ų131.982%0.81780%0.795SS**  trans79.8137167.2-43.1174.6000115.4
23G31.4Very low37.6Very low72 Ų72130.7 Ų130.774%0.74279%0.791SS**  cis141.271.9-3.600000112.8A25G23-A25 PolarHBondContact O-N 2.87Å
24E34.5Very low37.1Very low206 Ų206134.3 Ų134.396%0.96379%0.794SS**  trans-87.8105.5173.5-70.9-162.5145.100111.2
25A33.9Very low37.3Very low90 Ų90134.4 Ų134.474%0.74479%0.787SS**  trans-143.171.6173.600000111.1G23G23-A25 PolarHBondContact O-N 2.87Å
26E32.5Very low37.7Very low184 Ų184125.9 Ų125.986%0.8677%0.768SS**  trans-123.4114.5156.7-73-157.111700107.9
27L37.7Very low38.1Very low151 Ų151125.2 Ų125.279%0.79177%0.769SS**  85.5105.764.4-73.9173.1000112.6
28D35.9Very low38.8Very low145 Ų145123.9 Ų123.978%0.77576%0.762SS**  trans-49.7124.3168.417540.1000113.2G30D28-G30 PolarHBondContact O-N 3.27Å
29P45.2Very low39.2Very low125 Ų125127 Ų12781%0.81276%0.762SS**  trans-82.786.7172.133.4-32.4000110.8
30G33.6Very low39.8Very low67 Ų67123.4 Ų123.469%0.69174%0.744SS**  trans-66.3173.4177.200000115.5D28D28-G30 PolarHBondContact O-N 3.27Å
31G34.3Very low40.8Very low76 Ų76124.6 Ų124.678%0.78474%0.735SS**  trans140.370.8-175.900000111.5
32D36.7Very low41.9Very low147 Ų147120 Ų12079%0.78672%0.72SS**  80.8139.360-16419.6000114.6
33S39.9Very low42.9Very low93 Ų93119.9 Ų119.965%0.6571%0.713SS**  trans40.483.9157.1-69.80000119.7A35S33-A35 VanDerWaalsContact C-N 3.31Å; S33-A35 PolarHBondContact O-N 3.46Å
34K39.3Very low44.4Very low204 Ų204120.9 Ų120.989%0.88770%0.699SS**SBendtrans-88.517166.2-135.2179.8-171.6-178.40115
35A41.6Very low45.7Very low82 Ų82114.4 Ų114.468%0.67867%0.673SS**SBendtrans-117.23.3-168.800000115S33S33-A35 VanDerWaalsContact C-N 3.31Å; S33-A35 PolarHBondContact O-N 3.46Å
36G45.4Very low47.3Very low44 Ų44114.3 Ų114.345%0.45466%0.663SS.*SBendtrans-83.2-45.9-179.100000113.9D38 K39 A40G36-D38 PolarHBondContact O-N 3.44Å; G36-K39 PolarHBondContact O-N 3.49Å; G36-A40 PolarHBondContact O-N 3.44Å
37D50.4Low49.1Very low130 Ų130110.9 Ų110.970%0.69565%0.65SS**Hα-helixtrans-63.7-47.1-162.2-62.2-31.7000113.5K39 A40 F41D37-K39 PolarHBondContact O-N 2.68Å; D37-K39 VanDerWaalsContact O-N 3.08Å; D37-A40 WeakPolarHBondContact O-CB 3.42Å; D37-A40 PolarHBondContact O-N 3.36Å; D37-F41 WeakPolarHBondContact O-CB 3.49Å; D37-F41 PolarHBondContact O-N 3.31Å
38D50.7Low50.5Low140 Ų140106.3 Ų106.375%0.74963%0.626SS**Hα-helixtrans-53.9-35.6179.6-68.4-27.4000112.5G36 G42G36-D38 PolarHBondContact O-N 3.44Å; D38-G42 PolarHBondContact O-N 2.91Å
39K50.8Low52Low172 Ų172104.9 Ų104.975%0.74862%0.616SS**Hα-helixtrans-84.7-20.6-176.9-150.5170.4-170.2172.70113G36 D37G36-K39 PolarHBondContact O-N 3.49Å; D37-K39 PolarHBondContact O-N 2.68Å; D37-K39 VanDerWaalsContact O-N 3.08Å
40A54.6Low53Low56 Ų56105.1 Ų105.146%0.46361%0.606SS.*Hα-helixtrans-77.6-48.2166.700000110.6G36 D37 G42 K43 E44G36-A40 PolarHBondContact O-N 3.44Å; D37-A40 WeakPolarHBondContact O-CB 3.42Å; D37-A40 PolarHBondContact O-N 3.36Å; A40-G42 VanDerWaalsContact C-N 3.32Å; A40-G42 PolarHBondContact O-N 2.89Å; A40-K43 WeakPolarHBondContact O-CB 3.14Å; A40-K43 PolarHBondContact O-N 3.18Å; A40-E44 PolarHBondContact O-N 3.29Å
41F56.1Low54.5Low138 Ų138104.6 Ų104.661%0.60560%0.595SS**Hα-helixtrans-56.8-44.3178.9-145.6-89.1000111.6D37 K43 E44 V45D37-F41 WeakPolarHBondContact O-CB 3.49Å; D37-F41 PolarHBondContact O-N 3.31Å; F41-K43 VanDerWaalsContact C-N 3.27Å; F41-K43 PolarHBondContact O-N 3.39Å; F41-E44 PolarHBondContact O-N 2.98Å; F41-V45 HydrophobicContact CD1-CG2 4.17Å; F41-V45 HydrophobicContact CE1-CG2 4.39Å; F41-V45 WeakPolarHBondContact O-CG2 3.2Å; F41-V45 PolarHBondContact O-N 3.42Å
42G54.8Low55.9Low42 Ų42102 Ų10243%0.43356%0.563SS.*Hα-helixtrans-60.5-29.417500000114.7D38 A40 V46D38-G42 PolarHBondContact O-N 2.91Å; A40-G42 VanDerWaalsContact C-N 3.32Å; A40-G42 PolarHBondContact O-N 2.89Å; G42-V46 WeakPolarHBondContact O-CG2 3.47Å
43K62Low57.4Low154 Ų154100.4 Ų100.467%0.6756%0.555SS**Hα-helixtrans-79-40.2173.9-76.7-176174.3-176.90112.4A40 F41 V45 V46 L47A40-K43 WeakPolarHBondContact O-CB 3.14Å; A40-K43 PolarHBondContact O-N 3.18Å; F41-K43 VanDerWaalsContact C-N 3.27Å; F41-K43 PolarHBondContact O-N 3.39Å; K43-V45 VanDerWaalsContact C-N 3.31Å; K43-V45 PolarHBondContact O-N 3.46Å; K43-V46 PolarHBondContact O-N 2.94Å; K43-L47 PolarHBondContact O-N 3.26Å
44E62.6Low58.4Low93 Ų93100.6 Ų100.644%0.43556%0.556SS.*Hα-helixtrans-59.2-42.4173.9-82.9-146.795.300111.9A40 F41 V46 L47 L48 K68A40-E44 PolarHBondContact O-N 3.29Å; F41-E44 PolarHBondContact O-N 2.98Å; E44-V46 VanDerWaalsContact C-N 3.31Å; E44-V46 PolarHBondContact O-N 3.34Å; E44-L47 PolarHBondContact O-N 2.85Å; E44-L48 VanDerWaalsContact O-CB 3.3Å; E44-L48 WeakPolarHBondContact O-CB 3.45Å; E44-L48 PolarHBondContact O-N 3.08Å; E44-K68 IonicContact OE1-NZ 2.68Å; E44-K68 PolarHBondContact OE1-NZ 3.4Å; E44-K68 IonicContact OE2-NZ 3.69Å
45V61.6Low59.7Low69 Ų6993.3 Ų93.342%0.41853%0.527SS..Hα-helixtrans-60.7-39.3177.8170.80000111.8F41 K43 M49F41-V45 HydrophobicContact CD1-CG2 4.17Å; F41-V45 HydrophobicContact CE1-CG2 4.39Å; F41-V45 WeakPolarHBondContact O-CG2 3.2Å; F41-V45 PolarHBondContact O-N 3.42Å; K43-V45 VanDerWaalsContact C-N 3.31Å; K43-V45 PolarHBondContact O-N 3.46Å; V45-M49 WeakPolarHBondContact O-CB 3.48Å; V45-M49 PolarHBondContact O-N 3.27Å
46V67.9Low60.4Low89 Ų8994.1 Ų94.154%0.53953%0.533SS..Hα-helixtrans-68.8-43.2176.6173.30000111.8G42 K43 E44 M49 Q50G42-V46 WeakPolarHBondContact O-CG2 3.47Å; K43-V46 PolarHBondContact O-N 2.94Å; E44-V46 VanDerWaalsContact C-N 3.31Å; E44-V46 PolarHBondContact O-N 3.34Å; V46-M49 PolarHBondContact O-N 3.49Å; V46-Q50 PolarHBondContact O-N 3.36Å
47L69.2Low61.2Low111 Ų11194.7 Ų94.758%0.58153%0.528SS*.Hα-helixtrans-64-40.5176.2-75.1168.8000111.8K43 E44 Q50 A51K43-L47 PolarHBondContact O-N 3.26Å; E44-L47 PolarHBondContact O-N 2.85Å; L47-Q50 PolarHBondContact O-N 2.98Å; L47-A51 WeakPolarHBondContact O-CB 3.48Å; L47-A51 PolarHBondContact O-N 2.84Å
48L68.8Low62.2Low55 Ų5593 Ų9329%0.28853%0.525SS..Hα-helixtrans-62-44.6173.9-174.962.4000111E44 Q50 A51 L52 L65 K68E44-L48 VanDerWaalsContact O-CB 3.3Å; E44-L48 WeakPolarHBondContact O-CB 3.45Å; E44-L48 PolarHBondContact O-N 3.08Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 3.33Å; L48-A51 PolarHBondContact O-N 3.2Å; L48-L52 HydrophobicContact CD1-CD1 4.37Å; L48-L52 HydrophobicContact CD1-CG 4.44Å; L48-L52 HydrophobicContact CG-CD1 4.02Å; L48-L52 WeakPolarHBondContact O-CB 2.92Å; L48-L52 WeakPolarHBondContact O-CG 2.96Å; L48-L52 PolarHBondContact O-N 3.14Å; L48-L65 HydrophobicContact CD2-CD2 4.24Å; L48-K68 HydrophobicContact CD1-CB 4.48Å; L48-K68 HydrophobicContact CD1-CG 4.17Å
49M65.9Low63.2Low115 Ų11592.9 Ų92.957%0.56752%0.519SS*.Hα-helixtrans-61.6-37.2177-158.191.576.900112.4V45 V46 N53V45-M49 WeakPolarHBondContact O-CB 3.48Å; V45-M49 PolarHBondContact O-N 3.27Å; V46-M49 PolarHBondContact O-N 3.49Å; M49-N53 WeakPolarHBondContact O-CB 3.27Å; M49-N53 PolarHBondContact O-N 2.86Å; M49-N53 VanDerWaalsContact O-N 3.14Å
50Q67.1Low64.2Low130 Ų13088.8 Ų88.861%0.60750%0.503SS*.Hα-helixtrans-68.9-48173.8-77.9-173-39.100112.2V46 L47 L48 L52 N53 S54V46-Q50 PolarHBondContact O-N 3.36Å; L47-Q50 PolarHBondContact O-N 2.98Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 3.33Å; Q50-L52 VanDerWaalsContact C-N 3.27Å; Q50-L52 PolarHBondContact O-N 3.1Å; Q50-N53 PolarHBondContact O-N 3.17Å; Q50-S54 PolarHBondContact O-N 2.88Å
51A64.5Low65.1Low56 Ų5689 Ų8946%0.46349%0.493SS..Hα-helixtrans-61.5-3517900000112.6L47 L48 S54L47-A51 WeakPolarHBondContact O-CB 3.48Å; L47-A51 PolarHBondContact O-N 2.84Å; L48-A51 PolarHBondContact O-N 3.2Å; A51-S54 PolarHBondContact O-OG 2.96Å
52L63.8Low66.1Low21 Ų2187.9 Ų87.911%0.1149%0.493CS..Hα-helixtrans-68.6-34.7171.2-68.4169000112L48 Q50 S54 L55 K61 A64 L65L48-L52 HydrophobicContact CD1-CD1 4.37Å; L48-L52 HydrophobicContact CD1-CG 4.44Å; L48-L52 HydrophobicContact CG-CD1 4.02Å; L48-L52 WeakPolarHBondContact O-CB 2.92Å; L48-L52 WeakPolarHBondContact O-CG 2.96Å; L48-L52 PolarHBondContact O-N 3.14Å; Q50-L52 VanDerWaalsContact C-N 3.27Å; Q50-L52 PolarHBondContact O-N 3.1Å; L52-S54 PolarHBondContact O-N 3.34Å; L52-L55 PolarHBondContact O-N 3.13Å; L52-K61 HydrophobicContact CB-CG 4.49Å; L52-K61 HydrophobicContact CD2-CB 4.03Å; L52-K61 WeakPolarHBondContact CD2-O 3.46Å; L52-K61 VanDerWaalsContact O-CD 3.27Å; L52-K61 WeakPolarHBondContact O-CD 3.47Å; L52-K61 WeakPolarHBondContact O-CE 3.48Å; L52-K61 VanDerWaalsContact O-CG 3.3Å; L52-K61 WeakPolarHBondContact O-CG 3.4Å; L52-K61 PolarHBondContact O-NZ 2.67Å; L52-A64 HydrophobicContact CD2-CB 3.85Å; L52-L65 HydrophobicContact CD1-CD1 3.94Å; L52-L65 HydrophobicContact CD1-CD2 4.49Å; L52-L65 HydrophobicContact CD1-CG 3.96Å; L52-L65 HydrophobicContact CD2-CD1 4.39Å; L52-L65 HydrophobicContact CD2-CG 4.14Å
53N68.3Low67.1Low114 Ų11488.9 Ų88.961%0.6150%0.497SS*.Hα-helixtrans-77.6-15.3-178.8-84.8-22.9000115.4M49 Q50 L55 K61M49-N53 WeakPolarHBondContact O-CB 3.27Å; M49-N53 PolarHBondContact O-N 2.86Å; M49-N53 VanDerWaalsContact O-N 3.14Å; Q50-N53 PolarHBondContact O-N 3.17Å; N53-L55 VanDerWaalsContact C-N 3.27Å; N53-K61 PolarHBondContact OD1-NZ 3.31Å; N53-K61 VanDerWaalsContact OD1-NZ 3.1Å
54S62.1Low67.8Low97 Ų9783.2 Ų83.268%0.67848%0.479SS*.THydrogen-bonded Turntrans-75.7-9.1167.239.20000114.8Q50 A51 L52Q50-S54 PolarHBondContact O-N 2.88Å; A51-S54 PolarHBondContact O-OG 2.96Å; L52-S54 PolarHBondContact O-N 3.34Å
55L66.3Low68.6Low51 Ų5181.6 Ų81.627%0.26747%0.473SS..  trans-91.9134.7178.7-58.5171000110.1L52 N53 E60 K61 A64L52-L55 PolarHBondContact O-N 3.13Å; N53-L55 VanDerWaalsContact C-N 3.27Å; L55-E60 HydrophobicContact CB-CB 3.85Å; L55-E60 HydrophobicContact CD1-CB 4.15Å; L55-E60 HydrophobicContact CD2-CB 4.32Å; L55-E60 HydrophobicContact CG-CB 4.32Å; L55-K61 HydrophobicContact CB-CG 3.92Å; L55-K61 HydrophobicContact CD1-CG 4.44Å; L55-K61 WeakPolarHBondContact O-CE 3.41Å; L55-A64 HydrophobicContact CD1-CB 3.82Å
56A56.5Low69.5Low99 Ų9982 Ų8282%0.81848%0.478SS*.SBendtrans-85.2-29.9-166.500000113.2E60A56-E60 PolarHBondContact N-OE2 3.22Å
57T61.6Low70.2Confident57 Ų5784.3 Ų84.335%0.3548%0.481SS..SBendtrans-108152.8-177.9640000112.3E59 E60 K61T57-E59 VanDerWaalsContact C-N 3.31Å; T57-E59 PolarHBondContact O-N 3.07Å; T57-E60 WeakPolarHBondContact CB-OE2 3.3Å; T57-E60 PolarHBondContact N-OE2 2.94Å; T57-E60 PolarHBondContact O-N 2.96Å; T57-E60 WeakPolarHBondContact OG1-CG 3.48Å; T57-E60 PolarHBondContact OG1-N 3Å; T57-E60 PolarHBondContact OG1-OE2 3.36Å; T57-K61 PolarHBondContact O-N 2.85Å
58P71.7Confident70.8Confident95 Ų9582 Ų8262%0.61747%0.466SS*.Hα-helixtrans-66.6-31.9176.125.3-29.9000112.4K61 L62P58-K61 PolarHBondContact O-N 3.21Å; P58-L62 PolarHBondContact O-N 2.93Å
59E70.9Confident71.4Confident136 Ų13687 Ų8764%0.63648%0.482SS*.Hα-helixtrans-59.1-45.1174-75.372.4-164.200112.5T57 K61 L62 A63T57-E59 VanDerWaalsContact C-N 3.31Å; T57-E59 PolarHBondContact O-N 3.07Å; E59-K61 VanDerWaalsContact C-N 3.34Å; E59-K61 PolarHBondContact O-N 2.82Å; E59-L62 PolarHBondContact O-N 3.14Å; E59-A63 WeakPolarHBondContact O-CB 3.3Å; E59-A63 PolarHBondContact O-N 2.96Å
60E72Confident72.2Confident86 Ų8684.1 Ų84.140%0.40248%0.477SS..Hα-helixtrans-62.4-41.5177.8-73.1164.5133.800111.7L55 A56 T57 L62 A63 A64L55-E60 HydrophobicContact CB-CB 3.85Å; L55-E60 HydrophobicContact CD1-CB 4.15Å; L55-E60 HydrophobicContact CD2-CB 4.32Å; L55-E60 HydrophobicContact CG-CB 4.32Å; A56-E60 PolarHBondContact N-OE2 3.22Å; T57-E60 WeakPolarHBondContact CB-OE2 3.3Å; T57-E60 PolarHBondContact N-OE2 2.94Å; T57-E60 PolarHBondContact O-N 2.96Å; T57-E60 WeakPolarHBondContact OG1-CG 3.48Å; T57-E60 PolarHBondContact OG1-N 3Å; T57-E60 PolarHBondContact OG1-OE2 3.36Å; E60-L62 VanDerWaalsContact C-N 3.34Å; E60-A63 PolarHBondContact O-N 3.39Å; E60-A64 WeakPolarHBondContact O-CB 3.5Å; E60-A64 PolarHBondContact O-N 3.01Å
61K73.2Confident72.9Confident62 Ų6281.4 Ų81.427%0.2747%0.466SS..Hα-helixtrans-62.9-42.2176.2-63.1-171.9-168.4-1580111.3L52 N53 L55 T57 P58 E59 L65L52-K61 HydrophobicContact CB-CG 4.49Å; L52-K61 HydrophobicContact CD2-CB 4.03Å; L52-K61 WeakPolarHBondContact CD2-O 3.46Å; L52-K61 VanDerWaalsContact O-CD 3.27Å; L52-K61 WeakPolarHBondContact O-CD 3.47Å; L52-K61 WeakPolarHBondContact O-CE 3.48Å; L52-K61 VanDerWaalsContact O-CG 3.3Å; L52-K61 WeakPolarHBondContact O-CG 3.4Å; L52-K61 PolarHBondContact O-NZ 2.67Å; N53-K61 PolarHBondContact OD1-NZ 3.31Å; N53-K61 VanDerWaalsContact OD1-NZ 3.1Å; L55-K61 HydrophobicContact CB-CG 3.92Å; L55-K61 HydrophobicContact CD1-CG 4.44Å; L55-K61 WeakPolarHBondContact O-CE 3.41Å; T57-K61 PolarHBondContact O-N 2.85Å; P58-K61 PolarHBondContact O-N 3.21Å; E59-K61 VanDerWaalsContact C-N 3.34Å; E59-K61 PolarHBondContact O-N 2.82Å; K61-L65 PolarHBondContact O-N 2.91Å; K61-L65 VanDerWaalsContact O-N 3.08Å
62L76.5Confident73.9Confident114 Ų11482.3 Ų82.360%0.59746%0.463SS*.Hα-helixtrans-64-45.5176-167.870.6000111.1P58 E59 E60 A64 L65 C66P58-L62 PolarHBondContact O-N 2.93Å; E59-L62 PolarHBondContact O-N 3.14Å; E60-L62 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 3.38Å; L62-L65 PolarHBondContact O-N 3.29Å; L62-C66 WeakPolarHBondContact O-CB 3.2Å; L62-C66 PolarHBondContact O-N 2.97Å; L62-C66 PolarHBondContact O-SG 3.18Å
63A75.8Confident74.8Confident62 Ų6287.3 Ų87.351%0.51249%0.489SS..Hα-helixtrans-61.9-41.6178.500000112.6E59 E60 C66 K67E59-A63 WeakPolarHBondContact O-CB 3.3Å; E59-A63 PolarHBondContact O-N 2.96Å; E60-A63 PolarHBondContact O-N 3.39Å; A63-C66 PolarHBondContact O-N 3.32Å; A63-K67 WeakPolarHBondContact O-CB 3.41Å; A63-K67 PolarHBondContact O-N 2.81Å
64A77.2Confident75.6Confident36 Ų3686.4 Ų86.430%0.29848%0.481SS..Hα-helixtrans-64.5-40.7175.300000112.4L52 L55 E60 L62 K67 K68L52-A64 HydrophobicContact CD2-CB 3.85Å; L55-A64 HydrophobicContact CD1-CB 3.82Å; E60-A64 WeakPolarHBondContact O-CB 3.5Å; E60-A64 PolarHBondContact O-N 3.01Å; L62-A64 PolarHBondContact O-N 3.38Å; A64-K67 PolarHBondContact O-N 3.32Å; A64-K68 PolarHBondContact O-N 3.01Å
65L80.6Confident76.7Confident59 Ų5987 Ų8731%0.30947%0.473SS..Hα-helixtrans-63.2-49.1172.4-95.3162.5000112L48 L52 K61 L62 K67 K68 Y69L48-L65 HydrophobicContact CD2-CD2 4.24Å; L52-L65 HydrophobicContact CD1-CD1 3.94Å; L52-L65 HydrophobicContact CD1-CD2 4.49Å; L52-L65 HydrophobicContact CD1-CG 3.96Å; L52-L65 HydrophobicContact CD2-CD1 4.39Å; L52-L65 HydrophobicContact CD2-CG 4.14Å; K61-L65 PolarHBondContact O-N 2.91Å; K61-L65 VanDerWaalsContact O-N 3.08Å; L62-L65 PolarHBondContact O-N 3.29Å; L65-K67 PolarHBondContact O-N 2.89Å; L65-K68 PolarHBondContact O-N 2.77Å; L65-Y69 HydrophobicContact CD2-CD2 4.37Å; L65-Y69 HydrophobicContact CD2-CE2 4.17Å; L65-Y69 WeakPolarHBondContact O-CD2 3.43Å; L65-Y69 PolarHBondContact O-N 3.41Å
66C78.9Confident77.5Confident78 Ų7887.9 Ų87.953%0.52748%0.484SS..Hα-helixtrans-56.7-38.4175.9-71.40000111.8L62 A63 A70L62-C66 WeakPolarHBondContact O-CB 3.2Å; L62-C66 PolarHBondContact O-N 2.97Å; L62-C66 PolarHBondContact O-SG 3.18Å; A63-C66 PolarHBondContact O-N 3.32Å; C66-A70 WeakPolarHBondContact O-CB 3.45Å; C66-A70 PolarHBondContact O-N 2.89Å
67K82.9Confident79Confident137 Ų13789.6 Ų89.660%0.59647%0.469SS*.Hα-helixtrans-65.7-52.4174-170.4-175.4172-174.80112.1A63 A64 L65 Y69 A70 D71A63-K67 WeakPolarHBondContact O-CB 3.41Å; A63-K67 PolarHBondContact O-N 2.81Å; A64-K67 PolarHBondContact O-N 3.32Å; L65-K67 PolarHBondContact O-N 2.89Å; K67-Y69 PolarHBondContact O-N 3.03Å; K67-A70 CarbonylContact O-C 3.6Å; K67-A70 WeakPolarHBondContact O-CA 3.45Å; K67-A70 WeakPolarHBondContact O-CB 3.25Å; K67-A70 PolarHBondContact O-N 2.9Å; K67-D71 WeakPolarHBondContact CE-OD2 3.45Å; K67-D71 VanDerWaalsContact O-CG 3.27Å; K67-D71 PolarHBondContact O-N 2.84Å
68K83.4Confident80.2Confident61 Ų6190.1 Ų90.127%0.26547%0.474SS..Hα-helixtrans-59.9-33.3179.8-131.1-71.9-170-179.90111.9E44 L48 A64 L65 L72E44-K68 IonicContact OE1-NZ 2.68Å; E44-K68 PolarHBondContact OE1-NZ 3.4Å; E44-K68 IonicContact OE2-NZ 3.69Å; L48-K68 HydrophobicContact CD1-CB 4.48Å; L48-K68 HydrophobicContact CD1-CG 4.17Å; A64-K68 PolarHBondContact O-N 3.01Å; L65-K68 PolarHBondContact O-N 2.77Å; K68-L72 HydrophobicContact CD-CD1 4.18Å; K68-L72 HydrophobicContact CD-CG 4.37Å; K68-L72 WeakPolarHBondContact O-CB 3.46Å; K68-L72 WeakPolarHBondContact O-CD1 3.43Å; K68-L72 VanDerWaalsContact O-CG 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.17Å; K68-L72 PolarHBondContact O-N 3.38Å
69Y80.7Confident80.9Confident162 Ų16291.2 Ų91.264%0.63547%0.472SS*.Hα-helixtrans-68.8-39.9170.9-92.8-76000113.4L65 K67 L73L65-Y69 HydrophobicContact CD2-CD2 4.37Å; L65-Y69 HydrophobicContact CD2-CE2 4.17Å; L65-Y69 WeakPolarHBondContact O-CD2 3.43Å; L65-Y69 PolarHBondContact O-N 3.41Å; K67-Y69 PolarHBondContact O-N 3.03Å; Y69-L73 WeakPolarHBondContact O-CB 3.48Å; Y69-L73 PolarHBondContact O-N 3.29Å
70A81.6Confident81.6Confident54 Ų5489.6 Ų89.645%0.44647%0.465SS..Hα-helixtrans-67-42.1175.200000112C66 K67 L73 E74C66-A70 WeakPolarHBondContact O-CB 3.45Å; C66-A70 PolarHBondContact O-N 2.89Å; K67-A70 CarbonylContact O-C 3.6Å; K67-A70 WeakPolarHBondContact O-CA 3.45Å; K67-A70 WeakPolarHBondContact O-CB 3.25Å; K67-A70 PolarHBondContact O-N 2.9Å; A70-L73 WeakPolarHBondContact O-CB 3.34Å; A70-L73 PolarHBondContact O-N 2.68Å; A70-L73 VanDerWaalsContact O-N 3.14Å; A70-E74 PolarHBondContact O-N 3.27Å
71D83.5Confident82.5Confident73 Ų7391.3 Ų91.339%0.3947%0.471SS..Hα-helixtrans-60.1-47.4175.5-63.9-24.7000110.2K67 L73 E74 E75K67-D71 WeakPolarHBondContact CE-OD2 3.45Å; K67-D71 VanDerWaalsContact O-CG 3.27Å; K67-D71 PolarHBondContact O-N 2.84Å; D71-L73 VanDerWaalsContact C-N 3.3Å; D71-L73 PolarHBondContact O-N 3.28Å; D71-E74 WeakPolarHBondContact O-CB 3.32Å; D71-E74 PolarHBondContact O-N 3.46Å; D71-E74 VanDerWaalsContact O-N 3.17Å; D71-E75 WeakPolarHBondContact O-CG 3.38Å; D71-E75 PolarHBondContact O-N 3.06Å
72L84.3Confident83.2Confident74 Ų7494 Ų9439%0.38748%0.484SS..Hα-helixtrans-61.4-33.6173.2-78.7167.2000113.4K68 S76K68-L72 HydrophobicContact CD-CD1 4.18Å; K68-L72 HydrophobicContact CD-CG 4.37Å; K68-L72 WeakPolarHBondContact O-CB 3.46Å; K68-L72 WeakPolarHBondContact O-CD1 3.43Å; K68-L72 VanDerWaalsContact O-CG 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.17Å; K68-L72 PolarHBondContact O-N 3.38Å; L72-S76 WeakPolarHBondContact O-CB 3.45Å; L72-S76 PolarHBondContact O-N 3.3Å
73L84Confident83.7Confident126 Ų12693.2 Ų93.266%0.6648%0.481SS*.Hα-helixtrans-71-37175.1-120.2166.7000111.7Y69 A70 D71 R77Y69-L73 WeakPolarHBondContact O-CB 3.48Å; Y69-L73 PolarHBondContact O-N 3.29Å; A70-L73 WeakPolarHBondContact O-CB 3.34Å; A70-L73 PolarHBondContact O-N 2.68Å; A70-L73 VanDerWaalsContact O-N 3.14Å; D71-L73 VanDerWaalsContact C-N 3.3Å; D71-L73 PolarHBondContact O-N 3.28Å; L73-R77 WeakPolarHBondContact O-CB 3.2Å; L73-R77 PolarHBondContact O-N 2.83Å
74E84.8Confident84.4Confident95 Ų9596.5 Ų96.544%0.44448%0.483SS..Hα-helixtrans-68.5-42.9173.7-171.273.4-88.200111.1A70 D71 R77 C78A70-E74 PolarHBondContact O-N 3.27Å; D71-E74 WeakPolarHBondContact O-CB 3.32Å; D71-E74 PolarHBondContact O-N 3.46Å; D71-E74 VanDerWaalsContact O-N 3.17Å; E74-R77 VanDerWaalsContact CD-NH2 3.31Å; E74-R77 CarbonylContact O-C 3.58Å; E74-R77 PolarHBondContact O-N 2.99Å; E74-R77 IonicContact OE1-CZ 3.16Å; E74-R77 IonicContact OE1-NE 2.86Å; E74-R77 PolarHBondContact OE1-NE 3.38Å; E74-R77 IonicContact OE1-NH2 2.67Å; E74-R77 PolarHBondContact OE1-NH2 2.96Å; E74-R77 IonicContact OE2-NH2 3.13Å; E74-R77 PolarHBondContact OE2-NH2 3.4Å; E74-R77 VanDerWaalsContact OE2-NH2 3.13Å; E74-C78 VanDerWaalsContact O-CB 3.32Å; E74-C78 WeakPolarHBondContact O-CB 3.39Å; E74-C78 PolarHBondContact O-N 3.15Å
75E83.9Confident85.1Confident110 Ų11097.4 Ų97.451%0.51449%0.491SS..Hα-helixtrans-61.9-47.7173.2-75.3-177.7161.200111.8D71 R77 C78 M79D71-E75 WeakPolarHBondContact O-CG 3.38Å; D71-E75 PolarHBondContact O-N 3.06Å; E75-R77 VanDerWaalsContact C-N 3.31Å; E75-R77 PolarHBondContact O-N 3.36Å; E75-C78 CarbonylContact O-C 3.58Å; E75-C78 WeakPolarHBondContact O-CA 3.3Å; E75-C78 WeakPolarHBondContact O-CB 3.47Å; E75-C78 PolarHBondContact O-N 2.92Å; E75-M79 PolarHBondContact O-N 3.16Å
76S83.7Confident85.5Confident69 Ų6999.5 Ų99.548%0.48350%0.502SS..Hα-helixtrans-58.4-43.2173.4-179.60000111.5L72 C78 Q80L72-S76 WeakPolarHBondContact O-CB 3.45Å; L72-S76 PolarHBondContact O-N 3.3Å; S76-C78 VanDerWaalsContact C-N 3.29Å; S76-C78 PolarHBondContact O-N 2.97Å; S76-Q80 WeakPolarHBondContact O-CB 3.49Å; S76-Q80 PolarHBondContact O-N 2.87Å
77R87.7Confident86Confident136 Ų136101.2 Ų101.251%0.51350%0.502SS..Hα-helixtrans-65.5-30.3173.9-170.617478.3153.7-3.3112.6L73 E74 E75 K81L73-R77 WeakPolarHBondContact O-CB 3.2Å; L73-R77 PolarHBondContact O-N 2.83Å; E74-R77 VanDerWaalsContact CD-NH2 3.31Å; E74-R77 CarbonylContact O-C 3.58Å; E74-R77 PolarHBondContact O-N 2.99Å; E74-R77 IonicContact OE1-CZ 3.16Å; E74-R77 IonicContact OE1-NE 2.86Å; E74-R77 PolarHBondContact OE1-NE 3.38Å; E74-R77 IonicContact OE1-NH2 2.67Å; E74-R77 PolarHBondContact OE1-NH2 2.96Å; E74-R77 IonicContact OE2-NH2 3.13Å; E74-R77 PolarHBondContact OE2-NH2 3.4Å; E74-R77 VanDerWaalsContact OE2-NH2 3.13Å; E75-R77 VanDerWaalsContact C-N 3.31Å; E75-R77 PolarHBondContact O-N 3.36Å; R77-K81 WeakPolarHBondContact O-CD 3.49Å; R77-K81 VanDerWaalsContact O-CG 3.25Å; R77-K81 WeakPolarHBondContact O-CG 3.47Å; R77-K81 PolarHBondContact O-N 3.04Å
