A0A087XFZ7_POEFO Loading...

rhomboid protease

AlphaFold DB , UniProt , Accession A0A087XFZ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 390 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
1M32.7Very low29.8Very low245 Ų245169.5 Ų169.5100%1.20788%0.883SS**  0133.30-71-173.6-17200108.1
2A32Very low29.6Very low98 Ų98172.2 Ų172.281%0.8188%0.882SS**  trans44.7122.2165.200000118.3
3C29.5Very low29.6Very low131 Ų131169.2 Ų169.289%0.88588%0.878SS**  cis-146.9115.248.2-82.40000111.9
4R34Very low29.6Very low259 Ų259169.4 Ų169.498%0.97787%0.872SS**  trans-93.2133.6150-80.8179.8166.1-165.4-3106.6
5G28.9Very low29.3Very low66 Ų66170.7 Ų170.768%0.6887%0.869SS**  trans158.183.3165.300000113.2
6F30Very low29.1Very low218 Ų218174.9 Ų174.996%0.95687%0.873SS**  trans-16163.4151.6-111.3-75.2000109.9
7I31.6Very low28.9Very low162 Ų162178.1 Ų178.183%0.83187%0.873SS**  trans-140.8140.2156.7-60.1-174.1000105.1
8I30.1Very low28.7Very low164 Ų164174.2 Ų174.284%0.84187%0.866SS**  trans100.383.8-179.6-48.8162.1000113.9
9K26.4Very low29.2Very low189 Ų189170.5 Ų170.582%0.82286%0.856SS**  -168.8116.8129.2-122.8179177.9-179.60107.1
10W26.7Very low29.1Very low265 Ų265169 Ų169100%1.00485%0.851SS**  trans17482138.2-98.794.2000107.1
11G26.3Very low29Very low68 Ų68168 Ų16870%0.70185%0.854SS**  trans-148.1122169.400000108.5
12K26.9Very low28.6Very low201 Ų201166.2 Ų166.287%0.87484%0.84SS**  trans92.4109.7165.8-59.5-178.3176.4-178.70118.5
13T30Very low28.3Very low134 Ų134167 Ų16782%0.82284%0.84SS**  179.9145.2121.831.20000106.2
14E28.8Very low28.2Very low171 Ų171172.3 Ų172.380%0.79984%0.841SS**  cis-163.4132.5-14.2-110.5-171.1171.300105.4
15F26.1Very low27.8Very low189 Ų189166 Ų16683%0.82984%0.835SS**  39.6111.6116.4-91.9-87000118.8
16Y26.2Very low27.7Very low239 Ų239168 Ų16894%0.93784%0.839SS**  trans-146.4135.2139.3-124.5-90.7000111
17R25.1Very low27.7Very low229 Ų229162.6 Ų162.686%0.86483%0.828SS**  trans-67.9132.3178.3-85.9174.4171.3170.8-3111.6
18S25.5Very low27.5Very low108 Ų108166 Ų16676%0.75583%0.831SS**  75.3150.494.5-136.10000115.2
19P38.6Very low27.4Very low104 Ų104166.6 Ų166.668%0.67583%0.834SS**  cis-143.2170.320.540.9-19.6000119.9
20N26.3Very low27.5Very low140 Ų140163.5 Ų163.575%0.74983%0.827SS**  trans56.7116.3147.8-71.1-12.1000121.8
21T26.4Very low27.7Very low149 Ų149156.6 Ų156.691%0.91482%0.816SS**  -162.6142.6113.216.70000111.6
22F25.4Very low27.8Very low206 Ų206163.2 Ų163.290%0.90482%0.821SS**  trans-61141.4-171.6-100.9-118.1000115.1
23S26.4Very low28Very low116 Ų116161.3 Ų161.381%0.81182%0.815SS**  179.8122.1119.7178.80000111.1
24R25.6Very low28.4Very low241 Ų241162.5 Ų162.591%0.90981%0.812SS**  trans-71.2133.3175.1-83.6171161.7170.5-5.1110.5
25C25.5Very low29Very low127 Ų127160.7 Ų160.786%0.85880%0.803SS**  trans-146.1104.3142.4-152.60000110.9
26S27.2Very low29.4Very low108 Ų108162 Ų16276%0.75580%0.803SS**  trans-79.1125.6169.2172.90000108.5
27S29.8Very low29.8Very low105 Ų105155.2 Ų155.273%0.73479%0.79SS**  trans-135.7112.4157.959.80000110L29S27-L29 PolarHBondContact O-N 3.39Å
28R29.2Very low30.2Very low234 Ų234146.4 Ų146.488%0.88377%0.771SS**  trans-65.4118.9170.7-68.4176.5177.6-178.8-1.5108.2N30R28-N30 PolarHBondContact O-N 3.3Å
29L27.8Very low31Very low175 Ų175148.4 Ų148.492%0.91677%0.767SS**  trans-71.7113.3171.8-76.3161.3000109.4S27S27-L29 PolarHBondContact O-N 3.39Å
30N28.1Very low30.7Very low125 Ų125155.4 Ų155.467%0.66878%0.779SS**  trans-98.5117.7176.1-163-2.5000108.7R28 Y32R28-N30 PolarHBondContact O-N 3.3Å; N30-Y32 PolarHBondContact O-N 3.07Å
31P30.2Very low31Very low120 Ų120159.5 Ų159.578%0.77978%0.784SS**G310 helixtrans-738.1-169.625.8-32.5000115.8Q33P31-Q33 PolarHBondContact O-N 3.25Å
32Y29.1Very low31.2Very low207 Ų207161.8 Ų161.881%0.81279%0.785SS**G310 helixtrans-84.2-4.5-170.3-114.2-92.1000116.3N30N30-Y32 PolarHBondContact O-N 3.07Å
33Q31.9Very low31.5Very low160 Ų160156.7 Ų156.775%0.74878%0.781SS**G310 helixtrans-97.8-12-173.5-84.6-174.9-24.200115.9P31 Q35 R36P31-Q33 PolarHBondContact O-N 3.25Å; Q33-Q35 PolarHBondContact O-N 3.23Å; Q33-Q35 VanDerWaalsContact O-N 3.12Å; Q33-R36 PolarHBondContact O-N 3.46Å
34Q37Very low31.6Very low159 Ų159160.9 Ų160.974%0.74378%0.784SS**THydrogen-bonded Turntrans-74.1-8-169.7-153169.8900114.6
35Q41.9Very low31.8Very low134 Ų134160.5 Ų160.563%0.62678%0.783SS**THydrogen-bonded Turntrans-100.40.2177-151.8173.7-17.300113.3Q33 R327Q33-Q35 PolarHBondContact O-N 3.23Å; Q33-Q35 VanDerWaalsContact O-N 3.12Å; Q35-R327 PolarHBondContact NE2-O 3.25Å; Q35-R327 VanDerWaalsContact NE2-O 3.14Å
36R34.6Very low32Very low215 Ų215160.8 Ų160.881%0.81178%0.781SS**SBendtrans-111.5-3.1-168.3-137.1176.6176.7-176.4-1.4115.9Q33Q33-R36 PolarHBondContact O-N 3.46Å
37S33.8Very low32.1Very low97 Ų97162.8 Ų162.868%0.67878%0.783SS**SBendtrans-102.821.5-171.950.80000115.6
38G34.1Very low32.5Very low45 Ų45162.9 Ų162.946%0.46478%0.781SS.*SBendtrans-108.9-12176.700000116.2
39F42.5Very low32.6Very low150 Ų150161.7 Ų161.766%0.65878%0.782SS**SBendtrans-118.588179.8-67.2-74.2000109.3R41 P271F39-R41 PolarHBondContact O-N 3.04Å; F39-R41 VanDerWaalsContact O-N 3.08Å; F39-P271 HydrophobicContact CE2-CG 4.12Å; F39-P271 HydrophobicContact CZ-CG 3.79Å
40R31.3Very low32.7Very low251 Ų251163.5 Ų163.595%0.94778%0.783SS**  trans-60.3110171.9-167.3176.6-169.2174.42.7108.2
41R33.8Very low32.6Very low226 Ų226161.1 Ų161.185%0.85379%0.788SS**PPolyproline II helixtrans-68.6132.3162.7-80.9-179.1170.9-177.1-5.2107.8F39F39-R41 PolarHBondContact O-N 3.04Å; F39-R41 VanDerWaalsContact O-N 3.08Å
42E30.5Very low32.6Very low196 Ų196163.1 Ų163.192%0.91679%0.792SS**PPolyproline II helixtrans-53.8136.8166.8-85.2171.2145.100110.2K44E42-K44 PolarHBondContact O-N 3.03Å
43A30.8Very low32.6Very low100 Ų100159.3 Ų159.383%0.82679%0.79SS**PPolyproline II helixtrans-69.9124.8-174.700000110.8R45A43-R45 PolarHBondContact O-N 3.09Å
44K29Very low32.4Very low204 Ų204159.2 Ų159.289%0.88780%0.795SS**  trans-77.1114.4162.4-163.2176-176.4-176.60107.1E42 T46E42-K44 PolarHBondContact O-N 3.03Å; K44-T46 PolarHBondContact O-N 2.8Å
45R28.8Very low32.1Very low233 Ų233160.5 Ų160.588%0.87980%0.801SS**  trans-48.7130.8171.3-87.9-179.3170.9-179.2-3.9110.3A43A43-R45 PolarHBondContact O-N 3.09Å
46T29.8Very low31.5Very low132 Ų132163.6 Ų163.681%0.8182%0.815SS**  trans-92.4131.6163.640.40000108.8K44K44-T46 PolarHBondContact O-N 2.8Å
47D30.4Very low31.2Very low151 Ų151161.9 Ų161.981%0.80782%0.816SS**  trans-132.6156.5159.6-91.2-38.4000109.7
48P38.1Very low31Very low107 Ų107163.4 Ų163.470%0.69582%0.822SS**  trans-112.2167.8-133.739.2-32.5000115.9
49K30.2Very low30.7Very low208 Ų208170.8 Ų170.890%0.90484%0.841SS**  trans67112.4152.8-79.6179174.91800119.8
50K29.9Very low30.5Very low214 Ų214170.8 Ų170.893%0.9385%0.854SS**  trans-65.8129.3153.2-79179170-178.70110.5
51G27.6Very low30.6Very low75 Ų75164 Ų16477%0.77384%0.844SS**  trans-118.3131.7153.600000108.6
52N29.8Very low31Very low161 Ų161158.6 Ų158.686%0.86184%0.839SS**  trans-70.9150.6170.3-87.9-14.6000110.3
53V29.5Very low31.7Very low128 Ų128155.6 Ų155.678%0.77684%0.836SS**  173.6131.6123.3156.70000111.2
54N28Very low32.2Very low158 Ų158159.6 Ų159.685%0.84584%0.838SS**  trans61.2129.4154.5-71.5-6.6000125.2
55Q29.8Very low33.1Very low185 Ų185154.3 Ų154.386%0.86483%0.832SS**  trans-66.3142.7159.8-63.9168.2-3.200111.5
56Q28.8Very low34Very low200 Ų200146.7 Ų146.794%0.93583%0.826SS**  -168.5138123.8-107.4169.313.400111.6
57Q29.1Very low35Very low178 Ų178146.6 Ų146.683%0.83283%0.825SS**  trans-73.4150.1-177.5-73.5164.8-43.100113.1
58T28.5Very low36.4Very low130 Ų130145.3 Ų145.380%0.79883%0.825SS**  133.2111.7128.947.90000112.4
59K29.6Very low37.7Very low200 Ų200142.9 Ų142.987%0.8782%0.82SS**  trans-176.9122.4137.2-100.3165.1-173.1-176.10109.2
60T37.3Very low39.7Very low150 Ų150138.8 Ų138.892%0.9281%0.814SS**  trans-57.8136.6170.320.60000110.9
61S34Very low41.5Very low107 Ų107134 Ų13475%0.74881%0.805SS**  trans-141.8151.1174.1-46.90000109.5
62P42.6Very low43.3Very low114 Ų114135.8 Ų135.874%0.7480%0.803SS**PPolyproline II helixtrans-75.8170.8-162.334.2-36.6000113.2E64P62-E64 PolarHBondContact O-N 2.88Å
63P43.6Very low44.8Very low132 Ų132133.3 Ų133.386%0.85780%0.796SS**PPolyproline II helixtrans-65.2125.6-159.726.2-32.2000111.8A65P63-A65 PolarHBondContact O-N 3.47Å
64E42.6Very low46.1Very low185 Ų185132.8 Ų132.886%0.86480%0.795SS**PPolyproline II helixtrans-66.2120.9179.6-157.2173-170.400109.5P62 G66P62-E64 PolarHBondContact O-N 2.88Å; E64-G66 PolarHBondContact O-N 3.35Å
65A48.3Very low47.4Very low92 Ų92135.1 Ų135.176%0.7680%0.798SS**PPolyproline II helixtrans-55.9126.9171.700000109.2P63 T67P63-A65 PolarHBondContact O-N 3.47Å; A65-T67 PolarHBondContact O-N 3.39Å
66G46.1Very low48.8Very low73 Ų73131.1 Ų131.175%0.75379%0.786SS**PPolyproline II helixtrans-47.6124.4-175.500000112.3E64E64-G66 PolarHBondContact O-N 3.35Å
67T51.5Low50.7Low130 Ų130131 Ų13180%0.79878%0.777SS**PPolyproline II helixtrans-54131.2170.411.30000108.8A65 G69A65-T67 PolarHBondContact O-N 3.39Å; T67-G69 PolarHBondContact O-N 2.99Å; T67-G69 VanDerWaalsContact O-N 3.07Å
68P59.4Low52.9Low124 Ų124132.2 Ų132.281%0.80577%0.774SS**PPolyproline II helixtrans-58.8120.8172.9-17.829000108
69G66.5Low55.3Low56 Ų56126.9 Ų126.958%0.57774%0.741SS**PPolyproline II helixtrans-51.9153.7173.900000110.8T67T67-G69 PolarHBondContact O-N 2.99Å; T67-G69 VanDerWaalsContact O-N 3.07Å
70P70.6Confident58.1Low122 Ų122126.2 Ų126.279%0.79273%0.733SS**PPolyproline II helixtrans-50.9135.1-179.119.4-30.6000110
71P68.4Low60.8Low113 Ų113121 Ų12173%0.73470%0.7SS**PPolyproline II helixtrans-54.9137.7-177.221.2-31.8000109
72P65.2Low63.6Low113 Ų113122.6 Ų122.673%0.73469%0.693SS**PPolyproline II helixtrans-53.7139.6179.821.2-31.7000109
73P61.2Low66.1Low110 Ų110126 Ų12671%0.71469%0.691SS**PPolyproline II helixtrans-52.6137.1-178.620.7-31.7000109.2K75P73-K75 PolarHBondContact O-N 3.3Å; P73-K75 VanDerWaalsContact O-N 3.09Å
74P56.6Low68.6Low116 Ų116119.7 Ų119.775%0.75365%0.65SS**PPolyproline II helixtrans-53.3124.3-17619-30.4000109V76P74-V76 VanDerWaalsContact C-N 3.34Å; P74-V76 PolarHBondContact O-N 2.87Å
75K55.5Low71.2Confident208 Ų208114.4 Ų114.490%0.90463%0.628SS**  trans-59.997.9177.9-73.8-179.1-180176.60108.1P73 R77P73-K75 PolarHBondContact O-N 3.3Å; P73-K75 VanDerWaalsContact O-N 3.09Å; K75-R77 PolarHBondContact O-N 3.09Å
76V60Low73.6Confident101 Ų101114.4 Ų114.461%0.61261%0.613SS**  trans-63113.4176.7-175.20000106.8P74 R78 F269P74-V76 VanDerWaalsContact C-N 3.34Å; P74-V76 PolarHBondContact O-N 2.87Å; V76-R78 PolarHBondContact O-N 3.42Å; V76-F269 HydrophobicContact CG1-CD2 4.35Å; V76-F269 HydrophobicContact CG1-CE2 4Å
77R68.1Low76Confident198 Ų198113.5 Ų113.575%0.74759%0.589SS**  trans-57.8115.7179.1-170176.8-176.7177.82.4108.1K75K75-R77 PolarHBondContact O-N 3.09Å
78R75Confident78.2Confident202 Ų202107.8 Ų107.876%0.76255%0.554SS**PPolyproline II helixtrans-58.2130.2179.4-70.4-172.4-179.5-170.20.4109.3V76 R80V76-R78 PolarHBondContact O-N 3.42Å; R78-R80 PolarHBondContact O-N 2.96Å
79P80.1Confident80.1Confident18 Ų18106.4 Ų106.412%0.11754%0.542CS..PPolyproline II helixtrans-57136.6177.4-27.836.1000112.1P199 F269P79-P199 HydrophobicContact CB-CB 4.16Å; P79-P199 VanDerWaalsContact CB-O 3.23Å; P79-P199 WeakPolarHBondContact CB-O 3.33Å; P79-P199 HydrophobicContact CG-CB 4.15Å; P79-P199 WeakPolarHBondContact CG-O 3.35Å; P79-F269 VanDerWaalsContact CD-CZ 3.42Å; P79-F269 HydrophobicContact CG-CD1 4.26Å; P79-F269 HydrophobicContact CG-CE1 3.56Å; P79-F269 HydrophobicContact CG-CZ 3.85Å
80R87.8Confident81.6Confident186 Ų186105.5 Ų105.570%0.70253%0.534SS*.PPolyproline II helixtrans-79.5124.9169.6-66.4-177.2177-176.9-1.9108.8R78 Q204R78-R80 PolarHBondContact O-N 2.96Å; R80-Q204 PolarHBondContact O-NE2 3.06Å; R80-Q204 PolarHBondContact O-OE1 3.4Å
81L92.8Very high82.9Confident41 Ų41102 Ų10222%0.21551%0.506CS..  trans-93.5-8.7-177.5-66.1180000114.1R83 P84 L85 M257 V261 T264L81-R83 PolarHBondContact O-N 2.97Å; L81-P84 WeakPolarHBondContact O-CD 3.29Å; L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 PolarHBondContact O-N 3.42Å; L81-M257 HydrophobicContact CB-CE 4.05Å; L81-V261 HydrophobicContact CD1-CB 4.44Å; L81-V261 HydrophobicContact CD1-CG2 4.04Å; L81-T264 HydrophobicContact CD1-CG2 4.15Å; L81-T264 HydrophobicContact CG-CG2 4.37Å
82F94.4Very high84.3Confident141 Ų14197.3 Ų97.362%0.61848%0.477SS*.Hα-helixtrans-59.2-45.6-177.9-178.9-103.3000113L85 M86F82-L85 PolarHBondContact O-N 3.29Å; F82-M86 HydrophobicContact CD1-CG 4.32Å; F82-M86 HydrophobicContact CD2-CG 4.39Å; F82-M86 HydrophobicContact CE1-CG 3.88Å; F82-M86 HydrophobicContact CE2-CE 4.22Å; F82-M86 HydrophobicContact CE2-CG 3.94Å; F82-M86 HydrophobicContact CE2-SD 4.15Å; F82-M86 HydrophobicContact CZ-CG 3.67Å; F82-M86 HydrophobicContact CZ-SD 4.07Å; F82-M86 WeakPolarHBondContact O-CG 3.36Å; F82-M86 PolarHBondContact O-N 3.39Å