78C87.2Confident86.5Confident68 Ų68102.1 Ų102.146%0.45951%0.506SS..Hα-helixtrans-73.2-51.9175.9-164.30000111.1E74 E75 S76 Q80 K81 Q82E74-C78 VanDerWaalsContact O-CB 3.32Å; E74-C78 WeakPolarHBondContact O-CB 3.39Å; E74-C78 PolarHBondContact O-N 3.15Å; E75-C78 CarbonylContact O-C 3.58Å; E75-C78 WeakPolarHBondContact O-CA 3.3Å; E75-C78 WeakPolarHBondContact O-CB 3.47Å; E75-C78 PolarHBondContact O-N 2.92Å; S76-C78 VanDerWaalsContact C-N 3.29Å; S76-C78 PolarHBondContact O-N 2.97Å; C78-Q80 VanDerWaalsContact C-N 3.27Å; C78-Q80 PolarHBondContact O-N 3.38Å; C78-K81 WeakPolarHBondContact O-CA 3.19Å; C78-K81 WeakPolarHBondContact O-CB 3.42Å; C78-K81 PolarHBondContact O-N 3.27Å; C78-Q82 PolarHBondContact O-N 2.78Å
79M85.4Confident86.9Confident117 Ų117106 Ų10658%0.57652%0.523SS*.Hα-helixtrans-56.8-41.1173.5-71.8-171.2-81.200111.3E75 K81 Q82 L83E75-M79 PolarHBondContact O-N 3.16Å; M79-K81 VanDerWaalsContact C-N 3.32Å; M79-K81 PolarHBondContact O-N 2.84Å; M79-Q82 PolarHBondContact O-N 2.97Å; M79-Q82 VanDerWaalsContact O-N 3.16Å; M79-L83 VanDerWaalsContact O-CB 3.29Å; M79-L83 WeakPolarHBondContact O-CB 3.25Å; M79-L83 PolarHBondContact O-N 3.34Å
80Q87.2Confident87.4Confident103 Ų103104.4 Ų104.448%0.48152%0.521SS..Hα-helixtrans-67.1-28.5176.5-169.568.8-25.800113.3S76 C78 K84S76-Q80 WeakPolarHBondContact O-CB 3.49Å; S76-Q80 PolarHBondContact O-N 2.87Å; C78-Q80 VanDerWaalsContact C-N 3.27Å; C78-Q80 PolarHBondContact O-N 3.38Å; Q80-K84 WeakPolarHBondContact O-CB 3.29Å; Q80-K84 WeakPolarHBondContact O-CD 3.45Å; Q80-K84 VanDerWaalsContact O-CG 3.25Å; Q80-K84 WeakPolarHBondContact O-CG 3.39Å; Q80-K84 PolarHBondContact O-N 3.22Å
81K89.3Confident87.9Confident121 Ų121104.4 Ų104.453%0.52652%0.518SS..Hα-helixtrans-72.2-44.3168.5-71.1161.3-176.8169.10110.9R77 C78 M79 K84 A85R77-K81 WeakPolarHBondContact O-CD 3.49Å; R77-K81 VanDerWaalsContact O-CG 3.25Å; R77-K81 WeakPolarHBondContact O-CG 3.47Å; R77-K81 PolarHBondContact O-N 3.04Å; C78-K81 WeakPolarHBondContact O-CA 3.19Å; C78-K81 WeakPolarHBondContact O-CB 3.42Å; C78-K81 PolarHBondContact O-N 3.27Å; M79-K81 VanDerWaalsContact C-N 3.32Å; M79-K81 PolarHBondContact O-N 2.84Å; K81-K84 PolarHBondContact O-N 3.04Å; K81-A85 WeakPolarHBondContact O-CB 3.47Å; K81-A85 PolarHBondContact O-N 2.75Å
82Q88.5Confident88.4Confident118 Ų118105.1 Ų105.155%0.55152%0.519SS*.Hα-helixtrans-66.2-42-178.2-171.6171.5-0.900111.9C78 M79 A85 L86C78-Q82 PolarHBondContact O-N 2.78Å; M79-Q82 PolarHBondContact O-N 2.97Å; M79-Q82 VanDerWaalsContact O-N 3.16Å; Q82-A85 WeakPolarHBondContact O-CB 3.49Å; Q82-A85 PolarHBondContact O-N 3.36Å; Q82-A85 VanDerWaalsContact O-N 3.15Å; Q82-L86 HydrophobicContact CG-CD1 4.32Å; Q82-L86 WeakPolarHBondContact O-CB 3.5Å; Q82-L86 WeakPolarHBondContact O-CG 3.37Å; Q82-L86 PolarHBondContact O-N 3.27Å
83L87.8Confident88.8Confident99 Ų99106.7 Ų106.752%0.51853%0.526SS..Hα-helixtrans-62.6-44.4174.6-164.2160.7000110.7M79 A85 L86 Q87M79-L83 VanDerWaalsContact O-CB 3.29Å; M79-L83 WeakPolarHBondContact O-CB 3.25Å; M79-L83 PolarHBondContact O-N 3.34Å; L83-A85 VanDerWaalsContact C-N 3.32Å; L83-A85 PolarHBondContact O-N 2.87Å; L83-L86 PolarHBondContact O-N 3.42Å; L83-Q87 VanDerWaalsContact O-CB 3.28Å; L83-Q87 WeakPolarHBondContact O-CB 3.46Å; L83-Q87 PolarHBondContact O-N 3.28Å
84K90.4Very high89.3Confident130 Ų130104.3 Ų104.357%0.56552%0.517SS*.Hα-helixtrans-61-37.3171.8-75.3175.6-179.9-176.50112.9Q80 K81 K88Q80-K84 WeakPolarHBondContact O-CB 3.29Å; Q80-K84 WeakPolarHBondContact O-CD 3.45Å; Q80-K84 VanDerWaalsContact O-CG 3.25Å; Q80-K84 WeakPolarHBondContact O-CG 3.39Å; Q80-K84 PolarHBondContact O-N 3.22Å; K81-K84 PolarHBondContact O-N 3.04Å; K84-K88 WeakPolarHBondContact O-CB 3.3Å; K84-K88 PolarHBondContact O-N 2.74Å
85A90.5Very high89.7Confident55 Ų55106 Ų10646%0.45552%0.523SS..Hα-helixtrans-69.3-41176.300000112.3K81 Q82 L83 K88 K89K81-A85 WeakPolarHBondContact O-CB 3.47Å; K81-A85 PolarHBondContact O-N 2.75Å; Q82-A85 WeakPolarHBondContact O-CB 3.49Å; Q82-A85 PolarHBondContact O-N 3.36Å; Q82-A85 VanDerWaalsContact O-N 3.15Å; L83-A85 VanDerWaalsContact C-N 3.32Å; L83-A85 PolarHBondContact O-N 2.87Å; A85-K88 PolarHBondContact O-N 3.08Å; A85-K89 PolarHBondContact O-N 3.04Å
86L89.8Confident90.1Very high103 Ų103104.9 Ų104.954%0.53952%0.517SS..Hα-helixtrans-66.5-43.5174.4-71.6171000111.6Q82 L83 K88 K89 Q90Q82-L86 HydrophobicContact CG-CD1 4.32Å; Q82-L86 WeakPolarHBondContact O-CB 3.5Å; Q82-L86 WeakPolarHBondContact O-CG 3.37Å; Q82-L86 PolarHBondContact O-N 3.27Å; L83-L86 PolarHBondContact O-N 3.42Å; L86-K88 VanDerWaalsContact C-N 3.3Å; L86-K88 PolarHBondContact O-N 2.92Å; L86-K89 CarbonylContact O-C 3.6Å; L86-K89 WeakPolarHBondContact O-CB 3.47Å; L86-K89 PolarHBondContact O-N 3.45Å; L86-K89 VanDerWaalsContact O-N 3.16Å; L86-Q90 WeakPolarHBondContact O-CB 3.44Å; L86-Q90 PolarHBondContact O-N 2.8Å
87Q90.5Very high90.6Very high114 Ų114108.7 Ų108.753%0.53353%0.525SS..Hα-helixtrans-60.1-39.9173.6-170.5-177.621.900111.4L83 Q90 S91L83-Q87 VanDerWaalsContact O-CB 3.28Å; L83-Q87 WeakPolarHBondContact O-CB 3.46Å; L83-Q87 PolarHBondContact O-N 3.28Å; Q87-Q90 PolarHBondContact O-N 3.16Å; Q87-S91 WeakPolarHBondContact O-CB 3.35Å; Q87-S91 PolarHBondContact O-N 3.4Å
88K92.1Very high90.9Very high156 Ų156107.4 Ų107.468%0.67853%0.528SS*.Hα-helixtrans-63.8-45.7173.1-171.2178179.6-177.60111.5K84 A85 L86 S91 Q92K84-K88 WeakPolarHBondContact O-CB 3.3Å; K84-K88 PolarHBondContact O-N 2.74Å; A85-K88 PolarHBondContact O-N 3.08Å; L86-K88 VanDerWaalsContact C-N 3.3Å; L86-K88 PolarHBondContact O-N 2.92Å; K88-S91 PolarHBondContact O-N 2.8Å; K88-S91 PolarHBondContact O-OG 3.22Å; K88-Q92 PolarHBondContact O-N 3.46Å
89K92.1Very high91.2Very high142 Ų142109.6 Ų109.662%0.61753%0.531SS*.Hα-helixtrans-58.8-46.5174.1-76.7-173.6175.2-171.70112A85 L86 S91 Q92 I93A85-K89 PolarHBondContact O-N 3.04Å; L86-K89 CarbonylContact O-C 3.6Å; L86-K89 WeakPolarHBondContact O-CB 3.47Å; L86-K89 PolarHBondContact O-N 3.45Å; L86-K89 VanDerWaalsContact O-N 3.16Å; K89-S91 VanDerWaalsContact C-N 3.34Å; K89-S91 PolarHBondContact O-N 3.08Å; K89-Q92 WeakPolarHBondContact O-CB 3.28Å; K89-Q92 PolarHBondContact O-N 3.01Å; K89-Q92 VanDerWaalsContact O-N 3.08Å; K89-I93 WeakPolarHBondContact O-CG1 3.42Å; K89-I93 PolarHBondContact O-N 3.28Å
90Q91.6Very high91.7Very high130 Ų130109.1 Ų109.161%0.60753%0.53SS*.Hα-helixtrans-57.5-46175.5-171.4-172.33300111.1L86 Q87 Q92 I93 V94L86-Q90 WeakPolarHBondContact O-CB 3.44Å; L86-Q90 PolarHBondContact O-N 2.8Å; Q87-Q90 PolarHBondContact O-N 3.16Å; Q90-Q92 PolarHBondContact O-N 3.28Å; Q90-I93 PolarHBondContact O-N 2.85Å; Q90-V94 WeakPolarHBondContact O-CB 3.47Å; Q90-V94 VanDerWaalsContact O-CG2 3.29Å; Q90-V94 WeakPolarHBondContact O-CG2 3.31Å; Q90-V94 PolarHBondContact O-N 3.34Å
91S92.3Very high92Very high53 Ų53110 Ų11037%0.37153%0.534SS..Hα-helixtrans-64.1-26.1177.581.80000113.6Q87 K88 K89 K95Q87-S91 WeakPolarHBondContact O-CB 3.35Å; Q87-S91 PolarHBondContact O-N 3.4Å; K88-S91 PolarHBondContact O-N 2.8Å; K88-S91 PolarHBondContact O-OG 3.22Å; K89-S91 VanDerWaalsContact C-N 3.34Å; K89-S91 PolarHBondContact O-N 3.08Å; S91-K95 WeakPolarHBondContact O-CD 3.27Å; S91-K95 VanDerWaalsContact O-CG 3.29Å; S91-K95 WeakPolarHBondContact O-CG 3.47Å; S91-K95 PolarHBondContact O-N 3.01Å
92Q93.7Very high92.2Very high89 Ų89105.6 Ų105.642%0.41652%0.524SS..Hα-helixtrans-80-49.1176.1-176.861.323.900110.7K88 K89 Q90 V94 K95 E96K88-Q92 PolarHBondContact O-N 3.46Å; K89-Q92 WeakPolarHBondContact O-CB 3.28Å; K89-Q92 PolarHBondContact O-N 3.01Å; K89-Q92 VanDerWaalsContact O-N 3.08Å; Q90-Q92 PolarHBondContact O-N 3.28Å; Q92-V94 VanDerWaalsContact C-N 3.26Å; Q92-V94 PolarHBondContact O-N 2.87Å; Q92-K95 WeakPolarHBondContact O-CA 3.41Å; Q92-K95 WeakPolarHBondContact O-CB 3.48Å; Q92-K95 PolarHBondContact O-N 3.46Å; Q92-E96 VanDerWaalsContact CG-OE1 3.3Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.46Å; Q92-E96 PolarHBondContact NE2-OE1 3.47Å; Q92-E96 WeakPolarHBondContact O-CG 3.29Å; Q92-E96 PolarHBondContact O-N 2.93Å
93I92.8Very high92.5Very high106 Ų106104.4 Ų104.454%0.54452%0.518SS..Hα-helixtrans-58.6-38176.4-67.1163.3000111.2K89 Q90 E96 K97K89-I93 WeakPolarHBondContact O-CG1 3.42Å; K89-I93 PolarHBondContact O-N 3.28Å; Q90-I93 PolarHBondContact O-N 2.85Å; I93-E96 PolarHBondContact O-N 2.84Å; I93-K97 WeakPolarHBondContact O-CB 3.45Å; I93-K97 PolarHBondContact O-N 2.92Å
94V93.4Very high92.8Very high76 Ų76105.6 Ų105.646%0.46152%0.521SS..Hα-helixtrans-64.8-40.5174.5168.80000111.7Q90 Q92 I98Q90-V94 WeakPolarHBondContact O-CB 3.47Å; Q90-V94 VanDerWaalsContact O-CG2 3.29Å; Q90-V94 WeakPolarHBondContact O-CG2 3.31Å; Q90-V94 PolarHBondContact O-N 3.34Å; Q92-V94 VanDerWaalsContact C-N 3.26Å; Q92-V94 PolarHBondContact O-N 2.87Å; V94-I98 HydrophobicContact CG1-CD1 3.95Å; V94-I98 WeakPolarHBondContact O-CD1 3.29Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.44Å; V94-I98 PolarHBondContact O-N 3.41Å
95K93.5Very high93.1Very high131 Ų131102.1 Ų102.157%0.5751%0.513SS*.Hα-helixtrans-66.7-42.2174.8-72.5169.2-176.8178.60111.9S91 Q92 I98 H99S91-K95 WeakPolarHBondContact O-CD 3.27Å; S91-K95 VanDerWaalsContact O-CG 3.29Å; S91-K95 WeakPolarHBondContact O-CG 3.47Å; S91-K95 PolarHBondContact O-N 3.01Å; Q92-K95 WeakPolarHBondContact O-CA 3.41Å; Q92-K95 WeakPolarHBondContact O-CB 3.48Å; Q92-K95 PolarHBondContact O-N 3.46Å; K95-I98 PolarHBondContact O-N 3.04Å; K95-H99 VanDerWaalsContact O-CB 3.31Å; K95-H99 WeakPolarHBondContact O-CB 3.31Å; K95-H99 PolarHBondContact O-N 3.3Å
96E93.3Very high93.3Very high86 Ų86106.4 Ų106.440%0.40252%0.521SS..Hα-helixtrans-63.8-42.9177-72.8162.5178.800111Q92 I93 I98 H99 L100Q92-E96 VanDerWaalsContact CG-OE1 3.3Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.46Å; Q92-E96 PolarHBondContact NE2-OE1 3.47Å; Q92-E96 WeakPolarHBondContact O-CG 3.29Å; Q92-E96 PolarHBondContact O-N 2.93Å; I93-E96 PolarHBondContact O-N 2.84Å; E96-I98 PolarHBondContact O-N 3.26Å; E96-H99 PolarHBondContact O-N 3.15Å; E96-L100 WeakPolarHBondContact O-CB 3.39Å; E96-L100 VanDerWaalsContact O-CG 3.31Å; E96-L100 WeakPolarHBondContact O-CG 3.35Å; E96-L100 PolarHBondContact O-N 2.99Å
97K94.1Very high93.6Very high150 Ų150104.2 Ų104.265%0.65252%0.518SS*.Hα-helixtrans-58.6-47.4172.3-178.4171.5-179.3170.30112I93 H99 Q101I93-K97 WeakPolarHBondContact O-CB 3.45Å; I93-K97 PolarHBondContact O-N 2.92Å; K97-H99 VanDerWaalsContact C-N 3.34Å; K97-H99 PolarHBondContact O-N 3.12Å; K97-Q101 WeakPolarHBondContact O-CB 3.32Å; K97-Q101 PolarHBondContact O-N 3.44Å
98I93.9Very high93.8Very high109 Ų109103.1 Ų103.156%0.55952%0.515SS*.Hα-helixtrans-64.1-40.2178-68.9165.2000111.1V94 K95 E96 G102V94-I98 HydrophobicContact CG1-CD1 3.95Å; V94-I98 WeakPolarHBondContact O-CD1 3.29Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.44Å; V94-I98 PolarHBondContact O-N 3.41Å; K95-I98 PolarHBondContact O-N 3.04Å; E96-I98 PolarHBondContact O-N 3.26Å; I98-G102 PolarHBondContact O-N 2.87Å
99H93.4Very high94Very high113 Ų113101.8 Ų101.852%0.52351%0.514SS..Hα-helixtrans-62.9-52.8177.4-177.716.9000111.4K95 E96 K97 Q101 G102 E103K95-H99 VanDerWaalsContact O-CB 3.31Å; K95-H99 WeakPolarHBondContact O-CB 3.31Å; K95-H99 PolarHBondContact O-N 3.3Å; E96-H99 PolarHBondContact O-N 3.15Å; K97-H99 VanDerWaalsContact C-N 3.34Å; K97-H99 PolarHBondContact O-N 3.12Å; H99-Q101 VanDerWaalsContact C-N 3.35Å; H99-Q101 PolarHBondContact O-N 3.47Å; H99-G102 WeakPolarHBondContact O-CA 3.45Å; H99-G102 PolarHBondContact O-N 3.5Å; H99-G102 VanDerWaalsContact O-N 3.12Å; H99-E103 VanDerWaalsContact CE1-CD 3.48Å; H99-E103 IonicContact CE1-OE1 3.68Å; H99-E103 PolarHBondContact CE1-OE1 3.17Å; H99-E103 VanDerWaalsContact CE1-OE1 3.28Å; H99-E103 IonicContact CE1-OE2 3.28Å; H99-E103 WeakPolarHBondContact O-CG 3.49Å; H99-E103 PolarHBondContact O-N 2.84Å
100L95.1Very high94.2Very high108 Ų10897.5 Ų97.557%0.56551%0.506SS*.Hα-helixtrans-62.3-38.4178-70170.2000112.1E96 G102 E103 H104E96-L100 WeakPolarHBondContact O-CB 3.39Å; E96-L100 VanDerWaalsContact O-CG 3.31Å; E96-L100 WeakPolarHBondContact O-CG 3.35Å; E96-L100 PolarHBondContact O-N 2.99Å; L100-G102 VanDerWaalsContact C-N 3.32Å; L100-G102 PolarHBondContact O-N 3.28Å; L100-E103 PolarHBondContact O-N 3.39Å; L100-H104 VanDerWaalsContact O-CB 3.26Å; L100-H104 WeakPolarHBondContact O-CB 3.49Å; L100-H104 PolarHBondContact O-N 3.5Å
101Q93.9Very high94.4Very high120 Ų12099.4 Ų99.456%0.56151%0.507SS*.Hα-helixtrans-64-37.4174.2-174.1176.16.600111.9K97 H99 S105K97-Q101 WeakPolarHBondContact O-CB 3.32Å; K97-Q101 PolarHBondContact O-N 3.44Å; H99-Q101 VanDerWaalsContact C-N 3.35Å; H99-Q101 PolarHBondContact O-N 3.47Å; Q101-S105 WeakPolarHBondContact O-CB 3.47Å; Q101-S105 PolarHBondContact O-N 3.16Å; Q101-S105 PolarHBondContact O-OG 2.73Å
102G93.5Very high94.6Very high30 Ų30100.2 Ų100.231%0.30951%0.513SS..Hα-helixtrans-68.4-36.6172.900000113.4I98 H99 L100 K106I98-G102 PolarHBondContact O-N 2.87Å; H99-G102 WeakPolarHBondContact O-CA 3.45Å; H99-G102 PolarHBondContact O-N 3.5Å; H99-G102 VanDerWaalsContact O-N 3.12Å; L100-G102 VanDerWaalsContact C-N 3.32Å; L100-G102 PolarHBondContact O-N 3.28Å; G102-K106 VanDerWaalsContact O-CG 3.32Å; G102-K106 WeakPolarHBondContact O-CG 3.26Å; G102-K106 PolarHBondContact O-N 3.49Å; G102-K106 VanDerWaalsContact O-N 3.15Å
103E94.2Very high94.8Very high92 Ų92103 Ų10343%0.4352%0.524SS..Hα-helixtrans-71.6-42.5174.1-67.5-165.714200112.4H99 L100 S105 K106 A107H99-E103 VanDerWaalsContact CE1-CD 3.48Å; H99-E103 IonicContact CE1-OE1 3.68Å; H99-E103 PolarHBondContact CE1-OE1 3.17Å; H99-E103 VanDerWaalsContact CE1-OE1 3.28Å; H99-E103 IonicContact CE1-OE2 3.28Å; H99-E103 WeakPolarHBondContact O-CG 3.49Å; H99-E103 PolarHBondContact O-N 2.84Å; L100-E103 PolarHBondContact O-N 3.39Å; E103-S105 VanDerWaalsContact C-N 3.29Å; E103-S105 PolarHBondContact O-N 2.8Å; E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 PolarHBondContact O-N 3.26Å; E103-K106 VanDerWaalsContact O-N 3.16Å; E103-A107 WeakPolarHBondContact O-CB 3.2Å; E103-A107 PolarHBondContact O-N 2.89Å
104H94.7Very high94.9Very high124 Ų124103.1 Ų103.157%0.57453%0.525SS*.Hα-helixtrans-58.7-41.8173.4-175.973.6000111.6L100 K106 A107 I108L100-H104 VanDerWaalsContact O-CB 3.26Å; L100-H104 WeakPolarHBondContact O-CB 3.49Å; L100-H104 PolarHBondContact O-N 3.5Å; H104-K106 PolarHBondContact O-N 2.84Å; H104-A107 WeakPolarHBondContact O-CB 3.35Å; H104-A107 PolarHBondContact O-N 3.36Å; H104-I108 WeakPolarHBondContact O-CG1 3.43Å; H104-I108 PolarHBondContact O-N 2.96Å
105S95.8Very high95Very high58 Ų58102.8 Ų102.841%0.40652%0.518SS..Hα-helixtrans-63.4-40.8175.3-60.50000112.3Q101 E103 L109Q101-S105 WeakPolarHBondContact O-CB 3.47Å; Q101-S105 PolarHBondContact O-N 3.16Å; Q101-S105 PolarHBondContact O-OG 2.73Å; E103-S105 VanDerWaalsContact C-N 3.29Å; E103-S105 PolarHBondContact O-N 2.8Å; S105-L109 WeakPolarHBondContact O-CG 3.4Å; S105-L109 PolarHBondContact O-N 3.47Å; S105-L109 VanDerWaalsContact O-N 3.17Å
106K96.3Very high95.2Very high145 Ų14599 Ų9963%0.6351%0.508SS*.Hα-helixtrans-64.5-40.4172-68.8166.3-173173.70111.8G102 E103 H104 L109 A110G102-K106 VanDerWaalsContact O-CG 3.32Å; G102-K106 WeakPolarHBondContact O-CG 3.26Å; G102-K106 PolarHBondContact O-N 3.49Å; G102-K106 VanDerWaalsContact O-N 3.15Å; E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 PolarHBondContact O-N 3.26Å; E103-K106 VanDerWaalsContact O-N 3.16Å; H104-K106 PolarHBondContact O-N 2.84Å; K106-L109 PolarHBondContact O-N 3.36Å; K106-A110 WeakPolarHBondContact O-CB 3.37Å; K106-A110 PolarHBondContact O-N 2.91Å
107A95.6Very high95.3Very high56 Ų5699 Ų9946%0.46351%0.511SS..Hα-helixtrans-64.5-41.7178.200000111.9E103 H104 A110 R111E103-A107 WeakPolarHBondContact O-CB 3.2Å; E103-A107 PolarHBondContact O-N 2.89Å; H104-A107 WeakPolarHBondContact O-CB 3.35Å; H104-A107 PolarHBondContact O-N 3.36Å; A107-A110 PolarHBondContact O-N 3.35Å; A107-R111 WeakPolarHBondContact O-CB 3.37Å; A107-R111 PolarHBondContact O-N 3.01Å
108I95.6Very high95.4Very high92 Ų9295.1 Ų95.147%0.47250%0.502SS..Hα-helixtrans-59.8-47.5173.1-70.3165.8000110.9H104 A110 R111 S112H104-I108 WeakPolarHBondContact O-CG1 3.43Å; H104-I108 PolarHBondContact O-N 2.96Å; I108-A110 PolarHBondContact O-N 3.17Å; I108-R111 PolarHBondContact O-N 3.47Å; I108-S112 WeakPolarHBondContact O-CB 3.4Å; I108-S112 PolarHBondContact O-N 3.03Å
109L95.8Very high95.6Very high127 Ų12796.8 Ų96.867%0.66550%0.501SS*.Hα-helixtrans-63.2-40.5178.6-70.7170000112.1S105 K106 K113S105-L109 WeakPolarHBondContact O-CG 3.4Å; S105-L109 PolarHBondContact O-N 3.47Å; S105-L109 VanDerWaalsContact O-N 3.17Å; K106-L109 PolarHBondContact O-N 3.36Å; L109-K113 WeakPolarHBondContact O-CB 3.33Å; L109-K113 PolarHBondContact O-N 3.39Å
110A95.9Very high95.7Very high53 Ų5395.5 Ų95.544%0.43850%0.495SS..Hα-helixtrans-63.8-44.3173.900000111.9K106 A107 I108 K113 L114K106-A110 WeakPolarHBondContact O-CB 3.37Å; K106-A110 PolarHBondContact O-N 2.91Å; A107-A110 PolarHBondContact O-N 3.35Å; I108-A110 PolarHBondContact O-N 3.17Å; A110-K113 PolarHBondContact O-N 2.9Å; A110-L114 WeakPolarHBondContact O-CG 3.43Å; A110-L114 PolarHBondContact O-N 3.2Å
111R95.9Very high95.8Very high169 Ų16995.5 Ų95.564%0.63850%0.495SS*.Hα-helixtrans-62-47.2177.3-154.2-167.590.1-179.18.3111.2A107 I108 K113 L114 E115A107-R111 WeakPolarHBondContact O-CB 3.37Å; A107-R111 PolarHBondContact O-N 3.01Å; I108-R111 PolarHBondContact O-N 3.47Å; R111-K113 PolarHBondContact O-N 3.01Å; R111-L114 PolarHBondContact O-N 2.99Å; R111-E115 IonicContact CZ-OE1 3.74Å; R111-E115 IonicContact NE-OE1 2.62Å; R111-E115 PolarHBondContact NE-OE1 2.85Å; R111-E115 IonicContact NH2-OE1 3.61Å; R111-E115 PolarHBondContact NH2-OE1 2.82Å; R111-E115 WeakPolarHBondContact O-CG 3.38Å; R111-E115 PolarHBondContact O-N 3.37Å
112S96.4Very high95.9Very high71 Ų7196.3 Ų96.350%0.49750%0.499SS..Hα-helixtrans-60.5-41.4177179.40000112.3I108 E115 S116I108-S112 WeakPolarHBondContact O-CB 3.4Å; I108-S112 PolarHBondContact O-N 3.03Å; S112-E115 PolarHBondContact O-N 3.36Å; S112-S116 PolarHBondContact O-N 3.22Å
113K96.9Very high96.1Very high148 Ų148101.8 Ų101.864%0.64351%0.51SS*.Hα-helixtrans-64.6-42.3174.8-171.7174.3-178.3178.60112.2L109 A110 R111 S116 L117L109-K113 WeakPolarHBondContact O-CB 3.33Å; L109-K113 PolarHBondContact O-N 3.39Å; A110-K113 PolarHBondContact O-N 2.9Å; R111-K113 PolarHBondContact O-N 3.01Å; K113-S116 PolarHBondContact O-N 3.44Å; K113-L117 HydrophobicContact CG-CD1 4.18Å; K113-L117 WeakPolarHBondContact O-CG 3.46Å; K113-L117 PolarHBondContact O-N 3.45Å
114L96.3Very high96.2Very high108 Ų108103.1 Ų103.157%0.56552%0.516SS*.Hα-helixtrans-65.5-40.6174.8-71.5170.4000111.8A110 R111 S116 L117 C118A110-L114 WeakPolarHBondContact O-CG 3.43Å; A110-L114 PolarHBondContact O-N 3.2Å; R111-L114 PolarHBondContact O-N 2.99Å; L114-S116 PolarHBondContact O-N 3.31Å; L114-L117 PolarHBondContact O-N 2.81Å; L114-C118 WeakPolarHBondContact O-CB 3.25Å; L114-C118 PolarHBondContact O-N 2.65Å; L114-C118 PolarHBondContact O-SG 2.82Å
115E95.6Very high96.3Very high68 Ų68101.5 Ų101.532%0.31851%0.512SS..Hα-helixtrans-60.3-41.2173.8-76.3-179.9-135.700112.2R111 S112 R119R111-E115 IonicContact CZ-OE1 3.74Å; R111-E115 IonicContact NE-OE1 2.62Å; R111-E115 PolarHBondContact NE-OE1 2.85Å; R111-E115 IonicContact NH2-OE1 3.61Å; R111-E115 PolarHBondContact NH2-OE1 2.82Å; R111-E115 WeakPolarHBondContact O-CG 3.38Å; R111-E115 PolarHBondContact O-N 3.37Å; S112-E115 PolarHBondContact O-N 3.36Å; E115-R119 WeakPolarHBondContact O-CB 3.35Å; E115-R119 VanDerWaalsContact O-CG 3.23Å; E115-R119 WeakPolarHBondContact O-CG 3.39Å; E115-R119 PolarHBondContact O-N 3.13Å
116S96.5Very high96.4Very high52 Ų52104.8 Ų104.836%0.36452%0.519SS..Hα-helixtrans-65.2-48.6175.3-156.50000111.5S112 K113 L114 C118 R119 E120S112-S116 PolarHBondContact O-N 3.22Å; K113-S116 PolarHBondContact O-N 3.44Å; L114-S116 PolarHBondContact O-N 3.31Å; S116-C118 VanDerWaalsContact C-N 3.33Å; S116-C118 PolarHBondContact O-N 2.84Å; S116-R119 PolarHBondContact O-N 3.39Å; S116-R119 VanDerWaalsContact O-N 3.13Å; S116-E120 WeakPolarHBondContact O-CB 3.43Å; S116-E120 WeakPolarHBondContact O-CG 3.41Å; S116-E120 PolarHBondContact O-N 2.84Å; S116-E120 PolarHBondContact OG-OE1 3.38Å
117L96.8Very high96.4Very high86 Ų86100.9 Ų100.945%0.4551%0.507SS..Hα-helixtrans-60.2-40.5178.1-72.8167.9000112.1K113 L114 E120 L121K113-L117 HydrophobicContact CG-CD1 4.18Å; K113-L117 WeakPolarHBondContact O-CG 3.46Å; K113-L117 PolarHBondContact O-N 3.45Å; L114-L117 PolarHBondContact O-N 2.81Å; L117-E120 PolarHBondContact O-N 2.74Å; L117-L121 VanDerWaalsContact O-CB 3.25Å; L117-L121 WeakPolarHBondContact O-CB 3.34Å; L117-L121 PolarHBondContact O-N 2.78Å
118C95.8Very high96.4Very high69 Ų69102.1 Ų102.147%0.46651%0.506SS..Hα-helixtrans-64.7-42.2174.4-74.30000112L114 S116 L121 Q122L114-C118 WeakPolarHBondContact O-CB 3.25Å; L114-C118 PolarHBondContact O-N 2.65Å; L114-C118 PolarHBondContact O-SG 2.82Å; S116-C118 VanDerWaalsContact C-N 3.33Å; S116-C118 PolarHBondContact O-N 2.84Å; C118-L121 PolarHBondContact O-N 3.44Å; C118-Q122 WeakPolarHBondContact O-CB 3.35Å; C118-Q122 VanDerWaalsContact O-CG 3.23Å; C118-Q122 WeakPolarHBondContact O-CG 3.4Å; C118-Q122 PolarHBondContact O-N 2.91Å
119R97.1Very high96.5Very high143 Ų143106 Ų10654%0.5452%0.519SS..Hα-helixtrans-65.7-38.2175.1-70.6169.2-169-1128.5111.9E115 S116 R123E115-R119 WeakPolarHBondContact O-CB 3.35Å; E115-R119 VanDerWaalsContact O-CG 3.23Å; E115-R119 WeakPolarHBondContact O-CG 3.39Å; E115-R119 PolarHBondContact O-N 3.13Å; S116-R119 PolarHBondContact O-N 3.39Å; S116-R119 VanDerWaalsContact O-N 3.13Å; R119-R123 WeakPolarHBondContact O-CG 3.45Å; R119-R123 PolarHBondContact O-N 3.45Å
120E96.7Very high96.5Very high86 Ų86104.9 Ų104.940%0.40251%0.511SS..Hα-helixtrans-66.5-46.2175.4-74.3157.6-138.100111.6S116 L117 Q122 R123 H124S116-E120 WeakPolarHBondContact O-CB 3.43Å; S116-E120 WeakPolarHBondContact O-CG 3.41Å; S116-E120 PolarHBondContact O-N 2.84Å; S116-E120 PolarHBondContact OG-OE1 3.38Å; L117-E120 PolarHBondContact O-N 2.74Å; E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 2.88Å; E120-R123 PolarHBondContact O-N 3.46Å; E120-H124 WeakPolarHBondContact O-CB 3.48Å; E120-H124 PolarHBondContact O-N 3.26Å
121L96.6Very high96.5Very high108 Ų108106.9 Ų106.957%0.56551%0.511SS*.Hα-helixtrans-62.6-39.7175.3-175.263.6000111.8L117 C118 H124 N125L117-L121 VanDerWaalsContact O-CB 3.25Å; L117-L121 WeakPolarHBondContact O-CB 3.34Å; L117-L121 PolarHBondContact O-N 2.78Å; C118-L121 PolarHBondContact O-N 3.44Å; L121-H124 PolarHBondContact O-N 2.95Å; L121-N125 WeakPolarHBondContact CD1-ND2 3.41Å; L121-N125 WeakPolarHBondContact O-CB 3.23Å; L121-N125 PolarHBondContact O-N 3.48Å; L121-N125 PolarHBondContact O-ND2 3.06Å
122Q96.4Very high96.4Very high138 Ų138103.7 Ų103.765%0.64551%0.507SS*.Hα-helixtrans-64.3-44.2173.6-77.9173.5-9.700112.1C118 E120 K126C118-Q122 WeakPolarHBondContact O-CB 3.35Å; C118-Q122 VanDerWaalsContact O-CG 3.23Å; C118-Q122 WeakPolarHBondContact O-CG 3.4Å; C118-Q122 PolarHBondContact O-N 2.91Å; E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 2.88Å; Q122-K126 WeakPolarHBondContact O-CB 3.33Å; Q122-K126 PolarHBondContact O-N 3.46Å
123R97.6Very high96.4Very high144 Ų144101.9 Ų101.954%0.54350%0.499SS..Hα-helixtrans-59.5-49.1173.1-73.8-175.3-134.6106.4-1.3111.1R119 E120 N125 K126 T127R119-R123 WeakPolarHBondContact O-CG 3.45Å; R119-R123 PolarHBondContact O-N 3.45Å; E120-R123 PolarHBondContact O-N 3.46Å; R123-N125 PolarHBondContact O-N 3.03Å; R123-K126 WeakPolarHBondContact O-CB 3.23Å; R123-K126 PolarHBondContact O-N 2.86Å; R123-K126 VanDerWaalsContact O-N 3.15Å; R123-T127 PolarHBondContact O-N 3.17Å; R123-T127 PolarHBondContact O-OG1 2.86Å
124H96.6Very high96.4Very high120 Ų12098.3 Ų98.356%0.55648%0.484SS*.Hα-helixtrans-62.3-41.6-179.1-170.8-90.5000112.5E120 L121 T127 L128E120-H124 WeakPolarHBondContact O-CB 3.48Å; E120-H124 PolarHBondContact O-N 3.26Å; L121-H124 PolarHBondContact O-N 2.95Å; H124-T127 PolarHBondContact O-N 3.46Å; H124-L128 WeakPolarHBondContact O-CB 3.3Å; H124-L128 PolarHBondContact O-N 2.89Å
125N96.3Very high96.4Very high91 Ų9198.6 Ų98.649%0.48748%0.478SS..Hα-helixtrans-65.9-37.3174.1-83.9-86.8000112.5L121 R123 K129L121-N125 WeakPolarHBondContact CD1-ND2 3.41Å; L121-N125 WeakPolarHBondContact O-CB 3.23Å; L121-N125 PolarHBondContact O-N 3.48Å; L121-N125 PolarHBondContact O-ND2 3.06Å; R123-N125 PolarHBondContact O-N 3.03Å; N125-K129 WeakPolarHBondContact O-CB 3.49Å; N125-K129 PolarHBondContact O-N 2.96Å
126K97.1Very high96.5Very high126 Ų12698.6 Ų98.655%0.54849%0.485SS..Hα-helixtrans-63.1-51.2173.6-179.9178.3169.3179.20110.7Q122 R123 L128 K129 E130Q122-K126 WeakPolarHBondContact O-CB 3.33Å; Q122-K126 PolarHBondContact O-N 3.46Å; R123-K126 WeakPolarHBondContact O-CB 3.23Å; R123-K126 PolarHBondContact O-N 2.86Å; R123-K126 VanDerWaalsContact O-N 3.15Å; K126-L128 PolarHBondContact O-N 3.15Å; K126-K129 WeakPolarHBondContact O-CB 3.41Å; K126-K129 PolarHBondContact O-N 2.96Å; K126-K129 VanDerWaalsContact O-N 3.12Å; K126-E130 VanDerWaalsContact CE-CD 3.43Å; K126-E130 WeakPolarHBondContact CE-OE1 3.39Å; K126-E130 HydrophobicContact CG-CG 4.49Å; K126-E130 IonicContact NZ-OE1 2.61Å; K126-E130 WeakPolarHBondContact O-CG 3.49Å; K126-E130 PolarHBondContact O-N 3.24Å
127T96.3Very high96.5Very high63 Ų63102.3 Ų102.339%0.38749%0.491SS..Hα-helixtrans-60.1-44.6178-58.10000111.8R123 H124 K129 E130 E131R123-T127 PolarHBondContact O-N 3.17Å; R123-T127 PolarHBondContact O-OG1 2.86Å; H124-T127 PolarHBondContact O-N 3.46Å; T127-K129 VanDerWaalsContact C-N 3.3Å; T127-K129 PolarHBondContact O-N 3.18Å; T127-E130 PolarHBondContact O-N 3.33Å; T127-E131 HydrophobicContact CG2-CG 4.24Å; T127-E131 WeakPolarHBondContact CG2-OE1 3.26Å; T127-E131 WeakPolarHBondContact O-CB 3.4Å; T127-E131 WeakPolarHBondContact O-CG 3.46Å; T127-E131 PolarHBondContact O-N 2.79Å
128L96.6Very high96.4Very high83 Ų83102.1 Ų102.144%0.43549%0.488SS..Hα-helixtrans-58.4-39.5173.8-96.1172.6000113H124 K126 N132H124-L128 WeakPolarHBondContact O-CB 3.3Å; H124-L128 PolarHBondContact O-N 2.89Å; K126-L128 PolarHBondContact O-N 3.15Å; L128-N132 WeakPolarHBondContact O-CB 3.32Å; L128-N132 PolarHBondContact O-N 3Å
129K96.6Very high96.5Very high172 Ų172106 Ų10675%0.74849%0.494SS*.Hα-helixtrans-69.2-38.8177.5-171.2175.8-1791790111.7N125 K126 T127 G133N125-K129 WeakPolarHBondContact O-CB 3.49Å; N125-K129 PolarHBondContact O-N 2.96Å; K126-K129 WeakPolarHBondContact O-CB 3.41Å; K126-K129 PolarHBondContact O-N 2.96Å; K126-K129 VanDerWaalsContact O-N 3.12Å; T127-K129 VanDerWaalsContact C-N 3.3Å; T127-K129 PolarHBondContact O-N 3.18Å; K129-G133 PolarHBondContact O-N 3.37Å
130E96.3Very high96.4Very high105 Ų105104 Ų10449%0.49149%0.491SS..Hα-helixtrans-68.2-47.4176.2-71.4170.9156.200111.3K126 T127 G133 Q134K126-E130 VanDerWaalsContact CE-CD 3.43Å; K126-E130 WeakPolarHBondContact CE-OE1 3.39Å; K126-E130 HydrophobicContact CG-CG 4.49Å; K126-E130 IonicContact NZ-OE1 2.61Å; K126-E130 WeakPolarHBondContact O-CG 3.49Å; K126-E130 PolarHBondContact O-N 3.24Å; T127-E130 PolarHBondContact O-N 3.33Å; E130-G133 CarbonylContact O-C 3.6Å; E130-G133 PolarHBondContact O-N 2.92Å; E130-Q134 VanDerWaalsContact O-CB 3.29Å; E130-Q134 WeakPolarHBondContact O-CB 3.18Å; E130-Q134 PolarHBondContact O-N 3.12Å
131E95.6Very high96.4Very high95 Ų95105 Ų10544%0.44450%0.496SS..Hα-helixtrans-61.1-45174.6-76.1-178.6-167.300112.6T127 Q134 R135T127-E131 HydrophobicContact CG2-CG 4.24Å; T127-E131 WeakPolarHBondContact CG2-OE1 3.26Å; T127-E131 WeakPolarHBondContact O-CB 3.4Å; T127-E131 WeakPolarHBondContact O-CG 3.46Å; T127-E131 PolarHBondContact O-N 2.79Å; E131-Q134 PolarHBondContact O-N 2.82Å; E131-R135 VanDerWaalsContact O-CB 3.3Å; E131-R135 WeakPolarHBondContact O-CB 3.24Å; E131-R135 PolarHBondContact O-N 3.25Å
132N95.4Very high96.5Very high102 Ų102105.2 Ų105.255%0.54549%0.493SS..Hα-helixtrans-68.5-37.7179.3-166.255.1000111.4L128 Q134 S136L128-N132 WeakPolarHBondContact O-CB 3.32Å; L128-N132 PolarHBondContact O-N 3Å; N132-Q134 VanDerWaalsContact C-N 3.31Å; N132-S136 VanDerWaalsContact O-CB 3.32Å; N132-S136 WeakPolarHBondContact O-CB 3.3Å; N132-S136 PolarHBondContact O-N 3.21Å
133G96.4Very high96.5Very high32 Ų32107.3 Ų107.333%0.3350%0.495SS..Hα-helixtrans-70.6-22.8172.600000114.2K129 E130 R137K129-G133 PolarHBondContact O-N 3.37Å; E130-G133 CarbonylContact O-C 3.6Å; E130-G133 PolarHBondContact O-N 2.92Å; G133-R137 PolarHBondContact O-NE 3.01Å; G133-R137 PolarHBondContact O-NH2 2.92Å
134Q96.6Very high96.5Very high73 Ų73106 Ų10634%0.34149%0.493SS..Hα-helixtrans-77.6-52.9170.8179.360.130.900110.7E130 E131 N132 S136 R137 E138E130-Q134 VanDerWaalsContact O-CB 3.29Å; E130-Q134 WeakPolarHBondContact O-CB 3.18Å; E130-Q134 PolarHBondContact O-N 3.12Å; E131-Q134 PolarHBondContact O-N 2.82Å; N132-Q134 VanDerWaalsContact C-N 3.31Å; Q134-S136 VanDerWaalsContact C-N 3.26Å; Q134-S136 PolarHBondContact O-N 3.43Å; Q134-R137 WeakPolarHBondContact O-CA 3.4Å; Q134-R137 WeakPolarHBondContact O-CB 2.76Å; Q134-R137 PolarHBondContact O-N 3.08Å; Q134-E138 VanDerWaalsContact CG-OE1 3.29Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.29Å; Q134-E138 PolarHBondContact NE2-OE1 2.97Å; Q134-E138 PolarHBondContact O-N 3.42Å
135R96.4Very high96.5Very high115 Ų115106.7 Ų106.743%0.43450%0.497SS..Hα-helixtrans-56.4-37.4176.8-166.7-173.4-56.5159.16112.8E131 R137 E138 Y139E131-R135 VanDerWaalsContact O-CB 3.3Å; E131-R135 WeakPolarHBondContact O-CB 3.24Å; E131-R135 PolarHBondContact O-N 3.25Å; R135-R137 VanDerWaalsContact C-N 3.33Å; R135-R137 PolarHBondContact O-N 3.07Å; R135-E138 PolarHBondContact O-N 3.36Å; R135-Y139 HydrophobicContact CG-CD2 4Å; R135-Y139 HydrophobicContact CG-CE2 3.64Å; R135-Y139 VanDerWaalsContact O-CD2 3.26Å; R135-Y139 WeakPolarHBondContact O-CD2 3.45Å; R135-Y139 PolarHBondContact O-N 3.5Å
136S96.1Very high96.6Very high67 Ų67104.6 Ų104.647%0.46949%0.492SS..Hα-helixtrans-66.1-33174.9-167.70000113N132 Q134 E140N132-S136 VanDerWaalsContact O-CB 3.32Å; N132-S136 WeakPolarHBondContact O-CB 3.3Å; N132-S136 PolarHBondContact O-N 3.21Å; Q134-S136 VanDerWaalsContact C-N 3.26Å; Q134-S136 PolarHBondContact O-N 3.43Å; S136-E140 PolarHBondContact O-N 2.83Å
137R96.5Very high96.6Very high131 Ų131103.2 Ų103.249%0.49449%0.489SS..Hα-helixtrans-74.6-42.9175-76.9177-75.2136.22.9111G133 Q134 R135 Y139 E140 E141G133-R137 PolarHBondContact O-NE 3.01Å; G133-R137 PolarHBondContact O-NH2 2.92Å; Q134-R137 WeakPolarHBondContact O-CA 3.4Å; Q134-R137 WeakPolarHBondContact O-CB 2.76Å; Q134-R137 PolarHBondContact O-N 3.08Å; R135-R137 VanDerWaalsContact C-N 3.33Å; R135-R137 PolarHBondContact O-N 3.07Å; R137-Y139 PolarHBondContact O-N 2.92Å; R137-E140 CarbonylContact O-C 3.59Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 2.96Å; R137-E140 VanDerWaalsContact O-N 3.08Å; R137-E141 WeakPolarHBondContact O-CB 3.44Å; R137-E141 WeakPolarHBondContact O-CG 3.44Å; R137-E141 PolarHBondContact O-N 3.24Å
138E96.4Very high96.7Very high81 Ų81105.2 Ų105.238%0.37950%0.497SS..Hα-helixtrans-58.9-43.7175.9-69.6164.1178.900112.1Q134 R135 E141 Q142Q134-E138 VanDerWaalsContact CG-OE1 3.29Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.29Å; Q134-E138 PolarHBondContact NE2-OE1 2.97Å; Q134-E138 PolarHBondContact O-N 3.42Å; R135-E138 PolarHBondContact O-N 3.36Å; E138-E141 PolarHBondContact O-N 2.92Å; E138-Q142 WeakPolarHBondContact O-CB 3.46Å; E138-Q142 VanDerWaalsContact O-CG 3.3Å; E138-Q142 WeakPolarHBondContact O-CG 3.29Å; E138-Q142 PolarHBondContact O-N 3.47Å
139Y96.5Very high96.7Very high152 Ų152106.7 Ų106.760%0.59650%0.501SS*.Hα-helixtrans-67.1-33.5173.8-76.1-47.8000113.4R135 R137 R143R135-Y139 HydrophobicContact CG-CD2 4Å; R135-Y139 HydrophobicContact CG-CE2 3.64Å; R135-Y139 VanDerWaalsContact O-CD2 3.26Å; R135-Y139 WeakPolarHBondContact O-CD2 3.45Å; R135-Y139 PolarHBondContact O-N 3.5Å; R137-Y139 PolarHBondContact O-N 2.92Å; Y139-R143 VanDerWaalsContact O-CB 3.24Å; Y139-R143 WeakPolarHBondContact O-CB 3.18Å; Y139-R143 PolarHBondContact O-N 2.85Å
140E95.9Very high96.8Very high101 Ų101105.5 Ų105.547%0.47250%0.497SS..Hα-helixtrans-69.5-38.3172.8-89.2-163.5-162.600112.8S136 R137 R143 K144S136-E140 PolarHBondContact O-N 2.83Å; R137-E140 CarbonylContact O-C 3.59Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 2.96Å; R137-E140 VanDerWaalsContact O-N 3.08Å; E140-R143 PolarHBondContact O-N 3.45Å; E140-K144 VanDerWaalsContact O-CD 3.29Å; E140-K144 WeakPolarHBondContact O-CD 3.29Å; E140-K144 WeakPolarHBondContact O-CG 3.5Å; E140-K144 PolarHBondContact O-N 2.79Å; E140-K144 IonicContact OE2-NZ 2.99Å; E140-K144 PolarHBondContact OE2-NZ 2.82Å
141E96.8Very high96.9Very high107 Ų107106.8 Ų106.850%0.550%0.503SS..Hα-helixtrans-67.4-50.3177.4-75.2168.6173.800110.3R137 E138 R143 K144 E145R137-E141 WeakPolarHBondContact O-CB 3.44Å; R137-E141 WeakPolarHBondContact O-CG 3.44Å; R137-E141 PolarHBondContact O-N 3.24Å; E138-E141 PolarHBondContact O-N 2.92Å; E141-R143 PolarHBondContact O-N 2.78Å; E141-K144 CarbonylContact O-C 3.57Å; E141-K144 WeakPolarHBondContact O-CA 3.09Å; E141-K144 WeakPolarHBondContact O-CB 3.29Å; E141-K144 PolarHBondContact O-N 2.96Å; E141-E145 WeakPolarHBondContact O-CG 3.46Å; E141-E145 PolarHBondContact O-N 3.41Å
142Q97.4Very high97Very high111 Ų111107.4 Ų107.452%0.51951%0.507SS..Hα-helixtrans-55.7-37.7172.4-71.51721300112.5E138 A146E138-Q142 WeakPolarHBondContact O-CB 3.46Å; E138-Q142 VanDerWaalsContact O-CG 3.3Å; E138-Q142 WeakPolarHBondContact O-CG 3.29Å; E138-Q142 PolarHBondContact O-N 3.47Å; Q142-A146 VanDerWaalsContact O-CB 3.29Å; Q142-A146 WeakPolarHBondContact O-CB 3.31Å; Q142-A146 PolarHBondContact O-N 2.9Å
143R97.6Very high97.1Very high182 Ų182105 Ų10569%0.68750%0.496SS*.Hα-helixtrans-68-37.7175.3-179.1178.6174.5-169.2-2.6112.5Y139 E140 E141 M147Y139-R143 VanDerWaalsContact O-CB 3.24Å; Y139-R143 WeakPolarHBondContact O-CB 3.18Å; Y139-R143 PolarHBondContact O-N 2.85Å; E140-R143 PolarHBondContact O-N 3.45Å; E141-R143 PolarHBondContact O-N 2.78Å; R143-M147 VanDerWaalsContact O-CB 3.31Å; R143-M147 WeakPolarHBondContact O-CB 3.36Å; R143-M147 PolarHBondContact O-N 2.83Å; R143-M147 VanDerWaalsContact O-N 3.09Å
144K97.5Very high97.2Very high116 Ų116108.4 Ų108.450%0.50451%0.506SS..Hα-helixtrans-69-44.6175.8-70.7156.8-165.61620110.5E140 E141 M147 L148E140-K144 VanDerWaalsContact O-CD 3.29Å; E140-K144 WeakPolarHBondContact O-CD 3.29Å; E140-K144 WeakPolarHBondContact O-CG 3.5Å; E140-K144 PolarHBondContact O-N 2.79Å; E140-K144 IonicContact OE2-NZ 2.99Å; E140-K144 PolarHBondContact OE2-NZ 2.82Å; E141-K144 CarbonylContact O-C 3.57Å; E141-K144 WeakPolarHBondContact O-CA 3.09Å; E141-K144 WeakPolarHBondContact O-CB 3.29Å; E141-K144 PolarHBondContact O-N 2.96Å; K144-M147 PolarHBondContact O-N 2.98Å; K144-L148 WeakPolarHBondContact O-CB 3.32Å; K144-L148 PolarHBondContact O-N 3.38Å
145E97.3Very high97.2Very high135 Ų135106 Ų10663%0.63150%0.501SS*.Hα-helixtrans-60.2-48.7175.4-71178.4158.800112E141 M147 L148 H149E141-E145 WeakPolarHBondContact O-CG 3.46Å; E141-E145 PolarHBondContact O-N 3.41Å; E145-M147 VanDerWaalsContact C-N 3.34Å; E145-M147 PolarHBondContact O-N 2.93Å; E145-L148 PolarHBondContact O-N 3.38Å; E145-H149 WeakPolarHBondContact O-CB 3.48Å; E145-H149 PolarHBondContact O-N 2.96Å
146A97.1Very high97.3Very high47 Ų47104.9 Ų104.939%0.38850%0.504SS..Hα-helixtrans-60.8-42.2176.600000112Q142 H149 F150Q142-A146 VanDerWaalsContact O-CB 3.29Å; Q142-A146 WeakPolarHBondContact O-CB 3.31Å; Q142-A146 PolarHBondContact O-N 2.9Å; A146-H149 PolarHBondContact O-N 3.33Å; A146-F150 WeakPolarHBondContact O-CD2 3.45Å; A146-F150 PolarHBondContact O-N 3.09Å
147M97Very high97.4Very high97 Ų97105.6 Ų105.648%0.47850%0.501SS..Hα-helixtrans-64-42.2176.8-172.3-179.6-58.800112.2R143 K144 E145 F150 Q151R143-M147 VanDerWaalsContact O-CB 3.31Å; R143-M147 WeakPolarHBondContact O-CB 3.36Å; R143-M147 PolarHBondContact O-N 2.83Å; R143-M147 VanDerWaalsContact O-N 3.09Å; K144-M147 PolarHBondContact O-N 2.98Å; E145-M147 VanDerWaalsContact C-N 3.34Å; E145-M147 PolarHBondContact O-N 2.93Å; M147-F150 PolarHBondContact O-N 3.23Å; M147-Q151 WeakPolarHBondContact O-CG 3.46Å; M147-Q151 PolarHBondContact O-N 2.7Å
148L98.1Very high97.4Very high105 Ų105105.8 Ų105.855%0.5551%0.508SS..Hα-helixtrans-67.6-40.1177.1-170.8151.3000111.2K144 E145 Q151 M152K144-L148 WeakPolarHBondContact O-CB 3.32Å; K144-L148 PolarHBondContact O-N 3.38Å; E145-L148 PolarHBondContact O-N 3.38Å; L148-Q151 PolarHBondContact O-N 2.83Å; L148-M152 WeakPolarHBondContact O-CB 3.27Å; L148-M152 PolarHBondContact O-N 3.28Å
149H98Very high97.5Very high115 Ų115105.5 Ų105.553%0.53251%0.512SS..Hα-helixtrans-60.6-44.4172.9-173-64.4000111.6E145 A146 M152 T153E145-H149 WeakPolarHBondContact O-CB 3.48Å; E145-H149 PolarHBondContact O-N 2.96Å; A146-H149 PolarHBondContact O-N 3.33Å; H149-M152 PolarHBondContact O-N 3.43Å; H149-T153 PolarHBondContact CE1-OG1 3.36Å; H149-T153 PolarHBondContact ND1-OG1 3.19Å; H149-T153 WeakPolarHBondContact O-CB 3.36Å; H149-T153 PolarHBondContact O-N 2.88Å; H149-T153 PolarHBondContact O-OG1 2.95Å
150F97.9Very high97.6Very high147 Ų147104.5 Ų104.565%0.64551%0.512SS*.Hα-helixtrans-63.1-43.1174.9-79-59.8000112.4A146 M147 T153 L154A146-F150 WeakPolarHBondContact O-CD2 3.45Å; A146-F150 PolarHBondContact O-N 3.09Å; M147-F150 PolarHBondContact O-N 3.23Å; F150-T153 PolarHBondContact O-N 3.17Å; F150-L154 WeakPolarHBondContact O-CB 3.4Å; F150-L154 VanDerWaalsContact O-CG 3.32Å; F150-L154 WeakPolarHBondContact O-CG 3.4Å; F150-L154 PolarHBondContact O-N 2.96Å
151Q97.9Very high97.6Very high132 Ų132106 Ų10662%0.61752%0.521SS*.Hα-helixtrans-63.2-43.2176-76.2-178.8-1500112.3M147 L148 L154 G155M147-Q151 WeakPolarHBondContact O-CG 3.46Å; M147-Q151 PolarHBondContact O-N 2.7Å; L148-Q151 PolarHBondContact O-N 2.83Å; Q151-L154 PolarHBondContact O-N 3.39Å; Q151-G155 PolarHBondContact O-N 2.85Å
152M98Very high97.7Very high108 Ų108106.8 Ų106.853%0.53253%0.525SS..Hα-helixtrans-65.3-43.9177.6-168.3164.667.500111.3L148 H149 L154 G155 D156L148-M152 WeakPolarHBondContact O-CB 3.27Å; L148-M152 PolarHBondContact O-N 3.28Å; H149-M152 PolarHBondContact O-N 3.43Å; M152-L154 VanDerWaalsContact C-N 3.32Å; M152-L154 PolarHBondContact O-N 3.09Å; M152-G155 PolarHBondContact O-N 3.31Å; M152-D156 PolarHBondContact O-N 3.29Å
153T97.7Very high97.7Very high52 Ų52107.6 Ų107.632%0.31953%0.528SS..Hα-helixtrans-61.7-38.8175.8-51.30000111.9H149 F150 I157H149-T153 PolarHBondContact CE1-OG1 3.36Å; H149-T153 PolarHBondContact ND1-OG1 3.19Å; H149-T153 WeakPolarHBondContact O-CB 3.36Å; H149-T153 PolarHBondContact O-N 2.88Å; H149-T153 PolarHBondContact O-OG1 2.95Å; F150-T153 PolarHBondContact O-N 3.17Å; T153-I157 HydrophobicContact CG2-CD1 4.22Å; T153-I157 WeakPolarHBondContact O-CD1 3.46Å; T153-I157 VanDerWaalsContact O-CG1 3.27Å; T153-I157 WeakPolarHBondContact O-CG1 3.41Å; T153-I157 PolarHBondContact O-N 3.45Å; T153-I157 VanDerWaalsContact O-N 3.09Å
154L97.8Very high97.7Very high102 Ų102105.1 Ų105.153%0.53452%0.524SS..Hα-helixtrans-66.2-44.2174.6-75.5167.5000111.5F150 Q151 M152 D156 I157 E158F150-L154 WeakPolarHBondContact O-CB 3.4Å; F150-L154 VanDerWaalsContact O-CG 3.32Å; F150-L154 WeakPolarHBondContact O-CG 3.4Å; F150-L154 PolarHBondContact O-N 2.96Å; Q151-L154 PolarHBondContact O-N 3.39Å; M152-L154 VanDerWaalsContact C-N 3.32Å; M152-L154 PolarHBondContact O-N 3.09Å; L154-D156 VanDerWaalsContact C-N 3.34Å; L154-D156 PolarHBondContact O-N 3.45Å; L154-I157 PolarHBondContact O-N 2.9Å; L154-I157 VanDerWaalsContact O-N 3.17Å; L154-E158 WeakPolarHBondContact O-CG 3.42Å; L154-E158 PolarHBondContact O-N 3.45Å
155G98.2Very high97.7Very high24 Ų24102.5 Ų102.525%0.24752%0.521CS..Hα-helixtrans-60.5-40.2174.500000113Q151 M152 I157 E158 V159Q151-G155 PolarHBondContact O-N 2.85Å; M152-G155 PolarHBondContact O-N 3.31Å; G155-I157 VanDerWaalsContact C-N 3.33Å; G155-I157 PolarHBondContact O-N 2.86Å; G155-E158 PolarHBondContact O-N 3.48Å; G155-V159 WeakPolarHBondContact O-CB 3.35Å; G155-V159 VanDerWaalsContact O-CG2 3.28Å; G155-V159 WeakPolarHBondContact O-CG2 3.33Å; G155-V159 PolarHBondContact O-N 3.26Å
156D98.1Very high97.7Very high90 Ų9098.3 Ų98.348%0.48151%0.506SS..Hα-helixtrans-63.4-38.2174.4-71.7-33.8000111.9M152 L154 Q160M152-D156 PolarHBondContact O-N 3.29Å; L154-D156 VanDerWaalsContact C-N 3.34Å; L154-D156 PolarHBondContact O-N 3.45Å; D156-Q160 WeakPolarHBondContact O-CB 3.33Å; D156-Q160 WeakPolarHBondContact O-CG 3.46Å; D156-Q160 PolarHBondContact O-N 3.49Å
157I97.8Very high97.8Very high82 Ų82101 Ų10142%0.42151%0.511SS..Hα-helixtrans-67.8-44.4174.7-69.2164.1000111T153 L154 G155 V159 Q160 M161T153-I157 HydrophobicContact CG2-CD1 4.22Å; T153-I157 WeakPolarHBondContact O-CD1 3.46Å; T153-I157 VanDerWaalsContact O-CG1 3.27Å; T153-I157 WeakPolarHBondContact O-CG1 3.41Å; T153-I157 PolarHBondContact O-N 3.45Å; T153-I157 VanDerWaalsContact O-N 3.09Å; L154-I157 PolarHBondContact O-N 2.9Å; L154-I157 VanDerWaalsContact O-N 3.17Å; G155-I157 VanDerWaalsContact C-N 3.33Å; G155-I157 PolarHBondContact O-N 2.86Å; I157-V159 VanDerWaalsContact C-N 3.35Å; I157-V159 PolarHBondContact O-N 2.91Å; I157-Q160 PolarHBondContact O-N 3.47Å; I157-M161 HydrophobicContact CG2-SD 4.35Å; I157-M161 WeakPolarHBondContact O-CG 3.29Å; I157-M161 PolarHBondContact O-N 2.84Å
158E97.4Very high97.8Very high135 Ų13599.1 Ų99.163%0.63150%0.503SS*.Hα-helixtrans-59.8-44.5175.5-73174.6175.800111.2L154 G155 M161 E162L154-E158 WeakPolarHBondContact O-CG 3.42Å; L154-E158 PolarHBondContact O-N 3.45Å; G155-E158 PolarHBondContact O-N 3.48Å; E158-M161 PolarHBondContact O-N 2.88Å; E158-E162 PolarHBondContact O-N 2.86Å
159V98.2Very high97.9Very high76 Ų7696.7 Ų96.746%0.46150%0.497SS..Hα-helixtrans-63.5-41.4175.3168.10000111.6G155 I157 E162 Q163G155-V159 WeakPolarHBondContact O-CB 3.35Å; G155-V159 VanDerWaalsContact O-CG2 3.28Å; G155-V159 WeakPolarHBondContact O-CG2 3.33Å; G155-V159 PolarHBondContact O-N 3.26Å; I157-V159 VanDerWaalsContact C-N 3.35Å; I157-V159 PolarHBondContact O-N 2.91Å; V159-E162 PolarHBondContact O-N 2.93Å; V159-Q163 HydrophobicContact CG1-CG 4.4Å; V159-Q163 VanDerWaalsContact CG1-NE2 3.3Å; V159-Q163 WeakPolarHBondContact O-CB 3.28Å; V159-Q163 WeakPolarHBondContact O-CG 3.13Å; V159-Q163 PolarHBondContact O-N 3.34Å
160Q97.8Very high97.9Very high130 Ų13096.6 Ų96.661%0.60750%0.495SS*.Hα-helixtrans-65.8-39.2174.6-76.3-178.927.700112.5D156 I157 Q163 H164D156-Q160 WeakPolarHBondContact O-CB 3.33Å; D156-Q160 WeakPolarHBondContact O-CG 3.46Å; D156-Q160 PolarHBondContact O-N 3.49Å; I157-Q160 PolarHBondContact O-N 3.47Å; Q160-Q163 PolarHBondContact O-N 2.87Å; Q160-H164 WeakPolarHBondContact O-CB 3.47Å; Q160-H164 PolarHBondContact O-N 2.93Å
161M96.9Very high97.9Very high132 Ų13292.6 Ų92.665%0.6548%0.48SS*.Hα-helixtrans-63.1-43.8175.1-76.2-175.462.500111.7I157 E158 H164 S165I157-M161 HydrophobicContact CG2-SD 4.35Å; I157-M161 WeakPolarHBondContact O-CG 3.29Å; I157-M161 PolarHBondContact O-N 2.84Å; E158-M161 PolarHBondContact O-N 2.88Å; M161-H164 PolarHBondContact O-N 3.43Å; M161-S165 VanDerWaalsContact O-CB 3.29Å; M161-S165 WeakPolarHBondContact O-CB 3.36Å; M161-S165 PolarHBondContact O-N 2.73Å
162E97.4Very high97.9Very high125 Ų12594 Ų9458%0.58448%0.48SS*.Hα-helixtrans-69.9-38.9177.7-173.452.6-142.200112.1E158 V159 H164 S165 S166E158-E162 PolarHBondContact O-N 2.86Å; V159-E162 PolarHBondContact O-N 2.93Å; E162-H164 PolarHBondContact O-N 3.48Å; E162-S165 WeakPolarHBondContact O-CB 3.36Å; E162-S165 PolarHBondContact O-N 2.91Å; E162-S166 VanDerWaalsContact O-CB 3.3Å; E162-S166 WeakPolarHBondContact O-CB 3.22Å; E162-S166 PolarHBondContact O-N 3.46Å