83R94.6Very high85.8Confident184 Ų18494.1 Ų94.169%0.69446%0.464SS*.Hα-helixtrans-62.6-51.9178.6-80.2178.6140.3179.9-3.8112.5L81 L85 M86 F87L81-R83 PolarHBondContact O-N 2.97Å; R83-L85 VanDerWaalsContact C-N 3.27Å; R83-L85 PolarHBondContact O-N 3.5Å; R83-M86 PolarHBondContact O-N 3.32Å; R83-F87 WeakPolarHBondContact O-CB 3.43Å; R83-F87 PolarHBondContact O-N 2.93Å
84P96.1Very high87.6Confident0 Ų093.4 Ų93.40%046%0.461CS..Hα-helixtrans-53.8-40.1171.1-31.236.2000114.2L81 F87 T88 Q204 M208 M257 Y260L81-P84 WeakPolarHBondContact O-CD 3.29Å; P84-F87 PolarHBondContact O-N 3.45Å; P84-T88 WeakPolarHBondContact O-CB 3.4Å; P84-T88 PolarHBondContact O-N 2.87Å; P84-T88 PolarHBondContact O-OG1 3.13Å; P84-Q204 HydrophobicContact CG-CB 3.83Å; P84-M208 HydrophobicContact CB-CE 4.22Å; P84-M208 HydrophobicContact CB-SD 3.8Å; P84-M257 HydrophobicContact CB-CE 4.37Å; P84-M257 HydrophobicContact CB-SD 3.59Å; P84-M257 VanDerWaalsContact CB-SD 3.59Å; P84-Y260 HydrophobicContact CB-CD2 4Å; P84-Y260 HydrophobicContact CB-CE2 4.4Å; P84-Y260 HydrophobicContact CG-CD2 4.05Å; P84-Y260 HydrophobicContact CG-CE2 4.27Å
85L97.2Very high89.5Confident75 Ų7588.7 Ų88.739%0.39343%0.431SS..Hα-helixtrans-65.4-50.9179.9-178.865.2000111.7L81 F82 R83 F87 T88 V89 M257L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 PolarHBondContact O-N 3.42Å; F82-L85 PolarHBondContact O-N 3.29Å; R83-L85 VanDerWaalsContact C-N 3.27Å; R83-L85 PolarHBondContact O-N 3.5Å; L85-F87 VanDerWaalsContact C-N 3.26Å; L85-F87 PolarHBondContact O-N 3.45Å; L85-T88 WeakPolarHBondContact O-CB 3.29Å; L85-T88 PolarHBondContact O-N 2.8Å; L85-T88 VanDerWaalsContact O-N 3.08Å; L85-V89 PolarHBondContact O-N 2.99Å; L85-M257 HydrophobicContact CB-CE 3.86Å; L85-M257 HydrophobicContact CB-SD 4.38Å; L85-M257 HydrophobicContact CD1-CE 4.25Å
86M97.8Very high91.6Very high91 Ų9179.5 Ų79.545%0.44839%0.391SS..Hα-helixtrans-60.4-39.6177.4-68.2-60.498.500111.5F82 R83 T88 V89 G90F82-M86 HydrophobicContact CD1-CG 4.32Å; F82-M86 HydrophobicContact CD2-CG 4.39Å; F82-M86 HydrophobicContact CE1-CG 3.88Å; F82-M86 HydrophobicContact CE2-CE 4.22Å; F82-M86 HydrophobicContact CE2-CG 3.94Å; F82-M86 HydrophobicContact CE2-SD 4.15Å; F82-M86 HydrophobicContact CZ-CG 3.67Å; F82-M86 HydrophobicContact CZ-SD 4.07Å; F82-M86 WeakPolarHBondContact O-CG 3.36Å; F82-M86 PolarHBondContact O-N 3.39Å; R83-M86 PolarHBondContact O-N 3.32Å; M86-T88 VanDerWaalsContact C-N 3.34Å; M86-T88 PolarHBondContact O-N 2.83Å; M86-V89 PolarHBondContact O-N 3.5Å; M86-G90 PolarHBondContact O-N 3.08Å
87F97.8Very high93.3Very high55 Ų5575.4 Ų75.424%0.24137%0.369CS..Hα-helixtrans-61.6-42.2173.8-179.9-101.6000112.3R83 P84 L85 F91 C205 M208 I209 V253R83-F87 WeakPolarHBondContact O-CB 3.43Å; R83-F87 PolarHBondContact O-N 2.93Å; P84-F87 PolarHBondContact O-N 3.45Å; L85-F87 VanDerWaalsContact C-N 3.26Å; L85-F87 PolarHBondContact O-N 3.45Å; F87-F91 WeakPolarHBondContact O-CB 3.23Å; F87-F91 PolarHBondContact O-N 2.99Å; F87-C205 HydrophobicContact CB-CB 4.03Å; F87-C205 HydrophobicContact CD1-CB 3.84Å; F87-C205 HydrophobicContact CD2-CB 3.68Å; F87-C205 HydrophobicContact CE1-CB 4.14Å; F87-C205 WeakPolarHBondContact CE1-O 3.32Å; F87-C205 HydrophobicContact CE2-CB 3.98Å; F87-C205 HydrophobicContact CG-CB 3.57Å; F87-C205 HydrophobicContact CZ-CB 4.17Å; F87-M208 HydrophobicContact CD1-SD 3.84Å; F87-M208 HydrophobicContact CE1-CB 4.22Å; F87-M208 HydrophobicContact CE1-SD 4.44Å; F87-I209 HydrophobicContact CE1-CD1 3.91Å; F87-I209 HydrophobicContact CE1-CG1 4Å; F87-I209 HydrophobicContact CZ-CD1 3.43Å; F87-I209 VanDerWaalsContact CZ-CD1 3.43Å; F87-I209 HydrophobicContact CZ-CG1 4.03Å; F87-V253 HydrophobicContact CD1-CG1 4.1Å; F87-V253 HydrophobicContact CE1-CG1 4.17Å
88T98.1Very high94.7Very high10 Ų1067.4 Ų67.46%0.06135%0.348CS..Hα-helixtrans-60.9-48.4178-57.70000111.6P84 L85 M86 A92 M208 V253 I254 M257P84-T88 WeakPolarHBondContact O-CB 3.4Å; P84-T88 PolarHBondContact O-N 2.87Å; P84-T88 PolarHBondContact O-OG1 3.13Å; L85-T88 WeakPolarHBondContact O-CB 3.29Å; L85-T88 PolarHBondContact O-N 2.8Å; L85-T88 VanDerWaalsContact O-N 3.08Å; M86-T88 VanDerWaalsContact C-N 3.34Å; M86-T88 PolarHBondContact O-N 2.83Å; T88-A92 VanDerWaalsContact O-CB 3.3Å; T88-A92 WeakPolarHBondContact O-CB 3.38Å; T88-A92 PolarHBondContact O-N 3.32Å; T88-M208 WeakPolarHBondContact OG1-CE 3.27Å; T88-V253 HydrophobicContact CG2-CG1 3.99Å; T88-I254 HydrophobicContact CG2-CB 4.4Å; T88-I254 HydrophobicContact CG2-CG1 3.59Å; T88-M257 HydrophobicContact CG2-CB 4.27Å
89V97.9Very high95.8Very high94 Ų9458.2 Ų58.257%0.5732%0.315SS*.Hα-helixtrans-64-49.5179.2175.60000110.8L85 M86 A92 G93L85-V89 PolarHBondContact O-N 2.99Å; M86-V89 PolarHBondContact O-N 3.5Å; V89-A92 PolarHBondContact O-N 3.04Å; V89-G93 PolarHBondContact O-N 3.45Å
90G98.1Very high96.6Very high38 Ų3857.4 Ų57.439%0.39231%0.31SS..Hα-helixtrans-62.4-45.2179.600000112.6M86 G93 C94M86-G90 PolarHBondContact O-N 3.08Å; G90-G93 PolarHBondContact O-N 2.96Å; G90-C94 WeakPolarHBondContact O-CB 3.18Å; G90-C94 PolarHBondContact O-N 2.89Å; G90-C94 PolarHBondContact O-SG 3.37Å; G90-C94 VanDerWaalsContact O-SG 3.32Å
91F98.3Very high97Very high48 Ų4850.3 Ų50.321%0.21129%0.286CS..Hα-helixtrans-64.8-45.3179.3-177.4-96000112.1F87 G93 C94 S95 I209 L249 V253F87-F91 WeakPolarHBondContact O-CB 3.23Å; F87-F91 PolarHBondContact O-N 2.99Å; F91-G93 VanDerWaalsContact C-N 3.35Å; F91-G93 PolarHBondContact O-N 3.32Å; F91-C94 PolarHBondContact O-N 2.81Å; F91-S95 VanDerWaalsContact O-CB 3.22Å; F91-S95 WeakPolarHBondContact O-CB 3.35Å; F91-S95 PolarHBondContact O-N 2.74Å; F91-I209 HydrophobicContact CD1-CD1 4.48Å; F91-I209 HydrophobicContact CD1-CG1 4.39Å; F91-I209 HydrophobicContact CD2-CD1 3.42Å; F91-I209 VanDerWaalsContact CD2-CD1 3.42Å; F91-I209 HydrophobicContact CD2-CG1 4.19Å; F91-I209 HydrophobicContact CE1-CD1 4.27Å; F91-I209 HydrophobicContact CE1-CG1 4.09Å; F91-I209 HydrophobicContact CE2-CD1 3.18Å; F91-I209 HydrophobicContact CE2-CG1 3.89Å; F91-I209 HydrophobicContact CG-CD1 4.08Å; F91-I209 HydrophobicContact CG-CG1 4.42Å; F91-I209 HydrophobicContact CZ-CD1 3.64Å; F91-I209 HydrophobicContact CZ-CG1 3.82Å; F91-I209 HydrophobicContact CZ-CG2 4.25Å; F91-L249 HydrophobicContact CE1-CB 3.98Å; F91-L249 HydrophobicContact CZ-CB 4.25Å; F91-V253 HydrophobicContact CD1-CB 4.16Å; F91-V253 HydrophobicContact CD1-CG2 3.46Å; F91-V253 VanDerWaalsContact CD1-CG2 3.46Å; F91-V253 HydrophobicContact CE1-CG2 3.63Å; F91-V253 HydrophobicContact CG-CG2 4.22Å
92A97.9Very high97.2Very high15 Ų1553.4 Ų53.412%0.12430%0.302CS..Hα-helixtrans-61.7-44176.700000111.3T88 V89 S95 F96T88-A92 VanDerWaalsContact O-CB 3.3Å; T88-A92 WeakPolarHBondContact O-CB 3.38Å; T88-A92 PolarHBondContact O-N 3.32Å; V89-A92 PolarHBondContact O-N 3.04Å; A92-S95 PolarHBondContact O-N 3.12Å; A92-F96 VanDerWaalsContact O-CD2 3.23Å; A92-F96 WeakPolarHBondContact O-CD2 3.46Å; A92-F96 PolarHBondContact O-N 2.86Å
93G97.2Very high97.3Very high46 Ų4648.8 Ų48.847%0.47428%0.282SS..Hα-helixtrans-58.1-50175.100000112.7V89 G90 F91 S95 F96 G97V89-G93 PolarHBondContact O-N 3.45Å; G90-G93 PolarHBondContact O-N 2.96Å; F91-G93 VanDerWaalsContact C-N 3.35Å; F91-G93 PolarHBondContact O-N 3.32Å; G93-S95 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 2.92Å; G93-F96 PolarHBondContact O-N 3.45Å; G93-G97 PolarHBondContact O-N 3.49Å
94C97.7Very high97.3Very high94 Ų9442.7 Ų42.764%0.63526%0.26SS*.Hα-helixtrans-62.4-38175.7-70.50000112.4G90 F91 G97 G98G90-C94 WeakPolarHBondContact O-CB 3.18Å; G90-C94 PolarHBondContact O-N 2.89Å; G90-C94 PolarHBondContact O-SG 3.37Å; G90-C94 VanDerWaalsContact O-SG 3.32Å; F91-C94 PolarHBondContact O-N 2.81Å; C94-G97 PolarHBondContact O-N 3.15Å; C94-G98 PolarHBondContact O-N 3.47Å
95S97.8Very high97.2Very high18 Ų1844.6 Ų44.613%0.12627%0.269CS..Hα-helixtrans-63.7-48.1179.1-170.10000111.3F91 A92 G93 A99 A246F91-S95 VanDerWaalsContact O-CB 3.22Å; F91-S95 WeakPolarHBondContact O-CB 3.35Å; F91-S95 PolarHBondContact O-N 2.74Å; A92-S95 PolarHBondContact O-N 3.12Å; G93-S95 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 2.92Å; S95-A99 VanDerWaalsContact O-CB 3.31Å; S95-A99 WeakPolarHBondContact O-CB 3.43Å; S95-A99 PolarHBondContact O-N 2.98Å; S95-A246 WeakPolarHBondContact OG-CA 3.21Å
96F98.1Very high97Very high14 Ų1443.1 Ų43.16%0.06126%0.263CS..Hα-helixtrans-67.6-40.5175.4-78.3-64.9000112.9A92 G93 A99 A100 A246 V247 F340 Y344 I352 W353A92-F96 VanDerWaalsContact O-CD2 3.23Å; A92-F96 WeakPolarHBondContact O-CD2 3.46Å; A92-F96 PolarHBondContact O-N 2.86Å; G93-F96 PolarHBondContact O-N 3.45Å; F96-A99 PolarHBondContact O-N 2.99Å; F96-A100 WeakPolarHBondContact O-CB 3.5Å; F96-A100 PolarHBondContact O-N 3.36Å; F96-A246 HydrophobicContact CD1-CB 3.63Å; F96-A246 HydrophobicContact CE1-CB 3.74Å; F96-A246 HydrophobicContact CG-CB 4.22Å; F96-A246 HydrophobicContact CZ-CB 4.45Å; F96-V247 HydrophobicContact CE1-CG2 3.87Å; F96-V247 HydrophobicContact CZ-CG2 3.89Å; F96-F340 HydrophobicContact CZ-CZ 4.5Å; F96-Y344 AromaticContact CE1-CE2 3.59Å; F96-Y344 HydrophobicContact CE1-CE2 3.59Å; F96-Y344 AromaticContact CE1-CZ 3.65Å; F96-Y344 WeakPolarHBondContact CE1-OH 3.49Å; F96-Y344 HydrophobicContact CE2-CE2 4.25Å; F96-Y344 HydrophobicContact CZ-CD2 4.08Å; F96-Y344 AromaticContact CZ-CE2 3.33Å; F96-Y344 HydrophobicContact CZ-CE2 3.33Å; F96-Y344 AromaticContact CZ-CZ 3.84Å; F96-I352 HydrophobicContact CB-CG2 4.04Å; F96-I352 HydrophobicContact CD1-CG2 4.23Å; F96-I352 HydrophobicContact CD2-CD1 4.49Å; F96-I352 HydrophobicContact CD2-CG2 4.21Å; F96-I352 HydrophobicContact CE2-CD1 4.39Å; F96-I352 HydrophobicContact CG-CG2 3.89Å; F96-W353 HydrophobicContact CD1-CE3 4.15Å; F96-W353 HydrophobicContact CD1-CZ3 4.34Å
97G97.3Very high96.7Very high15 Ų1544 Ų4416%0.15527%0.269CS..Hα-helixtrans-63.8-46.8177.600000112.3G93 C94 A99 A100 I101 L359G93-G97 PolarHBondContact O-N 3.49Å; C94-G97 PolarHBondContact O-N 3.15Å; G97-A99 PolarHBondContact O-N 2.95Å; G97-A100 PolarHBondContact O-N 3.49Å; G97-I101 WeakPolarHBondContact O-CG1 3.37Å; G97-I101 PolarHBondContact O-N 2.81Å; G97-I101 VanDerWaalsContact O-N 3.08Å; G97-L359 VanDerWaalsContact CA-CD2 3.48Å
98G97.6Very high96.4Very high30 Ų3046 Ų4631%0.30928%0.277SS..Hα-helixtrans-60.8-44.2174.800000112.2C94 A100 I101 L102C94-G98 PolarHBondContact O-N 3.47Å; G98-A100 PolarHBondContact O-N 3.26Å; G98-I101 PolarHBondContact O-N 2.71Å; G98-L102 WeakPolarHBondContact O-CB 3.27Å; G98-L102 VanDerWaalsContact O-CG 3.26Å; G98-L102 WeakPolarHBondContact O-CG 3.45Å; G98-L102 PolarHBondContact O-N 3.42Å
99A97.5Very high96.1Very high9 Ų948.1 Ų48.17%0.07430%0.296CS..Hα-helixtrans-64.1-37.6176.400000113.3S95 F96 G97 L102 Q103 E242 A246 W353S95-A99 VanDerWaalsContact O-CB 3.31Å; S95-A99 WeakPolarHBondContact O-CB 3.43Å; S95-A99 PolarHBondContact O-N 2.98Å; F96-A99 PolarHBondContact O-N 2.99Å; G97-A99 PolarHBondContact O-N 2.95Å; A99-L102 PolarHBondContact O-N 2.98Å; A99-Q103 WeakPolarHBondContact O-CB 3.15Å; A99-Q103 PolarHBondContact O-N 3.26Å; A99-E242 HydrophobicContact CB-CB 4.33Å; A99-E242 WeakPolarHBondContact CB-O 3.36Å; A99-A246 HydrophobicContact CB-CB 3.63Å; A99-W353 HydrophobicContact CB-CH2 4.08Å; A99-W353 HydrophobicContact CB-CZ3 4.03Å
100A97.3Very high95.7Very high2 Ų249.7 Ų49.72%0.01729%0.292CS..Hα-helixtrans-63.2-42.8175.300000111.7F96 G97 G98 Y104 W353 R356 L359 V360F96-A100 WeakPolarHBondContact O-CB 3.5Å; F96-A100 PolarHBondContact O-N 3.36Å; G97-A100 PolarHBondContact O-N 3.49Å; G98-A100 PolarHBondContact O-N 3.26Å; A100-Y104 PolarHBondContact O-N 3.29Å; A100-Y104 VanDerWaalsContact O-N 3.08Å; A100-W353 HydrophobicContact CB-CZ3 4.4Å; A100-R356 HydrophobicContact CB-CB 3.97Å; A100-R356 HydrophobicContact CB-CG 4.24Å; A100-L359 HydrophobicContact CB-CD2 4.4Å; A100-V360 HydrophobicContact CB-CG2 4.29Å
101I96.6Very high95.3Very high36 Ų3651.4 Ų51.419%0.18529%0.294CS..Hα-helixtrans-65.7-47.3175.9-67.5167.5000110.7G97 G98 Q103 Y104 E105 W363G97-I101 WeakPolarHBondContact O-CG1 3.37Å; G97-I101 PolarHBondContact O-N 2.81Å; G97-I101 VanDerWaalsContact O-N 3.08Å; G98-I101 PolarHBondContact O-N 2.71Å; I101-Q103 VanDerWaalsContact C-N 3.3Å; I101-Q103 PolarHBondContact O-N 2.84Å; I101-Y104 WeakPolarHBondContact O-CB 3.23Å; I101-Y104 PolarHBondContact O-N 3.35Å; I101-Y104 VanDerWaalsContact O-N 3.13Å; I101-E105 HydrophobicContact CG2-CG 4.32Å; I101-E105 WeakPolarHBondContact O-CG 3.11Å; I101-E105 PolarHBondContact O-N 2.94Å; I101-W363 HydrophobicContact CD1-CB 4.44Å; I101-W363 HydrophobicContact CD1-CD2 4.14Å; I101-W363 HydrophobicContact CD1-CE3 4.08Å; I101-W363 HydrophobicContact CD1-CG 4.29Å; I101-W363 HydrophobicContact CG1-CB 4.25Å; I101-W363 HydrophobicContact CG1-CD2 4.35Å; I101-W363 HydrophobicContact CG1-CG 4.09Å; I101-W363 HydrophobicContact CG2-CD2 3.9Å; I101-W363 HydrophobicContact CG2-CG 4.05Å; I101-W363 HydrophobicContact CG2-CZ2 4.13Å