163Q97.7Very high97.9Very high128 Ų12894 Ų9460%0.59848%0.479SS*.Hα-helixtrans-60.3-45171.9-76176.317.200111.8V159 Q160 S166 H167V159-Q163 HydrophobicContact CG1-CG 4.4Å; V159-Q163 VanDerWaalsContact CG1-NE2 3.3Å; V159-Q163 WeakPolarHBondContact O-CB 3.28Å; V159-Q163 WeakPolarHBondContact O-CG 3.13Å; V159-Q163 PolarHBondContact O-N 3.34Å; Q160-Q163 PolarHBondContact O-N 2.87Å; Q163-S166 PolarHBondContact O-N 2.86Å; Q163-H167 WeakPolarHBondContact O-CB 3.4Å; Q163-H167 PolarHBondContact O-N 3.24Å
164H97.8Very high98Very high129 Ų12996.3 Ų96.360%0.59749%0.486SS*.Hα-helixtrans-66.5-41.1177.1-174.2-95000111.6Q160 M161 E162 H167 N168Q160-H164 WeakPolarHBondContact O-CB 3.47Å; Q160-H164 PolarHBondContact O-N 2.93Å; M161-H164 PolarHBondContact O-N 3.43Å; E162-H164 PolarHBondContact O-N 3.48Å; H164-H167 PolarHBondContact O-N 3.42Å; H164-N168 WeakPolarHBondContact O-CB 3.49Å; H164-N168 PolarHBondContact O-N 3.45Å
165S97.8Very high98Very high62 Ų6296.4 Ų96.443%0.43449%0.487SS..Hα-helixtrans-56.5-52.6172.5-176.90000111.4M161 E162 H167 N168 A169M161-S165 VanDerWaalsContact O-CB 3.29Å; M161-S165 WeakPolarHBondContact O-CB 3.36Å; M161-S165 PolarHBondContact O-N 2.73Å; E162-S165 WeakPolarHBondContact O-CB 3.36Å; E162-S165 PolarHBondContact O-N 2.91Å; S165-H167 PolarHBondContact O-N 2.88Å; S165-N168 PolarHBondContact O-N 3.03Å; S165-A169 WeakPolarHBondContact O-CB 3.43Å; S165-A169 PolarHBondContact O-N 3.31Å
166S98Very high98Very high46 Ų46101.4 Ų101.432%0.32251%0.506SS..Hα-helixtrans-60.6-43.1178.3-171.30000112.7E162 Q163 A169 K170E162-S166 VanDerWaalsContact O-CB 3.3Å; E162-S166 WeakPolarHBondContact O-CB 3.22Å; E162-S166 PolarHBondContact O-N 3.46Å; Q163-S166 PolarHBondContact O-N 2.86Å; S166-A169 PolarHBondContact O-N 3.45Å; S166-K170 WeakPolarHBondContact O-CG 3.42Å; S166-K170 PolarHBondContact O-N 3.34Å
167H98.1Very high98Very high105 Ų105100.8 Ų100.849%0.48650%0.5SS..Hα-helixtrans-65.6-43175.5-179.750.9000111.9Q163 H164 S165 A169 K170 L171Q163-H167 WeakPolarHBondContact O-CB 3.4Å; Q163-H167 PolarHBondContact O-N 3.24Å; H164-H167 PolarHBondContact O-N 3.42Å; S165-H167 PolarHBondContact O-N 2.88Å; H167-A169 VanDerWaalsContact C-N 3.3Å; H167-A169 PolarHBondContact O-N 2.83Å; H167-K170 PolarHBondContact O-N 2.77Å; H167-L171 WeakPolarHBondContact O-CG 3.42Å; H167-L171 PolarHBondContact O-N 3.5Å
168N98.4Very high98.1Very high57 Ų57101.4 Ų101.431%0.30550%0.503SS..Hα-helixtrans-68.3-28.3178-164-109.4000112.3H164 S165 R172H164-N168 WeakPolarHBondContact O-CB 3.49Å; H164-N168 PolarHBondContact O-N 3.45Å; S165-N168 PolarHBondContact O-N 3.03Å; N168-R172 PolarHBondContact O-N 3.42Å; N168-R172 PolarHBondContact O-NH1 3.28Å; N168-R172 PolarHBondContact OD1-NH1 3.41Å; N168-R172 PolarHBondContact OD1-NH2 2.84Å
169A98.2Very high98.1Very high53 Ų5397.6 Ų97.644%0.43850%0.495SS..Hα-helixtrans-70.1-46.9169.500000112S165 S166 H167 L171 R172 Q173S165-A169 WeakPolarHBondContact O-CB 3.43Å; S165-A169 PolarHBondContact O-N 3.31Å; S166-A169 PolarHBondContact O-N 3.45Å; H167-A169 VanDerWaalsContact C-N 3.3Å; H167-A169 PolarHBondContact O-N 2.83Å; A169-L171 PolarHBondContact O-N 3.11Å; A169-R172 WeakPolarHBondContact O-CB 3.42Å; A169-R172 PolarHBondContact O-N 3.04Å; A169-R172 VanDerWaalsContact O-N 3.1Å; A169-Q173 PolarHBondContact O-N 3.1Å
170K98.4Very high98.1Very high114 Ų11497.6 Ų97.650%0.49649%0.492SS..Hα-helixtrans-57.4-46.8174.9-72166.1-175.1169.90111.8S166 H167 R172 Q173 E174S166-K170 WeakPolarHBondContact O-CG 3.42Å; S166-K170 PolarHBondContact O-N 3.34Å; H167-K170 PolarHBondContact O-N 2.77Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 3.47Å; K170-Q173 WeakPolarHBondContact O-CB 3.3Å; K170-Q173 PolarHBondContact O-N 3.45Å; K170-E174 WeakPolarHBondContact O-CG 3.45Å; K170-E174 PolarHBondContact O-N 2.96Å
171L98.4Very high98.2Very high63 Ų6397 Ų9733%0.3349%0.487SS..Hα-helixtrans-58.7-35.9175.3-73.6174.1000112.9H167 A169 N175H167-L171 WeakPolarHBondContact O-CG 3.42Å; H167-L171 PolarHBondContact O-N 3.5Å; A169-L171 PolarHBondContact O-N 3.11Å; L171-N175 WeakPolarHBondContact O-CB 3.49Å; L171-N175 PolarHBondContact O-N 3.05Å; L171-N175 VanDerWaalsContact O-N 3.07Å; L171-N175 PolarHBondContact O-ND2 3Å
172R98.3Very high98.3Very high161 Ų16195.9 Ų95.961%0.60848%0.484SS*.Hα-helixtrans-67.3-42.3172.7-75.7-171.7-16776.43.8112.1N168 A169 K170 N175 M176N168-R172 PolarHBondContact O-N 3.42Å; N168-R172 PolarHBondContact O-NH1 3.28Å; N168-R172 PolarHBondContact OD1-NH1 3.41Å; N168-R172 PolarHBondContact OD1-NH2 2.84Å; A169-R172 WeakPolarHBondContact O-CB 3.42Å; A169-R172 PolarHBondContact O-N 3.04Å; A169-R172 VanDerWaalsContact O-N 3.1Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 3.47Å; R172-N175 PolarHBondContact O-N 3.07Å; R172-M176 WeakPolarHBondContact O-CB 3.49Å; R172-M176 PolarHBondContact O-N 2.86Å
173Q98.4Very high98.3Very high109 Ų10995.8 Ų95.851%0.50948%0.482SS..Hα-helixtrans-62.6-47.7176.6-177.5-178.5-3100111.2A169 K170 N175 M176 E177A169-Q173 PolarHBondContact O-N 3.1Å; K170-Q173 WeakPolarHBondContact O-CB 3.3Å; K170-Q173 PolarHBondContact O-N 3.45Å; Q173-N175 VanDerWaalsContact C-N 3.34Å; Q173-N175 PolarHBondContact O-N 3.26Å; Q173-M176 WeakPolarHBondContact O-CB 3.34Å; Q173-M176 PolarHBondContact O-N 3.35Å; Q173-M176 VanDerWaalsContact O-N 3.11Å; Q173-E177 HydrophobicContact CG-CG 4.47Å; Q173-E177 PolarHBondContact NE2-OE1 3.48Å; Q173-E177 WeakPolarHBondContact O-CG 3.39Å; Q173-E177 PolarHBondContact O-N 2.93Å
174E98.3Very high98.4Very high100 Ų10094.6 Ų94.647%0.46747%0.474SS..Hα-helixtrans-58.9-43.9178.2-71.9167.2-155.400111.7K170 M176 E177 L178K170-E174 WeakPolarHBondContact O-CG 3.45Å; K170-E174 PolarHBondContact O-N 2.96Å; E174-M176 PolarHBondContact O-N 2.92Å; E174-E177 PolarHBondContact O-N 2.84Å; E174-L178 WeakPolarHBondContact O-CB 3.2Å; E174-L178 VanDerWaalsContact O-CG 3.24Å; E174-L178 WeakPolarHBondContact O-CG 3.24Å; E174-L178 PolarHBondContact O-N 2.9Å
175N98.5Very high98.4Very high104 Ų10492.3 Ų92.356%0.55647%0.466SS*.Hα-helixtrans-63.3-39.7174-83.8-76.3000112.6L171 R172 Q173 L178 A179L171-N175 WeakPolarHBondContact O-CB 3.49Å; L171-N175 PolarHBondContact O-N 3.05Å; L171-N175 VanDerWaalsContact O-N 3.07Å; L171-N175 PolarHBondContact O-ND2 3Å; R172-N175 PolarHBondContact O-N 3.07Å; Q173-N175 VanDerWaalsContact C-N 3.34Å; Q173-N175 PolarHBondContact O-N 3.26Å; N175-L178 PolarHBondContact O-N 3.36Å; N175-A179 WeakPolarHBondContact O-CB 3.5Å; N175-A179 PolarHBondContact O-N 3.41Å
176M98.3Very high98.4Very high129 Ų12993.9 Ų93.964%0.63547%0.469SS*.Hα-helixtrans-65.9-43.2176.6-171.2171.268.500111.4R172 Q173 E174 L178 A179 D180R172-M176 WeakPolarHBondContact O-CB 3.49Å; R172-M176 PolarHBondContact O-N 2.86Å; Q173-M176 WeakPolarHBondContact O-CB 3.34Å; Q173-M176 PolarHBondContact O-N 3.35Å; Q173-M176 VanDerWaalsContact O-N 3.11Å; E174-M176 PolarHBondContact O-N 2.92Å; M176-L178 VanDerWaalsContact C-N 3.33Å; M176-L178 PolarHBondContact O-N 3.46Å; M176-A179 PolarHBondContact O-N 3.39Å; M176-D180 WeakPolarHBondContact O-CB 2.91Å; M176-D180 PolarHBondContact O-N 2.95Å
177E98.4Very high98.5Very high76 Ų7695.3 Ų95.336%0.35547%0.47SS..Hα-helixtrans-64-36.2173.9-72.5-174.9-150.900112.9Q173 E174 D180 K181Q173-E177 HydrophobicContact CG-CG 4.47Å; Q173-E177 PolarHBondContact NE2-OE1 3.48Å; Q173-E177 WeakPolarHBondContact O-CG 3.39Å; Q173-E177 PolarHBondContact O-N 2.93Å; E174-E177 PolarHBondContact O-N 2.84Å; E177-D180 PolarHBondContact O-N 3.33Å; E177-K181 WeakPolarHBondContact O-CB 3.38Å; E177-K181 WeakPolarHBondContact O-CD 3.42Å; E177-K181 WeakPolarHBondContact O-CG 3.5Å; E177-K181 PolarHBondContact O-N 3.27Å; E177-K181 IonicContact OE2-NZ 3.96Å; E177-K181 PolarHBondContact OE2-NZ 2.88Å
178L98.6Very high98.5Very high96 Ų9695.3 Ų95.350%0.50347%0.47SS..Hα-helixtrans-67.7-41.4174.9-74.4168.3000111.6E174 N175 M176 D180 K181 L182E174-L178 WeakPolarHBondContact O-CB 3.2Å; E174-L178 VanDerWaalsContact O-CG 3.24Å; E174-L178 WeakPolarHBondContact O-CG 3.24Å; E174-L178 PolarHBondContact O-N 2.9Å; N175-L178 PolarHBondContact O-N 3.36Å; M176-L178 VanDerWaalsContact C-N 3.33Å; M176-L178 PolarHBondContact O-N 3.46Å; L178-D180 VanDerWaalsContact C-N 3.32Å; L178-D180 PolarHBondContact O-N 2.91Å; L178-K181 PolarHBondContact O-N 2.92Å; L178-L182 WeakPolarHBondContact O-CB 3.12Å; L178-L182 WeakPolarHBondContact O-CG 3.42Å; L178-L182 PolarHBondContact O-N 3.45Å
179A98.6Very high98.5Very high54 Ų5499.5 Ų99.545%0.44648%0.483SS..Hα-helixtrans-60.8-42172.400000111.6N175 M176 L182 K183N175-A179 WeakPolarHBondContact O-CB 3.5Å; N175-A179 PolarHBondContact O-N 3.41Å; M176-A179 PolarHBondContact O-N 3.39Å; A179-L182 PolarHBondContact O-N 2.84Å; A179-K183 WeakPolarHBondContact O-CB 3.48Å; A179-K183 PolarHBondContact O-N 2.76Å
180D98.6Very high98.5Very high77 Ų77102.1 Ų102.141%0.41249%0.486SS..Hα-helixtrans-64.1-38.7175.4-118.434.9000112.8M176 E177 L178 K184M176-D180 WeakPolarHBondContact O-CB 2.91Å; M176-D180 PolarHBondContact O-N 2.95Å; E177-D180 PolarHBondContact O-N 3.33Å; L178-D180 VanDerWaalsContact C-N 3.32Å; L178-D180 PolarHBondContact O-N 2.91Å; D180-K184 WeakPolarHBondContact O-CB 3.47Å; D180-K184 WeakPolarHBondContact O-CD 3.47Å; D180-K184 VanDerWaalsContact O-CG 3.27Å; D180-K184 WeakPolarHBondContact O-CG 3.4Å; D180-K184 PolarHBondContact O-N 3.18Å; D180-K184 VanDerWaalsContact O-N 3.07Å; D180-K184 IonicContact OD2-NZ 2.63Å; D180-K184 PolarHBondContact OD2-NZ 3Å
181K98.6Very high98.5Very high116 Ų116102.1 Ų102.150%0.50449%0.491SS..Hα-helixtrans-67.6-41.3175.5-71.6156.1-162.9163.10110.9E177 L178 L185E177-K181 WeakPolarHBondContact O-CB 3.38Å; E177-K181 WeakPolarHBondContact O-CD 3.42Å; E177-K181 WeakPolarHBondContact O-CG 3.5Å; E177-K181 PolarHBondContact O-N 3.27Å; E177-K181 IonicContact OE2-NZ 3.96Å; E177-K181 PolarHBondContact OE2-NZ 2.88Å; L178-K181 PolarHBondContact O-N 2.92Å; K181-L185 WeakPolarHBondContact O-CB 3.47Å; K181-L185 PolarHBondContact O-N 2.92Å; K181-L185 VanDerWaalsContact O-N 3.1Å
182L98.6Very high98.5Very high110 Ų110105.5 Ų105.558%0.57650%0.499SS*.Hα-helixtrans-65.3-44.5174.3-74.4168.4000112.1L178 A179 L185 I186L178-L182 WeakPolarHBondContact O-CB 3.12Å; L178-L182 WeakPolarHBondContact O-CG 3.42Å; L178-L182 PolarHBondContact O-N 3.45Å; A179-L182 PolarHBondContact O-N 2.84Å; L182-L185 WeakPolarHBondContact O-CB 3.42Å; L182-L185 PolarHBondContact O-N 3.12Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L182-I186 WeakPolarHBondContact O-CG1 3.27Å; L182-I186 PolarHBondContact O-N 3.1Å
183K98.6Very high98.5Very high123 Ų123104.5 Ų104.554%0.53550%0.501SS..Hα-helixtrans-58.7-49.6176.6179.1176.3168.5-179.90111.6A179 L185 I186 E187A179-K183 WeakPolarHBondContact O-CB 3.48Å; A179-K183 PolarHBondContact O-N 2.76Å; K183-L185 PolarHBondContact O-N 2.99Å; K183-I186 PolarHBondContact O-N 3.27Å; K183-I186 VanDerWaalsContact O-N 3.12Å; K183-E187 WeakPolarHBondContact CE-OE1 3.45Å; K183-E187 IonicContact NZ-OE1 3.29Å; K183-E187 WeakPolarHBondContact O-CG 3.44Å; K183-E187 PolarHBondContact O-N 2.82Å
184K98.6Very high98.5Very high103 Ų103104.1 Ų104.145%0.44850%0.5SS..Hα-helixtrans-62.3-28.4176.8-71.2162-168.8149.50112.8D180 Q188D180-K184 WeakPolarHBondContact O-CB 3.47Å; D180-K184 WeakPolarHBondContact O-CD 3.47Å; D180-K184 VanDerWaalsContact O-CG 3.27Å; D180-K184 WeakPolarHBondContact O-CG 3.4Å; D180-K184 PolarHBondContact O-N 3.18Å; D180-K184 VanDerWaalsContact O-N 3.07Å; D180-K184 IonicContact OD2-NZ 2.63Å; D180-K184 PolarHBondContact OD2-NZ 3Å; K184-Q188 WeakPolarHBondContact O-CB 3.5Å; K184-Q188 VanDerWaalsContact O-CG 3.29Å; K184-Q188 WeakPolarHBondContact O-CG 3.44Å; K184-Q188 PolarHBondContact O-N 3.04Å
185L98.6Very high98.5Very high80 Ų80105 Ų10542%0.41950%0.504SS..Hα-helixtrans-72-43173.9-174.862.8000111.4K181 L182 K183 Q188 Y189K181-L185 WeakPolarHBondContact O-CB 3.47Å; K181-L185 PolarHBondContact O-N 2.92Å; K181-L185 VanDerWaalsContact O-N 3.1Å; L182-L185 WeakPolarHBondContact O-CB 3.42Å; L182-L185 PolarHBondContact O-N 3.12Å; L182-L185 VanDerWaalsContact O-N 3.16Å; K183-L185 PolarHBondContact O-N 2.99Å; L185-Q188 PolarHBondContact O-N 3.16Å; L185-Y189 HydrophobicContact CD1-CD2 4.16Å; L185-Y189 HydrophobicContact CD1-CE2 3.73Å; L185-Y189 HydrophobicContact CD2-CE2 4.44Å; L185-Y189 HydrophobicContact CG-CD2 4.06Å; L185-Y189 HydrophobicContact CG-CE2 3.86Å; L185-Y189 VanDerWaalsContact O-CD2 3.25Å; L185-Y189 WeakPolarHBondContact O-CD2 3.29Å; L185-Y189 PolarHBondContact O-N 3.4Å
186I98.5Very high98.5Very high96 Ų96104.3 Ų104.349%0.49250%0.499SS..Hα-helixtrans-60.6-50.5175-66.5163.6000110.3L182 K183 Q188 Y189 E190L182-I186 WeakPolarHBondContact O-CG1 3.27Å; L182-I186 PolarHBondContact O-N 3.1Å; K183-I186 PolarHBondContact O-N 3.27Å; K183-I186 VanDerWaalsContact O-N 3.12Å; I186-Q188 PolarHBondContact O-N 2.84Å; I186-Y189 WeakPolarHBondContact O-CA 3.39Å; I186-Y189 PolarHBondContact O-N 2.97Å; I186-E190 HydrophobicContact CG2-CG 4.31Å; I186-E190 WeakPolarHBondContact O-CG 3.34Å; I186-E190 PolarHBondContact O-N 3.07Å
187E98.6Very high98.5Very high76 Ų76101.7 Ų101.736%0.35549%0.488SS..Hα-helixtrans-55.2-36.2176.3-68.3167.5167.300111.9K183 L191K183-E187 WeakPolarHBondContact CE-OE1 3.45Å; K183-E187 IonicContact NZ-OE1 3.29Å; K183-E187 WeakPolarHBondContact O-CG 3.44Å; K183-E187 PolarHBondContact O-N 2.82Å; E187-L191 WeakPolarHBondContact O-CB 3.38Å; E187-L191 WeakPolarHBondContact O-CD1 3.47Å; E187-L191 VanDerWaalsContact O-CG 3.25Å; E187-L191 WeakPolarHBondContact O-CG 3.46Å; E187-L191 PolarHBondContact O-N 2.89Å
188Q98.4Very high98.5Very high104 Ų104103.9 Ų103.949%0.48650%0.496SS..Hα-helixtrans-75.5-20.8174.6-78.9-177.334.600115K184 L185 I186 R192K184-Q188 WeakPolarHBondContact O-CB 3.5Å; K184-Q188 VanDerWaalsContact O-CG 3.29Å; K184-Q188 WeakPolarHBondContact O-CG 3.44Å; K184-Q188 PolarHBondContact O-N 3.04Å; L185-Q188 PolarHBondContact O-N 3.16Å; I186-Q188 PolarHBondContact O-N 2.84Å; Q188-R192 WeakPolarHBondContact O-CG 3.25Å; Q188-R192 PolarHBondContact O-N 3.26Å; Q188-R192 PolarHBondContact O-NH1 3.44Å
189Y98.6Very high98.5Very high146 Ų146102.5 Ų102.557%0.57349%0.491SS*.Hα-helixtrans-81.6-45171.2-86.3-71.9000110.6L185 I186 L191 R192 E193L185-Y189 HydrophobicContact CD1-CD2 4.16Å; L185-Y189 HydrophobicContact CD1-CE2 3.73Å; L185-Y189 HydrophobicContact CD2-CE2 4.44Å; L185-Y189 HydrophobicContact CG-CD2 4.06Å; L185-Y189 HydrophobicContact CG-CE2 3.86Å; L185-Y189 VanDerWaalsContact O-CD2 3.25Å; L185-Y189 WeakPolarHBondContact O-CD2 3.29Å; L185-Y189 PolarHBondContact O-N 3.4Å; I186-Y189 WeakPolarHBondContact O-CA 3.39Å; I186-Y189 PolarHBondContact O-N 2.97Å; Y189-L191 VanDerWaalsContact C-N 3.35Å; Y189-L191 PolarHBondContact O-N 3.07Å; Y189-R192 CarbonylContact O-C 3.59Å; Y189-R192 WeakPolarHBondContact O-CA 3.48Å; Y189-R192 WeakPolarHBondContact O-CB 3.38Å; Y189-R192 PolarHBondContact O-N 3.25Å; Y189-E193 WeakPolarHBondContact O-CB 3.47Å; Y189-E193 PolarHBondContact O-N 2.59Å
190E98.4Very high98.5Very high108 Ų108106.8 Ų106.851%0.50550%0.5SS..Hα-helixtrans-55.7-47.4174.4-67169.916100111.2I186 R192 E193 E194I186-E190 HydrophobicContact CG2-CG 4.31Å; I186-E190 WeakPolarHBondContact O-CG 3.34Å; I186-E190 PolarHBondContact O-N 3.07Å; E190-R192 VanDerWaalsContact C-N 3.32Å; E190-R192 PolarHBondContact O-N 3.38Å; E190-E193 PolarHBondContact O-N 3.07Å; E190-E194 WeakPolarHBondContact O-CB 3.49Å; E190-E194 PolarHBondContact O-N 3.2Å
191L98.6Very high98.5Very high114 Ų114108.8 Ų108.860%0.59751%0.505SS*.Hα-helixtrans-64.8-30.7175.5-73.7170.5000113.8E187 Y189 H195E187-L191 WeakPolarHBondContact O-CB 3.38Å; E187-L191 WeakPolarHBondContact O-CD1 3.47Å; E187-L191 VanDerWaalsContact O-CG 3.25Å; E187-L191 WeakPolarHBondContact O-CG 3.46Å; E187-L191 PolarHBondContact O-N 2.89Å; Y189-L191 VanDerWaalsContact C-N 3.35Å; Y189-L191 PolarHBondContact O-N 3.07Å; L191-H195 WeakPolarHBondContact O-CB 3.31Å; L191-H195 PolarHBondContact O-N 2.61Å
192R98.4Very high98.5Very high134 Ų134109 Ų10951%0.50651%0.508SS..Hα-helixtrans-72.9-42.4173.2-87.1-173-177.287.7-6.1111.5Q188 Y189 E190 H195 I196Q188-R192 WeakPolarHBondContact O-CG 3.25Å; Q188-R192 PolarHBondContact O-N 3.26Å; Q188-R192 PolarHBondContact O-NH1 3.44Å; Y189-R192 CarbonylContact O-C 3.59Å; Y189-R192 WeakPolarHBondContact O-CA 3.48Å; Y189-R192 WeakPolarHBondContact O-CB 3.38Å; Y189-R192 PolarHBondContact O-N 3.25Å; E190-R192 VanDerWaalsContact C-N 3.32Å; E190-R192 PolarHBondContact O-N 3.38Å; R192-H195 PolarHBondContact O-N 3.21Å; R192-I196 WeakPolarHBondContact O-CB 3.24Å; R192-I196 VanDerWaalsContact O-CG1 3.28Å; R192-I196 WeakPolarHBondContact O-CG1 3.39Å; R192-I196 PolarHBondContact O-N 3.04Å
193E98.4Very high98.5Very high139 Ų139109.1 Ų109.165%0.6550%0.504SS*.Hα-helixtrans-62.6-49.2178.2-171.3163.8-158.700109.9Y189 E190 H195 I196 D197Y189-E193 WeakPolarHBondContact O-CB 3.47Å; Y189-E193 PolarHBondContact O-N 2.59Å; E190-E193 PolarHBondContact O-N 3.07Å; E193-H195 VanDerWaalsContact C-N 3.27Å; E193-H195 PolarHBondContact O-N 3.47Å; E193-I196 PolarHBondContact O-N 3.46Å; E193-I196 VanDerWaalsContact O-N 3.15Å; E193-D197 VanDerWaalsContact O-CB 3.24Å; E193-D197 WeakPolarHBondContact O-CB 3.44Å; E193-D197 PolarHBondContact O-N 2.83Å
194E98.4Very high98.5Very high101 Ų101108.3 Ų108.347%0.47250%0.502SS..Hα-helixtrans-51.9-41.9170.3-91.2-160.3-145.300113.3E190 K198E190-E194 WeakPolarHBondContact O-CB 3.49Å; E190-E194 PolarHBondContact O-N 3.2Å; E194-K198 WeakPolarHBondContact O-CB 3.25Å; E194-K198 WeakPolarHBondContact O-CD 3.48Å; E194-K198 WeakPolarHBondContact O-CE 3.42Å; E194-K198 WeakPolarHBondContact O-CG 3.28Å; E194-K198 PolarHBondContact O-N 2.87Å; E194-K198 IonicContact OE2-NZ 3.2Å; E194-K198 PolarHBondContact OE2-NZ 3.2Å
195H98.4Very high98.5Very high119 Ų119108.7 Ų108.755%0.55151%0.508SS*.Hα-helixtrans-69.7-44.4178.9177.1-83.4000111.9L191 R192 E193 D197 K198 V199L191-H195 WeakPolarHBondContact O-CB 3.31Å; L191-H195 PolarHBondContact O-N 2.61Å; R192-H195 PolarHBondContact O-N 3.21Å; E193-H195 VanDerWaalsContact C-N 3.27Å; E193-H195 PolarHBondContact O-N 3.47Å; H195-D197 VanDerWaalsContact C-N 3.29Å; H195-D197 PolarHBondContact O-N 2.83Å; H195-K198 PolarHBondContact O-N 2.98Å; H195-V199 WeakPolarHBondContact O-CG2 3.45Å; H195-V199 PolarHBondContact O-N 3.32Å
196I98.6Very high98.5Very high90 Ų90108.7 Ų108.746%0.46251%0.506SS..Hα-helixtrans-58.7-44.4175.1-72.7163.9000109.9R192 E193 K198 V199 F200R192-I196 WeakPolarHBondContact O-CB 3.24Å; R192-I196 VanDerWaalsContact O-CG1 3.28Å; R192-I196 WeakPolarHBondContact O-CG1 3.39Å; R192-I196 PolarHBondContact O-N 3.04Å; E193-I196 PolarHBondContact O-N 3.46Å; E193-I196 VanDerWaalsContact O-N 3.15Å; I196-K198 PolarHBondContact O-N 3.23Å; I196-V199 CarbonylContact O-C 3.58Å; I196-V199 WeakPolarHBondContact O-CB 3.49Å; I196-V199 PolarHBondContact O-N 2.97Å; I196-V199 VanDerWaalsContact O-N 3.13Å; I196-F200 HydrophobicContact CG2-CD2 3.65Å; I196-F200 HydrophobicContact CG2-CE2 3.69Å; I196-F200 WeakPolarHBondContact O-CD2 3.15Å; I196-F200 PolarHBondContact O-N 3.45Å
197D98.6Very high98.5Very high74 Ų74108.9 Ų108.940%0.39651%0.505SS..Hα-helixtrans-64.5-38.9-180-159.347.4000112.2E193 H195 F200 K201E193-D197 VanDerWaalsContact O-CB 3.24Å; E193-D197 WeakPolarHBondContact O-CB 3.44Å; E193-D197 PolarHBondContact O-N 2.83Å; H195-D197 VanDerWaalsContact C-N 3.29Å; H195-D197 PolarHBondContact O-N 2.83Å; D197-F200 PolarHBondContact O-N 3.13Å; D197-K201 WeakPolarHBondContact O-CB 3.49Å; D197-K201 WeakPolarHBondContact O-CD 3.3Å; D197-K201 VanDerWaalsContact O-CG 3.31Å; D197-K201 WeakPolarHBondContact O-CG 3.42Å; D197-K201 PolarHBondContact O-N 3.15Å; D197-K201 IonicContact OD1-NZ 2.88Å; D197-K201 WeakPolarHBondContact OD2-CE 3.5Å; D197-K201 IonicContact OD2-NZ 2.74Å; D197-K201 PolarHBondContact OD2-NZ 3.21Å
198K98.6Very high98.5Very high121 Ų121109.8 Ų109.853%0.52651%0.509SS..Hα-helixtrans-65.4-38.7171.1-70158.2-161.6168.60112.2E194 H195 I196 H202E194-K198 WeakPolarHBondContact O-CB 3.25Å; E194-K198 WeakPolarHBondContact O-CD 3.48Å; E194-K198 WeakPolarHBondContact O-CE 3.42Å; E194-K198 WeakPolarHBondContact O-CG 3.28Å; E194-K198 PolarHBondContact O-N 2.87Å; E194-K198 IonicContact OE2-NZ 3.2Å; E194-K198 PolarHBondContact OE2-NZ 3.2Å; H195-K198 PolarHBondContact O-N 2.98Å; I196-K198 PolarHBondContact O-N 3.23Å; K198-H202 WeakPolarHBondContact O-CB 3.4Å; K198-H202 PolarHBondContact O-N 2.74Å
199V98.6Very high98.5Very high68 Ų68109.1 Ų109.141%0.41251%0.508SS..Hα-helixtrans-67.8-42.2175.1170.70000111.5H195 I196 H202 K203H195-V199 WeakPolarHBondContact O-CG2 3.45Å; H195-V199 PolarHBondContact O-N 3.32Å; I196-V199 CarbonylContact O-C 3.58Å; I196-V199 WeakPolarHBondContact O-CB 3.49Å; I196-V199 PolarHBondContact O-N 2.97Å; I196-V199 VanDerWaalsContact O-N 3.13Å; V199-H202 PolarHBondContact O-N 3.14Å; V199-K203 WeakPolarHBondContact O-CG 3.19Å; V199-K203 PolarHBondContact O-N 3.13Å
200F98.6Very high98.5Very high144 Ų144106.5 Ų106.563%0.63250%0.502SS*.Hα-helixtrans-60.3-49174-92.6-72.7000111.4I196 D197 H202 K203 E204I196-F200 HydrophobicContact CG2-CD2 3.65Å; I196-F200 HydrophobicContact CG2-CE2 3.69Å; I196-F200 WeakPolarHBondContact O-CD2 3.15Å; I196-F200 PolarHBondContact O-N 3.45Å; D197-F200 PolarHBondContact O-N 3.13Å; F200-H202 VanDerWaalsContact C-N 3.29Å; F200-H202 PolarHBondContact O-N 2.93Å; F200-K203 PolarHBondContact O-N 3.35Å; F200-E204 WeakPolarHBondContact O-CB 3.4Å; F200-E204 PolarHBondContact O-N 2.84Å