102L96.2Very high94.8Very high106 Ų10653.7 Ų53.756%0.55531%0.306SS*.Hα-helixtrans-60.5-39.8178.1-73.5172.1000112G98 A99 E105 T106G98-L102 WeakPolarHBondContact O-CB 3.27Å; G98-L102 VanDerWaalsContact O-CG 3.26Å; G98-L102 WeakPolarHBondContact O-CG 3.45Å; G98-L102 PolarHBondContact O-N 3.42Å; A99-L102 PolarHBondContact O-N 2.98Å; L102-E105 PolarHBondContact O-N 3.4Å; L102-T106 VanDerWaalsContact O-CB 3.26Å; L102-T106 WeakPolarHBondContact O-CB 3.23Å; L102-T106 PolarHBondContact O-N 3.13Å; L102-T106 PolarHBondContact O-OG1 3.23Å
103Q96.4Very high94.4Very high44 Ų4457.2 Ų57.221%0.20633%0.326CS..Hα-helixtrans-62.6-45174.8-177.8178.76200111A99 I101 T106 L107 E242 R356A99-Q103 WeakPolarHBondContact O-CB 3.15Å; A99-Q103 PolarHBondContact O-N 3.26Å; I101-Q103 VanDerWaalsContact C-N 3.3Å; I101-Q103 PolarHBondContact O-N 2.84Å; Q103-T106 PolarHBondContact O-N 2.97Å; Q103-L107 WeakPolarHBondContact O-CB 3.24Å; Q103-L107 PolarHBondContact O-N 3.44Å; Q103-E242 HydrophobicContact CB-CB 4.06Å; Q103-E242 HydrophobicContact CB-CG 3.96Å; Q103-R356 VanDerWaalsContact OE1-NE 3.07Å
104Y94.4Very high93.8Very high57 Ų5758 Ų5822%0.22433%0.328CS..Hα-helixtrans-60.2-48.4177.4170.5-100.5000111.9A100 I101 T106 L107 K108 V360 H364A100-Y104 PolarHBondContact O-N 3.29Å; A100-Y104 VanDerWaalsContact O-N 3.08Å; I101-Y104 WeakPolarHBondContact O-CB 3.23Å; I101-Y104 PolarHBondContact O-N 3.35Å; I101-Y104 VanDerWaalsContact O-N 3.13Å; Y104-T106 PolarHBondContact O-N 2.85Å; Y104-L107 PolarHBondContact O-N 3.23Å; Y104-K108 HydrophobicContact CE1-CD 4.43Å; Y104-K108 WeakPolarHBondContact O-CB 3.34Å; Y104-K108 PolarHBondContact O-N 3.32Å; Y104-V360 HydrophobicContact CD1-CG1 4.13Å; Y104-V360 HydrophobicContact CD2-CG1 3.32Å; Y104-V360 HydrophobicContact CE2-CG1 3.97Å; Y104-V360 HydrophobicContact CG-CG1 3.42Å; Y104-V360 VanDerWaalsContact CG-CG1 3.42Å; Y104-H364 AromaticContact CZ-ND1 3.83Å; Y104-H364 PolarHBondContact OH-ND1 3.35Å
105E94.4Very high93.2Very high40 Ų4059.4 Ų59.419%0.18732%0.323CS..Hα-helixtrans-65.1-39.6179.3-67.8-66.5160.200111.9I101 L102 K108 A109 W363 R367I101-E105 HydrophobicContact CG2-CG 4.32Å; I101-E105 WeakPolarHBondContact O-CG 3.11Å; I101-E105 PolarHBondContact O-N 2.94Å; L102-E105 PolarHBondContact O-N 3.4Å; E105-K108 PolarHBondContact O-N 3.42Å; E105-A109 WeakPolarHBondContact O-CB 3.24Å; E105-A109 PolarHBondContact O-N 3.35Å; E105-W363 PolarHBondContact OE1-NE1 3.28Å; E105-R367 IonicContact OE1-CZ 2.72Å; E105-R367 IonicContact OE1-NH1 3.41Å; E105-R367 PolarHBondContact OE1-NH1 2.84Å; E105-R367 IonicContact OE2-CZ 2.91Å; E105-R367 IonicContact OE2-NH1 3.68Å; E105-R367 PolarHBondContact OE2-NH1 2.95Å
106T93.2Very high92.5Very high44 Ų4462.1 Ų62.127%0.2734%0.336SS..Hα-helixtrans-64.3-43.3176.2-59.20000111.3L102 Q103 Y104 A109 R110L102-T106 VanDerWaalsContact O-CB 3.26Å; L102-T106 WeakPolarHBondContact O-CB 3.23Å; L102-T106 PolarHBondContact O-N 3.13Å; L102-T106 PolarHBondContact O-OG1 3.23Å; Q103-T106 PolarHBondContact O-N 2.97Å; Y104-T106 PolarHBondContact O-N 2.85Å; T106-A109 PolarHBondContact O-N 3.22Å; T106-R110 WeakPolarHBondContact O-CB 3.38Å; T106-R110 VanDerWaalsContact O-CG 3.28Å; T106-R110 WeakPolarHBondContact O-CG 3.37Å; T106-R110 PolarHBondContact O-N 3.37Å
107L91.8Very high91.6Very high109 Ų10963 Ų6357%0.57135%0.348SS*.Hα-helixtrans-65.2-44177.5-175.564.8000111.1Q103 Y104 R110 V111Q103-L107 WeakPolarHBondContact O-CB 3.24Å; Q103-L107 PolarHBondContact O-N 3.44Å; Y104-L107 PolarHBondContact O-N 3.23Å; L107-R110 PolarHBondContact O-N 3.03Å; L107-V111 WeakPolarHBondContact O-CG2 3.43Å; L107-V111 PolarHBondContact O-N 2.87Å
108K91.6Very high90.6Very high97 Ų9767.7 Ų67.742%0.42237%0.367SS..Hα-helixtrans-60.7-46.6176.4-175.9-176.8175.7-173.10111.7Y104 E105 R110 V111 Q112Y104-K108 HydrophobicContact CE1-CD 4.43Å; Y104-K108 WeakPolarHBondContact O-CB 3.34Å; Y104-K108 PolarHBondContact O-N 3.32Å; E105-K108 PolarHBondContact O-N 3.42Å; K108-R110 VanDerWaalsContact C-N 3.34Å; K108-R110 PolarHBondContact O-N 2.92Å; K108-V111 PolarHBondContact O-N 3.28Å; K108-Q112 PolarHBondContact O-N 3.45Å
109A91.1Very high89.5Confident54 Ų5472.6 Ų72.645%0.44638%0.381SS..Hα-helixtrans-60.2-44177.400000111.4E105 T106 V111 Q112 T113E105-A109 WeakPolarHBondContact O-CB 3.24Å; E105-A109 PolarHBondContact O-N 3.35Å; T106-A109 PolarHBondContact O-N 3.22Å; A109-V111 VanDerWaalsContact C-N 3.35Å; A109-V111 PolarHBondContact O-N 3.3Å; A109-Q112 PolarHBondContact O-N 2.95Å; A109-T113 WeakPolarHBondContact O-CG2 3.33Å; A109-T113 PolarHBondContact O-N 2.86Å; A109-T113 PolarHBondContact O-OG1 2.96Å; A109-T113 VanDerWaalsContact O-OG1 3.09Å
110R88.9Confident88.3Confident128 Ų12877.1 Ų77.148%0.48340%0.404SS..Hα-helixtrans-59.8-42.7176.2-75.6173.6176.5-172.2-3.6112.6T106 L107 K108 Q112 T113 A114 E163T106-R110 WeakPolarHBondContact O-CB 3.38Å; T106-R110 VanDerWaalsContact O-CG 3.28Å; T106-R110 WeakPolarHBondContact O-CG 3.37Å; T106-R110 PolarHBondContact O-N 3.37Å; L107-R110 PolarHBondContact O-N 3.03Å; K108-R110 VanDerWaalsContact C-N 3.34Å; K108-R110 PolarHBondContact O-N 2.92Å; R110-Q112 VanDerWaalsContact C-N 3.34Å; R110-T113 WeakPolarHBondContact CA-OG1 3.21Å; R110-T113 PolarHBondContact O-OG1 3.02Å; R110-A114 WeakPolarHBondContact O-CB 3.34Å; R110-A114 PolarHBondContact O-N 3.29Å; R110-E163 IonicContact NH2-OE1 2.79Å
111V90.4Very high87Confident73 Ų7383.7 Ų83.744%0.44243%0.434SS..Hα-helixtrans-65.2-39.8177171.20000111L107 K108 A109 A114 K115L107-V111 WeakPolarHBondContact O-CG2 3.43Å; L107-V111 PolarHBondContact O-N 2.87Å; K108-V111 PolarHBondContact O-N 3.28Å; A109-V111 VanDerWaalsContact C-N 3.35Å; A109-V111 PolarHBondContact O-N 3.3Å; V111-A114 PolarHBondContact O-N 2.86Å; V111-K115 WeakPolarHBondContact O-CG 3.43Å; V111-K115 PolarHBondContact O-N 3.13Å
112Q88.4Confident85.7Confident97 Ų9788.7 Ų88.745%0.45346%0.455SS..Hα-helixtrans-66.5-49.3177.6-169.861.542.200111.3K108 A109 R110 A114 K115 D116K108-Q112 PolarHBondContact O-N 3.45Å; A109-Q112 PolarHBondContact O-N 2.95Å; R110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-A114 PolarHBondContact O-N 3.3Å; Q112-K115 WeakPolarHBondContact O-CB 3.4Å; Q112-K115 PolarHBondContact O-N 3.27Å; Q112-K115 VanDerWaalsContact O-N 3.08Å; Q112-D116 PolarHBondContact NE2-OD1 2.99Å; Q112-D116 PolarHBondContact O-N 2.93Å
113T88Confident84.4Confident89 Ų8990.5 Ų90.555%0.54646%0.464SS..Hα-helixtrans-62.8-30.3178.352.60000113A109 R110 G117A109-T113 WeakPolarHBondContact O-CG2 3.33Å; A109-T113 PolarHBondContact O-N 2.86Å; A109-T113 PolarHBondContact O-OG1 2.96Å; A109-T113 VanDerWaalsContact O-OG1 3.09Å; R110-T113 WeakPolarHBondContact CA-OG1 3.21Å; R110-T113 PolarHBondContact O-OG1 3.02Å; T113-G117 WeakPolarHBondContact O-CA 3.35Å; T113-G117 PolarHBondContact O-N 3.13Å
114A85.6Confident82.9Confident62 Ų6292.7 Ų92.751%0.51248%0.48SS..Hα-helixtrans-68.2-39.8175.200000111.6R110 V111 Q112 E118R110-A114 WeakPolarHBondContact O-CB 3.34Å; R110-A114 PolarHBondContact O-N 3.29Å; V111-A114 PolarHBondContact O-N 2.86Å; Q112-A114 PolarHBondContact O-N 3.3Å; A114-E118 PolarHBondContact O-N 3.44Å; A114-E118 VanDerWaalsContact O-N 3.07Å
115K83.8Confident81.2Confident124 Ų12498.2 Ų98.254%0.53951%0.51SS..Hα-helixtrans-66.3-48.1174.7-69.7176.3176.7-170.90111.5V111 Q112 G117 E118 E119V111-K115 WeakPolarHBondContact O-CG 3.43Å; V111-K115 PolarHBondContact O-N 3.13Å; Q112-K115 WeakPolarHBondContact O-CB 3.4Å; Q112-K115 PolarHBondContact O-N 3.27Å; Q112-K115 VanDerWaalsContact O-N 3.08Å; K115-G117 VanDerWaalsContact C-N 3.29Å; K115-G117 PolarHBondContact O-N 3.43Å; K115-E118 PolarHBondContact O-N 3.02Å; K115-E119 PolarHBondContact O-N 2.58Å
116D84.3Confident79.2Confident75 Ų7599.7 Ų99.740%0.40154%0.536SS..Hα-helixtrans-65.8-35.2-179.8-54.7-16000111.2Q112 E119 L120Q112-D116 PolarHBondContact NE2-OD1 2.99Å; Q112-D116 PolarHBondContact O-N 2.93Å; D116-E119 PolarHBondContact O-N 2.89Å; D116-L120 WeakPolarHBondContact O-CB 3.36Å; D116-L120 PolarHBondContact O-N 3.48Å
117G79Confident77.7Confident31 Ų31102.8 Ų102.832%0.3256%0.559SS.*Hα-helixtrans-69.1-39.4177.100000113.2T113 K115 E119 L120 E121T113-G117 WeakPolarHBondContact O-CA 3.35Å; T113-G117 PolarHBondContact O-N 3.13Å; K115-G117 VanDerWaalsContact C-N 3.29Å; K115-G117 PolarHBondContact O-N 3.43Å; G117-E119 VanDerWaalsContact C-N 3.29Å; G117-E119 PolarHBondContact O-N 3.19Å; G117-L120 PolarHBondContact O-N 3.38Å; G117-E121 WeakPolarHBondContact O-CB 3.49Å; G117-E121 PolarHBondContact O-N 2.64Å
118E76.8Confident76.3Confident115 Ų115105.7 Ų105.754%0.53757%0.57SS.*Hα-helixtrans-64.6-35.2173.6-162.4-165.4142.400111.6A114 K115 K122A114-E118 PolarHBondContact O-N 3.44Å; A114-E118 VanDerWaalsContact O-N 3.07Å; K115-E118 PolarHBondContact O-N 3.02Å; E118-K122 WeakPolarHBondContact O-CD 3.44Å; E118-K122 VanDerWaalsContact O-CG 3.3Å; E118-K122 WeakPolarHBondContact O-CG 3.5Å; E118-K122 PolarHBondContact O-N 2.67Å; E118-K122 IonicContact OE1-NZ 3.98Å; E118-K122 PolarHBondContact OE1-NZ 2.99Å
119E73.9Confident75.2Confident132 Ų132106.6 Ų106.662%0.61758%0.58SS**Hα-helixtrans-70.1-42.4172.6-74.4-169.1160.100112.3K115 D116 G117 K122 L123K115-E119 PolarHBondContact O-N 2.58Å; D116-E119 PolarHBondContact O-N 2.89Å; G117-E119 VanDerWaalsContact C-N 3.29Å; G117-E119 PolarHBondContact O-N 3.19Å; E119-K122 PolarHBondContact O-N 3.3Å; E119-L123 WeakPolarHBondContact O-CG 3.23Å; E119-L123 PolarHBondContact O-N 3.43Å
120L72.4Confident74.1Confident104 Ų104110.8 Ų110.855%0.54559%0.592SS.*Hα-helixtrans-69.2-39.2-179.7-172.667.5000112.3D116 G117 K122 L123 V124D116-L120 WeakPolarHBondContact O-CB 3.36Å; D116-L120 PolarHBondContact O-N 3.48Å; G117-L120 PolarHBondContact O-N 3.38Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 2.97Å; L120-L123 CarbonylContact O-C 3.55Å; L120-L123 WeakPolarHBondContact O-CA 3.46Å; L120-L123 WeakPolarHBondContact O-CB 3.46Å; L120-L123 PolarHBondContact O-N 2.89Å; L120-V124 HydrophobicContact CD1-CG2 3.74Å; L120-V124 HydrophobicContact CG-CG2 3.84Å; L120-V124 WeakPolarHBondContact O-CB 3.35Å; L120-V124 VanDerWaalsContact O-CG2 3.25Å; L120-V124 WeakPolarHBondContact O-CG2 3.43Å; L120-V124 PolarHBondContact O-N 3.15Å
121E70Confident73.4Confident140 Ų140107.7 Ų107.765%0.65459%0.594SS**Hα-helixtrans-62.2-38.7177.2-170.6172-17900111.3G117 L123 V124 M125G117-E121 WeakPolarHBondContact O-CB 3.49Å; G117-E121 PolarHBondContact O-N 2.64Å; E121-L123 PolarHBondContact O-N 3.34Å; E121-V124 PolarHBondContact O-N 2.88Å; E121-M125 PolarHBondContact O-N 3.25Å
122K68.7Low73Confident142 Ų142111.8 Ų111.862%0.61760%0.602SS**Hα-helixtrans-62.4-28.6171.9-71.6170.2-171163.60113E118 E119 L120E118-K122 WeakPolarHBondContact O-CD 3.44Å; E118-K122 VanDerWaalsContact O-CG 3.3Å; E118-K122 WeakPolarHBondContact O-CG 3.5Å; E118-K122 PolarHBondContact O-N 2.67Å; E118-K122 IonicContact OE1-NZ 3.98Å; E118-K122 PolarHBondContact OE1-NZ 2.99Å; E119-K122 PolarHBondContact O-N 3.3Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 2.97Å
123L69.6Low72.5Confident143 Ų143114 Ų11475%0.74961%0.606SS**Hα-helixtrans-88.7-28.2179-67.7169.2000113.4E119 L120 E121E119-L123 WeakPolarHBondContact O-CG 3.23Å; E119-L123 PolarHBondContact O-N 3.43Å; L120-L123 CarbonylContact O-C 3.55Å; L120-L123 WeakPolarHBondContact O-CA 3.46Å; L120-L123 WeakPolarHBondContact O-CB 3.46Å; L120-L123 PolarHBondContact O-N 2.89Å; E121-L123 PolarHBondContact O-N 3.34Å
124V64.7Low72.1Confident91 Ų91115.8 Ų115.855%0.55261%0.608SS**Hα-helixtrans-97-4.7-169.1173.60000113.6L120 E121 G126L120-V124 HydrophobicContact CD1-CG2 3.74Å; L120-V124 HydrophobicContact CG-CG2 3.84Å; L120-V124 WeakPolarHBondContact O-CB 3.35Å; L120-V124 VanDerWaalsContact O-CG2 3.25Å; L120-V124 WeakPolarHBondContact O-CG2 3.43Å; L120-V124 PolarHBondContact O-N 3.15Å; E121-V124 PolarHBondContact O-N 2.88Å; V124-G126 PolarHBondContact O-N 3.03Å
125M57.9Low72Confident172 Ų172117.5 Ų117.585%0.84761%0.609SS**THydrogen-bonded Turntrans-59.411.7174-87-166.173.400116.1E121E121-M125 PolarHBondContact O-N 3.25Å
126G54.1Low72.2Confident71 Ų71115.9 Ų115.973%0.73260%0.599SS**THydrogen-bonded Turntrans-108.5-12.1-174.100000118V124V124-G126 PolarHBondContact O-N 3.03Å
127S61.4Low72.2Confident109 Ų109116.4 Ų116.476%0.76260%0.596SS**  trans-159.8106.7178.691.60000113.6