201K98.5Very high98.5Very high119 Ų119104.9 Ų104.952%0.51750%0.497SS..Hα-helixtrans-59.2-38.4176.7-73.5161.9-177.91660112.4D197 L205D197-K201 WeakPolarHBondContact O-CB 3.49Å; D197-K201 WeakPolarHBondContact O-CD 3.3Å; D197-K201 VanDerWaalsContact O-CG 3.31Å; D197-K201 WeakPolarHBondContact O-CG 3.42Å; D197-K201 PolarHBondContact O-N 3.15Å; D197-K201 IonicContact OD1-NZ 2.88Å; D197-K201 WeakPolarHBondContact OD2-CE 3.5Å; D197-K201 IonicContact OD2-NZ 2.74Å; D197-K201 PolarHBondContact OD2-NZ 3.21Å; K201-L205 WeakPolarHBondContact O-CB 3.41Å; K201-L205 VanDerWaalsContact O-CG 3.3Å; K201-L205 WeakPolarHBondContact O-CG 3.35Å; K201-L205 PolarHBondContact O-N 3.01Å; K201-L205 VanDerWaalsContact O-N 3.14Å
202H98.4Very high98.5Very high120 Ų120102.4 Ų102.456%0.55649%0.493SS*.Hα-helixtrans-66.5-39.7173.2179.166.4000112.8K198 V199 F200 Q206K198-H202 WeakPolarHBondContact O-CB 3.4Å; K198-H202 PolarHBondContact O-N 2.74Å; V199-H202 PolarHBondContact O-N 3.14Å; F200-H202 VanDerWaalsContact C-N 3.29Å; F200-H202 PolarHBondContact O-N 2.93Å; H202-Q206 WeakPolarHBondContact O-CB 3.46Å; H202-Q206 PolarHBondContact O-N 2.82Å
203K98.5Very high98.5Very high113 Ų113101.3 Ų101.349%0.49149%0.492SS..Hα-helixtrans-69.9-40178.3-75.5-73.5161.6-162.90112.9V199 F200 Q206 Q207V199-K203 WeakPolarHBondContact O-CG 3.19Å; V199-K203 PolarHBondContact O-N 3.13Å; F200-K203 PolarHBondContact O-N 3.35Å; K203-Q206 WeakPolarHBondContact O-CB 3.45Å; K203-Q206 PolarHBondContact O-N 2.97Å; K203-Q207 WeakPolarHBondContact O-CB 3.47Å; K203-Q207 PolarHBondContact O-N 2.94Å
204E98.6Very high98.5Very high105 Ų10599.8 Ų99.849%0.49149%0.488SS..Hα-helixtrans-60.2-49.7174.1-178.256.6-150.500111F200 Q206 Q207 Q208F200-E204 WeakPolarHBondContact O-CB 3.4Å; F200-E204 PolarHBondContact O-N 2.84Å; E204-Q206 VanDerWaalsContact C-N 3.29Å; E204-Q206 PolarHBondContact O-N 3.05Å; E204-Q207 WeakPolarHBondContact O-CB 3.32Å; E204-Q207 PolarHBondContact O-N 2.92Å; E204-Q207 VanDerWaalsContact O-N 3.13Å; E204-Q208 WeakPolarHBondContact O-CG 3.44Å; E204-Q208 PolarHBondContact O-N 3.33Å; E204-Q208 PolarHBondContact OE1-NE2 3.32Å
205L98.6Very high98.5Very high112 Ų112100.4 Ų100.459%0.58649%0.491SS*.Hα-helixtrans-63.3-33.2174.9-69.2170.7000112.8K201 L209K201-L205 WeakPolarHBondContact O-CB 3.41Å; K201-L205 VanDerWaalsContact O-CG 3.3Å; K201-L205 WeakPolarHBondContact O-CG 3.35Å; K201-L205 PolarHBondContact O-N 3.01Å; K201-L205 VanDerWaalsContact O-N 3.14Å; L205-L209 VanDerWaalsContact O-CB 3.28Å; L205-L209 WeakPolarHBondContact O-CB 3.44Å; L205-L209 PolarHBondContact O-N 2.91Å
206Q98.2Very high98.5Very high80 Ų80102.8 Ų102.837%0.37450%0.495SS..Hα-helixtrans-66.7-40.2173.5-175.1176.919.300111.6H202 K203 E204 M210H202-Q206 WeakPolarHBondContact O-CB 3.46Å; H202-Q206 PolarHBondContact O-N 2.82Å; K203-Q206 WeakPolarHBondContact O-CB 3.45Å; K203-Q206 PolarHBondContact O-N 2.97Å; E204-Q206 VanDerWaalsContact C-N 3.29Å; E204-Q206 PolarHBondContact O-N 3.05Å; Q206-M210 WeakPolarHBondContact O-CG 3.49Å; Q206-M210 PolarHBondContact O-N 2.77Å
207Q98.5Very high98.4Very high99 Ų99103.1 Ų103.146%0.46350%0.497SS..Hα-helixtrans-66.9-53.5178.4-17856.144.900110.9K203 E204 L209 M210 D211K203-Q207 WeakPolarHBondContact O-CB 3.47Å; K203-Q207 PolarHBondContact O-N 2.94Å; E204-Q207 WeakPolarHBondContact O-CB 3.32Å; E204-Q207 PolarHBondContact O-N 2.92Å; E204-Q207 VanDerWaalsContact O-N 3.13Å; Q207-L209 PolarHBondContact O-N 2.88Å; Q207-L209 VanDerWaalsContact O-N 3.15Å; Q207-M210 WeakPolarHBondContact O-CA 3.29Å; Q207-M210 PolarHBondContact O-N 3.49Å; Q207-D211 WeakPolarHBondContact CG-OD2 3.37Å; Q207-D211 PolarHBondContact NE2-OD1 3.17Å; Q207-D211 PolarHBondContact NE2-OD2 2.97Å; Q207-D211 PolarHBondContact O-N 3.15Å
208Q98.6Very high98.4Very high95 Ų95103.4 Ų103.444%0.44450%0.501SS..Hα-helixtrans-54-37.6176.7-68.2175.18.100112.7E204 M210 D211 A212E204-Q208 WeakPolarHBondContact O-CG 3.44Å; E204-Q208 PolarHBondContact O-N 3.33Å; E204-Q208 PolarHBondContact OE1-NE2 3.32Å; Q208-M210 VanDerWaalsContact C-N 3.35Å; Q208-D211 PolarHBondContact O-N 2.86Å; Q208-A212 VanDerWaalsContact O-CB 3.29Å; Q208-A212 WeakPolarHBondContact O-CB 3.28Å; Q208-A212 PolarHBondContact O-N 2.67Å
209L98.5Very high98.4Very high91 Ų91102.5 Ų102.548%0.47650%0.499SS..Hα-helixtrans-69.9-27.6176.1178.6146.6000113.4L205 Q207 K213L205-L209 VanDerWaalsContact O-CB 3.28Å; L205-L209 WeakPolarHBondContact O-CB 3.44Å; L205-L209 PolarHBondContact O-N 2.91Å; Q207-L209 PolarHBondContact O-N 2.88Å; Q207-L209 VanDerWaalsContact O-N 3.15Å; L209-K213 HydrophobicContact CD2-CD 4.18Å; L209-K213 WeakPolarHBondContact O-CD 3.32Å; L209-K213 VanDerWaalsContact O-CG 3.25Å; L209-K213 WeakPolarHBondContact O-CG 3.39Å; L209-K213 PolarHBondContact O-N 2.83Å
210M98Very high98.3Very high90 Ų90104.2 Ų104.244%0.44350%0.504SS..Hα-helixtrans-80.5-39.9172.6-66.3-57.2-178.500111.6Q206 Q207 Q208 K213 L214Q206-M210 WeakPolarHBondContact O-CG 3.49Å; Q206-M210 PolarHBondContact O-N 2.77Å; Q207-M210 WeakPolarHBondContact O-CA 3.29Å; Q207-M210 PolarHBondContact O-N 3.49Å; Q208-M210 VanDerWaalsContact C-N 3.35Å; M210-K213 WeakPolarHBondContact O-CB 3.45Å; M210-K213 PolarHBondContact O-N 3.48Å; M210-K213 HydrophobicContact SD-CD 4.14Å; M210-L214 WeakPolarHBondContact O-CB 3.36Å; M210-L214 PolarHBondContact O-N 3.32Å
211D98.6Very high98.3Very high75 Ų75102.3 Ų102.340%0.40150%0.498SS..Hα-helixtrans-64.2-43.1176.7-64.1-38.5000111.5Q207 Q208 K213 L214 Q215Q207-D211 WeakPolarHBondContact CG-OD2 3.37Å; Q207-D211 PolarHBondContact NE2-OD1 3.17Å; Q207-D211 PolarHBondContact NE2-OD2 2.97Å; Q207-D211 PolarHBondContact O-N 3.15Å; Q208-D211 PolarHBondContact O-N 2.86Å; D211-K213 VanDerWaalsContact C-N 3.28Å; D211-K213 PolarHBondContact O-N 3.28Å; D211-L214 PolarHBondContact O-N 3.22Å; D211-Q215 WeakPolarHBondContact O-CB 3.49Å; D211-Q215 PolarHBondContact O-N 3.17Å
212A98.4Very high98.2Very high61 Ų61102.2 Ų102.250%0.50450%0.497SS..Hα-helixtrans-63.4-31.5173.900000113.2Q208 R216Q208-A212 VanDerWaalsContact O-CB 3.29Å; Q208-A212 WeakPolarHBondContact O-CB 3.28Å; Q208-A212 PolarHBondContact O-N 2.67Å; A212-R216 WeakPolarHBondContact O-CB 3.35Å; A212-R216 PolarHBondContact O-N 2.89Å; A212-R216 VanDerWaalsContact O-N 3.17Å
213K98.4Very high98.2Very high112 Ų112101.4 Ų101.449%0.48749%0.494SS..Hα-helixtrans-71.7-42.9172.3-78.6171.8-179.8178.90111.8L209 M210 D211 R216 I217L209-K213 HydrophobicContact CD2-CD 4.18Å; L209-K213 WeakPolarHBondContact O-CD 3.32Å; L209-K213 VanDerWaalsContact O-CG 3.25Å; L209-K213 WeakPolarHBondContact O-CG 3.39Å; L209-K213 PolarHBondContact O-N 2.83Å; M210-K213 WeakPolarHBondContact O-CB 3.45Å; M210-K213 PolarHBondContact O-N 3.48Å; M210-K213 HydrophobicContact SD-CD 4.14Å; D211-K213 VanDerWaalsContact C-N 3.28Å; D211-K213 PolarHBondContact O-N 3.28Å; K213-R216 PolarHBondContact O-N 3.04Å; K213-I217 VanDerWaalsContact O-CG1 3.32Å; K213-I217 WeakPolarHBondContact O-CG1 3.46Å; K213-I217 PolarHBondContact O-N 3.16Å
214L98.6Very high98.2Very high107 Ų10799.4 Ų99.456%0.5649%0.491SS*.Hα-helixtrans-62.1-51.3177.8179.360.4000110.3M210 D211 R216 I217 T218M210-L214 WeakPolarHBondContact O-CB 3.36Å; M210-L214 PolarHBondContact O-N 3.32Å; D211-L214 PolarHBondContact O-N 3.22Å; L214-R216 VanDerWaalsContact C-N 3.34Å; L214-R216 PolarHBondContact O-N 3.19Å; L214-I217 PolarHBondContact O-N 3.36Å; L214-T218 PolarHBondContact O-N 3.44Å; L214-T218 PolarHBondContact O-OG1 3.34Å
215Q98.3Very high98.1Very high114 Ų11499.5 Ų99.553%0.53349%0.492SS..Hα-helixtrans-53.2-49.4175.5178.7176.8-9.500111.4D211 I217 T218 E219D211-Q215 WeakPolarHBondContact O-CB 3.49Å; D211-Q215 PolarHBondContact O-N 3.17Å; Q215-I217 VanDerWaalsContact C-N 3.3Å; Q215-I217 PolarHBondContact O-N 2.83Å; Q215-T218 PolarHBondContact O-N 3.05Å; Q215-T218 VanDerWaalsContact O-N 3.16Å; Q215-E219 HydrophobicContact CG-CG 4.31Å; Q215-E219 WeakPolarHBondContact CG-OE1 3.41Å; Q215-E219 PolarHBondContact NE2-OE1 3.15Å; Q215-E219 WeakPolarHBondContact O-CB 3.37Å; Q215-E219 WeakPolarHBondContact O-CG 3.25Å; Q215-E219 PolarHBondContact O-N 2.86Å
216R97.9Very high98.1Very high168 Ų16897.5 Ų97.563%0.63448%0.479SS*.Hα-helixtrans-59.2-38.2177.3179.5177.5174.2174.11.3112.9A212 K213 L214 M220A212-R216 WeakPolarHBondContact O-CB 3.35Å; A212-R216 PolarHBondContact O-N 2.89Å; A212-R216 VanDerWaalsContact O-N 3.17Å; K213-R216 PolarHBondContact O-N 3.04Å; L214-R216 VanDerWaalsContact C-N 3.34Å; L214-R216 PolarHBondContact O-N 3.19Å; R216-M220 HydrophobicContact CG-SD 4.29Å; R216-M220 WeakPolarHBondContact O-CB 3.44Å; R216-M220 VanDerWaalsContact O-CG 3.29Å; R216-M220 WeakPolarHBondContact O-CG 3.41Å; R216-M220 PolarHBondContact O-N 2.71Å
217I97.9Very high98Very high98 Ų9898.2 Ų98.250%0.50348%0.481SS..Hα-helixtrans-68-44.9176.2-69.4165000110.2K213 L214 Q215 E219 M220 M221K213-I217 VanDerWaalsContact O-CG1 3.32Å; K213-I217 WeakPolarHBondContact O-CG1 3.46Å; K213-I217 PolarHBondContact O-N 3.16Å; L214-I217 PolarHBondContact O-N 3.36Å; Q215-I217 VanDerWaalsContact C-N 3.3Å; Q215-I217 PolarHBondContact O-N 2.83Å; I217-E219 PolarHBondContact O-N 3.17Å; I217-M220 PolarHBondContact O-N 3.21Å; I217-M221 HydrophobicContact CG2-CG 4.49Å; I217-M221 HydrophobicContact CG2-SD 4.21Å; I217-M221 WeakPolarHBondContact O-CB 3.25Å; I217-M221 WeakPolarHBondContact O-CG 3.3Å; I217-M221 PolarHBondContact O-N 2.88Å
218T98.1Very high98Very high80 Ų8097.2 Ų97.249%0.49148%0.476SS..Hα-helixtrans-60.8-42.4176.3-57.60000112.2L214 Q215 M221 K222L214-T218 PolarHBondContact O-N 3.44Å; L214-T218 PolarHBondContact O-OG1 3.34Å; Q215-T218 PolarHBondContact O-N 3.05Å; Q215-T218 VanDerWaalsContact O-N 3.16Å; T218-M221 PolarHBondContact O-N 3.38Å; T218-K222 WeakPolarHBondContact O-CB 3.39Å; T218-K222 PolarHBondContact O-N 3.38Å
219E97.9Very high98Very high101 Ų10196.7 Ų96.747%0.47247%0.474SS..Hα-helixtrans-64.2-45.2175.4-73.1169.5174.300111.7Q215 I217 M221 K222 E223Q215-E219 HydrophobicContact CG-CG 4.31Å; Q215-E219 WeakPolarHBondContact CG-OE1 3.41Å; Q215-E219 PolarHBondContact NE2-OE1 3.15Å; Q215-E219 WeakPolarHBondContact O-CB 3.37Å; Q215-E219 WeakPolarHBondContact O-CG 3.25Å; Q215-E219 PolarHBondContact O-N 2.86Å; I217-E219 PolarHBondContact O-N 3.17Å; E219-M221 PolarHBondContact O-N 3.44Å; E219-K222 PolarHBondContact O-N 3.4Å; E219-E223 PolarHBondContact O-N 3.48Å
220M97.9Very high97.9Very high105 Ų10598.7 Ų98.752%0.51748%0.475SS..Hα-helixtrans-64.2-37.7175.5-75.5-1786300112.8R216 I217 V224R216-M220 HydrophobicContact CG-SD 4.29Å; R216-M220 WeakPolarHBondContact O-CB 3.44Å; R216-M220 VanDerWaalsContact O-CG 3.29Å; R216-M220 WeakPolarHBondContact O-CG 3.41Å; R216-M220 PolarHBondContact O-N 2.71Å; I217-M220 PolarHBondContact O-N 3.21Å; M220-V224 WeakPolarHBondContact O-CG2 3.15Å; M220-V224 PolarHBondContact O-N 3.01Å
221M97.4Very high97.9Very high104 Ų104100.1 Ų100.151%0.51248%0.481SS..Hα-helixtrans-63.6-49.5173.2-76.2-178.263.600111I217 T218 E219 E223 V224 E225I217-M221 HydrophobicContact CG2-CG 4.49Å; I217-M221 HydrophobicContact CG2-SD 4.21Å; I217-M221 WeakPolarHBondContact O-CB 3.25Å; I217-M221 WeakPolarHBondContact O-CG 3.3Å; I217-M221 PolarHBondContact O-N 2.88Å; T218-M221 PolarHBondContact O-N 3.38Å; E219-M221 PolarHBondContact O-N 3.44Å; M221-E223 VanDerWaalsContact C-N 3.33Å; M221-E223 PolarHBondContact O-N 3.41Å; M221-V224 PolarHBondContact O-N 3.32Å; M221-E225 WeakPolarHBondContact O-CG 3.29Å; M221-E225 PolarHBondContact O-N 3Å
222K97.8Very high97.9Very high117 Ų117102.7 Ų102.751%0.50949%0.485SS..Hα-helixtrans-59.1-42177.8-175.1174.4-175.9-80.60112.2T218 E219 V224 E225 E226T218-K222 WeakPolarHBondContact O-CB 3.39Å; T218-K222 PolarHBondContact O-N 3.38Å; E219-K222 PolarHBondContact O-N 3.4Å; K222-V224 VanDerWaalsContact C-N 3.31Å; K222-V224 PolarHBondContact O-N 2.88Å; K222-E225 PolarHBondContact O-N 3.33Å; K222-E226 HydrophobicContact CG-CG 4.42Å; K222-E226 IonicContact NZ-OE1 2.78Å; K222-E226 PolarHBondContact NZ-OE1 3.19Å; K222-E226 WeakPolarHBondContact O-CB 3.39Å; K222-E226 VanDerWaalsContact O-CG 3.3Å; K222-E226 WeakPolarHBondContact O-CG 2.79Å; K222-E226 PolarHBondContact O-N 2.93Å
223E97.8Very high97.8Very high102 Ų102104.9 Ų104.948%0.47749%0.485SS..Hα-helixtrans-57.2-42.6173.2-91.6-162.6-132.700112.7E219 M221 K227E219-E223 PolarHBondContact O-N 3.48Å; M221-E223 VanDerWaalsContact C-N 3.33Å; M221-E223 PolarHBondContact O-N 3.41Å; E223-K227 WeakPolarHBondContact O-CB 3.29Å; E223-K227 VanDerWaalsContact O-CD 3.29Å; E223-K227 WeakPolarHBondContact O-CD 3.38Å; E223-K227 WeakPolarHBondContact O-CG 3.36Å; E223-K227 PolarHBondContact O-N 2.86Å; E223-K227 IonicContact OE2-NZ 2.84Å; E223-K227 PolarHBondContact OE2-NZ 2.86Å
224V97.9Very high97.8Very high72 Ų72106.2 Ų106.244%0.43649%0.49SS..Hα-helixtrans-71.1-43.1179.2169.80000111.1M220 M221 K222 K227 Q228M220-V224 WeakPolarHBondContact O-CG2 3.15Å; M220-V224 PolarHBondContact O-N 3.01Å; M221-V224 PolarHBondContact O-N 3.32Å; K222-V224 VanDerWaalsContact C-N 3.31Å; K222-V224 PolarHBondContact O-N 2.88Å; V224-K227 PolarHBondContact O-N 3.28Å; V224-Q228 HydrophobicContact CG1-CG 4.44Å; V224-Q228 VanDerWaalsContact O-CG 3.31Å; V224-Q228 WeakPolarHBondContact O-CG 3.49Å; V224-Q228 PolarHBondContact O-N 3.46Å
225E96.8Very high97.8Very high107 Ų107106.4 Ų106.450%0.549%0.492SS..Hα-helixtrans-59.6-47.3175.2-72.6169.3179.200111.3M221 K222 K227 Q228 Q229M221-E225 WeakPolarHBondContact O-CG 3.29Å; M221-E225 PolarHBondContact O-N 3Å; K222-E225 PolarHBondContact O-N 3.33Å; E225-K227 PolarHBondContact O-N 2.62Å; E225-Q228 PolarHBondContact O-N 2.76Å; E225-Q229 VanDerWaalsContact O-CB 3.29Å; E225-Q229 WeakPolarHBondContact O-CB 3.48Å; E225-Q229 PolarHBondContact O-N 2.94Å
226E97.7Very high97.8Very high70 Ų70106.6 Ų106.633%0.32750%0.495SS..Hα-helixtrans-65.2-35.8175.6-69.6179.5-168.400112.6K222 Q229 R230K222-E226 HydrophobicContact CG-CG 4.42Å; K222-E226 IonicContact NZ-OE1 2.78Å; K222-E226 PolarHBondContact NZ-OE1 3.19Å; K222-E226 WeakPolarHBondContact O-CB 3.39Å; K222-E226 VanDerWaalsContact O-CG 3.3Å; K222-E226 WeakPolarHBondContact O-CG 2.79Å; K222-E226 PolarHBondContact O-N 2.93Å; E226-Q229 PolarHBondContact O-N 3.48Å; E226-R230 VanDerWaalsContact O-CG 3.25Å; E226-R230 WeakPolarHBondContact O-CG 3.29Å; E226-R230 PolarHBondContact O-N 3.24Å; E226-R230 PolarHBondContact O-NH1 3.46Å; E226-R230 IonicContact OE2-CZ 3.58Å; E226-R230 IonicContact OE2-NH1 2.76Å; E226-R230 IonicContact OE2-NH2 2.79Å; E226-R230 PolarHBondContact OE2-NH2 2.9Å
227K97.8Very high97.8Very high94 Ų94104.2 Ų104.241%0.40949%0.49SS..Hα-helixtrans-65.3-50.9175.4-77161.9-167.3162.70110.5E223 V224 E225 Q229 R230 E231E223-K227 WeakPolarHBondContact O-CB 3.29Å; E223-K227 VanDerWaalsContact O-CD 3.29Å; E223-K227 WeakPolarHBondContact O-CD 3.38Å; E223-K227 WeakPolarHBondContact O-CG 3.36Å; E223-K227 PolarHBondContact O-N 2.86Å; E223-K227 IonicContact OE2-NZ 2.84Å; E223-K227 PolarHBondContact OE2-NZ 2.86Å; V224-K227 PolarHBondContact O-N 3.28Å; E225-K227 PolarHBondContact O-N 2.62Å; K227-Q229 PolarHBondContact O-N 3.4Å; K227-R230 PolarHBondContact O-N 3.04Å; K227-E231 WeakPolarHBondContact O-CG 3.36Å; K227-E231 PolarHBondContact O-N 3.25Å
228Q97.8Very high97.8Very high78 Ų78103.9 Ų103.936%0.36449%0.489SS..Hα-helixtrans-59.1-35.6174.7-68.117714.300112.3V224 E225 E231 R232V224-Q228 HydrophobicContact CG1-CG 4.44Å; V224-Q228 VanDerWaalsContact O-CG 3.31Å; V224-Q228 WeakPolarHBondContact O-CG 3.49Å; V224-Q228 PolarHBondContact O-N 3.46Å; E225-Q228 PolarHBondContact O-N 2.76Å; Q228-E231 PolarHBondContact O-N 2.85Å; Q228-R232 WeakPolarHBondContact O-CB 3.36Å; Q228-R232 WeakPolarHBondContact O-CG 3.31Å; Q228-R232 PolarHBondContact O-N 3.05Å
229Q97.6Very high97.7Very high85 Ų85102.7 Ų102.740%0.39749%0.487SS..Hα-helixtrans-67.4-45.8177.9-175.15821.700111.8E225 E226 K227 E231 R232 E233E225-Q229 VanDerWaalsContact O-CB 3.29Å; E225-Q229 WeakPolarHBondContact O-CB 3.48Å; E225-Q229 PolarHBondContact O-N 2.94Å; E226-Q229 PolarHBondContact O-N 3.48Å; K227-Q229 PolarHBondContact O-N 3.4Å; Q229-E231 VanDerWaalsContact C-N 3.3Å; Q229-E231 PolarHBondContact O-N 2.92Å; Q229-R232 PolarHBondContact O-N 2.98Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.2Å; Q229-E233 PolarHBondContact NE2-OE1 3.39Å; Q229-E233 WeakPolarHBondContact O-CB 3.47Å; Q229-E233 WeakPolarHBondContact O-CG 3.33Å; Q229-E233 PolarHBondContact O-N 3.45Å
230R97.8Very high97.7Very high133 Ų13399.4 Ų99.450%0.50247%0.474SS..Hα-helixtrans-59.3-40.6173.1-67.3168.3-166.3110.8-0.4111.9E226 K227 E233 F234E226-R230 VanDerWaalsContact O-CG 3.25Å; E226-R230 WeakPolarHBondContact O-CG 3.29Å; E226-R230 PolarHBondContact O-N 3.24Å; E226-R230 PolarHBondContact O-NH1 3.46Å; E226-R230 IonicContact OE2-CZ 3.58Å; E226-R230 IonicContact OE2-NH1 2.76Å; E226-R230 IonicContact OE2-NH2 2.79Å; E226-R230 PolarHBondContact OE2-NH2 2.9Å; K227-R230 PolarHBondContact O-N 3.04Å; R230-E233 PolarHBondContact O-N 2.78Å; R230-F234 VanDerWaalsContact O-CB 3.32Å; R230-F234 WeakPolarHBondContact O-CB 3.42Å; R230-F234 PolarHBondContact O-N 3.29Å
231E97.3Very high97.7Very high119 Ų11999.2 Ų99.256%0.55647%0.472SS*.Hα-helixtrans-64.7-44.5176.5-72.5165.2-166.900112.1K227 Q228 Q229 F234 L235K227-E231 WeakPolarHBondContact O-CG 3.36Å; K227-E231 PolarHBondContact O-N 3.25Å; Q228-E231 PolarHBondContact O-N 2.85Å; Q229-E231 VanDerWaalsContact C-N 3.3Å; Q229-E231 PolarHBondContact O-N 2.92Å; E231-F234 PolarHBondContact O-N 3Å; E231-L235 WeakPolarHBondContact O-CB 3.39Å; E231-L235 WeakPolarHBondContact O-CG 3.32Å; E231-L235 PolarHBondContact O-N 3.36Å
232R98.1Very high97.7Very high130 Ų13097.3 Ų97.349%0.49147%0.469SS..Hα-helixtrans-60.5-45.5174.4-73.3167-170.3125.78.9111.8Q228 Q229 L236Q228-R232 WeakPolarHBondContact O-CB 3.36Å; Q228-R232 WeakPolarHBondContact O-CG 3.31Å; Q228-R232 PolarHBondContact O-N 3.05Å; Q229-R232 PolarHBondContact O-N 2.98Å; R232-L236 WeakPolarHBondContact O-CB 3.21Å; R232-L236 PolarHBondContact O-N 2.94Å
233E97.6Very high97.6Very high107 Ų10798.6 Ų98.650%0.547%0.471SS..Hα-helixtrans-64.5-41.5178.4-74169.2-169.900111.9Q229 R230 K237Q229-E233 WeakPolarHBondContact CG-OE1 3.2Å; Q229-E233 PolarHBondContact NE2-OE1 3.39Å; Q229-E233 WeakPolarHBondContact O-CB 3.47Å; Q229-E233 WeakPolarHBondContact O-CG 3.33Å; Q229-E233 PolarHBondContact O-N 3.45Å; R230-E233 PolarHBondContact O-N 2.78Å; E233-K237 WeakPolarHBondContact O-CB 3.46Å; E233-K237 PolarHBondContact O-N 2.94Å
234F97.9Very high97.6Very high139 Ų139101.5 Ų101.561%0.6148%0.477SS*.Hα-helixtrans-63.2-50175.4179.2-93.6000112.2R230 E231 L236 K237 D238R230-F234 VanDerWaalsContact O-CB 3.32Å; R230-F234 WeakPolarHBondContact O-CB 3.42Å; R230-F234 PolarHBondContact O-N 3.29Å; E231-F234 PolarHBondContact O-N 3Å; F234-L236 PolarHBondContact O-N 3.22Å; F234-K237 WeakPolarHBondContact O-CB 3.33Å; F234-K237 PolarHBondContact O-N 2.9Å; F234-D238 PolarHBondContact O-N 2.95Å
235L98.2Very high97.6Very high112 Ų112104.9 Ų104.959%0.58649%0.486SS*.Hα-helixtrans-65.3-38.1179.3-70.3171.8000112.2E231 A239E231-L235 WeakPolarHBondContact O-CB 3.39Å; E231-L235 WeakPolarHBondContact O-CG 3.32Å; E231-L235 PolarHBondContact O-N 3.36Å; L235-A239 VanDerWaalsContact O-CB 3.24Å; L235-A239 WeakPolarHBondContact O-CB 3.49Å; L235-A239 PolarHBondContact O-N 3.4Å
236L98.1Very high97.6Very high117 Ų117103 Ų10361%0.61348%0.484SS*.Hα-helixtrans-62.8-43.9173.4178.960.8000111R232 F234 T240R232-L236 WeakPolarHBondContact O-CB 3.21Å; R232-L236 PolarHBondContact O-N 2.94Å; F234-L236 PolarHBondContact O-N 3.22Å; L236-T240 HydrophobicContact CD1-CG2 4.36Å; L236-T240 VanDerWaalsContact O-CG2 3.29Å; L236-T240 WeakPolarHBondContact O-CG2 3.29Å; L236-T240 PolarHBondContact O-N 3.35Å; L236-T240 PolarHBondContact O-OG1 2.96Å
237K98Very high97.6Very high119 Ų119103.9 Ų103.952%0.51749%0.488SS..Hα-helixtrans-59.9-56.1176.8-178-178.1172.3-175.60111.1E233 F234 A239 T240 E241E233-K237 WeakPolarHBondContact O-CB 3.46Å; E233-K237 PolarHBondContact O-N 2.94Å; F234-K237 WeakPolarHBondContact O-CB 3.33Å; F234-K237 PolarHBondContact O-N 2.9Å; K237-A239 VanDerWaalsContact C-N 3.33Å; K237-A239 PolarHBondContact O-N 3.48Å; K237-T240 PolarHBondContact O-N 3.48Å; K237-T240 PolarHBondContact O-OG1 2.96Å; K237-E241 WeakPolarHBondContact CE-OE1 3.45Å; K237-E241 HydrophobicContact CG-CG 4.48Å; K237-E241 IonicContact NZ-OE1 2.76Å; K237-E241 PolarHBondContact O-N 2.95Å
238D97.8Very high97.6Very high91 Ų91103.7 Ų103.749%0.48749%0.491SS..Hα-helixtrans-56.1-45.5-179.9-178.670.2000111.8F234 T240 E241 S242F234-D238 PolarHBondContact O-N 2.95Å; D238-T240 VanDerWaalsContact C-N 3.31Å; D238-T240 PolarHBondContact O-N 3.29Å; D238-E241 PolarHBondContact O-N 3.32Å; D238-S242 WeakPolarHBondContact O-CB 3.23Å; D238-S242 PolarHBondContact O-N 3.08Å
239A97.3Very high97.6Very high54 Ų54105 Ų10545%0.44650%0.498SS..Hα-helixtrans-59.6-37.7175.200000113L235 K237 R243L235-A239 VanDerWaalsContact O-CB 3.24Å; L235-A239 WeakPolarHBondContact O-CB 3.49Å; L235-A239 PolarHBondContact O-N 3.4Å; K237-A239 VanDerWaalsContact C-N 3.33Å; K237-A239 PolarHBondContact O-N 3.48Å; A239-R243 VanDerWaalsContact O-CB 3.23Å; A239-R243 WeakPolarHBondContact O-CB 3.47Å; A239-R243 PolarHBondContact O-N 2.91Å
240T97.6Very high97.5Very high32 Ų32107.6 Ų107.620%0.19651%0.508CS..Hα-helixtrans-75.2-32176.7640000113.9L236 K237 D238 R244L236-T240 HydrophobicContact CD1-CG2 4.36Å; L236-T240 VanDerWaalsContact O-CG2 3.29Å; L236-T240 WeakPolarHBondContact O-CG2 3.29Å; L236-T240 PolarHBondContact O-N 3.35Å; L236-T240 PolarHBondContact O-OG1 2.96Å; K237-T240 PolarHBondContact O-N 3.48Å; K237-T240 PolarHBondContact O-OG1 2.96Å; D238-T240 VanDerWaalsContact C-N 3.31Å; D238-T240 PolarHBondContact O-N 3.29Å; T240-R244 WeakPolarHBondContact O-CG 3.22Å; T240-R244 PolarHBondContact O-N 3.48Å; T240-R244 VanDerWaalsContact O-N 3.08Å
241E97.6Very high97.5Very high102 Ų102106.8 Ų106.848%0.47751%0.51SS..Hα-helixtrans-74.7-43.6176.4-70.6-177.9177.600111K237 D238 R243 R244 K245K237-E241 WeakPolarHBondContact CE-OE1 3.45Å; K237-E241 HydrophobicContact CG-CG 4.48Å; K237-E241 IonicContact NZ-OE1 2.76Å; K237-E241 PolarHBondContact O-N 2.95Å; D238-E241 PolarHBondContact O-N 3.32Å; E241-R243 PolarHBondContact O-N 3.3Å; E241-R244 PolarHBondContact O-N 3.21Å; E241-K245 PolarHBondContact O-N 3Å
242S96.4Very high97.5Very high64 Ų64105.2 Ų105.245%0.44850%0.503SS..Hα-helixtrans-58.7-44.2171.1-176.30000111.8D238 K245 C246D238-S242 WeakPolarHBondContact O-CB 3.23Å; D238-S242 PolarHBondContact O-N 3.08Å; S242-K245 PolarHBondContact O-N 2.82Å; S242-C246 PolarHBondContact O-N 3.05Å; S242-C246 PolarHBondContact O-SG 3.31Å; S242-C246 VanDerWaalsContact O-SG 3.35Å
243R97.4Very high97.5Very high144 Ų144103.7 Ų103.754%0.54350%0.501SS..Hα-helixtrans-60.6-48.2174.5-173.9176.867.8-138.3-1.5112.2A239 E241 K245 C246 E247A239-R243 VanDerWaalsContact O-CB 3.23Å; A239-R243 WeakPolarHBondContact O-CB 3.47Å; A239-R243 PolarHBondContact O-N 2.91Å; E241-R243 PolarHBondContact O-N 3.3Å; R243-K245 VanDerWaalsContact C-N 3.29Å; R243-K245 PolarHBondContact O-N 2.99Å; R243-C246 WeakPolarHBondContact O-CB 3.37Å; R243-C246 PolarHBondContact O-N 3.35Å; R243-C246 VanDerWaalsContact O-N 3.1Å; R243-E247 WeakPolarHBondContact CD-OE1 3.47Å; R243-E247 HydrophobicContact CG-CG 4.41Å; R243-E247 VanDerWaalsContact CG-OE1 3.3Å; R243-E247 WeakPolarHBondContact CG-OE1 3.41Å; R243-E247 IonicContact NE-OE1 3.54Å; R243-E247 WeakPolarHBondContact O-CG 3.3Å; R243-E247 PolarHBondContact O-N 3.49Å
244R98Very high97.5Very high163 Ų163101.3 Ų101.362%0.61550%0.496SS*.Hα-helixtrans-58.3-39.3176-81.4-173176.3105.3-5.3112.9T240 E241 C246 E247 L248T240-R244 WeakPolarHBondContact O-CG 3.22Å; T240-R244 PolarHBondContact O-N 3.48Å; T240-R244 VanDerWaalsContact O-N 3.08Å; E241-R244 PolarHBondContact O-N 3.21Å; R244-C246 VanDerWaalsContact C-N 3.35Å; R244-E247 WeakPolarHBondContact CA-OE2 3.33Å; R244-E247 PolarHBondContact O-N 3.04Å; R244-L248 WeakPolarHBondContact O-CB 3.24Å; R244-L248 PolarHBondContact O-N 3.31Å
245K97.6Very high97.4Very high142 Ų142100.4 Ų100.462%0.61749%0.494SS*.Hα-helixtrans-64.6-39.7176-171177.7180-179.10111.8E241 S242 R243 M249E241-K245 PolarHBondContact O-N 3Å; S242-K245 PolarHBondContact O-N 2.82Å; R243-K245 VanDerWaalsContact C-N 3.29Å; R243-K245 PolarHBondContact O-N 2.99Å; K245-M249 WeakPolarHBondContact O-CB 3.42Å; K245-M249 VanDerWaalsContact O-CG 3.23Å; K245-M249 WeakPolarHBondContact O-CG 3.23Å; K245-M249 PolarHBondContact O-N 3.1Å
246C96.4Very high97.4Very high69 Ų69100 Ų10047%0.46649%0.492SS..Hα-helixtrans-68.3-35.7173.9-69.10000113S242 R243 R244 K250S242-C246 PolarHBondContact O-N 3.05Å; S242-C246 PolarHBondContact O-SG 3.31Å; S242-C246 VanDerWaalsContact O-SG 3.35Å; R243-C246 WeakPolarHBondContact O-CB 3.37Å; R243-C246 PolarHBondContact O-N 3.35Å; R243-C246 VanDerWaalsContact O-N 3.1Å; R244-C246 VanDerWaalsContact C-N 3.35Å; C246-K250 WeakPolarHBondContact O-CG 3.38Å; C246-K250 PolarHBondContact O-N 3.03Å; C246-K250 VanDerWaalsContact O-N 3.16Å
247E97.1Very high97.3Very high88 Ų88100.2 Ų100.241%0.41149%0.488SS..Hα-helixtrans-63.7-51.9174.2-71.9159.717100110.4R243 R244 M249 K250 E251R243-E247 WeakPolarHBondContact CD-OE1 3.47Å; R243-E247 HydrophobicContact CG-CG 4.41Å; R243-E247 VanDerWaalsContact CG-OE1 3.3Å; R243-E247 WeakPolarHBondContact CG-OE1 3.41Å; R243-E247 IonicContact NE-OE1 3.54Å; R243-E247 WeakPolarHBondContact O-CG 3.3Å; R243-E247 PolarHBondContact O-N 3.49Å; R244-E247 WeakPolarHBondContact CA-OE2 3.33Å; R244-E247 PolarHBondContact O-N 3.04Å; E247-M249 VanDerWaalsContact C-N 3.34Å; E247-M249 PolarHBondContact O-N 3.35Å; E247-K250 WeakPolarHBondContact O-CB 3.48Å; E247-K250 PolarHBondContact O-N 3.05Å; E247-K250 VanDerWaalsContact O-N 3.12Å; E247-E251 PolarHBondContact O-N 3.12Å
248L97.9Very high97.3Very high90 Ų90100.5 Ų100.547%0.47149%0.491SS..Hα-helixtrans-58.8-40.5176.5-179.564.6000113.1R244 K250 E251 Q252R244-L248 WeakPolarHBondContact O-CB 3.24Å; R244-L248 PolarHBondContact O-N 3.31Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.88Å; L248-E251 PolarHBondContact O-N 3.16Å; L248-Q252 WeakPolarHBondContact O-CG 3.3Å; L248-Q252 PolarHBondContact O-N 3.01Å
249M96.9Very high97.3Very high105 Ų105100.7 Ų100.752%0.51749%0.489SS..Hα-helixtrans-65-36.4176.9-75.7-74173.900112.3K245 E247 Q252 E253K245-M249 WeakPolarHBondContact O-CB 3.42Å; K245-M249 VanDerWaalsContact O-CG 3.23Å; K245-M249 WeakPolarHBondContact O-CG 3.23Å; K245-M249 PolarHBondContact O-N 3.1Å; E247-M249 VanDerWaalsContact C-N 3.34Å; E247-M249 PolarHBondContact O-N 3.35Å; M249-Q252 PolarHBondContact O-N 2.93Å; M249-E253 WeakPolarHBondContact O-CB 3.33Å; M249-E253 PolarHBondContact O-N 3.33Å
250K97.5Very high97.2Very high140 Ų140103.8 Ų103.861%0.60950%0.498SS*.Hα-helixtrans-68.8-36174.3-73.7171.6178.5-178.50112.4C246 E247 L248 E253 S254C246-K250 WeakPolarHBondContact O-CG 3.38Å; C246-K250 PolarHBondContact O-N 3.03Å; C246-K250 VanDerWaalsContact O-N 3.16Å; E247-K250 WeakPolarHBondContact O-CB 3.48Å; E247-K250 PolarHBondContact O-N 3.05Å; E247-K250 VanDerWaalsContact O-N 3.12Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.88Å; K250-E253 PolarHBondContact O-N 2.95Å; K250-S254 WeakPolarHBondContact O-CB 3.47Å; K250-S254 PolarHBondContact O-N 3.5Å
251E97.5Very high97.1Very high115 Ų115104.8 Ų104.854%0.53751%0.506SS..Hα-helixtrans-63.3-44.8173.4-69.8175.4175.100111.1E247 L248 S254 Q255E247-E251 PolarHBondContact O-N 3.12Å; L248-E251 PolarHBondContact O-N 3.16Å; E251-S254 WeakPolarHBondContact O-CB 3.38Å; E251-S254 PolarHBondContact O-N 3.33Å; E251-Q255 VanDerWaalsContact O-CG 3.3Å; E251-Q255 WeakPolarHBondContact O-CG 3.37Å; E251-Q255 PolarHBondContact O-N 3.47Å
252Q97.4Very high97.1Very high86 Ų86104 Ų10440%0.40250%0.504SS..Hα-helixtrans-63.8-43174.8-69.8176.3-0.300112.4L248 M249 S254 Q255 L256L248-Q252 WeakPolarHBondContact O-CG 3.3Å; L248-Q252 PolarHBondContact O-N 3.01Å; M249-Q252 PolarHBondContact O-N 2.93Å; Q252-S254 VanDerWaalsContact C-N 3.31Å; Q252-S254 PolarHBondContact O-N 2.95Å; Q252-Q255 PolarHBondContact O-N 2.89Å; Q252-L256 WeakPolarHBondContact O-CG 3.44Å; Q252-L256 PolarHBondContact O-N 3.01Å
253E96.6Very high97.1Very high98 Ų98107.3 Ų107.346%0.45851%0.508SS..Hα-helixtrans-59.4-41.9174.4-169.1-163.2151.100111.6M249 K250 L256 K257M249-E253 WeakPolarHBondContact O-CB 3.33Å; M249-E253 PolarHBondContact O-N 3.33Å; K250-E253 PolarHBondContact O-N 2.95Å; E253-L256 PolarHBondContact O-N 3.27Å; E253-K257 HydrophobicContact CG-CD 4.37Å; E253-K257 WeakPolarHBondContact O-CB 3.47Å; E253-K257 WeakPolarHBondContact O-CG 3.33Å; E253-K257 PolarHBondContact O-N 3.49Å; E253-K257 WeakPolarHBondContact OE1-CE 3.21Å; E253-K257 IonicContact OE1-NZ 3.91Å; E253-K257 PolarHBondContact OE1-NZ 3.06Å
254S97.3Very high97.1Very high57 Ų57105.3 Ų105.340%0.39951%0.506SS..Hα-helixtrans-64.6-45.6176.6-169.70000111.9K250 E251 Q252 L256 K257 Q258K250-S254 WeakPolarHBondContact O-CB 3.47Å; K250-S254 PolarHBondContact O-N 3.5Å; E251-S254 WeakPolarHBondContact O-CB 3.38Å; E251-S254 PolarHBondContact O-N 3.33Å; Q252-S254 VanDerWaalsContact C-N 3.31Å; Q252-S254 PolarHBondContact O-N 2.95Å; S254-L256 PolarHBondContact O-N 3.43Å; S254-K257 PolarHBondContact O-N 3.31Å; S254-Q258 WeakPolarHBondContact O-CG 3.45Å; S254-Q258 PolarHBondContact O-N 2.93Å
255Q97.6Very high97Very high120 Ų120101.1 Ų101.156%0.56150%0.496SS*.Hα-helixtrans-61.3-43.5176.3-71.5167.911.900112E251 Q252 Q258 Q259E251-Q255 VanDerWaalsContact O-CG 3.3Å; E251-Q255 WeakPolarHBondContact O-CG 3.37Å; E251-Q255 PolarHBondContact O-N 3.47Å; Q252-Q255 PolarHBondContact O-N 2.89Å; Q255-Q258 PolarHBondContact O-N 3.44Å; Q255-Q259 PolarHBondContact O-N 3.4Å
256L97.3Very high96.9Very high103 Ų10398.8 Ų98.854%0.53949%0.486SS..Hα-helixtrans-66.3-37.1176.5-71.1171.6000112.2Q252 E253 S254 Q259 L260Q252-L256 WeakPolarHBondContact O-CG 3.44Å; Q252-L256 PolarHBondContact O-N 3.01Å; E253-L256 PolarHBondContact O-N 3.27Å; S254-L256 PolarHBondContact O-N 3.43Å; L256-Q259 PolarHBondContact O-N 3.35Å; L256-L260 WeakPolarHBondContact O-CB 3.34Å; L256-L260 WeakPolarHBondContact O-CG 3.44Å; L256-L260 PolarHBondContact O-N 2.98Å
257K97.1Very high96.9Very high122 Ų122101.5 Ų101.553%0.5349%0.49SS..Hα-helixtrans-64.7-41.4172.9-78.5171170.4175.50112.5E253 S254 L260 S261E253-K257 HydrophobicContact CG-CD 4.37Å; E253-K257 WeakPolarHBondContact O-CB 3.47Å; E253-K257 WeakPolarHBondContact O-CG 3.33Å; E253-K257 PolarHBondContact O-N 3.49Å; E253-K257 WeakPolarHBondContact OE1-CE 3.21Å; E253-K257 IonicContact OE1-NZ 3.91Å; E253-K257 PolarHBondContact OE1-NZ 3.06Å; S254-K257 PolarHBondContact O-N 3.31Å; K257-L260 PolarHBondContact O-N 2.61Å; K257-S261 PolarHBondContact O-N 2.93Å
258Q97.3Very high96.7Very high126 Ų126103 Ų10359%0.58950%0.497SS*.Hα-helixtrans-62.4-42.2173.3-70.3169.69.700111.5S254 Q255 S261 L262S254-Q258 WeakPolarHBondContact O-CG 3.45Å; S254-Q258 PolarHBondContact O-N 2.93Å; Q255-Q258 PolarHBondContact O-N 3.44Å; Q258-S261 PolarHBondContact O-N 3.37Å; Q258-L262 WeakPolarHBondContact O-CB 3.34Å; Q258-L262 PolarHBondContact O-N 2.88Å
259Q96.5Very high96.6Very high94 Ų94104.7 Ų104.744%0.43950%0.502SS..Hα-helixtrans-65.4-39.9176.4-169.1-178.92100112.4Q255 L256 L262 Y263Q255-Q259 PolarHBondContact O-N 3.4Å; L256-Q259 PolarHBondContact O-N 3.35Å; Q259-L262 PolarHBondContact O-N 3.3Å; Q259-Y263 HydrophobicContact CG-CD2 3.93Å; Q259-Y263 HydrophobicContact CG-CE2 3.62Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.37Å; Q259-Y263 PolarHBondContact O-N 2.97Å
260L95.7Very high96.5Very high119 Ų119106.8 Ų106.862%0.62351%0.509SS*.Hα-helixtrans-63.9-42.9174.7-77.1168.2000111.9L256 K257 Y263 M264L256-L260 WeakPolarHBondContact O-CB 3.34Å; L256-L260 WeakPolarHBondContact O-CG 3.44Å; L256-L260 PolarHBondContact O-N 2.98Å; K257-L260 PolarHBondContact O-N 2.61Å; L260-Y263 PolarHBondContact O-N 3.45Å; L260-M264 WeakPolarHBondContact O-CB 3.08Å; L260-M264 PolarHBondContact O-N 2.99Å
261S96.6Very high96.3Very high54 Ų54104.6 Ų104.638%0.37850%0.501SS..Hα-helixtrans-57.3-52.3172.6-161.10000110.5K257 Q258 Y263 M264 D265K257-S261 PolarHBondContact O-N 2.93Å; Q258-S261 PolarHBondContact O-N 3.37Å; S261-Y263 PolarHBondContact O-N 3.4Å; S261-Y263 VanDerWaalsContact O-N 3.1Å; S261-M264 CarbonylContact O-C 3.6Å; S261-M264 WeakPolarHBondContact O-CA 3.27Å; S261-M264 VanDerWaalsContact O-CB 3.31Å; S261-M264 WeakPolarHBondContact O-CB 3.42Å; S261-M264 PolarHBondContact O-N 2.94Å; S261-D265 PolarHBondContact O-N 2.94Å
262L97.3Very high96.1Very high84 Ų84101.5 Ų101.544%0.4449%0.492SS..Hα-helixtrans-59.4-27.9-179.8-178.3150.4000113.8Q258 Q259 K266Q258-L262 WeakPolarHBondContact O-CB 3.34Å; Q258-L262 PolarHBondContact O-N 2.88Å; Q259-L262 PolarHBondContact O-N 3.3Å; L262-K266 HydrophobicContact CD2-CD 4.15Å; L262-K266 WeakPolarHBondContact O-CD 3.45Å; L262-K266 VanDerWaalsContact O-CG 3.27Å; L262-K266 WeakPolarHBondContact O-CG 3.31Å; L262-K266 PolarHBondContact O-N 2.91Å
263Y97Very high96Very high135 Ų135101.5 Ų101.553%0.52950%0.498SS..Hα-helixtrans-81.6-32171.2-76.7-55.7000113.6Q259 L260 S261 F267Q259-Y263 HydrophobicContact CG-CD2 3.93Å; Q259-Y263 HydrophobicContact CG-CE2 3.62Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.37Å; Q259-Y263 PolarHBondContact O-N 2.97Å; L260-Y263 PolarHBondContact O-N 3.45Å; S261-Y263 PolarHBondContact O-N 3.4Å; S261-Y263 VanDerWaalsContact O-N 3.1Å; Y263-F267 WeakPolarHBondContact O-CB 3.44Å; Y263-F267 PolarHBondContact O-N 2.74Å
264M96.2Very high95.8Very high101 Ų101101.3 Ų101.350%0.49850%0.5SS..Hα-helixtrans-64.9-50.7172.6-172.5-178.178.600110.4L260 S261 K266 F267 E268L260-M264 WeakPolarHBondContact O-CB 3.08Å; L260-M264 PolarHBondContact O-N 2.99Å; S261-M264 CarbonylContact O-C 3.6Å; S261-M264 WeakPolarHBondContact O-CA 3.27Å; S261-M264 VanDerWaalsContact O-CB 3.31Å; S261-M264 WeakPolarHBondContact O-CB 3.42Å; S261-M264 PolarHBondContact O-N 2.94Å; M264-K266 VanDerWaalsContact C-N 3.3Å; M264-K266 PolarHBondContact O-N 3.1Å; M264-F267 WeakPolarHBondContact O-CA 3.39Å; M264-F267 WeakPolarHBondContact O-CB 3.34Å; M264-F267 PolarHBondContact O-N 2.94Å; M264-E268 PolarHBondContact O-N 3.48Å
265D95.8Very high95.6Very high75 Ų75101.2 Ų101.240%0.40150%0.503SS..Hα-helixtrans-53.1-47.8176.7-50.1-25.7000110.5S261 F267 E268 E269S261-D265 PolarHBondContact O-N 2.94Å; D265-F267 PolarHBondContact O-N 2.82Å; D265-E268 PolarHBondContact O-N 2.89Å; D265-E269 WeakPolarHBondContact O-CG 3.41Å; D265-E269 PolarHBondContact O-N 3.44Å
266K96.3Very high95.4Very high93 Ų93101.2 Ų101.240%0.40450%0.501SS..Hα-helixtrans-64.7-34.9175.2-75.9175.9-178.9-178.50113.8L262 M264 E268 E269 F270L262-K266 HydrophobicContact CD2-CD 4.15Å; L262-K266 WeakPolarHBondContact O-CD 3.45Å; L262-K266 VanDerWaalsContact O-CG 3.27Å; L262-K266 WeakPolarHBondContact O-CG 3.31Å; L262-K266 PolarHBondContact O-N 2.91Å; M264-K266 VanDerWaalsContact C-N 3.3Å; M264-K266 PolarHBondContact O-N 3.1Å; K266-E268 VanDerWaalsContact C-N 3.34Å; K266-E269 PolarHBondContact O-N 3.26Å; K266-F270 WeakPolarHBondContact O-CD2 3.43Å; K266-F270 PolarHBondContact O-N 3.27Å
267F95.3Very high95.2Very high127 Ų12798.9 Ų98.956%0.55749%0.493SS*.Hα-helixtrans-69.3-36.1176.3-173.9-99.2000111Y263 M264 D265 F270 Q271Y263-F267 WeakPolarHBondContact O-CB 3.44Å; Y263-F267 PolarHBondContact O-N 2.74Å; M264-F267 WeakPolarHBondContact O-CA 3.39Å; M264-F267 WeakPolarHBondContact O-CB 3.34Å; M264-F267 PolarHBondContact O-N 2.94Å; D265-F267 PolarHBondContact O-N 2.82Å; F267-F270 PolarHBondContact O-N 2.86Å; F267-Q271 HydrophobicContact CD1-CG 4.02Å; F267-Q271 HydrophobicContact CE1-CG 3.67Å; F267-Q271 HydrophobicContact CZ-CG 3.99Å; F267-Q271 WeakPolarHBondContact O-CB 3.47Å; F267-Q271 VanDerWaalsContact O-CG 3.3Å; F267-Q271 WeakPolarHBondContact O-CG 3.27Å; F267-Q271 PolarHBondContact O-N 3.39Å
268E94.7Very high95Very high118 Ų11897.1 Ų97.155%0.55149%0.489SS*.Hα-helixtrans-67-40.4171.6-67.7-179.6-164.300111.9M264 D265 K266 F270 Q271 S272M264-E268 PolarHBondContact O-N 3.48Å; D265-E268 PolarHBondContact O-N 2.89Å; K266-E268 VanDerWaalsContact C-N 3.34Å; E268-F270 PolarHBondContact O-N 2.83Å; E268-Q271 PolarHBondContact O-N 2.82Å; E268-S272 VanDerWaalsContact O-CB 3.25Å; E268-S272 WeakPolarHBondContact O-CB 3.31Å; E268-S272 PolarHBondContact O-N 2.91Å
269E94.4Very high94.8Very high126 Ų12697.1 Ų97.159%0.58949%0.489SS*.Hα-helixtrans-57.6-47169.8-72.1178.7157.700111.9D265 K266 S272 T273D265-E269 WeakPolarHBondContact O-CG 3.41Å; D265-E269 PolarHBondContact O-N 3.44Å; K266-E269 PolarHBondContact O-N 3.26Å; E269-S272 PolarHBondContact O-N 3.45Å; E269-T273 WeakPolarHBondContact O-CB 3.24Å; E269-T273 PolarHBondContact O-N 3.38Å; E269-T273 PolarHBondContact O-OG1 3.31Å
270F94.7Very high94.7Very high149 Ų14996.1 Ų96.165%0.65449%0.489SS*.Hα-helixtrans-64.3-44177.1-81-58.5000112.2K266 F267 E268 T273 L274K266-F270 WeakPolarHBondContact O-CD2 3.43Å; K266-F270 PolarHBondContact O-N 3.27Å; F267-F270 PolarHBondContact O-N 2.86Å; E268-F270 PolarHBondContact O-N 2.83Å; F270-T273 PolarHBondContact O-N 2.85Å; F270-L274 VanDerWaalsContact O-CB 3.27Å; F270-L274 WeakPolarHBondContact O-CB 3.3Å; F270-L274 PolarHBondContact O-N 3.5Å
271Q93.4Very high94.5Very high94 Ų9496.9 Ų96.944%0.43949%0.488SS..Hα-helixtrans-65.1-42.1177-74.9-75.82800111.9F267 E268 T273 L274 A275F267-Q271 HydrophobicContact CD1-CG 4.02Å; F267-Q271 HydrophobicContact CE1-CG 3.67Å; F267-Q271 HydrophobicContact CZ-CG 3.99Å; F267-Q271 WeakPolarHBondContact O-CB 3.47Å; F267-Q271 VanDerWaalsContact O-CG 3.3Å; F267-Q271 WeakPolarHBondContact O-CG 3.27Å; F267-Q271 PolarHBondContact O-N 3.39Å; E268-Q271 PolarHBondContact O-N 2.82Å; Q271-T273 VanDerWaalsContact C-N 3.3Å; Q271-T273 PolarHBondContact O-N 3.42Å; Q271-L274 PolarHBondContact O-N 3.09Å; Q271-A275 VanDerWaalsContact O-CB 3.32Å; Q271-A275 WeakPolarHBondContact O-CB 3.45Å; Q271-A275 PolarHBondContact O-N 3.25Å
272S94.2Very high94.2Very high51 Ų5197.7 Ų97.736%0.35749%0.491SS..Hα-helixtrans-59.7-42.8174-169.40000111.3E268 E269 K276E268-S272 VanDerWaalsContact O-CB 3.25Å; E268-S272 WeakPolarHBondContact O-CB 3.31Å; E268-S272 PolarHBondContact O-N 2.91Å; E269-S272 PolarHBondContact O-N 3.45Å; S272-K276 VanDerWaalsContact O-CD 3.31Å; S272-K276 WeakPolarHBondContact O-CD 3.33Å; S272-K276 VanDerWaalsContact O-CG 3.24Å; S272-K276 WeakPolarHBondContact O-CG 3.15Å; S272-K276 PolarHBondContact O-N 2.91Å; S272-K276 VanDerWaalsContact O-N 3.09Å; S272-K276 PolarHBondContact OG-NZ 3.17Å
273T94Very high93.9Very high86 Ų8696.7 Ų96.753%0.52849%0.488SS..Hα-helixtrans-68.3-39.8178-56.40000112E269 F270 Q271 S277E269-T273 WeakPolarHBondContact O-CB 3.24Å; E269-T273 PolarHBondContact O-N 3.38Å; E269-T273 PolarHBondContact O-OG1 3.31Å; F270-T273 PolarHBondContact O-N 2.85Å; Q271-T273 VanDerWaalsContact C-N 3.3Å; Q271-T273 PolarHBondContact O-N 3.42Å; T273-S277 WeakPolarHBondContact O-CB 3.48Å; T273-S277 PolarHBondContact O-N 3.38Å
274L93.6Very high93.6Very high93 Ų9396.2 Ų96.249%0.48749%0.489SS..Hα-helixtrans-71.1-36.7178.2-174.3142.1000112F270 Q271 S277 N278F270-L274 VanDerWaalsContact O-CB 3.27Å; F270-L274 WeakPolarHBondContact O-CB 3.3Å; F270-L274 PolarHBondContact O-N 3.5Å; Q271-L274 PolarHBondContact O-N 3.09Å; L274-S277 PolarHBondContact O-N 2.91Å; L274-N278 WeakPolarHBondContact CD2-ND2 3.42Å; L274-N278 WeakPolarHBondContact O-CB 3.25Å; L274-N278 PolarHBondContact O-N 2.76Å; L274-N278 PolarHBondContact O-ND2 2.91Å
275A92.9Very high93.4Very high56 Ų5699.6 Ų99.646%0.46350%0.496SS..Hα-helixtrans-61.7-50.6171.600000111.5Q271 S277 N278 E279Q271-A275 VanDerWaalsContact O-CB 3.32Å; Q271-A275 WeakPolarHBondContact O-CB 3.45Å; Q271-A275 PolarHBondContact O-N 3.25Å; A275-S277 VanDerWaalsContact C-N 3.3Å; A275-S277 PolarHBondContact O-N 3.37Å; A275-N278 PolarHBondContact O-N 3.01Å; A275-N278 VanDerWaalsContact O-N 3.17Å; A275-E279 PolarHBondContact O-N 2.98Å
276K93.4Very high93.3Very high120 Ų120101 Ų10152%0.52250%0.5SS..Hα-helixtrans-57.7-40.7174.1-71160.9-177.8152.10112.1S272 E279 V280S272-K276 VanDerWaalsContact O-CD 3.31Å; S272-K276 WeakPolarHBondContact O-CD 3.33Å; S272-K276 VanDerWaalsContact O-CG 3.24Å; S272-K276 WeakPolarHBondContact O-CG 3.15Å; S272-K276 PolarHBondContact O-N 2.91Å; S272-K276 VanDerWaalsContact O-N 3.09Å; S272-K276 PolarHBondContact OG-NZ 3.17Å; K276-E279 PolarHBondContact O-N 3.45Å; K276-V280 WeakPolarHBondContact O-CG2 3.39Å; K276-V280 PolarHBondContact O-N 2.91Å
277S93Very high93Very high53 Ų53101.9 Ų101.937%0.37151%0.506SS..Hα-helixtrans-63.9-43.6176.1-170.30000112.1T273 L274 A275 E279 V280 F281T273-S277 WeakPolarHBondContact O-CB 3.48Å; T273-S277 PolarHBondContact O-N 3.38Å; L274-S277 PolarHBondContact O-N 2.91Å; A275-S277 VanDerWaalsContact C-N 3.3Å; A275-S277 PolarHBondContact O-N 3.37Å; S277-E279 VanDerWaalsContact C-N 3.34Å; S277-E279 PolarHBondContact O-N 2.83Å; S277-V280 PolarHBondContact O-N 3.34Å; S277-F281 WeakPolarHBondContact O-CD2 3.4Å; S277-F281 PolarHBondContact O-N 3.3Å
278N92.8Very high92.7Very high86 Ų86102 Ų10246%0.4651%0.51SS..Hα-helixtrans-63.4-37.2175-75-28000112.6L274 A275 F281 T282L274-N278 WeakPolarHBondContact CD2-ND2 3.42Å; L274-N278 WeakPolarHBondContact O-CB 3.25Å; L274-N278 PolarHBondContact O-N 2.76Å; L274-N278 PolarHBondContact O-ND2 2.91Å; A275-N278 PolarHBondContact O-N 3.01Å; A275-N278 VanDerWaalsContact O-N 3.17Å; N278-F281 PolarHBondContact O-N 3.41Å; N278-T282 WeakPolarHBondContact O-CG2 3.32Å; N278-T282 PolarHBondContact O-N 3.26Å; N278-T282 PolarHBondContact O-OG1 3.35Å
279E93.1Very high92.6Very high125 Ų125100.6 Ų100.658%0.58450%0.503SS*.Hα-helixtrans-64.7-40.7173.6-174.4177.1-162.500112.2A275 K276 S277 F281 T282 T283A275-E279 PolarHBondContact O-N 2.98Å; K276-E279 PolarHBondContact O-N 3.45Å; S277-E279 VanDerWaalsContact C-N 3.34Å; S277-E279 PolarHBondContact O-N 2.83Å; E279-F281 VanDerWaalsContact C-N 3.34Å; E279-T282 WeakPolarHBondContact CA-OG1 3.35Å; E279-T282 PolarHBondContact O-N 2.96Å; E279-T282 PolarHBondContact O-OG1 3Å; E279-T282 VanDerWaalsContact O-OG1 3.07Å; E279-T283 WeakPolarHBondContact O-CB 3.48Å; E279-T283 WeakPolarHBondContact O-CG2 3.41Å; E279-T283 PolarHBondContact O-N 3.01Å; E279-T283 PolarHBondContact O-OG1 3.07Å
280V93.9Very high92.5Very high73 Ų73100.8 Ų100.844%0.44250%0.502SS..Hα-helixtrans-63.4-38.7171170.50000111.3K276 S277 T283 F284K276-V280 WeakPolarHBondContact O-CG2 3.39Å; K276-V280 PolarHBondContact O-N 2.91Å; S277-V280 PolarHBondContact O-N 3.34Å; V280-T283 WeakPolarHBondContact CA-OG1 3.46Å; V280-T283 PolarHBondContact O-OG1 3.25Å; V280-F284 HydrophobicContact CG1-CD2 3.66Å; V280-F284 HydrophobicContact CG1-CE2 3.66Å; V280-F284 WeakPolarHBondContact O-CB 3.3Å; V280-F284 VanDerWaalsContact O-CD2 3.27Å; V280-F284 WeakPolarHBondContact O-CD2 3.28Å; V280-F284 PolarHBondContact O-N 2.96Å
281F91.1Very high92.3Very high136 Ų13699.5 Ų99.560%0.59650%0.5SS*.Hα-helixtrans-70.4-36.5175.3-78.5-61.7000114S277 N278 E279 R285S277-F281 WeakPolarHBondContact O-CD2 3.4Å; S277-F281 PolarHBondContact O-N 3.3Å; N278-F281 PolarHBondContact O-N 3.41Å; E279-F281 VanDerWaalsContact C-N 3.34Å; F281-R285 WeakPolarHBondContact O-CB 3.27Å; F281-R285 PolarHBondContact O-N 2.88Å