128Q62.3Low72.6Confident170 Ų170118.5 Ų118.579%0.79460%0.6SS**  trans-136.791163.8-140179.89.800109
129D67.7Low73.3Confident117 Ų117120.1 Ų120.163%0.62661%0.607SS**  trans-94.4110.4-175.3-151.9-14000110A131 Y132D129-A131 PolarHBondContact O-N 3.05Å; D129-Y132 PolarHBondContact O-N 2.91Å
130M68.2Low74Confident142 Ų142115 Ų11570%0.758%0.584SS**Hα-helixtrans-63.8-22-178.4-72.9-68.1171.900112.4Y132 W133 H134M130-Y132 VanDerWaalsContact C-N 3.32Å; M130-Y132 PolarHBondContact O-N 2.81Å; M130-W133 PolarHBondContact O-N 3.25Å; M130-H134 PolarHBondContact O-N 2.97Å
131A74.9Confident75Confident63 Ų63112.8 Ų112.852%0.52158%0.577SS.*Hα-helixtrans-64.3-34.4177.900000113D129 N135D129-A131 PolarHBondContact O-N 3.05Å; A131-N135 PolarHBondContact O-N 2.97Å
132Y80.8Confident75.9Confident158 Ų158111.2 Ų111.262%0.6258%0.582SS**Hα-helixtrans-63.1-49178.5173.8-97.4000111.9D129 M130 H134 N135 W136D129-Y132 PolarHBondContact O-N 2.91Å; M130-Y132 VanDerWaalsContact C-N 3.32Å; M130-Y132 PolarHBondContact O-N 2.81Å; Y132-H134 VanDerWaalsContact C-N 3.31Å; Y132-H134 PolarHBondContact O-N 3.36Å; Y132-N135 PolarHBondContact O-N 3.48Å; Y132-W136 WeakPolarHBondContact O-CB 3.07Å; Y132-W136 PolarHBondContact O-N 3.16Å
133W78.6Confident77.1Confident143 Ų143111.6 Ų111.654%0.54258%0.584SS.*Hα-helixtrans-63.3-37.9-178.7-76.6101.1000112.5M130 W136 W137M130-W133 PolarHBondContact O-N 3.25Å; W133-W136 HydrophobicContact CE3-CE3 4.02Å; W133-W136 HydrophobicContact CE3-CZ3 4.29Å; W133-W136 HydrophobicContact CZ3-CE3 4.21Å; W133-W136 HydrophobicContact CZ3-CZ3 4.16Å; W133-W137 WeakPolarHBondContact O-CB 3.26Å; W133-W137 PolarHBondContact O-N 3.38Å
134H78.9Confident78.1Confident128 Ų128109.1 Ų109.159%0.59357%0.568SS**Hα-helixtrans-67.1-41.7178.3-168-94.6000112.1M130 Y132 W137 N138M130-H134 PolarHBondContact O-N 2.97Å; Y132-H134 VanDerWaalsContact C-N 3.31Å; Y132-H134 PolarHBondContact O-N 3.36Å; H134-W137 PolarHBondContact O-N 2.91Å; H134-N138 PolarHBondContact CE1-ND2 2.95Å; H134-N138 VanDerWaalsContact CE1-ND2 3.29Å; H134-N138 PolarHBondContact ND1-ND2 3.42Å; H134-N138 PolarHBondContact O-N 3.34Å; H134-N138 PolarHBondContact O-ND2 3.4Å; H134-N138 VanDerWaalsContact O-ND2 3.13Å
135N84.8Confident79.3Confident98 Ų98108.3 Ų108.352%0.52456%0.555SS.*Hα-helixtrans-68.2-43.4177.7-162.56.6000111.6A131 Y132 W137 N138 Q139A131-N135 PolarHBondContact O-N 2.97Å; Y132-N135 PolarHBondContact O-N 3.48Å; N135-W137 PolarHBondContact O-N 2.81Å; N135-N138 PolarHBondContact O-N 3.2Å; N135-Q139 PolarHBondContact O-N 2.9Å
136W87.4Confident80.9Confident89 Ų89106.2 Ų106.234%0.33754%0.543SS..Hα-helixtrans-58.2-45.1174175.682.5000112.4Y132 W133 N138 Q139 L140 L148Y132-W136 WeakPolarHBondContact O-CB 3.07Å; Y132-W136 PolarHBondContact O-N 3.16Å; W133-W136 HydrophobicContact CE3-CE3 4.02Å; W133-W136 HydrophobicContact CE3-CZ3 4.29Å; W133-W136 HydrophobicContact CZ3-CE3 4.21Å; W133-W136 HydrophobicContact CZ3-CZ3 4.16Å; W136-N138 PolarHBondContact O-N 2.94Å; W136-Q139 PolarHBondContact O-N 3.44Å; W136-Q139 VanDerWaalsContact O-N 3.14Å; W136-L140 HydrophobicContact CE3-CD1 4.3Å; W136-L140 HydrophobicContact CH2-CD1 3.9Å; W136-L140 HydrophobicContact CZ2-CD1 4.24Å; W136-L140 HydrophobicContact CZ2-CD2 4.37Å; W136-L140 HydrophobicContact CZ3-CD1 3.94Å; W136-L148 HydrophobicContact CH2-CD1 3.85Å; W136-L148 HydrophobicContact CH2-CD2 4.47Å; W136-L148 HydrophobicContact CZ3-CD1 4.44Å
137W85Confident82.7Confident86 Ų86107 Ų10733%0.32653%0.531SS..Hα-helixtrans-59.4-37.2178.2-173.4-97.2000112.4W133 H134 N135 Q139 L140 R145 L148 L149W133-W137 WeakPolarHBondContact O-CB 3.26Å; W133-W137 PolarHBondContact O-N 3.38Å; H134-W137 PolarHBondContact O-N 2.91Å; N135-W137 PolarHBondContact O-N 2.81Å; W137-Q139 VanDerWaalsContact C-N 3.3Å; W137-Q139 PolarHBondContact O-N 3.32Å; W137-L140 HydrophobicContact CE3-CD1 4.15Å; W137-L140 PolarHBondContact O-N 3.25Å; W137-R145 HydrophobicContact CZ2-CB 4.2Å; W137-R145 HydrophobicContact CZ2-CG 4.31Å; W137-R145 PolarHBondContact O-NE 3.29Å; W137-R145 PolarHBondContact O-NH2 3.46Å; W137-L148 HydrophobicContact CH2-CB 4.22Å; W137-L148 HydrophobicContact CZ3-CB 4.17Å; W137-L148 HydrophobicContact CZ3-CD1 4.17Å; W137-L149 HydrophobicContact CH2-CD2 4.1Å; W137-L149 HydrophobicContact CH2-CG 4.19Å; W137-L149 HydrophobicContact CZ2-CD2 4.3Å; W137-L149 HydrophobicContact CZ2-CG 4.36Å
138N86.5Confident84.1Confident75 Ų75104.8 Ų104.840%0.40151%0.51SS..Hα-helixtrans-74.2-16.9-179-72.8-32.1000114.1H134 N135 W136 R145H134-N138 PolarHBondContact CE1-ND2 2.95Å; H134-N138 VanDerWaalsContact CE1-ND2 3.29Å; H134-N138 PolarHBondContact ND1-ND2 3.42Å; H134-N138 PolarHBondContact O-N 3.34Å; H134-N138 PolarHBondContact O-ND2 3.4Å; H134-N138 VanDerWaalsContact O-ND2 3.13Å; N135-N138 PolarHBondContact O-N 3.2Å; W136-N138 PolarHBondContact O-N 2.94Å; N138-R145 VanDerWaalsContact C-NH2 3.3Å; N138-R145 VanDerWaalsContact CA-NH2 3.35Å; N138-R145 PolarHBondContact O-NH2 2.92Å
139Q90.8Very high85.4Confident149 Ų149100.6 Ų100.670%0.69649%0.492SS*.Hα-helixtrans-81.9-14175-67.3179.65.200113.4N135 W136 W137N135-Q139 PolarHBondContact O-N 2.9Å; W136-Q139 PolarHBondContact O-N 3.44Å; W136-Q139 VanDerWaalsContact O-N 3.14Å; W137-Q139 VanDerWaalsContact C-N 3.3Å; W137-Q139 PolarHBondContact O-N 3.32Å
140L89.5Confident86.6Confident26 Ų2699.7 Ų99.714%0.13649%0.487CS..SBendtrans-77143.3-179-63.9167.4000112W136 W137 Q144 R145 L148W136-L140 HydrophobicContact CE3-CD1 4.3Å; W136-L140 HydrophobicContact CH2-CD1 3.9Å; W136-L140 HydrophobicContact CZ2-CD1 4.24Å; W136-L140 HydrophobicContact CZ2-CD2 4.37Å; W136-L140 HydrophobicContact CZ3-CD1 3.94Å; W137-L140 HydrophobicContact CE3-CD1 4.15Å; W137-L140 PolarHBondContact O-N 3.25Å; L140-Q144 HydrophobicContact CB-CB 4.08Å; L140-Q144 HydrophobicContact CD2-CB 4.11Å; L140-R145 HydrophobicContact CB-CG 3.73Å; L140-R145 HydrophobicContact CD1-CG 4.33Å; L140-R145 PolarHBondContact O-NE 3.4Å; L140-R145 PolarHBondContact O-NH2 3.25Å; L140-R145 VanDerWaalsContact O-NH2 3.1Å; L140-L148 HydrophobicContact CD1-CD1 3.38Å; L140-L148 HydrophobicContact CD2-CD1 4.48Å
141S93.1Very high87.7Confident56 Ų5696.8 Ų96.839%0.39248%0.477SS..  trans-65.9160.2171.375.80000111.8F143 Q144 R145S141-F143 PolarHBondContact O-N 3.03Å; S141-Q144 PolarHBondContact O-N 3.4Å; S141-Q144 VanDerWaalsContact O-N 3.1Å; S141-Q144 WeakPolarHBondContact OG-CG 3.23Å; S141-Q144 PolarHBondContact OG-N 3.24Å; S141-Q144 PolarHBondContact OG-OE1 3.27Å; S141-R145 WeakPolarHBondContact O-CG 3.3Å; S141-R145 PolarHBondContact O-N 3.48Å
142S89.5Confident88.5Confident107 Ų10796.3 Ų96.375%0.74847%0.47SS*.Hα-helixtrans-56.2-40.317854.90000112.4Q146S142-Q146 WeakPolarHBondContact O-CB 3.44Å; S142-Q146 PolarHBondContact O-N 3.34Å
143F92.6Very high89Confident150 Ų15095.3 Ų95.366%0.65847%0.472SS*.Hα-helixtrans-64-44.6175179-102.4000112.5S141 R145 Q146 L147S141-F143 PolarHBondContact O-N 3.03Å; F143-R145 PolarHBondContact O-N 3.43Å; F143-Q146 PolarHBondContact O-N 2.86Å; F143-L147 WeakPolarHBondContact O-CB 3.44Å; F143-L147 PolarHBondContact O-N 2.99Å
144Q90.6Very high89.7Confident91 Ų9192.6 Ų92.643%0.42547%0.471SS..Hα-helixtrans-62.9-42.3178.6-75.4171.3-27.300112.1L140 S141 L147 L148L140-Q144 HydrophobicContact CB-CB 4.08Å; L140-Q144 HydrophobicContact CD2-CB 4.11Å; S141-Q144 PolarHBondContact O-N 3.4Å; S141-Q144 VanDerWaalsContact O-N 3.1Å; S141-Q144 WeakPolarHBondContact OG-CG 3.23Å; S141-Q144 PolarHBondContact OG-N 3.24Å; S141-Q144 PolarHBondContact OG-OE1 3.27Å; Q144-L147 PolarHBondContact O-N 3.05Å; Q144-L148 PolarHBondContact O-N 3.42Å
145R90.8Very high90.3Very high75 Ų7589.4 Ų89.428%0.28346%0.459SS..Hα-helixtrans-62.6-44.9175.2-64.2-179.7-158.5-164.54.1111.4W137 N138 L140 S141 F143 L147 L148 L149W137-R145 HydrophobicContact CZ2-CB 4.2Å; W137-R145 HydrophobicContact CZ2-CG 4.31Å; W137-R145 PolarHBondContact O-NE 3.29Å; W137-R145 PolarHBondContact O-NH2 3.46Å; N138-R145 VanDerWaalsContact C-NH2 3.3Å; N138-R145 VanDerWaalsContact CA-NH2 3.35Å; N138-R145 PolarHBondContact O-NH2 2.92Å; L140-R145 HydrophobicContact CB-CG 3.73Å; L140-R145 HydrophobicContact CD1-CG 4.33Å; L140-R145 PolarHBondContact O-NE 3.4Å; L140-R145 PolarHBondContact O-NH2 3.25Å; L140-R145 VanDerWaalsContact O-NH2 3.1Å; S141-R145 WeakPolarHBondContact O-CG 3.3Å; S141-R145 PolarHBondContact O-N 3.48Å; F143-R145 PolarHBondContact O-N 3.43Å; R145-L147 VanDerWaalsContact C-N 3.3Å; R145-L147 PolarHBondContact O-N 3.41Å; R145-L148 PolarHBondContact O-N 2.92Å; R145-L149 WeakPolarHBondContact O-CG 3.35Å; R145-L149 PolarHBondContact O-N 3.42Å
146Q91.6Very high90.6Very high127 Ų12789.5 Ų89.559%0.59346%0.459SS*.Hα-helixtrans-61.7-40.1177.6-168.965.121.900111.9S142 F143 L150S142-Q146 WeakPolarHBondContact O-CB 3.44Å; S142-Q146 PolarHBondContact O-N 3.34Å; F143-Q146 PolarHBondContact O-N 2.86Å; Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 PolarHBondContact O-N 2.92Å
147L92.1Very high90.9Very high89 Ų8991 Ų9147%0.46647%0.468SS..Hα-helixtrans-65-44.1175.5-178.263000111.6F143 Q144 R145 L150 V151F143-L147 WeakPolarHBondContact O-CB 3.44Å; F143-L147 PolarHBondContact O-N 2.99Å; Q144-L147 PolarHBondContact O-N 3.05Å; R145-L147 VanDerWaalsContact C-N 3.3Å; R145-L147 PolarHBondContact O-N 3.41Å; L147-L150 PolarHBondContact O-N 2.92Å; L147-V151 HydrophobicContact CD1-CG2 4.48Å; L147-V151 VanDerWaalsContact O-CG2 3.3Å; L147-V151 WeakPolarHBondContact O-CG2 3.1Å; L147-V151 PolarHBondContact O-N 3.49Å
148L90.3Very high91.3Very high62 Ų6291.9 Ų91.933%0.32547%0.472SS..Hα-helixtrans-62.4-42.1176.5-83.3158.7000112.4W136 W137 L140 Q144 R145 L150 V151 S152W136-L148 HydrophobicContact CH2-CD1 3.85Å; W136-L148 HydrophobicContact CH2-CD2 4.47Å; W136-L148 HydrophobicContact CZ3-CD1 4.44Å; W137-L148 HydrophobicContact CH2-CB 4.22Å; W137-L148 HydrophobicContact CZ3-CB 4.17Å; W137-L148 HydrophobicContact CZ3-CD1 4.17Å; L140-L148 HydrophobicContact CD1-CD1 3.38Å; L140-L148 HydrophobicContact CD2-CD1 4.48Å; Q144-L148 PolarHBondContact O-N 3.42Å; R145-L148 PolarHBondContact O-N 2.92Å; L148-L150 VanDerWaalsContact C-N 3.32Å; L148-L150 PolarHBondContact O-N 3.41Å; L148-V151 PolarHBondContact O-N 3.35Å; L148-S152 WeakPolarHBondContact O-CB 3.49Å; L148-S152 PolarHBondContact O-N 3.38Å
149L90.2Very high91.5Very high82 Ų8296 Ų9643%0.42948%0.481SS..Hα-helixtrans-63.3-38.6174.6-70.8173.7000112W137 R145 S152 M153W137-L149 HydrophobicContact CH2-CD2 4.1Å; W137-L149 HydrophobicContact CH2-CG 4.19Å; W137-L149 HydrophobicContact CZ2-CD2 4.3Å; W137-L149 HydrophobicContact CZ2-CG 4.36Å; R145-L149 WeakPolarHBondContact O-CG 3.35Å; R145-L149 PolarHBondContact O-N 3.42Å; L149-S152 PolarHBondContact O-N 2.92Å; L149-S152 PolarHBondContact O-OG 3.4Å; L149-M153 WeakPolarHBondContact O-CB 3.48Å; L149-M153 PolarHBondContact O-N 2.98Å
150L92.2Very high91.7Very high98 Ų9893.1 Ų93.151%0.51348%0.478SS..Hα-helixtrans-66.2-45.5175.1-170.1155.4000110.8Q146 L147 L148 S152 M153 V154Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 PolarHBondContact O-N 2.92Å; L147-L150 PolarHBondContact O-N 2.92Å; L148-L150 VanDerWaalsContact C-N 3.32Å; L148-L150 PolarHBondContact O-N 3.41Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 2.84Å; L150-M153 PolarHBondContact O-N 3.19Å; L150-V154 HydrophobicContact CD2-CG2 4.06Å; L150-V154 WeakPolarHBondContact O-CG2 3.46Å; L150-V154 PolarHBondContact O-N 2.81Å
151V91.7Very high91.9Very high81 Ų8192.5 Ų92.549%0.49147%0.474SS..Hα-helixtrans-61.2-41.4176.2170.80000110.9L147 L148 V154 D155L147-V151 HydrophobicContact CD1-CG2 4.48Å; L147-V151 VanDerWaalsContact O-CG2 3.3Å; L147-V151 WeakPolarHBondContact O-CG2 3.1Å; L147-V151 PolarHBondContact O-N 3.49Å; L148-V151 PolarHBondContact O-N 3.35Å; V151-V154 PolarHBondContact O-N 3.19Å; V151-D155 WeakPolarHBondContact O-CB 3.39Å; V151-D155 PolarHBondContact O-N 2.8Å
152S90.9Very high92.1Very high52 Ų5292.7 Ų92.736%0.36447%0.473SS..Hα-helixtrans-66.1-43.1176.995.80000111.4L148 L149 L150 V154 D155 D156L148-S152 WeakPolarHBondContact O-CB 3.49Å; L148-S152 PolarHBondContact O-N 3.38Å; L149-S152 PolarHBondContact O-N 2.92Å; L149-S152 PolarHBondContact O-OG 3.4Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 2.84Å; S152-V154 VanDerWaalsContact C-N 3.28Å; S152-V154 PolarHBondContact O-N 3.34Å; S152-D155 CarbonylContact O-C 3.6Å; S152-D155 PolarHBondContact O-N 2.96Å; S152-D155 VanDerWaalsContact O-N 3.1Å; S152-D156 WeakPolarHBondContact O-CB 3.45Å; S152-D156 VanDerWaalsContact O-CG 3.31Å; S152-D156 PolarHBondContact O-N 3.22Å