282T91.9Very high92.2Very high71 Ų7198 Ų9844%0.43650%0.497SS..Hα-helixtrans-72.5-39.6176.952.80000111.6N278 E279 R285 Q286N278-T282 WeakPolarHBondContact O-CG2 3.32Å; N278-T282 PolarHBondContact O-N 3.26Å; N278-T282 PolarHBondContact O-OG1 3.35Å; E279-T282 WeakPolarHBondContact CA-OG1 3.35Å; E279-T282 PolarHBondContact O-N 2.96Å; E279-T282 PolarHBondContact O-OG1 3Å; E279-T282 VanDerWaalsContact O-OG1 3.07Å; T282-R285 PolarHBondContact O-N 3.45Å; T282-Q286 WeakPolarHBondContact O-CG 3.4Å; T282-Q286 PolarHBondContact O-N 2.82Å
283T91.1Very high92.1Very high63 Ų63101.7 Ų101.739%0.38751%0.506SS..Hα-helixtrans-62.9-49.2172.948.30000111.6E279 V280 R285 Q286 E287E279-T283 WeakPolarHBondContact O-CB 3.48Å; E279-T283 WeakPolarHBondContact O-CG2 3.41Å; E279-T283 PolarHBondContact O-N 3.01Å; E279-T283 PolarHBondContact O-OG1 3.07Å; V280-T283 WeakPolarHBondContact CA-OG1 3.46Å; V280-T283 PolarHBondContact O-OG1 3.25Å; T283-R285 VanDerWaalsContact C-N 3.3Å; T283-R285 PolarHBondContact O-N 2.89Å; T283-Q286 WeakPolarHBondContact O-CB 3.49Å; T283-Q286 PolarHBondContact O-N 3.5Å; T283-Q286 VanDerWaalsContact O-N 3.1Å; T283-E287 PolarHBondContact O-N 2.71Å
284F90.8Very high91.9Very high125 Ų125104.6 Ų104.655%0.54851%0.512SS..Hα-helixtrans-58.3-37.5173.8-88-54.4000113.3V280 E287 M288V280-F284 HydrophobicContact CG1-CD2 3.66Å; V280-F284 HydrophobicContact CG1-CE2 3.66Å; V280-F284 WeakPolarHBondContact O-CB 3.3Å; V280-F284 VanDerWaalsContact O-CD2 3.27Å; V280-F284 WeakPolarHBondContact O-CD2 3.28Å; V280-F284 PolarHBondContact O-N 2.96Å; F284-E287 PolarHBondContact O-N 3.38Å; F284-M288 PolarHBondContact O-N 2.81Å
285R91.9Very high91.7Very high172 Ų172104.1 Ų104.165%0.64951%0.509SS*.Hα-helixtrans-63.3-46.1174-177.6-179.7-66.2171.40.9111.4F281 T282 T283 E287 M288 E289F281-R285 WeakPolarHBondContact O-CB 3.27Å; F281-R285 PolarHBondContact O-N 2.88Å; T282-R285 PolarHBondContact O-N 3.45Å; T283-R285 VanDerWaalsContact C-N 3.3Å; T283-R285 PolarHBondContact O-N 2.89Å; R285-E287 VanDerWaalsContact C-N 3.27Å; R285-E287 PolarHBondContact O-N 2.88Å; R285-M288 PolarHBondContact O-N 3.35Å; R285-E289 PolarHBondContact O-N 2.97Å
286Q92.3Very high91.5Very high103 Ų103107.6 Ų107.648%0.48151%0.514SS..Hα-helixtrans-61.1-37.1176.4-70175.32300111.8T282 T283 E289 K290T282-Q286 WeakPolarHBondContact O-CG 3.4Å; T282-Q286 PolarHBondContact O-N 2.82Å; T283-Q286 WeakPolarHBondContact O-CB 3.49Å; T283-Q286 PolarHBondContact O-N 3.5Å; T283-Q286 VanDerWaalsContact O-N 3.1Å; Q286-E289 PolarHBondContact O-N 3.29Å; Q286-K290 WeakPolarHBondContact O-CB 3.48Å; Q286-K290 WeakPolarHBondContact O-CD 3.48Å; Q286-K290 WeakPolarHBondContact O-CG 3.45Å; Q286-K290 PolarHBondContact O-N 3.18Å
287E89.8Confident91.3Very high113 Ų113108 Ų10853%0.52852%0.515SS..Hα-helixtrans-68.7-43.9174.6-69.4-165.8155.300112.8T283 F284 R285 E289 K290 M291T283-E287 PolarHBondContact O-N 2.71Å; F284-E287 PolarHBondContact O-N 3.38Å; R285-E287 VanDerWaalsContact C-N 3.27Å; R285-E287 PolarHBondContact O-N 2.88Å; E287-E289 VanDerWaalsContact C-N 3.28Å; E287-E289 PolarHBondContact O-N 3.34Å; E287-K290 PolarHBondContact O-N 3.29Å; E287-M291 VanDerWaalsContact O-CB 3.3Å; E287-M291 WeakPolarHBondContact O-CB 3.2Å; E287-M291 PolarHBondContact O-N 3.24Å
288M90.3Very high91Very high130 Ų130109.8 Ų109.864%0.6452%0.52SS*.Hα-helixtrans-59.8-38.1171.8-77.9-155.576.600112F284 R285 M291 T292F284-M288 PolarHBondContact O-N 2.81Å; R285-M288 PolarHBondContact O-N 3.35Å; M288-M291 PolarHBondContact O-N 2.91Å; M288-T292 VanDerWaalsContact O-CB 3.28Å; M288-T292 WeakPolarHBondContact O-CB 3.47Å; M288-T292 PolarHBondContact O-N 3.39Å; M288-T292 PolarHBondContact O-OG1 3.1Å
289E91.8Very high90.8Very high88 Ų88110.9 Ų110.941%0.41152%0.523SS..Hα-helixtrans-66.7-45.4174.1-79.7-173.7-141.100112.5R285 Q286 E287 M291 T292 K293R285-E289 PolarHBondContact O-N 2.97Å; Q286-E289 PolarHBondContact O-N 3.29Å; E287-E289 VanDerWaalsContact C-N 3.28Å; E287-E289 PolarHBondContact O-N 3.34Å; E289-M291 VanDerWaalsContact C-N 3.31Å; E289-M291 PolarHBondContact O-N 3.46Å; E289-T292 PolarHBondContact O-N 3.15Å; E289-K293 WeakPolarHBondContact O-CB 3.34Å; E289-K293 WeakPolarHBondContact O-CD 3.37Å; E289-K293 WeakPolarHBondContact O-CG 3.36Å; E289-K293 PolarHBondContact O-N 2.93Å; E289-K293 IonicContact OE2-NZ 2.67Å; E289-K293 PolarHBondContact OE2-NZ 3.07Å
290K92.3Very high90.6Very high129 Ų129112 Ų11256%0.56153%0.526SS*.Hα-helixtrans-58.4-44.4174.3-73.5163.9-175.51720110.5Q286 E287 K293 K294Q286-K290 WeakPolarHBondContact O-CB 3.48Å; Q286-K290 WeakPolarHBondContact O-CD 3.48Å; Q286-K290 WeakPolarHBondContact O-CG 3.45Å; Q286-K290 PolarHBondContact O-N 3.18Å; E287-K290 PolarHBondContact O-N 3.29Å; K290-K293 PolarHBondContact O-N 2.83Å; K290-K294 WeakPolarHBondContact O-CB 3.44Å; K290-K294 PolarHBondContact O-N 3.47Å
291M90.6Very high90.3Very high122 Ų122111.4 Ų111.460%0.60152%0.518SS*.Hα-helixtrans-64.1-44.8176.5-169.7-178.6-65.700111.7E287 M288 E289 K293 K294 I295E287-M291 VanDerWaalsContact O-CB 3.3Å; E287-M291 WeakPolarHBondContact O-CB 3.2Å; E287-M291 PolarHBondContact O-N 3.24Å; M288-M291 PolarHBondContact O-N 2.91Å; E289-M291 VanDerWaalsContact C-N 3.31Å; E289-M291 PolarHBondContact O-N 3.46Å; M291-K293 PolarHBondContact O-N 2.83Å; M291-K294 WeakPolarHBondContact O-CB 3.42Å; M291-K294 PolarHBondContact O-N 3.41Å; M291-K294 VanDerWaalsContact O-N 3.15Å; M291-I295 HydrophobicContact CG-CD1 4.2Å; M291-I295 WeakPolarHBondContact O-CG1 3.38Å; M291-I295 PolarHBondContact O-N 2.99Å
292T90.9Very high90.1Very high62 Ų62108.7 Ų108.738%0.3851%0.513SS..Hα-helixtrans-63.6-40176.5-58.20000111.9M288 E289 K294 I295 K296M288-T292 VanDerWaalsContact O-CB 3.28Å; M288-T292 WeakPolarHBondContact O-CB 3.47Å; M288-T292 PolarHBondContact O-N 3.39Å; M288-T292 PolarHBondContact O-OG1 3.1Å; E289-T292 PolarHBondContact O-N 3.15Å; T292-K294 VanDerWaalsContact C-N 3.34Å; T292-I295 PolarHBondContact O-N 2.85Å; T292-K296 HydrophobicContact CG2-CD 4.47Å; T292-K296 WeakPolarHBondContact O-CG 3.36Å; T292-K296 PolarHBondContact O-N 3.34Å
293K92.3Very high89.8Confident129 Ų129108.4 Ų108.456%0.56151%0.511SS*.Hα-helixtrans-63-40.4173-72.1159.6-174.9158.50110.8E289 K290 M291 K296 K297E289-K293 WeakPolarHBondContact O-CB 3.34Å; E289-K293 WeakPolarHBondContact O-CD 3.37Å; E289-K293 WeakPolarHBondContact O-CG 3.36Å; E289-K293 PolarHBondContact O-N 2.93Å; E289-K293 IonicContact OE2-NZ 2.67Å; E289-K293 PolarHBondContact OE2-NZ 3.07Å; K290-K293 PolarHBondContact O-N 2.83Å; M291-K293 PolarHBondContact O-N 2.83Å; K293-K296 PolarHBondContact O-N 3.31Å; K293-K297 PolarHBondContact O-N 3.47Å
294K90.7Very high89.7Confident147 Ų147111.3 Ų111.364%0.63952%0.52SS*.Hα-helixtrans-67.5-42.2176-167.3171.9-176.8176.40112.6K290 M291 T292 K297 L298K290-K294 WeakPolarHBondContact O-CB 3.44Å; K290-K294 PolarHBondContact O-N 3.47Å; M291-K294 WeakPolarHBondContact O-CB 3.42Å; M291-K294 PolarHBondContact O-N 3.41Å; M291-K294 VanDerWaalsContact O-N 3.15Å; T292-K294 VanDerWaalsContact C-N 3.34Å; K294-K297 WeakPolarHBondContact O-CB 3.28Å; K294-K297 PolarHBondContact O-N 2.9Å; K294-L298 HydrophobicContact CG-CD1 4.4Å; K294-L298 WeakPolarHBondContact O-CG 3.38Å; K294-L298 PolarHBondContact O-N 3.02Å
295I87.9Confident89.6Confident83 Ų83113.9 Ų113.943%0.42653%0.526SS..Hα-helixtrans-58.2-51.7172.6-69.8164.6000109.9M291 T292 K297 L298 E299M291-I295 HydrophobicContact CG-CD1 4.2Å; M291-I295 WeakPolarHBondContact O-CG1 3.38Å; M291-I295 PolarHBondContact O-N 2.99Å; T292-I295 PolarHBondContact O-N 2.85Å; I295-K297 PolarHBondContact O-N 2.99Å; I295-L298 CarbonylContact O-C 3.51Å; I295-L298 PolarHBondContact O-N 2.69Å; I295-L298 VanDerWaalsContact O-N 3.07Å; I295-E299 HydrophobicContact CG2-CG 4.2Å; I295-E299 WeakPolarHBondContact O-CG 3.41Å; I295-E299 PolarHBondContact O-N 2.84Å
296K90.3Very high89.3Confident129 Ų129111.8 Ų111.856%0.56152%0.518SS*.Hα-helixtrans-60.9-27177.9-73179.5178-176.70114.3T292 K293 E299 K300T292-K296 HydrophobicContact CG2-CD 4.47Å; T292-K296 WeakPolarHBondContact O-CG 3.36Å; T292-K296 PolarHBondContact O-N 3.34Å; K293-K296 PolarHBondContact O-N 3.31Å; K296-E299 WeakPolarHBondContact CA-OE2 3.5Å; K296-K300 WeakPolarHBondContact O-CG 3.21Å; K296-K300 PolarHBondContact O-N 3.06Å
297K89.6Confident89Confident128 Ų128110.9 Ų110.956%0.55752%0.52SS*.Hα-helixtrans-71.7-49.4172-168.4176.6-171.7-78.30110.8K293 K294 I295 E299 K300 E301K293-K297 PolarHBondContact O-N 3.47Å; K294-K297 WeakPolarHBondContact O-CB 3.28Å; K294-K297 PolarHBondContact O-N 2.9Å; I295-K297 PolarHBondContact O-N 2.99Å; K297-E299 VanDerWaalsContact C-N 3.32Å; K297-E299 PolarHBondContact O-N 3.19Å; K297-K300 PolarHBondContact O-N 3.4Å; K297-E301 WeakPolarHBondContact CG-OE1 3.23Å; K297-E301 IonicContact NZ-OE1 3.65Å; K297-E301 PolarHBondContact NZ-OE1 3.44Å; K297-E301 WeakPolarHBondContact O-CG 3.41Å; K297-E301 PolarHBondContact O-N 3.45Å
298L86.3Confident88.8Confident92 Ų92111.6 Ų111.648%0.48252%0.521SS..Hα-helixtrans-62-36.2176.7-67.9166.4000112.4K294 I295 E301 T302K294-L298 HydrophobicContact CG-CD1 4.4Å; K294-L298 WeakPolarHBondContact O-CG 3.38Å; K294-L298 PolarHBondContact O-N 3.02Å; I295-L298 CarbonylContact O-C 3.51Å; I295-L298 PolarHBondContact O-N 2.69Å; I295-L298 VanDerWaalsContact O-N 3.07Å; L298-E301 PolarHBondContact O-N 2.93Å; L298-T302 VanDerWaalsContact O-CB 3.28Å; L298-T302 WeakPolarHBondContact O-CB 3.32Å; L298-T302 PolarHBondContact O-N 2.96Å; L298-T302 PolarHBondContact O-OG1 3.32Å
299E87.4Confident88.7Confident109 Ų109113.3 Ų113.351%0.50952%0.521SS..Hα-helixtrans-62.7-44.8173.6-73.1173.315200111.8I295 K296 K297 T302 T303I295-E299 HydrophobicContact CG2-CG 4.2Å; I295-E299 WeakPolarHBondContact O-CG 3.41Å; I295-E299 PolarHBondContact O-N 2.84Å; K296-E299 WeakPolarHBondContact CA-OE2 3.5Å; K297-E299 VanDerWaalsContact C-N 3.32Å; K297-E299 PolarHBondContact O-N 3.19Å; E299-T302 PolarHBondContact O-N 3.3Å; E299-T303 PolarHBondContact O-N 2.9Å; E299-T303 PolarHBondContact O-OG1 3.23Å
300K89.2Confident88.5Confident148 Ų148113.3 Ų113.364%0.64352%0.521SS*.Hα-helixtrans-65.4-41.1175.2-77.8-177.7174.6-169.90112.5K296 K297 T302 T303 Q304K296-K300 WeakPolarHBondContact O-CG 3.21Å; K296-K300 PolarHBondContact O-N 3.06Å; K297-K300 PolarHBondContact O-N 3.4Å; K300-T302 VanDerWaalsContact C-N 3.32Å; K300-T303 PolarHBondContact O-N 3.35Å; K300-T303 PolarHBondContact O-OG1 3.44Å; K300-T303 VanDerWaalsContact O-OG1 3.09Å; K300-Q304 WeakPolarHBondContact O-CB 3.5Å; K300-Q304 WeakPolarHBondContact O-CG 3.46Å; K300-Q304 PolarHBondContact O-N 3Å
301E87.4Confident88.1Confident60 Ų60110.9 Ų110.928%0.2852%0.52SS..Hα-helixtrans-63.7-41.5175-72163.4177.600110.2K297 L298 Q304 W305K297-E301 WeakPolarHBondContact CG-OE1 3.23Å; K297-E301 IonicContact NZ-OE1 3.65Å; K297-E301 PolarHBondContact NZ-OE1 3.44Å; K297-E301 WeakPolarHBondContact O-CG 3.41Å; K297-E301 PolarHBondContact O-N 3.45Å; L298-E301 PolarHBondContact O-N 2.93Å; E301-Q304 PolarHBondContact O-N 3.49Å; E301-W305 WeakPolarHBondContact O-CB 3.42Å; E301-W305 PolarHBondContact O-N 3.47Å
302T87.5Confident87.9Confident80 Ų80110.3 Ų110.349%0.49152%0.519SS..Hα-helixtrans-63.6-41.5176.5-58.70000112.4L298 E299 K300 R306L298-T302 VanDerWaalsContact O-CB 3.28Å; L298-T302 WeakPolarHBondContact O-CB 3.32Å; L298-T302 PolarHBondContact O-N 2.96Å; L298-T302 PolarHBondContact O-OG1 3.32Å; E299-T302 PolarHBondContact O-N 3.3Å; K300-T302 VanDerWaalsContact C-N 3.32Å; T302-R306 WeakPolarHBondContact O-CB 3.29Å; T302-R306 PolarHBondContact O-N 3.03Å
303T86.3Confident87.7Confident64 Ų64110.4 Ų110.439%0.39352%0.518SS..Hα-helixtrans-71.1-38.9175.752.90000112.2E299 K300 W305 R306 T307E299-T303 PolarHBondContact O-N 2.9Å; E299-T303 PolarHBondContact O-OG1 3.23Å; K300-T303 PolarHBondContact O-N 3.35Å; K300-T303 PolarHBondContact O-OG1 3.44Å; K300-T303 VanDerWaalsContact O-OG1 3.09Å; T303-W305 PolarHBondContact O-N 3.48Å; T303-R306 WeakPolarHBondContact O-CB 3.44Å; T303-R306 PolarHBondContact O-N 3.5Å; T303-T307 PolarHBondContact O-N 2.63Å; T303-T307 PolarHBondContact O-OG1 3.37Å
304Q89.2Confident87.4Confident124 Ų124109.1 Ų109.158%0.57951%0.514SS*.Hα-helixtrans-59.8-45.4172.6-77-177.3-4.600112.3K300 E301 R306 T307 K308K300-Q304 WeakPolarHBondContact O-CB 3.5Å; K300-Q304 WeakPolarHBondContact O-CG 3.46Å; K300-Q304 PolarHBondContact O-N 3Å; E301-Q304 PolarHBondContact O-N 3.49Å; Q304-R306 VanDerWaalsContact C-N 3.33Å; Q304-R306 PolarHBondContact O-N 2.9Å; Q304-T307 PolarHBondContact O-N 2.8Å; Q304-K308 WeakPolarHBondContact O-CB 3.49Å; Q304-K308 WeakPolarHBondContact O-CG 3.45Å; Q304-K308 PolarHBondContact O-N 3.13Å
305W86.7Confident87Confident179 Ų179104.3 Ų104.368%0.67850%0.502SS*.Hα-helixtrans-62.8-39.1175.7-79.1119.6000112.3E301 T303 K308 W309E301-W305 WeakPolarHBondContact O-CB 3.42Å; E301-W305 PolarHBondContact O-N 3.47Å; T303-W305 PolarHBondContact O-N 3.48Å; W305-K308 HydrophobicContact CE3-CD 4.08Å; W305-K308 HydrophobicContact CZ3-CD 4.15Å; W305-K308 PolarHBondContact O-N 3.25Å; W305-W309 WeakPolarHBondContact O-CB 3.29Å; W305-W309 PolarHBondContact O-N 3.44Å
306R87.4Confident86.7Confident128 Ų128105.5 Ų105.548%0.48351%0.508SS..Hα-helixtrans-61.6-49.1174.2-163.8-167.3-56.9144.56.2111.8T302 T303 Q304 K308 W309 E310T302-R306 WeakPolarHBondContact O-CB 3.29Å; T302-R306 PolarHBondContact O-N 3.03Å; T303-R306 WeakPolarHBondContact O-CB 3.44Å; T303-R306 PolarHBondContact O-N 3.5Å; Q304-R306 VanDerWaalsContact C-N 3.33Å; Q304-R306 PolarHBondContact O-N 2.9Å; R306-K308 VanDerWaalsContact C-N 3.35Å; R306-K308 PolarHBondContact O-N 3.37Å; R306-W309 WeakPolarHBondContact O-CB 3.47Å; R306-W309 PolarHBondContact O-N 3.2Å; R306-W309 VanDerWaalsContact O-N 3.13Å; R306-E310 VanDerWaalsContact CD-OE1 3.23Å; R306-E310 WeakPolarHBondContact CD-OE1 3.42Å; R306-E310 HydrophobicContact CG-CG 4.36Å; R306-E310 WeakPolarHBondContact CG-OE1 3.4Å; R306-E310 WeakPolarHBondContact O-CB 3.36Å; R306-E310 VanDerWaalsContact O-CG 3.29Å; R306-E310 WeakPolarHBondContact O-CG 3.45Å; R306-E310 PolarHBondContact O-N 2.99Å
307T85.2Confident86.3Confident84 Ų84103.2 Ų103.252%0.51550%0.502SS..Hα-helixtrans-67.1-33.7179.9-570000112.7T303 Q304 E310 S311T303-T307 PolarHBondContact O-N 2.63Å; T303-T307 PolarHBondContact O-OG1 3.37Å; Q304-T307 PolarHBondContact O-N 2.8Å; T307-E310 WeakPolarHBondContact CA-OE2 3.48Å; T307-S311 VanDerWaalsContact O-CB 3.24Å; T307-S311 WeakPolarHBondContact O-CB 3.49Å; T307-S311 PolarHBondContact O-N 3.38Å
308K86.6Confident85.9Confident128 Ų128102.2 Ų102.256%0.55750%0.499SS*.Hα-helixtrans-61.7-44.2169.6-76.4-179.6177.4-174.60111.7Q304 W305 R306 N312Q304-K308 WeakPolarHBondContact O-CB 3.49Å; Q304-K308 WeakPolarHBondContact O-CG 3.45Å; Q304-K308 PolarHBondContact O-N 3.13Å; W305-K308 HydrophobicContact CE3-CD 4.08Å; W305-K308 HydrophobicContact CZ3-CD 4.15Å; W305-K308 PolarHBondContact O-N 3.25Å; R306-K308 VanDerWaalsContact C-N 3.35Å; R306-K308 PolarHBondContact O-N 3.37Å; K308-N312 WeakPolarHBondContact O-CB 3.38Å; K308-N312 PolarHBondContact O-N 2.92Å
309W87.7Confident85.5Confident166 Ų166104.6 Ų104.663%0.62951%0.509SS*.Hα-helixtrans-67.2-45177.4178.284.5000112.4W305 R306 S311 N312 N313W305-W309 WeakPolarHBondContact O-CB 3.29Å; W305-W309 PolarHBondContact O-N 3.44Å; R306-W309 WeakPolarHBondContact O-CB 3.47Å; R306-W309 PolarHBondContact O-N 3.2Å; R306-W309 VanDerWaalsContact O-N 3.13Å; W309-S311 VanDerWaalsContact C-N 3.34Å; W309-S311 PolarHBondContact O-N 2.93Å; W309-N312 PolarHBondContact O-N 2.96Å; W309-N313 VanDerWaalsContact O-CB 3.29Å; W309-N313 WeakPolarHBondContact O-CB 3.43Å; W309-N313 PolarHBondContact O-N 3.09Å
310E86.5Confident84.9Confident88 Ų88101.8 Ų101.841%0.41151%0.505SS..Hα-helixtrans-57.2-46.4174.9-72.9162.4172.100111R306 T307 N313 Q314R306-E310 VanDerWaalsContact CD-OE1 3.23Å; R306-E310 WeakPolarHBondContact CD-OE1 3.42Å; R306-E310 HydrophobicContact CG-CG 4.36Å; R306-E310 WeakPolarHBondContact CG-OE1 3.4Å; R306-E310 WeakPolarHBondContact O-CB 3.36Å; R306-E310 VanDerWaalsContact O-CG 3.29Å; R306-E310 WeakPolarHBondContact O-CG 3.45Å; R306-E310 PolarHBondContact O-N 2.99Å; T307-E310 WeakPolarHBondContact CA-OE2 3.48Å; E310-N313 PolarHBondContact O-N 3.05Å; E310-Q314 WeakPolarHBondContact O-CB 3.45Å; E310-Q314 PolarHBondContact O-N 3.2Å
311S84.9Confident84.4Confident79 Ų79100.8 Ų100.855%0.55250%0.503SS*.Hα-helixtrans-64.1-45.9177.6-177.10000112.8T307 W309 N313 Q314 A315T307-S311 VanDerWaalsContact O-CB 3.24Å; T307-S311 WeakPolarHBondContact O-CB 3.49Å; T307-S311 PolarHBondContact O-N 3.38Å; W309-S311 VanDerWaalsContact C-N 3.34Å; W309-S311 PolarHBondContact O-N 2.93Å; S311-N313 VanDerWaalsContact C-N 3.35Å; S311-N313 PolarHBondContact O-N 3.46Å; S311-Q314 WeakPolarHBondContact O-CB 3.37Å; S311-Q314 PolarHBondContact O-N 3.37Å; S311-A315 PolarHBondContact O-N 3.39Å
312N85.6Confident84Confident109 Ų109104.7 Ų104.758%0.58352%0.521SS*.Hα-helixtrans-63-41.5176.8-178.3-105.3000111.9K308 W309 Q314 A315 L316K308-N312 WeakPolarHBondContact O-CB 3.38Å; K308-N312 PolarHBondContact O-N 2.92Å; W309-N312 PolarHBondContact O-N 2.96Å; N312-Q314 VanDerWaalsContact C-N 3.34Å; N312-A315 PolarHBondContact O-N 3.01Å; N312-L316 WeakPolarHBondContact O-CB 3.38Å; N312-L316 PolarHBondContact O-N 2.93Å
313N86.6Confident83.7Confident65 Ų65107.4 Ų107.435%0.34853%0.526SS..Hα-helixtrans-66.6-34.7175.3-171.673.7000112.2W309 E310 S311 L316 L317W309-N313 VanDerWaalsContact O-CB 3.29Å; W309-N313 WeakPolarHBondContact O-CB 3.43Å; W309-N313 PolarHBondContact O-N 3.09Å; E310-N313 PolarHBondContact O-N 3.05Å; S311-N313 VanDerWaalsContact C-N 3.35Å; S311-N313 PolarHBondContact O-N 3.46Å; N313-L316 PolarHBondContact O-N 2.98Å; N313-L317 WeakPolarHBondContact O-CG 3.48Å; N313-L317 PolarHBondContact O-N 3.21Å
314Q86.7Confident83.4Confident101 Ų101109 Ų10947%0.47254%0.535SS..Hα-helixtrans-66.2-41.7174.2-173.763.255.800112.3E310 S311 N312 L316 L317 Q318E310-Q314 WeakPolarHBondContact O-CB 3.45Å; E310-Q314 PolarHBondContact O-N 3.2Å; S311-Q314 WeakPolarHBondContact O-CB 3.37Å; S311-Q314 PolarHBondContact O-N 3.37Å; N312-Q314 VanDerWaalsContact C-N 3.34Å; Q314-L316 VanDerWaalsContact C-N 3.34Å; Q314-L317 PolarHBondContact O-N 2.88Å; Q314-Q318 WeakPolarHBondContact O-CG 3.48Å; Q314-Q318 PolarHBondContact O-N 2.95Å
315A82.1Confident82.9Confident47 Ų47108.3 Ų108.339%0.38854%0.535SS..Hα-helixtrans-65.6-37.7173.700000112S311 N312 L317 Q318 M319S311-A315 PolarHBondContact O-N 3.39Å; N312-A315 PolarHBondContact O-N 3.01Å; A315-L317 VanDerWaalsContact C-N 3.34Å; A315-Q318 PolarHBondContact O-N 3.01Å; A315-M319 PolarHBondContact O-N 3.33Å
316L82.1Confident82.3Confident107 Ų107109.5 Ų109.556%0.5654%0.54SS*.Hα-helixtrans-67.4-34.1176.3-164.3146.9000112.1N312 N313 Q314 A320N312-L316 WeakPolarHBondContact O-CB 3.38Å; N312-L316 PolarHBondContact O-N 2.93Å; N313-L316 PolarHBondContact O-N 2.98Å; Q314-L316 VanDerWaalsContact C-N 3.34Å; L316-A320 PolarHBondContact O-N 3.04Å
317L82Confident81.8Confident81 Ų81107.3 Ų107.342%0.42454%0.537SS..Hα-helixtrans-65.7-43.5169-75.4167.7000112.2N313 Q314 A315 M319 A320 E321N313-L317 WeakPolarHBondContact O-CG 3.48Å; N313-L317 PolarHBondContact O-N 3.21Å; Q314-L317 PolarHBondContact O-N 2.88Å; A315-L317 VanDerWaalsContact C-N 3.34Å; L317-M319 PolarHBondContact O-N 3.46Å; L317-A320 WeakPolarHBondContact O-CA 3.46Å; L317-A320 WeakPolarHBondContact O-CB 3.34Å; L317-A320 PolarHBondContact O-N 3.44Å; L317-E321 PolarHBondContact O-N 2.96Å
318Q81.6Confident81.3Confident107 Ų107105.1 Ų105.150%0.553%0.532SS..Hα-helixtrans-60.8-43.4176.9-73.8173.4-3000112.1Q314 A315 A320 E321 E322Q314-Q318 WeakPolarHBondContact O-CG 3.48Å; Q314-Q318 PolarHBondContact O-N 2.95Å; A315-Q318 PolarHBondContact O-N 3.01Å; Q318-A320 VanDerWaalsContact C-N 3.26Å; Q318-A320 PolarHBondContact O-N 3.29Å; Q318-E321 PolarHBondContact O-N 3.46Å; Q318-E322 PolarHBondContact O-N 3.28Å
319M76.4Confident80.8Confident142 Ų142105 Ų10570%0.753%0.533SS*.Hα-helixtrans-59.9-34.3172.2-82.6-168.4164.100113.1A315 L317 K323A315-M319 PolarHBondContact O-N 3.33Å; L317-M319 PolarHBondContact O-N 3.46Å; M319-K323 WeakPolarHBondContact O-CB 3.24Å; M319-K323 PolarHBondContact O-N 3.07Å
320A76.2Confident80.3Confident51 Ų51103.7 Ų103.742%0.42153%0.532SS..Hα-helixtrans-69.9-41.4175.300000111.9L316 L317 Q318 K323 T324L316-A320 PolarHBondContact O-N 3.04Å; L317-A320 WeakPolarHBondContact O-CA 3.46Å; L317-A320 WeakPolarHBondContact O-CB 3.34Å; L317-A320 PolarHBondContact O-N 3.44Å; Q318-A320 VanDerWaalsContact C-N 3.26Å; Q318-A320 PolarHBondContact O-N 3.29Å; A320-K323 PolarHBondContact O-N 3.26Å; A320-T324 WeakPolarHBondContact O-CG2 3.49Å; A320-T324 PolarHBondContact O-N 2.78Å; A320-T324 VanDerWaalsContact O-N 3.07Å
321E78.6Confident79.9Confident127 Ų127106.6 Ų106.659%0.59354%0.543SS*.Hα-helixtrans-61.4-51.5175.8-70.8179.8161.500111.4L317 Q318 K323 T324 L325L317-E321 PolarHBondContact O-N 2.96Å; Q318-E321 PolarHBondContact O-N 3.46Å; E321-K323 VanDerWaalsContact C-N 3.27Å; E321-K323 PolarHBondContact O-N 3.41Å; E321-T324 PolarHBondContact O-N 3.19Å; E321-T324 VanDerWaalsContact O-N 3.11Å; E321-T324 PolarHBondContact O-OG1 2.96Å; E321-L325 PolarHBondContact O-N 3.21Å
322E78.5Confident79.4Confident142 Ų142105.5 Ų105.566%0.66454%0.539SS*.Hα-helixtrans-55.3-41.1176.9-72.7-166.6155.100112.7Q318 L325 R326Q318-E322 PolarHBondContact O-N 3.28Å; E322-L325 PolarHBondContact O-N 3.11Å; E322-R326 PolarHBondContact O-N 3.01Å
323K81.4Confident78.8Confident137 Ų137105.8 Ų105.860%0.59654%0.54SS*.Hα-helixtrans-61.6-49.6175.9-178.4-178.5175.3-177.80111.7M319 A320 E321 L325 R326 D327M319-K323 WeakPolarHBondContact O-CB 3.24Å; M319-K323 PolarHBondContact O-N 3.07Å; A320-K323 PolarHBondContact O-N 3.26Å; E321-K323 VanDerWaalsContact C-N 3.27Å; E321-K323 PolarHBondContact O-N 3.41Å; K323-L325 PolarHBondContact O-N 3.22Å; K323-R326 PolarHBondContact O-N 2.98Å; K323-D327 PolarHBondContact O-N 3.01Å