153M92.9Very high92.3Very high138 Ų13891.4 Ų91.468%0.6846%0.455SS*.Hα-helixtrans-59.8-40175.8-177.6-175.4-67.900111.7L149 L150 F157L149-M153 WeakPolarHBondContact O-CB 3.48Å; L149-M153 PolarHBondContact O-N 2.98Å; L150-M153 PolarHBondContact O-N 3.19Å; M153-F157 VanDerWaalsContact O-CB 3.32Å; M153-F157 WeakPolarHBondContact O-CB 3.22Å; M153-F157 PolarHBondContact O-N 2.86Å
154V91.4Very high92.4Very high85 Ų8584.3 Ų84.352%0.51543%0.425SS..Hα-helixtrans-66.7-41.4174.8170.90000111.1L150 V151 S152 F157 W158L150-V154 HydrophobicContact CD2-CG2 4.06Å; L150-V154 WeakPolarHBondContact O-CG2 3.46Å; L150-V154 PolarHBondContact O-N 2.81Å; V151-V154 PolarHBondContact O-N 3.19Å; S152-V154 VanDerWaalsContact C-N 3.28Å; S152-V154 PolarHBondContact O-N 3.34Å; V154-F157 PolarHBondContact O-N 3.45Å; V154-W158 VanDerWaalsContact O-CB 3.25Å; V154-W158 WeakPolarHBondContact O-CB 3.38Å; V154-W158 PolarHBondContact O-N 2.86Å
155D91.6Very high92.7Very high61 Ų6181.9 Ų81.933%0.32641%0.414SS..Hα-helixtrans-64.3-45.5176.8-168.248.3000111.4V151 S152 F157 W158 R159V151-D155 WeakPolarHBondContact O-CB 3.39Å; V151-D155 PolarHBondContact O-N 2.8Å; S152-D155 CarbonylContact O-C 3.6Å; S152-D155 PolarHBondContact O-N 2.96Å; S152-D155 VanDerWaalsContact O-N 3.1Å; D155-F157 PolarHBondContact O-N 2.85Å; D155-W158 WeakPolarHBondContact O-CB 3.23Å; D155-W158 PolarHBondContact O-N 3.27Å; D155-R159 VanDerWaalsContact CG-NE 3.33Å; D155-R159 WeakPolarHBondContact O-CB 3.31Å; D155-R159 VanDerWaalsContact O-CG 3.24Å; D155-R159 WeakPolarHBondContact O-CG 3.1Å; D155-R159 PolarHBondContact O-N 2.98Å; D155-R159 IonicContact OD1-CZ 3.77Å; D155-R159 IonicContact OD1-NE 3.51Å; D155-R159 PolarHBondContact OD1-NE 3.13Å; D155-R159 IonicContact OD1-NH2 3.95Å; D155-R159 IonicContact OD2-CZ 2.94Å; D155-R159 VanDerWaalsContact OD2-CZ 3.26Å; D155-R159 IonicContact OD2-NE 2.84Å; D155-R159 PolarHBondContact OD2-NE 2.94Å; D155-R159 IonicContact OD2-NH2 2.73Å; D155-R159 PolarHBondContact OD2-NH2 2.89Å
156D92.1Very high93Very high100 Ų10082.5 Ų82.554%0.53542%0.416SS..Hα-helixtrans-60.9-45.8176.1-71.1-27.6000111.4S152 R159 S160S152-D156 WeakPolarHBondContact O-CB 3.45Å; S152-D156 VanDerWaalsContact O-CG 3.31Å; S152-D156 PolarHBondContact O-N 3.22Å; D156-R159 PolarHBondContact O-N 3.32Å; D156-S160 PolarHBondContact O-N 2.73Å
157F93.1Very high93.2Very high120 Ų12077.9 Ų77.953%0.52640%0.396SS..Hα-helixtrans-59.4-49173.7173.5-101.9000111M153 V154 D155 R159 S160 L161M153-F157 VanDerWaalsContact O-CB 3.32Å; M153-F157 WeakPolarHBondContact O-CB 3.22Å; M153-F157 PolarHBondContact O-N 2.86Å; V154-F157 PolarHBondContact O-N 3.45Å; D155-F157 PolarHBondContact O-N 2.85Å; F157-R159 VanDerWaalsContact C-N 3.29Å; F157-R159 PolarHBondContact O-N 3.33Å; F157-S160 WeakPolarHBondContact O-CB 3.27Å; F157-S160 PolarHBondContact O-N 2.81Å; F157-S160 VanDerWaalsContact O-N 3.09Å; F157-S160 PolarHBondContact O-OG 3.45Å; F157-L161 HydrophobicContact CE1-CD1 4Å; F157-L161 HydrophobicContact CE1-CD2 4.29Å; F157-L161 HydrophobicContact CE1-CG 4.33Å; F157-L161 HydrophobicContact CE2-CD2 4.18Å; F157-L161 HydrophobicContact CZ-CD1 4.38Å; F157-L161 HydrophobicContact CZ-CD2 3.88Å; F157-L161 HydrophobicContact CZ-CG 4.4Å; F157-L161 PolarHBondContact O-N 2.68Å
158W92.9Very high93.5Very high106 Ų10673.6 Ų73.640%0.40237%0.374SS..Hα-helixtrans-59.3-40.9178.9-178.1-102.8000112.1V154 D155 S160 L161 R166 T169V154-W158 VanDerWaalsContact O-CB 3.25Å; V154-W158 WeakPolarHBondContact O-CB 3.38Å; V154-W158 PolarHBondContact O-N 2.86Å; D155-W158 WeakPolarHBondContact O-CB 3.23Å; D155-W158 PolarHBondContact O-N 3.27Å; W158-S160 VanDerWaalsContact C-N 3.34Å; W158-L161 HydrophobicContact CE3-CD1 4.13Å; W158-L161 WeakPolarHBondContact O-CB 3.28Å; W158-L161 PolarHBondContact O-N 2.93Å; W158-R166 HydrophobicContact CD2-CG 4.32Å; W158-R166 HydrophobicContact CH2-CB 4.02Å; W158-R166 HydrophobicContact CH2-CG 4.3Å; W158-R166 HydrophobicContact CZ2-CB 3.9Å; W158-R166 HydrophobicContact CZ2-CG 3.99Å; W158-R166 PolarHBondContact O-NE 2.93Å; W158-R166 PolarHBondContact O-NH2 3.49Å; W158-T169 HydrophobicContact CZ3-CG2 3.86Å
159R92.4Very high93.8Very high161 Ų16172.6 Ų72.661%0.60837%0.371SS*.Hα-helixtrans-66.8-32.8175.5-73176.6-168-102.61.2112.6D155 D156 F157 L161 R166D155-R159 VanDerWaalsContact CG-NE 3.33Å; D155-R159 WeakPolarHBondContact O-CB 3.31Å; D155-R159 VanDerWaalsContact O-CG 3.24Å; D155-R159 WeakPolarHBondContact O-CG 3.1Å; D155-R159 PolarHBondContact O-N 2.98Å; D155-R159 IonicContact OD1-CZ 3.77Å; D155-R159 IonicContact OD1-NE 3.51Å; D155-R159 PolarHBondContact OD1-NE 3.13Å; D155-R159 IonicContact OD1-NH2 3.95Å; D155-R159 IonicContact OD2-CZ 2.94Å; D155-R159 VanDerWaalsContact OD2-CZ 3.26Å; D155-R159 IonicContact OD2-NE 2.84Å; D155-R159 PolarHBondContact OD2-NE 2.94Å; D155-R159 IonicContact OD2-NH2 2.73Å; D155-R159 PolarHBondContact OD2-NH2 2.89Å; D156-R159 PolarHBondContact O-N 3.32Å; F157-R159 VanDerWaalsContact C-N 3.29Å; F157-R159 PolarHBondContact O-N 3.33Å; R159-L161 VanDerWaalsContact C-N 3.26Å; R159-L161 PolarHBondContact O-N 2.79Å; R159-R166 PolarHBondContact O-NH2 3.41Å
160S93.9Very high94.1Very high88 Ų8870.7 Ų70.762%0.61537%0.37SS*.Hα-helixtrans-68-23.8175.580.30000113.7D156 F157 W158D156-S160 PolarHBondContact O-N 2.73Å; F157-S160 WeakPolarHBondContact O-CB 3.27Å; F157-S160 PolarHBondContact O-N 2.81Å; F157-S160 VanDerWaalsContact O-N 3.09Å; F157-S160 PolarHBondContact O-OG 3.45Å; W158-S160 VanDerWaalsContact C-N 3.34Å
161L94.2Very high94.4Very high13 Ų1366.4 Ų66.47%0.06835%0.348CS..SBendtrans-69.7141.2-179.2-62.3-178000112.2F157 W158 R159 Q165 R166 W229F157-L161 HydrophobicContact CE1-CD1 4Å; F157-L161 HydrophobicContact CE1-CD2 4.29Å; F157-L161 HydrophobicContact CE1-CG 4.33Å; F157-L161 HydrophobicContact CE2-CD2 4.18Å; F157-L161 HydrophobicContact CZ-CD1 4.38Å; F157-L161 HydrophobicContact CZ-CD2 3.88Å; F157-L161 HydrophobicContact CZ-CG 4.4Å; F157-L161 PolarHBondContact O-N 2.68Å; W158-L161 HydrophobicContact CE3-CD1 4.13Å; W158-L161 WeakPolarHBondContact O-CB 3.28Å; W158-L161 PolarHBondContact O-N 2.93Å; R159-L161 VanDerWaalsContact C-N 3.26Å; R159-L161 PolarHBondContact O-N 2.79Å; L161-Q165 HydrophobicContact CB-CB 4.07Å; L161-Q165 HydrophobicContact CD2-CB 4.29Å; L161-R166 HydrophobicContact CB-CG 3.74Å; L161-R166 HydrophobicContact CD1-CG 4.37Å; L161-R166 PolarHBondContact O-NE 3.5Å; L161-R166 PolarHBondContact O-NH2 3.19Å; L161-W229 HydrophobicContact CD1-CH2 3.88Å; L161-W229 HydrophobicContact CD2-CH2 3.64Å; L161-W229 HydrophobicContact CD2-CZ2 3.79Å; L161-W229 HydrophobicContact CG-CH2 4.39Å
162T96.1Very high94.7Very high60 Ų6064.7 Ų64.737%0.36834%0.336SS..  trans-62.6157.2169.362.20000111.4G164 Q165 R166 S233T162-G164 PolarHBondContact O-N 3Å; T162-Q165 PolarHBondContact O-N 3.2Å; T162-Q165 VanDerWaalsContact O-N 3.08Å; T162-Q165 WeakPolarHBondContact OG1-CB 3.33Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.2Å; T162-Q165 PolarHBondContact OG1-N 3.43Å; T162-Q165 PolarHBondContact OG1-OE1 3.45Å; T162-R166 PolarHBondContact O-N 3.42Å; T162-S233 PolarHBondContact OG1-OG 3.32Å
163E95Very high95Very high80 Ų8064.9 Ų64.937%0.37434%0.34SS..Hα-helixtrans-57.7-33.5176.9-171.3167.6-147.300112.1R110 T167 V236 K241R110-E163 IonicContact NH2-OE1 2.79Å; E163-T167 PolarHBondContact O-N 3.28Å; E163-T167 VanDerWaalsContact O-N 3.11Å; E163-T167 PolarHBondContact O-OG1 2.86Å; E163-V236 HydrophobicContact CB-CG1 4.32Å; E163-V236 HydrophobicContact CG-CG1 4.25Å; E163-K241 HydrophobicContact CG-CB 4.42Å; E163-K241 HydrophobicContact CG-CD 4.16Å; E163-K241 VanDerWaalsContact OE1-CD 3.29Å; E163-K241 WeakPolarHBondContact OE1-CD 3.35Å; E163-K241 WeakPolarHBondContact OE1-CE 3.31Å; E163-K241 IonicContact OE1-NZ 3.78Å; E163-K241 PolarHBondContact OE1-NZ 3.22Å
164G95.4Very high95.2Very high2 Ų261.7 Ų61.72%0.02133%0.328CS..Hα-helixtrans-63-49.4172.900000113.4T162 R166 T167 A168 S232T162-G164 PolarHBondContact O-N 3Å; G164-R166 PolarHBondContact O-N 3.14Å; G164-T167 PolarHBondContact O-N 3.42Å; G164-A168 WeakPolarHBondContact O-CB 3.49Å; G164-A168 PolarHBondContact O-N 3.13Å; G164-S232 WeakPolarHBondContact O-CB 3.48Å
165Q96.6Very high95.6Very high39 Ų3957.7 Ų57.718%0.18230%0.304CS..Hα-helixtrans-63.7-42.6179-76.5164.8-37.900111.9L161 T162 T167 A168 T169 W229 S232L161-Q165 HydrophobicContact CB-CB 4.07Å; L161-Q165 HydrophobicContact CD2-CB 4.29Å; T162-Q165 PolarHBondContact O-N 3.2Å; T162-Q165 VanDerWaalsContact O-N 3.08Å; T162-Q165 WeakPolarHBondContact OG1-CB 3.33Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.2Å; T162-Q165 PolarHBondContact OG1-N 3.43Å; T162-Q165 PolarHBondContact OG1-OE1 3.45Å; Q165-T167 VanDerWaalsContact C-N 3.29Å; Q165-T167 PolarHBondContact O-N 3.34Å; Q165-A168 CarbonylContact O-C 3.59Å; Q165-A168 PolarHBondContact O-N 3.08Å; Q165-T169 PolarHBondContact O-N 2.91Å; Q165-T169 PolarHBondContact O-OG1 3.29Å; Q165-W229 HydrophobicContact CB-CE3 4.36Å; Q165-W229 HydrophobicContact CB-CH2 3.79Å; Q165-W229 HydrophobicContact CB-CZ2 4.04Å; Q165-W229 HydrophobicContact CB-CZ3 3.95Å; Q165-W229 HydrophobicContact CG-CD2 4.11Å; Q165-W229 HydrophobicContact CG-CE3 4.32Å; Q165-W229 HydrophobicContact CG-CH2 4.05Å; Q165-W229 HydrophobicContact CG-CZ2 3.78Å; Q165-W229 HydrophobicContact CG-CZ3 4.29Å; Q165-S232 PolarHBondContact N-OG 2.93Å
166R96.3Very high95.9Very high89 Ų8956.5 Ų56.534%0.33630%0.303SS..Hα-helixtrans-58.5-42.3175-66.5-175.2-165.8152.911.2111.9W158 R159 L161 T162 G164 T169W158-R166 HydrophobicContact CD2-CG 4.32Å; W158-R166 HydrophobicContact CH2-CB 4.02Å; W158-R166 HydrophobicContact CH2-CG 4.3Å; W158-R166 HydrophobicContact CZ2-CB 3.9Å; W158-R166 HydrophobicContact CZ2-CG 3.99Å; W158-R166 PolarHBondContact O-NE 2.93Å; W158-R166 PolarHBondContact O-NH2 3.49Å; R159-R166 PolarHBondContact O-NH2 3.41Å; L161-R166 HydrophobicContact CB-CG 3.74Å; L161-R166 HydrophobicContact CD1-CG 4.37Å; L161-R166 PolarHBondContact O-NE 3.5Å; L161-R166 PolarHBondContact O-NH2 3.19Å; T162-R166 PolarHBondContact O-N 3.42Å; G164-R166 PolarHBondContact O-N 3.14Å; R166-T169 WeakPolarHBondContact O-CB 3.36Å; R166-T169 PolarHBondContact O-N 2.75Å
167T96.1Very high96.1Very high29 Ų2954.4 Ų54.418%0.17830%0.3CS..Hα-helixtrans-67.3-41.6177.3-49.10000111.2E163 G164 Q165 T169 G170 K241 F244E163-T167 PolarHBondContact O-N 3.28Å; E163-T167 VanDerWaalsContact O-N 3.11Å; E163-T167 PolarHBondContact O-OG1 2.86Å; G164-T167 PolarHBondContact O-N 3.42Å; Q165-T167 VanDerWaalsContact C-N 3.29Å; Q165-T167 PolarHBondContact O-N 3.34Å; T167-T169 VanDerWaalsContact C-N 3.34Å; T167-T169 PolarHBondContact O-N 3.36Å; T167-G170 PolarHBondContact O-N 3.32Å; T167-K241 HydrophobicContact CG2-CB 4.34Å; T167-F244 HydrophobicContact CG2-CD1 3.78Å; T167-F244 HydrophobicContact CG2-CE1 3.69Å
168A97.4Very high96.3Very high0 Ų049.4 Ų49.40%028%0.279CS..Hα-helixtrans-63.7-36.2175.100000112.4G164 Q165 G170 I171 I172 L228G164-A168 WeakPolarHBondContact O-CB 3.49Å; G164-A168 PolarHBondContact O-N 3.13Å; Q165-A168 CarbonylContact O-C 3.59Å; Q165-A168 PolarHBondContact O-N 3.08Å; A168-G170 PolarHBondContact O-N 3.38Å; A168-I171 WeakPolarHBondContact O-CB 3.31Å; A168-I171 PolarHBondContact O-N 3.48Å; A168-I172 VanDerWaalsContact O-CG1 3.24Å; A168-I172 WeakPolarHBondContact O-CG1 3.33Å; A168-I172 PolarHBondContact O-N 2.94Å; A168-L228 HydrophobicContact CB-CG 4.35Å
169T96.9Very high96.5Very high41 Ų4145 Ų4525%0.25226%0.263SS..Hα-helixtrans-56.1-39.7175.2-54.40000111.7W158 Q165 R166 T167 I171 I172 A173 W229W158-T169 HydrophobicContact CZ3-CG2 3.86Å; Q165-T169 PolarHBondContact O-N 2.91Å; Q165-T169 PolarHBondContact O-OG1 3.29Å; R166-T169 WeakPolarHBondContact O-CB 3.36Å; R166-T169 PolarHBondContact O-N 2.75Å; T167-T169 VanDerWaalsContact C-N 3.34Å; T167-T169 PolarHBondContact O-N 3.36Å; T169-I171 PolarHBondContact O-N 2.98Å; T169-I172 PolarHBondContact O-N 3.08Å; T169-A173 WeakPolarHBondContact O-CB 3.37Å; T169-A173 PolarHBondContact O-N 3.29Å; T169-W229 WeakPolarHBondContact OG1-CZ3 3.31Å
170G96.6Very high96.6Very high41 Ų4141.2 Ų41.242%0.42326%0.26SS..Hα-helixtrans-60.4-45.1174.600000112.6T167 A168 A173 V174T167-G170 PolarHBondContact O-N 3.32Å; A168-G170 PolarHBondContact O-N 3.38Å; G170-A173 PolarHBondContact O-N 3.45Å; G170-V174 WeakPolarHBondContact O-CG2 3.14Å; G170-V174 PolarHBondContact O-N 3.5Å; G170-V174 VanDerWaalsContact O-N 3.1Å