324T78.8Confident78.1Confident96 Ų96107.6 Ų107.659%0.58955%0.546SS*.Hα-helixtrans-61.8-32.517961.60000112.4A320 E321 D327 G328A320-T324 WeakPolarHBondContact O-CG2 3.49Å; A320-T324 PolarHBondContact O-N 2.78Å; A320-T324 VanDerWaalsContact O-N 3.07Å; E321-T324 PolarHBondContact O-N 3.19Å; E321-T324 VanDerWaalsContact O-N 3.11Å; E321-T324 PolarHBondContact O-OG1 2.96Å; T324-D327 PolarHBondContact O-N 3.33Å; T324-G328 PolarHBondContact O-N 2.88Å
325L78.9Confident77.5Confident110 Ų110104.7 Ų104.758%0.57654%0.544SS*.Hα-helixtrans-69.8-42.8177.7-155.4146.6000111E321 E322 K323 G328 H329E321-L325 PolarHBondContact O-N 3.21Å; E322-L325 PolarHBondContact O-N 3.11Å; K323-L325 PolarHBondContact O-N 3.22Å; L325-G328 PolarHBondContact O-N 2.76Å; L325-H329 PolarHBondContact O-CD2 2.99Å; L325-H329 PolarHBondContact O-N 3.13Å
326R74Confident77Confident204 Ų204109.2 Ų109.277%0.7756%0.555SS**Hα-helixtrans-60.8-44.7170.4-80.7-168.2174.4-177.71.4113E322 K323 G328 H329 F330E322-R326 PolarHBondContact O-N 3.01Å; K323-R326 PolarHBondContact O-N 2.98Å; R326-G328 PolarHBondContact O-N 3.08Å; R326-H329 PolarHBondContact O-N 3.24Å; R326-F330 PolarHBondContact O-N 3.39Å
327D77.2Confident76.4Confident82 Ų82109.4 Ų109.444%0.43956%0.556SS.*Hα-helixtrans-61.4-34.4177.5-72.3-21.5000111.9K323 T324 K331K323-D327 PolarHBondContact O-N 3.01Å; T324-D327 PolarHBondContact O-N 3.33Å; D327-K331 WeakPolarHBondContact O-CG 3.44Å; D327-K331 PolarHBondContact O-N 3.35Å; D327-K331 VanDerWaalsContact O-N 3.14Å
328G75Confident76Confident38 Ų38109.9 Ų109.939%0.39256%0.556SS.*Hα-helixtrans-64.6-47.4171.900000113.2T324 L325 R326 F330 K331 A332T324-G328 PolarHBondContact O-N 2.88Å; L325-G328 PolarHBondContact O-N 2.76Å; R326-G328 PolarHBondContact O-N 3.08Å; G328-F330 VanDerWaalsContact C-N 3.32Å; G328-F330 PolarHBondContact O-N 3.34Å; G328-K331 PolarHBondContact O-N 2.94Å; G328-A332 PolarHBondContact O-N 2.94Å
329H77.1Confident75.7Confident127 Ų127109.9 Ų109.959%0.58856%0.558SS**Hα-helixtrans-60.6-39.7174.8-87.7-99.2000112.4L325 R326 A332 L333L325-H329 PolarHBondContact O-CD2 2.99Å; L325-H329 PolarHBondContact O-N 3.13Å; R326-H329 PolarHBondContact O-N 3.24Å; H329-A332 PolarHBondContact O-N 3.17Å; H329-L333 PolarHBondContact O-N 3.39Å; H329-L333 VanDerWaalsContact O-N 3.1Å
330F75.9Confident75.3Confident137 Ų137108.7 Ų108.760%0.60155%0.554SS**Hα-helixtrans-62.8-48.1177.7-169.4-89.9000111.8R326 G328 A332 L333 Q334R326-F330 PolarHBondContact O-N 3.39Å; G328-F330 VanDerWaalsContact C-N 3.32Å; G328-F330 PolarHBondContact O-N 3.34Å; F330-A332 VanDerWaalsContact C-N 3.3Å; F330-A332 PolarHBondContact O-N 3.45Å; F330-L333 PolarHBondContact O-N 3.14Å; F330-L333 VanDerWaalsContact O-N 3.16Å; F330-Q334 PolarHBondContact O-N 3.4Å
331K78.6Confident74.9Confident149 Ų149110.6 Ų110.665%0.64856%0.555SS**Hα-helixtrans-58.6-39.6174.6-75.7173.5178.4170.50112.6D327 G328 L333 Q334 G335D327-K331 WeakPolarHBondContact O-CG 3.44Å; D327-K331 PolarHBondContact O-N 3.35Å; D327-K331 VanDerWaalsContact O-N 3.14Å; G328-K331 PolarHBondContact O-N 2.94Å; K331-L333 VanDerWaalsContact C-N 3.32Å; K331-L333 PolarHBondContact O-N 3.16Å; K331-Q334 PolarHBondContact O-N 3.44Å; K331-G335 PolarHBondContact O-N 3.07Å
332A74.9Confident74.7Confident57 Ų57111.7 Ų111.747%0.47155%0.553SS.*Hα-helixtrans-67.3-30178.300000113.3G328 H329 F330 K336G328-A332 PolarHBondContact O-N 2.94Å; H329-A332 PolarHBondContact O-N 3.17Å; F330-A332 VanDerWaalsContact C-N 3.3Å; F330-A332 PolarHBondContact O-N 3.45Å; A332-K336 WeakPolarHBondContact O-CG 3.44Å
333L72.7Confident74Confident114 Ų114109.9 Ų109.960%0.59755%0.548SS*.Hα-helixtrans-74.7-45170.8-76.7164.3000111.5H329 F330 K331 G335 K336 L337H329-L333 PolarHBondContact O-N 3.39Å; H329-L333 VanDerWaalsContact O-N 3.1Å; F330-L333 PolarHBondContact O-N 3.14Å; F330-L333 VanDerWaalsContact O-N 3.16Å; K331-L333 VanDerWaalsContact C-N 3.32Å; K331-L333 PolarHBondContact O-N 3.16Å; L333-G335 VanDerWaalsContact C-N 3.34Å; L333-G335 PolarHBondContact O-N 3.1Å; L333-K336 WeakPolarHBondContact O-CB 3.37Å; L333-K336 PolarHBondContact O-N 3.01Å; L333-K336 VanDerWaalsContact O-N 3.14Å; L333-L337 PolarHBondContact O-N 3.07Å
334Q72.3Confident73.2Confident103 Ų103107.2 Ų107.248%0.48155%0.545SS..Hα-helixtrans-58.9-42.9179.7-167.5171.211.300112.1F330 K331 K336 L337 E338F330-Q334 PolarHBondContact O-N 3.4Å; K331-Q334 PolarHBondContact O-N 3.44Å; Q334-K336 VanDerWaalsContact C-N 3.33Å; Q334-K336 PolarHBondContact O-N 3.34Å; Q334-L337 WeakPolarHBondContact O-CB 3.43Å; Q334-L337 PolarHBondContact O-N 3.31Å; Q334-L337 VanDerWaalsContact O-N 3.13Å; Q334-E338 PolarHBondContact O-N 3.32Å; Q334-E338 VanDerWaalsContact O-N 3.08Å
335G73.4Confident72.7Confident41 Ų41111 Ų11142%0.42355%0.549SS..Hα-helixtrans-64.3-31176.300000114.6K331 L333 L339K331-G335 PolarHBondContact O-N 3.07Å; L333-G335 VanDerWaalsContact C-N 3.34Å; L333-G335 PolarHBondContact O-N 3.1Å; G335-L339 PolarHBondContact O-N 3.36Å
336K72.3Confident71.9Confident142 Ų142108.3 Ų108.362%0.61754%0.543SS*.Hα-helixtrans-69.5-36.2172.7-70.1172.8-178.2179.50111.5A332 L333 Q334 L339 L340A332-K336 WeakPolarHBondContact O-CG 3.44Å; L333-K336 WeakPolarHBondContact O-CB 3.37Å; L333-K336 PolarHBondContact O-N 3.01Å; L333-K336 VanDerWaalsContact O-N 3.14Å; Q334-K336 VanDerWaalsContact C-N 3.33Å; Q334-K336 PolarHBondContact O-N 3.34Å; K336-L339 PolarHBondContact O-N 3.07Å; K336-L340 PolarHBondContact O-N 3.46Å
337L69.6Low71.3Confident111 Ų111103.9 Ų103.958%0.58153%0.534SS*.Hα-helixtrans-66.8-46.4179.1-146.9167.4000110.9L333 Q334 L339 L340 E341L333-L337 PolarHBondContact O-N 3.07Å; Q334-L337 WeakPolarHBondContact O-CB 3.43Å; Q334-L337 PolarHBondContact O-N 3.31Å; Q334-L337 VanDerWaalsContact O-N 3.13Å; L337-L339 VanDerWaalsContact C-N 3.27Å; L337-L339 PolarHBondContact O-N 2.67Å; L337-L340 WeakPolarHBondContact O-CB 3.48Å; L337-L340 PolarHBondContact O-N 3.24Å; L337-E341 HydrophobicContact CD2-CG 4.45Å; L337-E341 PolarHBondContact O-N 2.97Å
338E72.5Confident70.5Confident91 Ų91105 Ų10543%0.42554%0.536SS..Hα-helixtrans-61.1-33.2174.5-65.8-169-164.600113.6Q334 E341 R342Q334-E338 PolarHBondContact O-N 3.32Å; Q334-E338 VanDerWaalsContact O-N 3.08Å; E338-E341 PolarHBondContact O-N 3.4Å; E338-R342 VanDerWaalsContact CB-NH1 3.29Å; E338-R342 WeakPolarHBondContact O-CG 3.27Å; E338-R342 PolarHBondContact O-N 3.47Å; E338-R342 IonicContact OE2-CZ 2.59Å; E338-R342 VanDerWaalsContact OE2-CZ 3.29Å; E338-R342 IonicContact OE2-NH1 3.86Å; E338-R342 PolarHBondContact OE2-NH1 3.41Å; E338-R342 IonicContact OE2-NH2 2.61Å; E338-R342 PolarHBondContact OE2-NH2 3.39Å
339L74.9Confident70.2Confident106 Ų106109.7 Ų109.756%0.55555%0.546SS*.Hα-helixtrans-68.9-39.6179.4-168.967.4000111G335 K336 L337 R342 L343G335-L339 PolarHBondContact O-N 3.36Å; K336-L339 PolarHBondContact O-N 3.07Å; L337-L339 VanDerWaalsContact C-N 3.27Å; L337-L339 PolarHBondContact O-N 2.67Å; L339-R342 PolarHBondContact O-N 3.03Å; L339-L343 PolarHBondContact O-N 3.05Å
340L68.1Low69.4Low118 Ų118110.1 Ų110.162%0.61855%0.548SS*.Hα-helixtrans-60.3-45.5170.4-111.768.1000111.5K336 L337 R342 L343 C344K336-L340 PolarHBondContact O-N 3.46Å; L337-L340 WeakPolarHBondContact O-CB 3.48Å; L337-L340 PolarHBondContact O-N 3.24Å; L340-R342 PolarHBondContact O-N 3.43Å; L340-L343 PolarHBondContact O-N 3.24Å; L340-C344 PolarHBondContact O-N 3.3Å; L340-C344 PolarHBondContact O-SG 3.18Å
341E67.4Low68.6Low91 Ų91110.6 Ų110.643%0.42555%0.546SS..Hα-helixtrans-60.2-42.7177-77.1-157.1-170.600113L337 E338 L343 C344 R345L337-E341 HydrophobicContact CD2-CG 4.45Å; L337-E341 PolarHBondContact O-N 2.97Å; E338-E341 PolarHBondContact O-N 3.4Å; E341-L343 VanDerWaalsContact C-N 3.34Å; E341-L343 PolarHBondContact O-N 3.44Å; E341-C344 PolarHBondContact O-N 3.38Å; E341-R345 WeakPolarHBondContact O-CB 3.5Å; E341-R345 VanDerWaalsContact O-CG 3.27Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.14Å; E341-R345 IonicContact OE2-CZ 2.67Å; E341-R345 IonicContact OE2-NE 2.71Å; E341-R345 IonicContact OE2-NH2 3.6Å; E341-R345 PolarHBondContact OE2-NH2 3.37Å
342R74.6Confident67.8Low149 Ų149107.3 Ų107.356%0.56254%0.535SS*.Hα-helixtrans-61.2-42.6177.7-74-178.7-178.191.41.2111.5E338 L339 L340 R345 A346E338-R342 VanDerWaalsContact CB-NH1 3.29Å; E338-R342 WeakPolarHBondContact O-CG 3.27Å; E338-R342 PolarHBondContact O-N 3.47Å; E338-R342 IonicContact OE2-CZ 2.59Å; E338-R342 VanDerWaalsContact OE2-CZ 3.29Å; E338-R342 IonicContact OE2-NH1 3.86Å; E338-R342 PolarHBondContact OE2-NH1 3.41Å; E338-R342 IonicContact OE2-NH2 2.61Å; E338-R342 PolarHBondContact OE2-NH2 3.39Å; L339-R342 PolarHBondContact O-N 3.03Å; L340-R342 PolarHBondContact O-N 3.43Å; R342-R345 PolarHBondContact O-N 3.29Å; R342-A346 PolarHBondContact O-N 2.74Å
343L64.7Low67.1Low105 Ų105108.7 Ų108.755%0.5554%0.535SS..Hα-helixtrans-62.5-47.5175.4-94156.2000112.5L339 L340 E341 R345 A346 L347L339-L343 PolarHBondContact O-N 3.05Å; L340-L343 PolarHBondContact O-N 3.24Å; E341-L343 VanDerWaalsContact C-N 3.34Å; E341-L343 PolarHBondContact O-N 3.44Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.17Å; L343-A346 PolarHBondContact O-N 3.26Å; L343-L347 PolarHBondContact O-N 3.46Å; L343-L347 VanDerWaalsContact O-N 3.17Å
344C63.9Low66.4Low81 Ų81109.1 Ų109.155%0.54754%0.537SS..Hα-helixtrans-61-39.7177.1-710000112.4L340 E341 Q348L340-C344 PolarHBondContact O-N 3.3Å; L340-C344 PolarHBondContact O-SG 3.18Å; E341-C344 PolarHBondContact O-N 3.38Å; C344-Q348 WeakPolarHBondContact O-CB 3.48Å; C344-Q348 PolarHBondContact O-N 3.42Å
345R69.3Low65.5Low174 Ų174107.8 Ų107.866%0.65754%0.539SS*.Hα-helixtrans-69-33177.3-68174-163.3-142.310112.8E341 R342 L343 K349E341-R345 WeakPolarHBondContact O-CB 3.5Å; E341-R345 VanDerWaalsContact O-CG 3.27Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.14Å; E341-R345 IonicContact OE2-CZ 2.67Å; E341-R345 IonicContact OE2-NE 2.71Å; E341-R345 IonicContact OE2-NH2 3.6Å; E341-R345 PolarHBondContact OE2-NH2 3.37Å; R342-R345 PolarHBondContact O-N 3.29Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.17Å; R345-K349 PolarHBondContact O-N 3.21Å
346A62.6Low64.6Low54 Ų54111 Ų11145%0.44655%0.547SS..Hα-helixtrans-66.5-51.8176.300000111.8R342 L343 Q348 K349R342-A346 PolarHBondContact O-N 2.74Å; L343-A346 PolarHBondContact O-N 3.26Å; A346-Q348 PolarHBondContact O-N 3.35Å; A346-K349 WeakPolarHBondContact O-CB 3.42Å; A346-K349 PolarHBondContact O-N 3.31Å
347L61.3Low63.6Low112 Ų112112.4 Ų112.459%0.58656%0.556SS**Hα-helixtrans-59.9-31.1177.7-68.9167.5000112.7L343 K349L343-L347 PolarHBondContact O-N 3.46Å; L343-L347 VanDerWaalsContact O-N 3.17Å; L347-K349 VanDerWaalsContact C-N 3.28Å; L347-K349 PolarHBondContact O-N 3.28Å
348Q59.7Low62.4Low105 Ų105114.3 Ų114.349%0.49157%0.565SS.*Hα-helixtrans-68.5-25.8175.2-138.275.8-5600113.4C344 A346C344-Q348 WeakPolarHBondContact O-CB 3.48Å; C344-Q348 PolarHBondContact O-N 3.42Å; A346-Q348 PolarHBondContact O-N 3.35Å
349K68.4Low61Low137 Ų137113.9 Ų113.960%0.59657%0.573SS**Hα-helixtrans-83.9-51.4-172.9-166.9-174.6174.6-168.40112.5R345 A346 L347 R351 N352 D353R345-K349 PolarHBondContact O-N 3.21Å; A346-K349 WeakPolarHBondContact O-CB 3.42Å; A346-K349 PolarHBondContact O-N 3.31Å; L347-K349 VanDerWaalsContact C-N 3.28Å; L347-K349 PolarHBondContact O-N 3.28Å; K349-R351 PolarHBondContact O-N 3.11Å; K349-N352 PolarHBondContact O-N 3.38Å; K349-D353 PolarHBondContact O-N 2.93Å
350E60.6Low59.4Low136 Ų136116.5 Ų116.564%0.63659%0.586SS**Hα-helixtrans-57.7-37.7179.6-63.6-175.8132.700111.9N352 D353 L354E350-N352 VanDerWaalsContact C-N 3.27Å; E350-N352 PolarHBondContact O-N 3.03Å; E350-D353 PolarHBondContact O-N 3.35Å; E350-L354 PolarHBondContact O-N 3.23Å; E350-L354 VanDerWaalsContact O-N 3.17Å
351R59.3Low57.9Low147 Ų147118.8 Ų118.856%0.55560%0.598SS**Hα-helixtrans-64.4-25.8175.7-178.4-98.4-71-156.4-6.2113.7K349K349-R351 PolarHBondContact O-N 3.11Å
352N60.5Low55.9Low79 Ų79122 Ų12242%0.42261%0.613SS.*Hα-helixtrans-87.2-40.3174.9-71.9-6.1000111.8K349 E350 L354 S355 N356K349-N352 PolarHBondContact O-N 3.38Å; E350-N352 VanDerWaalsContact C-N 3.27Å; E350-N352 PolarHBondContact O-N 3.03Å; N352-L354 PolarHBondContact O-N 3.46Å; N352-S355 WeakPolarHBondContact O-CB 3.49Å; N352-S355 PolarHBondContact O-N 3.44Å; N352-S355 VanDerWaalsContact O-N 3.11Å; N352-N356 PolarHBondContact O-N 2.95Å; N352-N356 PolarHBondContact O-ND2 3.17Å
353D61.5Low53.5Low86 Ų86122.7 Ų122.746%0.4662%0.623SS.*Hα-helixtrans-65.1-38.7-177.4-70.6-27000111.7K349 E350K349-D353 PolarHBondContact O-N 2.93Å; E350-D353 PolarHBondContact O-N 3.35Å
354L57.3Low51.6Low123 Ų123126.1 Ų126.164%0.64464%0.636SS**Hα-helixtrans-67.3-34.3171-73.6169.6000113.1E350 N352 N356E350-L354 PolarHBondContact O-N 3.23Å; E350-L354 VanDerWaalsContact O-N 3.17Å; N352-L354 PolarHBondContact O-N 3.46Å; L354-N356 PolarHBondContact O-N 3.23Å
355S54.1Low49.7Very low75 Ų75133.3 Ų133.352%0.52465%0.652SS.*Hα-helixtrans-66.7-25-179.8-170.70000113.1N352N352-S355 WeakPolarHBondContact O-CB 3.49Å; N352-S355 PolarHBondContact O-N 3.44Å; N352-S355 VanDerWaalsContact O-N 3.11Å
356N54.5Low47.6Very low109 Ų109130.4 Ų130.458%0.58365%0.649SS**Hα-helixtrans-78-35.5-177.2-73.7-40000112.7N352 L354 L358 S359N352-N356 PolarHBondContact O-N 2.95Å; N352-N356 PolarHBondContact O-ND2 3.17Å; L354-N356 PolarHBondContact O-N 3.23Å; N356-L358 VanDerWaalsContact C-N 3.32Å; N356-L358 PolarHBondContact O-N 3.2Å; N356-S359 PolarHBondContact O-N 3.42Å; N356-S359 PolarHBondContact O-OG 2.98Å
357Q51.6Low45.9Very low172 Ų172136.7 Ų136.780%0.80467%0.667SS**Hα-helixtrans-72.3-23.4-177.4-67.5-169.7-9.200113.7S359Q357-S359 VanDerWaalsContact C-N 3.3Å; Q357-S359 PolarHBondContact O-N 3.17Å
358L44Very low44.5Very low150 Ų150134.6 Ų134.679%0.78567%0.672SS**G310 helixtrans-79.6-6177-73.5165.6000114N356N356-L358 VanDerWaalsContact C-N 3.32Å; N356-L358 PolarHBondContact O-N 3.2Å
359S42.8Very low44.3Very low83 Ų83135.6 Ų135.658%0.5869%0.687SS**G310 helixtrans-85.3-13-168.667.80000116.2N356 Q357N356-S359 PolarHBondContact O-N 3.42Å; N356-S359 PolarHBondContact O-OG 2.98Å; Q357-S359 VanDerWaalsContact C-N 3.3Å; Q357-S359 PolarHBondContact O-N 3.17Å
360L41.6Very low43.1Very low160 Ų160135.3 Ų135.384%0.83870%0.697SS**G310 helixtrans-103.23.6-170.9-127.877.2000115.9
361L35.8Very low43Very low166 Ų166134 Ų13487%0.86970%0.701SS**SBendtrans-128.458.3174.4-80.9173.9000112.5
362Q26.4Very low42.7Very low160 Ų160133 Ų13375%0.74871%0.713SS**  trans57.1127.4144.3-171.4165.5-17.500120.3
363E24.3Very low41.4Very low162 Ų162132.7 Ų132.776%0.75773%0.728SS**  trans68.1132.1170.7-71.8176.6-177.300115.2
364Q23.9Very low41Very low177 Ų177135.3 Ų135.383%0.82775%0.75SS**  cis-150.2170.134.1-67.3-178.62.600114.7
365R23.7Very low39.9Very low232 Ų232132.6 Ų132.688%0.87575%0.752SS**  trans-11.7163.7145.4-78.9-170.2177.7176.3-0.5119.1
366D25.7Very low39Very low114 Ų114137 Ų13761%0.6176%0.764SS**  cis174.6156.5-8172.724.9000107.2
367K28.1Very low38Very low186 Ų186138.6 Ų138.681%0.80977%0.767SS**  trans65.6161.6174.6-36.9-169-174.3-174.10115.8
368G31.2Very low36.9Very low68 Ų68138.1 Ų138.170%0.70177%0.765SS**  cis-165.6-178.81.400000112.3
369P55.7Low36.1Very low125 Ų125134.8 Ų134.881%0.81276%0.76SS**  trans-133.3-171.4-152.635.6-14.7000117.9
370V42.3Very low35.4Very low131 Ų131138.7 Ų138.779%0.79477%0.773SS**  trans88.3-175.8159.8-129.30000118
371P58.2Low36.2Very low110 Ų110135.8 Ų135.871%0.71476%0.764SS**  -125.4-133.2-123.247.2-26.6000112.9
372P54Low35.8Very low126 Ų126134.4 Ų134.482%0.81875%0.754SS**  cis-128.6-166.6-35.639.8-22.4000113.5
373G32.5Very low35.9Very low71 Ų71133.7 Ų133.773%0.73275%0.751SS**  trans163.3132.8159.800000118.1
374P52.7Low36Very low141 Ų141133 Ų13392%0.91675%0.752SS**  trans-132.8174.8-179.843.3-30.2000117.1
375G36.1Very low36.2Very low67 Ų67133.5 Ų133.569%0.69176%0.755SS**  trans149.8123.7149.800000120.5
376Q34Very low36.7Very low167 Ų167131.5 Ų131.578%0.7876%0.755SS**  trans61.4170.5148.1-63.6-171.4-106.400120.2
377H33.2Very low36.7Very low142 Ų142133.8 Ų133.866%0.65777%0.768SS**  cis-163.7-172.4-32.8-96.1-164.8000107.4
378E28Very low37.3Very low163 Ų163133.5 Ų133.576%0.76277%0.769SS**  cis-146.6-137.912.6-151.599.6-121.400111.8
379A28.3Very low37.4Very low80 Ų80139 Ų13966%0.66178%0.776SS**  trans-154.8152.2-162.100000119
380L27.4Very low36.4Very low164 Ų164141.4 Ų141.486%0.85978%0.777SS**  trans57.6174.1138.2-71.8178000122.3
381P58.9Low35.9Very low99 Ų99141.5 Ų141.564%0.64377%0.773SS**  cis-136.4-150.4-28.933-9000114.2
382M27.3Very low34.7Very low137 Ų137141.3 Ų141.368%0.67577%0.774SS**  trans87.6137.2167.9-43.3-53.3-73.900116.7
383E28.4Very low33.9Very low145 Ų145142.8 Ų142.868%0.67877%0.77SS**  cis73.3136.533.1-56.9165.5-16800111.9
384D26.3Very low33.8Very low147 Ų147147.2 Ų147.279%0.78678%0.777SS**  cis-158.4-163.4-1.9-123.9-19000110.9
385E29Very low33Very low189 Ų189146.8 Ų146.888%0.88377%0.767SS**  trans114.5125153.2-61.8-170.2166.900119.4
386E33.6Very low32.9Very low189 Ų189148.4 Ų148.488%0.88377%0.773SS**  trans-93.9166.6166.5-56.3168.6130.100108.5
387D25.5Very low32.8Very low162 Ų162147.6 Ų147.687%0.86677%0.769SS**  -175.5169.3119.6-121.8-39.3000113.5
388E40.3Very low32.8Very low180 Ų180148.4 Ų148.484%0.84178%0.778SS**  trans-105.2-138.6-177.6-57-162.3137.400114.2
389E33.1Very low33.3Very low183 Ų183147.1 Ų147.186%0.85577%0.772SS**  trans66.7157.9178.7-60.4-167.1-17600118.7
390E35.2Very low33.7Very low176 Ų176150.5 Ų150.582%0.82278%0.775SS**  176162-52.7-106.7-151.5149.800107.6
391D32.3Very low34.3Very low134 Ų134149.2 Ų149.272%0.71777%0.768SS**  trans67.2174.4149.4-147.819.8000123.4
392S33.6Very low33.4Very low105 Ų105152.5 Ų152.573%0.73477%0.774SS**  trans70.5105.9-168.765.50000114.3
393E36.8Very low33.9Very low157 Ų157149.5 Ų149.573%0.73477%0.772SS**  61.8124.952.9-59.3-149.9139.400115.1
394D30.7Very low34.3Very low164 Ų164148.2 Ų148.288%0.87778%0.777SS**  -154.5159.6122.8-149.3-17000110.4
395L34.7Very low34.8Very low133 Ų133150.1 Ų150.170%0.69678%0.781SS**  trans-117.8149.1-164.4-72.1161.8000113.5
396A34.3Very low35.2Very low100 Ų100149.1 Ų149.183%0.82678%0.777SS**  trans-161.2114.1148.600000111.5
397H32.5Very low36.5Very low151 Ų151144.9 Ų144.970%0.69977%0.765SS**  trans-91.9153.7161-90.135.1000110
398N33.1Very low38.3Very low158 Ų158141.8 Ų141.885%0.84575%0.754SS**  -164.7142.8113.4-115.735.9000114.6
399E38.5Very low38.4Very low136 Ų136141 Ų14164%0.63675%0.751SS**  trans-72.5175.8170.9-78.9147.2147.800112.5
400E37.3Very low38.7Very low152 Ų152140.1 Ų140.171%0.7175%0.746SS**  cis-158.91583.6-119.5168.9154.600108.3
401L39.5Very low38.9Very low136 Ų136135.6 Ų135.671%0.71274%0.739SS**  50.6149.291-50.3-173.7000116.6
402E39.8Very low39Very low168 Ų168133.8 Ų133.879%0.78574%0.742SS**  cis-161.7167.5-1.9-131-178.2178.600115.6
403A37.5Very low39.2Very low75 Ų75136 Ų13662%0.6275%0.746SS**  trans42.9136.3141.300000128.6
404C35.9Very low39.4Very low118 Ų118137.3 Ų137.380%0.79775%0.749SS**  trans57.5166.4133.5-59.60000123
405E38.1Very low40.4Very low186 Ų186135.3 Ų135.387%0.86975%0.745SS**  cis-155.1-166.97-140.6171.9-151.900115.3
406E36.4Very low40.5Very low169 Ų169135 Ų13579%0.7975%0.749SS**  trans-67.9-160.3-166.4-104.2-161.916900121.9
407P62.3Low40.7Very low99 Ų99136.9 Ų136.964%0.64375%0.75SS**  cis-126.6-63-26.721.9-5.4000126.1
408P63.3Low40.8Very low97 Ų97134.3 Ų134.363%0.6376%0.756SS**  -128.7149.2-104.235.3-18.7000123.4
409Q42.4Very low41.3Very low164 Ų164131.9 Ų131.977%0.76676%0.757SS**  90.8140.2127.9-82.6175.47.400129.4
410H38.8Very low41.2Very low165 Ų165130.1 Ų130.176%0.76477%0.766SS**  trans67.7161.6147.6-71.7-58.3000123.9
411A38.2Very low41.5Very low81 Ų81129.4 Ų129.467%0.66977%0.772SS**  cis-178.7150.1-46.200000114.2
412A36.4Very low42.9Very low95 Ų95128.1 Ų128.179%0.78577%0.772SS**  trans60.5170.4158.800000119.2
413D37.2Very low43.8Very low153 Ų153125.7 Ų125.782%0.81877%0.771SS**  cis-154.6-175.3-10-145-35.6000112
414K41.6Very low44.3Very low184 Ų184127.8 Ų127.880%0.878%0.776SS**  trans-88.7164.3175.9-56.3176.5-179.2172.10113.8
415P51.4Low45.3Very low121 Ų121133.3 Ų133.379%0.78678%0.78SS**  -142.5-16891.231.2-8.3000112.1
416T36.6Very low45.8Very low127 Ų127131.9 Ų131.978%0.77978%0.778SS**  cis-157.7163.827.5-49.70000112.1
417T37.8Very low46.7Very low139 Ų139131 Ų13185%0.85378%0.778SS**  trans-94171.2177.944.80000114.7
418A35.4Very low46.1Very low98 Ų98137.2 Ų137.281%0.8181%0.805SS**  trans-146.2138.2174.600000115.2
419A42Very low45.3Very low106 Ų106139.2 Ų139.288%0.87681%0.814SS**  trans46.7129.715000000123.6
420A37.8Very low45.4Very low99 Ų99137.9 Ų137.982%0.81882%0.817SS**  trans-160.7147.7142.800000111.7
421T43.3Very low45.8Very low137 Ų137136.4 Ų136.484%0.8482%0.819SS**  trans-147.8-178.5176.4-24.10000110.4
422P67.6Low46.3Very low110 Ų110139.6 Ų139.671%0.71483%0.828SS**  -90-171-116.744.1-31.6000115.5
423P58.7Low46.9Very low117 Ų117142.4 Ų142.476%0.7683%0.831SS**  trans-143.4127.9131.135.4-19.9000117.6
424T49.5Very low47.5Very low119 Ų119141.7 Ų141.773%0.7383%0.832SS**  47.9117.2113.9-41.40000123.5
425R55.5Low47.9Very low233 Ų233138.7 Ų138.788%0.87983%0.834SS**  trans42.1139.8142.6-63.8179.2170-175.8-4.8123.2
426L50.4Low47.7Very low156 Ų156140.1 Ų140.182%0.81784%0.838SS**  -158.9168.1113.8-96.8160.3000106.8
427L54.7Low48.6Very low151 Ų151141.2 Ų141.279%0.79184%0.843SS**  cis-137.5156.224.9-70156.3000111.9
428D50.4Low49.6Very low229 Ų229141.4 Ų141.4100%1.22584%0.842SS**  -104.70127.5-88.8-54.9000106.2

Retrieved 428 of 428 residues in 874.6 ms (Link to these results)