171I98Very high96.7Very high9 Ų938.7 Ų38.75%0.04624%0.242CC..Hα-helixtrans-64.8-41.6176.8-62.3170.5000111A168 T169 V174 N175 F213 L228 F244 L245 Y248A168-I171 WeakPolarHBondContact O-CB 3.31Å; A168-I171 PolarHBondContact O-N 3.48Å; T169-I171 PolarHBondContact O-N 2.98Å; I171-V174 PolarHBondContact O-N 2.82Å; I171-N175 PolarHBondContact O-N 3.27Å; I171-N175 PolarHBondContact O-ND2 2.79Å; I171-F213 HydrophobicContact CG2-CE1 4.16Å; I171-L228 HydrophobicContact CB-CD2 4.03Å; I171-L228 HydrophobicContact CD1-CD2 4.25Å; I171-L228 HydrophobicContact CG2-CD2 3.59Å; I171-F244 HydrophobicContact CD1-CE1 3.92Å; I171-F244 HydrophobicContact CD1-CZ 3.82Å; I171-L245 HydrophobicContact CD1-CD1 4.24Å; I171-L245 HydrophobicContact CG1-CD1 4.42Å; I171-Y248 HydrophobicContact CD1-CD1 4Å; I171-Y248 HydrophobicContact CD1-CD2 4.36Å; I171-Y248 HydrophobicContact CD1-CE1 4.11Å; I171-Y248 HydrophobicContact CD1-CE2 4.46Å; I171-Y248 HydrophobicContact CD1-CG 4.13Å; I171-Y248 HydrophobicContact CG2-CE1 3.82Å; I171-Y248 HydrophobicContact CG2-CE2 4.5Å; I171-Y248 WeakPolarHBondContact CG2-OH 3.19Å
172I98.3Very high96.7Very high45 Ų4539.3 Ų39.323%0.23124%0.244CC..Hα-helixtrans-62.5-45.3177.6-66.9165.9000110.3A168 T169 V174 N175 A176 M225 W229A168-I172 VanDerWaalsContact O-CG1 3.24Å; A168-I172 WeakPolarHBondContact O-CG1 3.33Å; A168-I172 PolarHBondContact O-N 2.94Å; T169-I172 PolarHBondContact O-N 3.08Å; I172-V174 PolarHBondContact O-N 3.46Å; I172-N175 PolarHBondContact O-N 3.23Å; I172-A176 WeakPolarHBondContact O-CB 3.32Å; I172-A176 PolarHBondContact O-N 3.47Å; I172-M225 HydrophobicContact CB-SD 4.18Å; I172-M225 HydrophobicContact CD1-CB 4.41Å; I172-M225 HydrophobicContact CG1-CB 3.99Å; I172-M225 HydrophobicContact CG1-CG 4Å; I172-M225 HydrophobicContact CG1-SD 3.58Å; I172-M225 VanDerWaalsContact CG1-SD 3.58Å; I172-M225 HydrophobicContact CG2-CG 4.36Å; I172-W229 HydrophobicContact CD1-CE3 3.84Å; I172-W229 HydrophobicContact CD1-CZ3 4.49Å
173A97.8Very high96.6Very high56 Ų5643.5 Ų43.546%0.46325%0.253SS..Hα-helixtrans-60.9-43.4178.500000111.8T169 G170 A176 A177T169-A173 WeakPolarHBondContact O-CB 3.37Å; T169-A173 PolarHBondContact O-N 3.29Å; G170-A173 PolarHBondContact O-N 3.45Å; A173-A176 PolarHBondContact O-N 2.62Å; A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.21Å
174V98.1Very high96.7Very high71 Ų7143.5 Ų43.543%0.4325%0.254SS..Hα-helixtrans-61.8-45.9174.8174.10000111.1G170 I171 I172 A176 A177 V178 F213G170-V174 WeakPolarHBondContact O-CG2 3.14Å; G170-V174 PolarHBondContact O-N 3.5Å; G170-V174 VanDerWaalsContact O-N 3.1Å; I171-V174 PolarHBondContact O-N 2.82Å; I172-V174 PolarHBondContact O-N 3.46Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 2.94Å; V174-A177 PolarHBondContact O-N 2.96Å; V174-V178 HydrophobicContact CG1-CG2 4.48Å; V174-V178 VanDerWaalsContact O-CG2 3.31Å; V174-V178 WeakPolarHBondContact O-CG2 3.29Å; V174-V178 PolarHBondContact O-N 3.27Å; V174-F213 HydrophobicContact CB-CD1 4.17Å; V174-F213 HydrophobicContact CB-CE1 4.49Å; V174-F213 HydrophobicContact CG1-CB 4.35Å; V174-F213 HydrophobicContact CG1-CD1 3.55Å; V174-F213 HydrophobicContact CG1-CE1 4.09Å; V174-F213 HydrophobicContact CG1-CG 4.09Å
175N98.1Very high96.7Very high0 Ų048.7 Ų48.70%029%0.288CS..Hα-helixtrans-61.9-40.2177.2-85.4-85.9000112.4I171 I172 V178 L179 F213 H215 M221 M225I171-N175 PolarHBondContact O-N 3.27Å; I171-N175 PolarHBondContact O-ND2 2.79Å; I172-N175 PolarHBondContact O-N 3.23Å; N175-V178 PolarHBondContact O-N 2.8Å; N175-L179 WeakPolarHBondContact O-CB 3.43Å; N175-L179 PolarHBondContact O-N 2.84Å; N175-F213 WeakPolarHBondContact ND2-CD1 3.26Å; N175-F213 VanDerWaalsContact OD1-CA 3.24Å; N175-F213 WeakPolarHBondContact OD1-CA 3.31Å; N175-F213 PolarHBondContact OD1-O 3.46Å; N175-F213 VanDerWaalsContact OD1-O 3.13Å; N175-H215 PolarHBondContact OD1-CE1 3.2Å; N175-H215 PolarHBondContact OD1-ND1 2.97Å; N175-H215 VanDerWaalsContact OD1-ND1 3.12Å; N175-M221 HydrophobicContact CB-SD 4.43Å; N175-M225 HydrophobicContact CB-CE 4.46Å; N175-M225 HydrophobicContact CB-SD 4.09Å
176A97.7Very high96.7Very high37 Ų3751.2 Ų51.231%0.30632%0.315SS..Hα-helixtrans-64.1-44176.200000111.4I172 A173 V174 V178 L179 C180I172-A176 WeakPolarHBondContact O-CB 3.32Å; I172-A176 PolarHBondContact O-N 3.47Å; A173-A176 PolarHBondContact O-N 2.62Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 2.94Å; A176-V178 PolarHBondContact O-N 3.38Å; A176-L179 WeakPolarHBondContact O-CB 3.2Å; A176-L179 PolarHBondContact O-N 3.08Å; A176-C180 PolarHBondContact O-N 2.8Å; A176-C180 PolarHBondContact O-SG 3.31Å; A176-C180 VanDerWaalsContact O-SG 3.35Å
177A97.3Very high96.6Very high56 Ų5649.9 Ų49.946%0.46331%0.313SS..Hα-helixtrans-60.3-45.1175.200000111.8A173 V174 L179 C180 C181A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.21Å; V174-A177 PolarHBondContact O-N 2.96Å; A177-L179 VanDerWaalsContact C-N 3.34Å; A177-L179 PolarHBondContact O-N 3.47Å; A177-C180 WeakPolarHBondContact O-CB 3.34Å; A177-C180 PolarHBondContact O-N 3.47Å; A177-C180 VanDerWaalsContact O-N 3.13Å; A177-C181 PolarHBondContact O-N 2.84Å; A177-C181 PolarHBondContact O-SG 2.88Å; A177-C181 VanDerWaalsContact O-SG 3.33Å
178V97.6Very high96.5Very high15 Ų1551.4 Ų51.49%0.09132%0.319CS..Hα-helixtrans-63.9-38.4176.3175.10000111.7V174 N175 A176 C180 C181 W182 M191 F195 F213V174-V178 HydrophobicContact CG1-CG2 4.48Å; V174-V178 VanDerWaalsContact O-CG2 3.31Å; V174-V178 WeakPolarHBondContact O-CG2 3.29Å; V174-V178 PolarHBondContact O-N 3.27Å; N175-V178 PolarHBondContact O-N 2.8Å; A176-V178 PolarHBondContact O-N 3.38Å; V178-C180 VanDerWaalsContact C-N 3.31Å; V178-C180 PolarHBondContact O-N 2.82Å; V178-C181 WeakPolarHBondContact O-CB 3.37Å; V178-C181 PolarHBondContact O-N 2.89Å; V178-W182 PolarHBondContact O-N 3.31Å; V178-M191 HydrophobicContact CG1-CE 3.7Å; V178-F195 HydrophobicContact CB-CE1 4.43Å; V178-F195 HydrophobicContact CG1-CD1 3.55Å; V178-F195 HydrophobicContact CG1-CE1 3.65Å; V178-F195 HydrophobicContact CG1-CG 4.49Å; V178-F195 HydrophobicContact CG2-CD1 4.48Å; V178-F195 HydrophobicContact CG2-CE1 3.8Å; V178-F213 VanDerWaalsContact CB-O 3.26Å; V178-F213 WeakPolarHBondContact CB-O 3.31Å; V178-F213 WeakPolarHBondContact CG1-O 3.22Å; V178-F213 HydrophobicContact CG2-CB 4.31Å
179L96.4Very high96.4Very high13 Ų1362 Ų627%0.06836%0.358CS..Hα-helixtrans-63-37.8173.2-176.269000111.7N175 A176 A177 W182 H215 I218 M221N175-L179 WeakPolarHBondContact O-CB 3.43Å; N175-L179 PolarHBondContact O-N 2.84Å; A176-L179 WeakPolarHBondContact O-CB 3.2Å; A176-L179 PolarHBondContact O-N 3.08Å; A177-L179 VanDerWaalsContact C-N 3.34Å; A177-L179 PolarHBondContact O-N 3.47Å; L179-W182 WeakPolarHBondContact O-CB 3.45Å; L179-W182 PolarHBondContact O-N 2.99Å; L179-H215 HydrophobicContact CD1-CB 4.47Å; L179-H215 WeakPolarHBondContact CD1-O 3.22Å; L179-I218 HydrophobicContact CD2-CG1 3.95Å; L179-M221 HydrophobicContact CB-SD 3.92Å; L179-M221 HydrophobicContact CD2-CE 3.47Å; L179-M221 VanDerWaalsContact CD2-CE 3.47Å; L179-M221 HydrophobicContact CD2-SD 3.52Å; L179-M221 VanDerWaalsContact CD2-SD 3.52Å; L179-M221 HydrophobicContact CG-SD 4.27Å
180C95.6Very high96.3Very high81 Ų8163.2 Ų63.255%0.54737%0.366SS..Hα-helixtrans-64.4-38.9172.9-69.30000111.8A176 A177 V178 W182 R183A176-C180 PolarHBondContact O-N 2.8Å; A176-C180 PolarHBondContact O-SG 3.31Å; A176-C180 VanDerWaalsContact O-SG 3.35Å; A177-C180 WeakPolarHBondContact O-CB 3.34Å; A177-C180 PolarHBondContact O-N 3.47Å; A177-C180 VanDerWaalsContact O-N 3.13Å; V178-C180 VanDerWaalsContact C-N 3.31Å; V178-C180 PolarHBondContact O-N 2.82Å; C180-W182 PolarHBondContact O-N 2.89Å; C180-R183 WeakPolarHBondContact O-CA 3.43Å; C180-R183 WeakPolarHBondContact O-CB 3.2Å; C180-R183 PolarHBondContact O-N 2.97Å
181C96Very high96.2Very high35 Ų3561.3 Ų61.324%0.23635%0.346CS..Hα-helixtrans-59.7-33.9173.8-63.90000112.6A177 V178 R183 I184 M187 M191A177-C181 PolarHBondContact O-N 2.84Å; A177-C181 PolarHBondContact O-SG 2.88Å; A177-C181 VanDerWaalsContact O-SG 3.33Å; V178-C181 WeakPolarHBondContact O-CB 3.37Å; V178-C181 PolarHBondContact O-N 2.89Å; C181-R183 PolarHBondContact O-N 3.23Å; C181-I184 PolarHBondContact O-N 3.44Å; C181-M187 HydrophobicContact CB-CE 3.69Å; C181-M187 HydrophobicContact CB-SD 3.98Å; C181-M191 HydrophobicContact CB-CE 4.01Å; C181-M191 HydrophobicContact CB-SD 3.75Å
182W94.5Very high96Very high27 Ų2764.3 Ų64.310%0.10236%0.361CS..THydrogen-bonded Turntrans-65.9-10.3171.4-82.1109.6000114.2V178 L179 C180 Q188 M191 I192 F195 T196 S214 L273V178-W182 PolarHBondContact O-N 3.31Å; L179-W182 WeakPolarHBondContact O-CB 3.45Å; L179-W182 PolarHBondContact O-N 2.99Å; C180-W182 PolarHBondContact O-N 2.89Å; W182-Q188 PolarHBondContact O-NE2 3.08Å; W182-M191 HydrophobicContact CD2-CB 3.79Å; W182-M191 HydrophobicContact CD2-CE 3.96Å; W182-M191 HydrophobicContact CD2-CG 4.14Å; W182-M191 HydrophobicContact CE3-CB 3.73Å; W182-M191 HydrophobicContact CE3-CG 4.3Å; W182-M191 HydrophobicContact CG-CE 3.74Å; W182-M191 HydrophobicContact CG-CG 4.45Å; W182-M191 HydrophobicContact CH2-CB 3.68Å; W182-M191 HydrophobicContact CZ2-CB 3.75Å; W182-M191 HydrophobicContact CZ2-CE 4.43Å; W182-M191 HydrophobicContact CZ3-CB 3.67Å; W182-I192 HydrophobicContact CH2-CG1 3.94Å; W182-I192 HydrophobicContact CZ3-CG1 3.97Å; W182-F195 HydrophobicContact CZ2-CB 4.38Å; W182-T196 HydrophobicContact CH2-CG2 3.71Å; W182-T196 HydrophobicContact CZ2-CG2 3.74Å; W182-S214 PolarHBondContact NE1-OG 3.41Å; W182-L273 HydrophobicContact CZ2-CD2 4.03Å
183R93.7Very high95.8Very high148 Ų14866.9 Ų66.956%0.55837%0.371SS*.THydrogen-bonded Turntrans-93.9-10.6175.8-54.1-51.3177.491-1.7113.5C180 C181 P185C180-R183 WeakPolarHBondContact O-CA 3.43Å; C180-R183 WeakPolarHBondContact O-CB 3.2Å; C180-R183 PolarHBondContact O-N 2.97Å; C181-R183 PolarHBondContact O-N 3.23Å; R183-P185 WeakPolarHBondContact O-CD 3.17Å
184I95.6Very high95.8Very high80 Ų8067.4 Ų67.441%0.4136%0.361SS..  trans-90.9114.7-178.9-60171.6000108.6C181 A186 M187C181-I184 PolarHBondContact O-N 3.44Å; I184-A186 VanDerWaalsContact C-N 3.26Å; I184-A186 HydrophobicContact CG2-CB 4.18Å; I184-A186 PolarHBondContact O-N 3.29Å; I184-M187 HydrophobicContact CB-CB 4.25Å; I184-M187 HydrophobicContact CB-CG 4.06Å; I184-M187 HydrophobicContact CB-SD 4.1Å; I184-M187 HydrophobicContact CD1-SD 3.7Å; I184-M187 HydrophobicContact CG1-SD 4.46Å; I184-M187 HydrophobicContact CG2-CB 4.39Å; I184-M187 HydrophobicContact CG2-CG 3.87Å; I184-M187 HydrophobicContact CG2-SD 4.26Å; I184-M187 PolarHBondContact O-N 3.36Å
185P95.4Very high95.7Very high111 Ų11165.6 Ų65.672%0.72135%0.348SS*.G310 helixtrans-58-36.7-177.5-27.436.5000113.5R183 M187 Q188R183-P185 WeakPolarHBondContact O-CD 3.17Å; P185-M187 PolarHBondContact O-N 3.12Å; P185-Q188 WeakPolarHBondContact O-CG 3.3Å; P185-Q188 PolarHBondContact O-N 3.47Å
186A97.3Very high95.5Very high91 Ų9166.5 Ų66.575%0.75235%0.353SS*.G310 helixtrans-62.4-29.217800000113.2I184I184-A186 VanDerWaalsContact C-N 3.26Å; I184-A186 HydrophobicContact CG2-CB 4.18Å; I184-A186 PolarHBondContact O-N 3.29Å
187M95.4Very high95.4Very high62 Ų6264.7 Ų64.731%0.30534%0.339SS..G310 helixtrans-88-11.6-176.9-65-175.873.200113.4C181 I184 P185 R189 T190 M191C181-M187 HydrophobicContact CB-CE 3.69Å; C181-M187 HydrophobicContact CB-SD 3.98Å; I184-M187 HydrophobicContact CB-CB 4.25Å; I184-M187 HydrophobicContact CB-CG 4.06Å; I184-M187 HydrophobicContact CB-SD 4.1Å; I184-M187 HydrophobicContact CD1-SD 3.7Å; I184-M187 HydrophobicContact CG1-SD 4.46Å; I184-M187 HydrophobicContact CG2-CB 4.39Å; I184-M187 HydrophobicContact CG2-CG 3.87Å; I184-M187 HydrophobicContact CG2-SD 4.26Å; I184-M187 PolarHBondContact O-N 3.36Å; P185-M187 PolarHBondContact O-N 3.12Å; M187-R189 VanDerWaalsContact C-N 3.3Å; M187-R189 PolarHBondContact O-N 2.99Å; M187-R189 VanDerWaalsContact O-N 3.14Å; M187-T190 WeakPolarHBondContact O-CA 3.12Å; M187-T190 WeakPolarHBondContact O-CB 3.42Å; M187-T190 PolarHBondContact O-N 3.4Å; M187-M191 HydrophobicContact CB-CG 4.26Å; M187-M191 WeakPolarHBondContact O-CG 3.16Å; M187-M191 PolarHBondContact O-N 3.28Å
188Q93.5Very high95.2Very high61 Ų6163.7 Ų63.729%0.28533%0.325SS..Hα-helixtrans-52.5-42.7-172.1-69.7-63.3-40.800113.9W182 P185 T190 M191 I192W182-Q188 PolarHBondContact O-NE2 3.08Å; P185-Q188 WeakPolarHBondContact O-CG 3.3Å; P185-Q188 PolarHBondContact O-N 3.47Å; Q188-T190 PolarHBondContact O-N 3.33Å; Q188-M191 PolarHBondContact O-N 3.14Å; Q188-I192 VanDerWaalsContact O-CG1 3.3Å; Q188-I192 WeakPolarHBondContact O-CG1 3.38Å; Q188-I192 PolarHBondContact O-N 3.42Å
189R94.2Very high94.9Very high222 Ų22263 Ų6384%0.83832%0.321SS*.Hα-helixtrans-63.9-42.5179.8-59.9-174.1-150.6164.26.9111.6M187 K193M187-R189 VanDerWaalsContact C-N 3.3Å; M187-R189 PolarHBondContact O-N 2.99Å; M187-R189 VanDerWaalsContact O-N 3.14Å; R189-K193 VanDerWaalsContact O-CB 3.26Å; R189-K193 WeakPolarHBondContact O-CB 3.26Å; R189-K193 PolarHBondContact O-N 3.02Å
190T95.1Very high94.5Very high66 Ų6665 Ų6541%0.40534%0.339SS..Hα-helixtrans-64.8-44.4176.6-57.20000110.5M187 Q188 K193 Y194M187-T190 WeakPolarHBondContact O-CA 3.12Å; M187-T190 WeakPolarHBondContact O-CB 3.42Å; M187-T190 PolarHBondContact O-N 3.4Å; Q188-T190 PolarHBondContact O-N 3.33Å; T190-K193 PolarHBondContact O-N 3.1Å; T190-Y194 HydrophobicContact CG2-CD2 3.76Å; T190-Y194 HydrophobicContact CG2-CE2 4.32Å; T190-Y194 WeakPolarHBondContact O-CB 3.09Å; T190-Y194 PolarHBondContact O-N 2.95Å
191M95.3Very high94.2Very high1 Ų163 Ų631%0.00533%0.326CS..Hα-helixtrans-60.8-47.8177.5-63.5-49.9-70.100111.7V178 C181 W182 M187 Q188 K193 F195 T196V178-M191 HydrophobicContact CG1-CE 3.7Å; C181-M191 HydrophobicContact CB-CE 4.01Å; C181-M191 HydrophobicContact CB-SD 3.75Å; W182-M191 HydrophobicContact CD2-CB 3.79Å; W182-M191 HydrophobicContact CD2-CE 3.96Å; W182-M191 HydrophobicContact CD2-CG 4.14Å; W182-M191 HydrophobicContact CE3-CB 3.73Å; W182-M191 HydrophobicContact CE3-CG 4.3Å; W182-M191 HydrophobicContact CG-CE 3.74Å; W182-M191 HydrophobicContact CG-CG 4.45Å; W182-M191 HydrophobicContact CH2-CB 3.68Å; W182-M191 HydrophobicContact CZ2-CB 3.75Å; W182-M191 HydrophobicContact CZ2-CE 4.43Å; W182-M191 HydrophobicContact CZ3-CB 3.67Å; M187-M191 HydrophobicContact CB-CG 4.26Å; M187-M191 WeakPolarHBondContact O-CG 3.16Å; M187-M191 PolarHBondContact O-N 3.28Å; Q188-M191 PolarHBondContact O-N 3.14Å; M191-K193 PolarHBondContact O-N 3.39Å; M191-F195 HydrophobicContact CE-CB 3.92Å; M191-F195 HydrophobicContact CE-CD1 3.98Å; M191-F195 HydrophobicContact CE-CD2 3.88Å; M191-F195 HydrophobicContact CE-CE1 4.45Å; M191-F195 HydrophobicContact CE-CE2 4.35Å; M191-F195 HydrophobicContact CE-CG 3.66Å; M191-F195 CarbonylContact O-C 3.47Å; M191-F195 VanDerWaalsContact O-CA 3.26Å; M191-F195 WeakPolarHBondContact O-CA 3.41Å; M191-F195 WeakPolarHBondContact O-CB 3.2Å; M191-F195 PolarHBondContact O-N 3.34Å; M191-F195 HydrophobicContact SD-CD2 3.64Å; M191-F195 HydrophobicContact SD-CE2 3.87Å; M191-F195 HydrophobicContact SD-CG 4.08Å; M191-F195 HydrophobicContact SD-CZ 4.49Å; M191-T196 PolarHBondContact O-N 3.41Å
192I94Very high93.8Very high72 Ų7271.3 Ų71.337%0.36936%0.358SS..Hα-helixtrans-62.3-44.5176.8-67.2165.4000110.8W182 Q188 T196W182-I192 HydrophobicContact CH2-CG1 3.94Å; W182-I192 HydrophobicContact CZ3-CG1 3.97Å; Q188-I192 VanDerWaalsContact O-CG1 3.3Å; Q188-I192 WeakPolarHBondContact O-CG1 3.38Å; Q188-I192 PolarHBondContact O-N 3.42Å; I192-T196 PolarHBondContact O-OG1 3.07Å
193K94.2Very high93.5Very high99 Ų9971.7 Ų71.743%0.4336%0.364SS..Hα-helixtrans-71.1-41-174.8-174179.3179.6-165.40113.6R189 T190 M191 T203R189-K193 VanDerWaalsContact O-CB 3.26Å; R189-K193 WeakPolarHBondContact O-CB 3.26Å; R189-K193 PolarHBondContact O-N 3.02Å; T190-K193 PolarHBondContact O-N 3.1Å; M191-K193 PolarHBondContact O-N 3.39Å; K193-T203 PolarHBondContact O-OG1 3.19Å
194Y95.9Very high93.3Very high68 Ų6865.9 Ų65.927%0.26734%0.343SS..Hα-helixtrans-111.8-24.3-169.6-61.4-63.5000114.1T190 T203 L206 P207 L210T190-Y194 HydrophobicContact CG2-CD2 3.76Å; T190-Y194 HydrophobicContact CG2-CE2 4.32Å; T190-Y194 WeakPolarHBondContact O-CB 3.09Å; T190-Y194 PolarHBondContact O-N 2.95Å; Y194-T203 HydrophobicContact CE1-CG2 3.96Å; Y194-L206 HydrophobicContact CD1-CD2 3.78Å; Y194-L206 HydrophobicContact CE1-CD2 4.24Å; Y194-L206 HydrophobicContact CG-CD2 4.36Å; Y194-P207 VanDerWaalsContact O-CA 3.22Å; Y194-P207 WeakPolarHBondContact O-CA 3.42Å; Y194-L210 VanDerWaalsContact O-CB 3.31Å; Y194-L210 WeakPolarHBondContact O-CB 3.06Å
195F96.7Very high93.3Very high33 Ų3363.7 Ų63.715%0.14533%0.334CS..SBendtrans-106.110.2-178.5-69.5-100.5000113.1V178 W182 M191 L210 S214V178-F195 HydrophobicContact CB-CE1 4.43Å; V178-F195 HydrophobicContact CG1-CD1 3.55Å; V178-F195 HydrophobicContact CG1-CE1 3.65Å; V178-F195 HydrophobicContact CG1-CG 4.49Å; V178-F195 HydrophobicContact CG2-CD1 4.48Å; V178-F195 HydrophobicContact CG2-CE1 3.8Å; W182-F195 HydrophobicContact CZ2-CB 4.38Å; M191-F195 HydrophobicContact CE-CB 3.92Å; M191-F195 HydrophobicContact CE-CD1 3.98Å; M191-F195 HydrophobicContact CE-CD2 3.88Å; M191-F195 HydrophobicContact CE-CE1 4.45Å; M191-F195 HydrophobicContact CE-CE2 4.35Å; M191-F195 HydrophobicContact CE-CG 3.66Å; M191-F195 CarbonylContact O-C 3.47Å; M191-F195 VanDerWaalsContact O-CA 3.26Å; M191-F195 WeakPolarHBondContact O-CA 3.41Å; M191-F195 WeakPolarHBondContact O-CB 3.2Å; M191-F195 PolarHBondContact O-N 3.34Å; M191-F195 HydrophobicContact SD-CD2 3.64Å; M191-F195 HydrophobicContact SD-CE2 3.87Å; M191-F195 HydrophobicContact SD-CG 4.08Å; M191-F195 HydrophobicContact SD-CZ 4.49Å; F195-L210 HydrophobicContact CD1-CB 3.85Å; F195-L210 WeakPolarHBondContact CD1-O 3.38Å; F195-L210 HydrophobicContact CD2-CD1 4.39Å; F195-L210 HydrophobicContact CE1-CB 4.02Å; F195-L210 HydrophobicContact CE1-CD1 4.43Å; F195-L210 HydrophobicContact CE1-CD2 4.13Å; F195-L210 HydrophobicContact CE1-CG 4.43Å; F195-L210 HydrophobicContact CE2-CD1 4.06Å; F195-L210 HydrophobicContact CG-CB 4.18Å; F195-L210 HydrophobicContact CZ-CB 4.49Å; F195-L210 HydrophobicContact CZ-CD1 4.09Å; F195-L210 HydrophobicContact CZ-CD2 4.25Å; F195-S214 WeakPolarHBondContact O-CB 3.12Å; F195-S214 PolarHBondContact O-OG 3.45Å
196T95.2Very high93.3Very high18 Ų1862.4 Ų62.411%0.1132%0.321CS..SBendtrans-124.8129.2169.681.50000110.1W182 M191 I192 P207 L273W182-T196 HydrophobicContact CH2-CG2 3.71Å; W182-T196 HydrophobicContact CZ2-CG2 3.74Å; M191-T196 PolarHBondContact O-N 3.41Å; I192-T196 PolarHBondContact O-OG1 3.07Å; T196-P207 WeakPolarHBondContact O-CB 3.2Å; T196-L273 HydrophobicContact CG2-CD2 3.67Å
197S93.9Very high93.3Very high0 Ų058 Ų580%029%0.285CS..BIsolated β-bridgetrans-87.8124.4-178.784.40000109.4P271 S272S197-P271 CarbonylContact O-C 3.57Å; S197-P271 VanDerWaalsContact O-CA 3.27Å; S197-P271 WeakPolarHBondContact O-CA 3.13Å; S197-S272 PolarHBondContact N-O 3.24Å; S197-S272 PolarHBondContact O-N 3.23Å; S197-S272 PolarHBondContact OG-O 3.48Å; S197-S272 VanDerWaalsContact OG-O 3.05Å; S197-S272 PolarHBondContact OG-OG 2.94Å
198N93.1Very high93.3Very high34 Ų3455.1 Ų55.118%0.18227%0.27CS..  trans-146.8118.7174-176.3-11000108.6A200 S201 Y260 P271N198-A200 PolarHBondContact O-N 3.24Å; N198-A200 VanDerWaalsContact O-N 3.15Å; N198-A200 WeakPolarHBondContact OD1-CB 3.49Å; N198-A200 PolarHBondContact OD1-N 2.98Å; N198-S201 VanDerWaalsContact O-CB 3.27Å; N198-S201 WeakPolarHBondContact O-CB 3.39Å; N198-S201 PolarHBondContact O-N 3.32Å; N198-Y260 PolarHBondContact N-OH 2.87Å; N198-P271 HydrophobicContact CB-CB 4.45Å
199P91.8Very high93.5Very high1 Ų153.7 Ų53.71%0.00626%0.264CS..THydrogen-bonded Turntrans-62.7-23-18027.7-37000112.5P79 S201 Q204 Y260 K263 F269P79-P199 HydrophobicContact CB-CB 4.16Å; P79-P199 VanDerWaalsContact CB-O 3.23Å; P79-P199 WeakPolarHBondContact CB-O 3.33Å; P79-P199 HydrophobicContact CG-CB 4.15Å; P79-P199 WeakPolarHBondContact CG-O 3.35Å; P199-S201 VanDerWaalsContact C-N 3.29Å; P199-S201 PolarHBondContact O-N 2.94Å; P199-Q204 PolarHBondContact O-NE2 2.86Å; P199-Y260 HydrophobicContact CB-CD1 4.02Å; P199-Y260 HydrophobicContact CB-CD2 4.13Å; P199-Y260 HydrophobicContact CB-CE1 4.42Å; P199-Y260 HydrophobicContact CB-CG 3.85Å; P199-Y260 HydrophobicContact CG-CD1 4.22Å; P199-Y260 HydrophobicContact CG-CG 4.47Å; P199-K263 HydrophobicContact CG-CB 3.89Å; P199-K263 HydrophobicContact CG-CD 4.31Å; P199-F269 HydrophobicContact CG-CD1 3.75Å; P199-F269 HydrophobicContact CG-CE1 4.23Å
200A89.3Confident93.6Very high54 Ų5445.2 Ų45.245%0.44624%0.236SC..THydrogen-bonded Turntrans-78.2-9175.500000114.1N198 F269N198-A200 PolarHBondContact O-N 3.24Å; N198-A200 VanDerWaalsContact O-N 3.15Å; N198-A200 WeakPolarHBondContact OD1-CB 3.49Å; N198-A200 PolarHBondContact OD1-N 2.98Å; A200-F269 HydrophobicContact CB-CB 3.98Å; A200-F269 HydrophobicContact CB-CD1 4.34Å; A200-F269 HydrophobicContact CB-CD2 4.38Å; A200-F269 HydrophobicContact CB-CG 3.98Å
201S88.3Confident93.7Very high39 Ų3942.2 Ų42.227%0.27322%0.218SC..SBendtrans-71.1152.5177.7-175.80000111.8N198 P199 T203 Q204N198-S201 VanDerWaalsContact O-CB 3.27Å; N198-S201 WeakPolarHBondContact O-CB 3.39Å; N198-S201 PolarHBondContact O-N 3.32Å; P199-S201 VanDerWaalsContact C-N 3.29Å; P199-S201 PolarHBondContact O-N 2.94Å; S201-T203 VanDerWaalsContact C-N 3.26Å; S201-T203 PolarHBondContact O-N 2.66Å; S201-T203 PolarHBondContact OG-N 2.93Å; S201-T203 PolarHBondContact OG-OG1 3.27Å; S201-Q204 WeakPolarHBondContact O-CG 3Å
202K87Confident93.7Very high211 Ų21142.4 Ų42.492%0.91722%0.219SC*.SBendtrans-66.4-31.4170.3-66.7-175.6-179.8-1790111.8
203T89.5Confident93.9Very high35 Ų3540.3 Ų40.322%0.21521%0.207CC..  trans-100.289.717947.60000108.9K193 Y194 S201 P207K193-T203 PolarHBondContact O-OG1 3.19Å; Y194-T203 HydrophobicContact CE1-CG2 3.96Å; S201-T203 VanDerWaalsContact C-N 3.26Å; S201-T203 PolarHBondContact O-N 2.66Å; S201-T203 PolarHBondContact OG-N 2.93Å; S201-T203 PolarHBondContact OG-OG1 3.27Å; T203-P207 WeakPolarHBondContact O-CD 3.18Å; T203-P207 WeakPolarHBondContact O-CG 3.42Å
204Q89.8Confident94Very high25 Ų2535.6 Ų35.612%0.11719%0.187CC..  trans-92.8-40-175.4-58.7173.8-55.500112.6R80 P84 P199 S201 M208 Y260R80-Q204 PolarHBondContact O-NE2 3.06Å; R80-Q204 PolarHBondContact O-OE1 3.4Å; P84-Q204 HydrophobicContact CG-CB 3.83Å; P199-Q204 PolarHBondContact O-NE2 2.86Å; S201-Q204 WeakPolarHBondContact O-CG 3Å; Q204-M208 VanDerWaalsContact O-CG 3.23Å; Q204-M208 WeakPolarHBondContact O-CG 3.46Å; Q204-Y260 HydrophobicContact CB-CE2 4.12Å; Q204-Y260 PolarHBondContact O-OH 3.02Å
205C94.9Very high94Very high34 Ų3432.3 Ų32.323%0.2317%0.174CC..Hα-helixtrans-74.6-54-169.6-57.10000113.5F87 P207 M208F87-C205 HydrophobicContact CB-CB 4.03Å; F87-C205 HydrophobicContact CD1-CB 3.84Å; F87-C205 HydrophobicContact CD2-CB 3.68Å; F87-C205 HydrophobicContact CE1-CB 4.14Å; F87-C205 WeakPolarHBondContact CE1-O 3.32Å; F87-C205 HydrophobicContact CE2-CB 3.98Å; F87-C205 HydrophobicContact CG-CB 3.57Å; F87-C205 HydrophobicContact CZ-CB 4.17Å; C205-P207 VanDerWaalsContact C-N 3.35Å; C205-M208 VanDerWaalsContact O-CB 3.31Å; C205-M208 WeakPolarHBondContact O-CB 3.3Å; C205-M208 WeakPolarHBondContact O-CG 3.4Å; C205-M208 PolarHBondContact O-N 3.3Å
206L95.3Very high93.3Very high84 Ų8436.6 Ų36.644%0.4419%0.19SC..Hα-helixtrans-58.5-40.7-176-172.564.3000112.9Y194 M208 I209 L210Y194-L206 HydrophobicContact CD1-CD2 3.78Å; Y194-L206 HydrophobicContact CE1-CD2 4.24Å; Y194-L206 HydrophobicContact CG-CD2 4.36Å; L206-M208 PolarHBondContact O-N 3.45Å; L206-I209 PolarHBondContact O-N 3.01Å; L206-L210 HydrophobicContact CD1-CD1 4.11Å; L206-L210 HydrophobicContact CD1-CG 4.29Å; L206-L210 HydrophobicContact CD2-CD1 4.01Å; L206-L210 HydrophobicContact CG-CD1 3.69Å; L206-L210 HydrophobicContact CG-CG 4.22Å; L206-L210 PolarHBondContact O-N 2.88Å
207P96.3Very high93.1Very high0 Ų037.9 Ų37.90%020%0.199CC..Hα-helixtrans-60.5-24173.4-27.337000115.6Y194 T196 T203 C205 I209 L210 S211Y194-P207 VanDerWaalsContact O-CA 3.22Å; Y194-P207 WeakPolarHBondContact O-CA 3.42Å; T196-P207 WeakPolarHBondContact O-CB 3.2Å; T203-P207 WeakPolarHBondContact O-CD 3.18Å; T203-P207 WeakPolarHBondContact O-CG 3.42Å; C205-P207 VanDerWaalsContact C-N 3.35Å; P207-I209 PolarHBondContact O-N 3.39Å; P207-L210 PolarHBondContact O-N 3.1Å; P207-S211 WeakPolarHBondContact O-CB 3.21Å; P207-S211 PolarHBondContact O-N 3.18Å; P207-S211 PolarHBondContact O-OG 3.42Å
208M96.4Very high93.1Very high0 Ų042.1 Ų42.10%022%0.221CC..Hα-helixtrans-61.9-30.4179.8-54176.57100112.6P84 F87 T88 Q204 C205 L206 S212 V253 T256 M257 Y260P84-M208 HydrophobicContact CB-CE 4.22Å; P84-M208 HydrophobicContact CB-SD 3.8Å; F87-M208 HydrophobicContact CD1-SD 3.84Å; F87-M208 HydrophobicContact CE1-CB 4.22Å; F87-M208 HydrophobicContact CE1-SD 4.44Å; T88-M208 WeakPolarHBondContact OG1-CE 3.27Å; Q204-M208 VanDerWaalsContact O-CG 3.23Å; Q204-M208 WeakPolarHBondContact O-CG 3.46Å; C205-M208 VanDerWaalsContact O-CB 3.31Å; C205-M208 WeakPolarHBondContact O-CB 3.3Å; C205-M208 WeakPolarHBondContact O-CG 3.4Å; C205-M208 PolarHBondContact O-N 3.3Å; L206-M208 PolarHBondContact O-N 3.45Å; M208-S212 PolarHBondContact O-OG 3.16Å; M208-V253 HydrophobicContact CB-CG1 3.95Å; M208-V253 HydrophobicContact CB-CG2 4.48Å; M208-V253 HydrophobicContact CE-CG1 3.86Å; M208-V253 WeakPolarHBondContact CE-O 3.26Å; M208-V253 HydrophobicContact SD-CG1 4.41Å; M208-T256 HydrophobicContact CB-CG2 4.03Å; M208-T256 HydrophobicContact CG-CG2 3.9Å; M208-T256 PolarHBondContact O-OG1 3.4Å; M208-M257 HydrophobicContact CE-CB 3.66Å; M208-M257 HydrophobicContact CE-CG 4.37Å; M208-M257 HydrophobicContact CE-SD 3.98Å; M208-Y260 HydrophobicContact CG-CE2 4.07Å; M208-Y260 HydrophobicContact SD-CE2 4.27Å
209I96.6Very high93.1Very high31 Ų3147.2 Ų47.216%0.15925%0.247CC..Hα-helixtrans-88-55.5174.3-57.7162.8000109.5F87 F91 L206 P207 S211 S212 F213 V253F87-I209 HydrophobicContact CE1-CD1 3.91Å; F87-I209 HydrophobicContact CE1-CG1 4Å; F87-I209 HydrophobicContact CZ-CD1 3.43Å; F87-I209 VanDerWaalsContact CZ-CD1 3.43Å; F87-I209 HydrophobicContact CZ-CG1 4.03Å; F91-I209 HydrophobicContact CD1-CD1 4.48Å; F91-I209 HydrophobicContact CD1-CG1 4.39Å; F91-I209 HydrophobicContact CD2-CD1 3.42Å; F91-I209 VanDerWaalsContact CD2-CD1 3.42Å; F91-I209 HydrophobicContact CD2-CG1 4.19Å; F91-I209 HydrophobicContact CE1-CD1 4.27Å; F91-I209 HydrophobicContact CE1-CG1 4.09Å; F91-I209 HydrophobicContact CE2-CD1 3.18Å; F91-I209 HydrophobicContact CE2-CG1 3.89Å; F91-I209 HydrophobicContact CG-CD1 4.08Å; F91-I209 HydrophobicContact CG-CG1 4.42Å; F91-I209 HydrophobicContact CZ-CD1 3.64Å; F91-I209 HydrophobicContact CZ-CG1 3.82Å; F91-I209 HydrophobicContact CZ-CG2 4.25Å; L206-I209 PolarHBondContact O-N 3.01Å; P207-I209 PolarHBondContact O-N 3.39Å; I209-S211 VanDerWaalsContact C-N 3.28Å; I209-S211 PolarHBondContact O-N 2.89Å; I209-S212 WeakPolarHBondContact O-CB 3.45Å; I209-S212 PolarHBondContact O-N 2.87Å; I209-F213 HydrophobicContact CG2-CE2 4.39Å; I209-V253 HydrophobicContact CB-CG2 4.37Å; I209-V253 HydrophobicContact CG1-CG2 3.43Å; I209-V253 VanDerWaalsContact CG1-CG2 3.43Å
210L97.3Very high93.2Very high45 Ų4549.1 Ų49.124%0.23626%0.256CS..Hα-helixtrans-65.8-30.8-169.7-66.2-176.2000112.9Y194 F195 L206 P207 S212 F213 S214Y194-L210 VanDerWaalsContact O-CB 3.31Å; Y194-L210 WeakPolarHBondContact O-CB 3.06Å; F195-L210 HydrophobicContact CD1-CB 3.85Å; F195-L210 WeakPolarHBondContact CD1-O 3.38Å; F195-L210 HydrophobicContact CD2-CD1 4.39Å; F195-L210 HydrophobicContact CE1-CB 4.02Å; F195-L210 HydrophobicContact CE1-CD1 4.43Å; F195-L210 HydrophobicContact CE1-CD2 4.13Å; F195-L210 HydrophobicContact CE1-CG 4.43Å; F195-L210 HydrophobicContact CE2-CD1 4.06Å; F195-L210 HydrophobicContact CG-CB 4.18Å; F195-L210 HydrophobicContact CZ-CB 4.49Å; F195-L210 HydrophobicContact CZ-CD1 4.09Å; F195-L210 HydrophobicContact CZ-CD2 4.25Å; L206-L210 HydrophobicContact CD1-CD1 4.11Å; L206-L210 HydrophobicContact CD1-CG 4.29Å; L206-L210 HydrophobicContact CD2-CD1 4.01Å; L206-L210 HydrophobicContact CG-CD1 3.69Å; L206-L210 HydrophobicContact CG-CG 4.22Å; L206-L210 PolarHBondContact O-N 2.88Å; P207-L210 PolarHBondContact O-N 3.1Å; L210-S212 PolarHBondContact O-N 3.23Å; L210-F213 PolarHBondContact O-N 2.78Å; L210-F213 VanDerWaalsContact O-N 3.1Å; L210-S214 PolarHBondContact O-N 2.94Å
211S96.4Very high93.5Very high3 Ų347.8 Ų47.82%0.02124%0.241CC..G310 helixtrans-64.9-24.9174.5730000112.6P207 I209 F213 S214 G274P207-S211 WeakPolarHBondContact O-CB 3.21Å; P207-S211 PolarHBondContact O-N 3.18Å; P207-S211 PolarHBondContact O-OG 3.42Å; I209-S211 VanDerWaalsContact C-N 3.28Å; I209-S211 PolarHBondContact O-N 2.89Å; S211-F213 PolarHBondContact O-N 2.87Å; S211-S214 PolarHBondContact O-N 2.91Å; S211-G274 PolarHBondContact O-N 3.05Å
212S96.8Very high93.8Very high5 Ų549.9 Ų49.94%0.03525%0.252CS..G310 helixtrans-69.4-16.5175.7-57.50000112.7M208 I209 L210 G252 A275M208-S212 PolarHBondContact O-OG 3.16Å; I209-S212 WeakPolarHBondContact O-CB 3.45Å; I209-S212 PolarHBondContact O-N 2.87Å; L210-S212 PolarHBondContact O-N 3.23Å; S212-G252 VanDerWaalsContact OG-CA 3.3Å; S212-G252 WeakPolarHBondContact OG-CA 3.4Å; S212-A275 WeakPolarHBondContact O-CA 3.49Å; S212-A275 VanDerWaalsContact O-CB 3.25Å; S212-A275 WeakPolarHBondContact O-CB 3.43Å; S212-A275 PolarHBondContact O-N 2.99Å
213F97.6Very high94.2Very high27 Ų2742.4 Ų42.412%0.11823%0.229CC..G310 helixtrans-107.28.4175.7-65.6-86.7000112.9I171 V174 N175 V178 I209 L210 S211 Y248 L249I171-F213 HydrophobicContact CG2-CE1 4.16Å; V174-F213 HydrophobicContact CB-CD1 4.17Å; V174-F213 HydrophobicContact CB-CE1 4.49Å; V174-F213 HydrophobicContact CG1-CB 4.35Å; V174-F213 HydrophobicContact CG1-CD1 3.55Å; V174-F213 HydrophobicContact CG1-CE1 4.09Å; V174-F213 HydrophobicContact CG1-CG 4.09Å; N175-F213 WeakPolarHBondContact ND2-CD1 3.26Å; N175-F213 VanDerWaalsContact OD1-CA 3.24Å; N175-F213 WeakPolarHBondContact OD1-CA 3.31Å; N175-F213 PolarHBondContact OD1-O 3.46Å; N175-F213 VanDerWaalsContact OD1-O 3.13Å; V178-F213 VanDerWaalsContact CB-O 3.26Å; V178-F213 WeakPolarHBondContact CB-O 3.31Å; V178-F213 WeakPolarHBondContact CG1-O 3.22Å; V178-F213 HydrophobicContact CG2-CB 4.31Å; I209-F213 HydrophobicContact CG2-CE2 4.39Å; L210-F213 PolarHBondContact O-N 2.78Å; L210-F213 VanDerWaalsContact O-N 3.1Å; S211-F213 PolarHBondContact O-N 2.87Å; F213-Y248 HydrophobicContact CE1-CE1 4.26Å; F213-Y248 HydrophobicContact CZ-CE1 4.14Å; F213-L249 HydrophobicContact CE2-CD2 3.88Å; F213-L249 HydrophobicContact CZ-CD2 3.67Å
214S97Very high94.5Very high0 Ų041.3 Ų41.30%022%0.222CC..  trans-112132.6-170.5-178.70000110.8W182 F195 L210 S211 L273 G274W182-S214 PolarHBondContact NE1-OG 3.41Å; F195-S214 WeakPolarHBondContact O-CB 3.12Å; F195-S214 PolarHBondContact O-OG 3.45Å; L210-S214 PolarHBondContact O-N 2.94Å; S211-S214 PolarHBondContact O-N 2.91Å; S214-L273 CarbonylContact O-C 3.58Å; S214-L273 WeakPolarHBondContact O-CD1 3.44Å; S214-G274 WeakPolarHBondContact O-CA 3.36Å; S214-G274 PolarHBondContact O-N 3.28Å
215H95.3Very high94.9Very high0 Ų040.7 Ų40.70%022%0.219CC..  trans-135.1134.1178.1-66.585000110.1N175 L179 H220 M221 A275N175-H215 PolarHBondContact OD1-CE1 3.2Å; N175-H215 PolarHBondContact OD1-ND1 2.97Å; N175-H215 VanDerWaalsContact OD1-ND1 3.12Å; L179-H215 HydrophobicContact CD1-CB 4.47Å; L179-H215 WeakPolarHBondContact CD1-O 3.22Å; H215-H220 AromaticContact CD2-ND1 3.76Å; H215-M221 HydrophobicContact CB-CB 3.81Å; H215-M221 HydrophobicContact CB-CG 4.36Å; H215-A275 PolarHBondContact CE1-N 3.45Å; H215-A275 PolarHBondContact NE2-N 2.83Å
216Y82.5Confident94.9Very high123 Ų12344 Ų4448%0.48223%0.227SC..SBendtrans-81.5-34.7179.5-179.1-103.8000112.1
217S89.9Confident94.9Very high44 Ų4441.9 Ų41.931%0.30822%0.218SC..SBendtrans-122.3148.5-178.973.90000111.9I219 H220 M221S217-I219 VanDerWaalsContact C-N 3.3Å; S217-I219 PolarHBondContact O-N 2.79Å; S217-H220 PolarHBondContact O-N 3.06Å; S217-H220 WeakPolarHBondContact OG-CB 3.49Å; S217-H220 PolarHBondContact OG-N 3.11Å; S217-M221 PolarHBondContact O-N 2.92Å; S217-M221 VanDerWaalsContact O-N 3.11Å
218I94.1Very high95Very high89 Ų8941.9 Ų41.946%0.45622%0.218SC..Hα-helixtrans-60.2-43.6176.8-67.3163.8000110.1L179 H220 M221 V222L179-I218 HydrophobicContact CD2-CG1 3.95Å; I218-H220 VanDerWaalsContact C-N 3.34Å; I218-H220 PolarHBondContact O-N 3.32Å; I218-M221 WeakPolarHBondContact O-CB 3.26Å; I218-M221 PolarHBondContact O-N 3.42Å; I218-M221 VanDerWaalsContact O-N 3.16Å; I218-V222 HydrophobicContact CG2-CG2 4.04Å; I218-V222 WeakPolarHBondContact O-CG2 3.3Å; I218-V222 PolarHBondContact O-N 3.29Å
219I93.1Very high95Very high141 Ų14145.4 Ų45.472%0.72323%0.231SC*.Hα-helixtrans-61.6-43.2-178.8-61.3173.2000110.8S217 M221 V222 A223S217-I219 VanDerWaalsContact C-N 3.3Å; S217-I219 PolarHBondContact O-N 2.79Å; I219-M221 VanDerWaalsContact C-N 3.33Å; I219-M221 PolarHBondContact O-N 3.08Å; I219-V222 PolarHBondContact O-N 3.25Å; I219-A223 WeakPolarHBondContact O-CB 3.49Å; I219-A223 PolarHBondContact O-N 2.96Å
220H93.3Very high94.9Very high41 Ų4147 Ų4719%0.1924%0.243CC..Hα-helixtrans-63.1-40.8176.8-176.5-150.7000111.4H215 S217 I218 N224H215-H220 AromaticContact CD2-ND1 3.76Å; S217-H220 PolarHBondContact O-N 3.06Å; S217-H220 WeakPolarHBondContact OG-CB 3.49Å; S217-H220 PolarHBondContact OG-N 3.11Å; I218-H220 VanDerWaalsContact C-N 3.34Å; I218-H220 PolarHBondContact O-N 3.32Å; H220-N224 PolarHBondContact CD2-ND2 2.98Å; H220-N224 PolarHBondContact NE2-ND2 3.23Å; H220-N224 PolarHBondContact O-N 3.47Å; H220-N224 PolarHBondContact O-ND2 2.87Å
221M95.4Very high94.9Very high27 Ų2746 Ų4613%0.13324%0.236CC..Hα-helixtrans-63.3-49.9174.5-172.2-176.472.400111.7N175 L179 H215 S217 I218 I219 A223 N224 M225N175-M221 HydrophobicContact CB-SD 4.43Å; L179-M221 HydrophobicContact CB-SD 3.92Å; L179-M221 HydrophobicContact CD2-CE 3.47Å; L179-M221 VanDerWaalsContact CD2-CE 3.47Å; L179-M221 HydrophobicContact CD2-SD 3.52Å; L179-M221 VanDerWaalsContact CD2-SD 3.52Å; L179-M221 HydrophobicContact CG-SD 4.27Å; H215-M221 HydrophobicContact CB-CB 3.81Å; H215-M221 HydrophobicContact CB-CG 4.36Å; S217-M221 PolarHBondContact O-N 2.92Å; S217-M221 VanDerWaalsContact O-N 3.11Å; I218-M221 WeakPolarHBondContact O-CB 3.26Å; I218-M221 PolarHBondContact O-N 3.42Å; I218-M221 VanDerWaalsContact O-N 3.16Å; I219-M221 VanDerWaalsContact C-N 3.33Å; I219-M221 PolarHBondContact O-N 3.08Å; M221-A223 VanDerWaalsContact C-N 3.32Å; M221-A223 PolarHBondContact O-N 3.36Å; M221-N224 PolarHBondContact O-N 2.97Å; M221-M225 HydrophobicContact CG-CG 4.04Å; M221-M225 WeakPolarHBondContact O-CB 3.24Å; M221-M225 VanDerWaalsContact O-CG 3.28Å; M221-M225 WeakPolarHBondContact O-CG 3.35Å; M221-M225 PolarHBondContact O-N 3.12Å
222V96.1Very high94.9Very high83 Ų8345.9 Ų45.950%0.50324%0.235SC..Hα-helixtrans-58.7-44.6-179.1169.30000110.8I218 I219 N224 M225 Y226I218-V222 HydrophobicContact CG2-CG2 4.04Å; I218-V222 WeakPolarHBondContact O-CG2 3.3Å; I218-V222 PolarHBondContact O-N 3.29Å; I219-V222 PolarHBondContact O-N 3.25Å; V222-N224 PolarHBondContact O-N 2.84Å; V222-M225 PolarHBondContact O-N 3.2Å; V222-Y226 WeakPolarHBondContact O-CB 3.27Å; V222-Y226 PolarHBondContact O-N 2.8Å
223A94.1Very high94.9Very high54 Ų5447.4 Ų47.445%0.44625%0.246SC..Hα-helixtrans-60-46.117700000112.2I219 M221 Y226 V227I219-A223 WeakPolarHBondContact O-CB 3.49Å; I219-A223 PolarHBondContact O-N 2.96Å; M221-A223 VanDerWaalsContact C-N 3.32Å; M221-A223 PolarHBondContact O-N 3.36Å; A223-Y226 PolarHBondContact O-N 3.48Å; A223-V227 WeakPolarHBondContact O-CG2 3.39Å; A223-V227 PolarHBondContact O-N 2.91Å
224N96.3Very high94.8Very high11 Ų1147.5 Ų47.56%0.05926%0.255CS..Hα-helixtrans-63.3-48177.6-85.2-80.6000112.4H220 M221 V222 Y226 V227 L228 A275 S276 V279H220-N224 PolarHBondContact CD2-ND2 2.98Å; H220-N224 PolarHBondContact NE2-ND2 3.23Å; H220-N224 PolarHBondContact O-N 3.47Å; H220-N224 PolarHBondContact O-ND2 2.87Å; M221-N224 PolarHBondContact O-N 2.97Å; V222-N224 PolarHBondContact O-N 2.84Å; N224-Y226 VanDerWaalsContact C-N 3.3Å; N224-Y226 PolarHBondContact O-N 3.37Å; N224-V227 PolarHBondContact O-N 3.24Å; N224-L228 WeakPolarHBondContact O-CB 3.36Å; N224-L228 PolarHBondContact O-N 3.46Å; N224-A275 HydrophobicContact CB-CB 4.38Å; N224-S276 WeakPolarHBondContact OD1-CA 3.33Å; N224-S276 VanDerWaalsContact OD1-CB 3.23Å; N224-S276 WeakPolarHBondContact OD1-CB 3.26Å; N224-S276 PolarHBondContact OD1-N 3.48Å; N224-S276 VanDerWaalsContact OD1-N 3.08Å; N224-V279 HydrophobicContact CB-CG2 4.49Å
225M97.6Very high94.8Very high13 Ų1347.5 Ų47.56%0.06426%0.255CS..Hα-helixtrans-69-32-177.5-65-52100.500111.5I172 N175 M221 V222 L228 W229 A275I172-M225 HydrophobicContact CB-SD 4.18Å; I172-M225 HydrophobicContact CD1-CB 4.41Å; I172-M225 HydrophobicContact CG1-CB 3.99Å; I172-M225 HydrophobicContact CG1-CG 4Å; I172-M225 HydrophobicContact CG1-SD 3.58Å; I172-M225 VanDerWaalsContact CG1-SD 3.58Å; I172-M225 HydrophobicContact CG2-CG 4.36Å; N175-M225 HydrophobicContact CB-CE 4.46Å; N175-M225 HydrophobicContact CB-SD 4.09Å; M221-M225 HydrophobicContact CG-CG 4.04Å; M221-M225 WeakPolarHBondContact O-CB 3.24Å; M221-M225 VanDerWaalsContact O-CG 3.28Å; M221-M225 WeakPolarHBondContact O-CG 3.35Å; M221-M225 PolarHBondContact O-N 3.12Å; V222-M225 PolarHBondContact O-N 3.2Å; M225-L228 PolarHBondContact O-N 3.08Å; M225-L228 HydrophobicContact SD-CD2 4.33Å; M225-W229 WeakPolarHBondContact O-CB 3.23Å; M225-W229 PolarHBondContact O-N 3.38Å; M225-A275 HydrophobicContact CE-CB 3.76Å
226Y96Very high94.9Very high103 Ų10347.9 Ų47.940%0.40426%0.257SS..Hα-helixtrans-62.9-48.2173.3172.2-99.9000112V222 A223 N224 W229 T230 I298V222-Y226 WeakPolarHBondContact O-CB 3.27Å; V222-Y226 PolarHBondContact O-N 2.8Å; A223-Y226 PolarHBondContact O-N 3.48Å; N224-Y226 VanDerWaalsContact C-N 3.3Å; N224-Y226 PolarHBondContact O-N 3.37Å; Y226-W229 PolarHBondContact O-N 2.88Å; Y226-T230 WeakPolarHBondContact O-CB 3.12Å; Y226-T230 PolarHBondContact O-N 3.45Å; Y226-T230 PolarHBondContact O-OG1 3.48Å; Y226-I298 HydrophobicContact CD1-CD1 4.43Å; Y226-I298 HydrophobicContact CD2-CD1 4.22Å; Y226-I298 HydrophobicContact CE1-CD1 3.67Å; Y226-I298 HydrophobicContact CE1-CG1 4.37Å; Y226-I298 HydrophobicContact CE2-CD1 3.43Å; Y226-I298 VanDerWaalsContact CE2-CD1 3.43Å; Y226-I298 HydrophobicContact CE2-CG1 4.28Å; Y226-I298 WeakPolarHBondContact OH-CD1 3.46Å; Y226-I298 WeakPolarHBondContact OH-CG1 3.18Å
227V95.6Very high95.5Very high40 Ų4047.1 Ų47.124%0.24227%0.27CS..Hα-helixtrans-63.7-46.1176.41770000109.9A223 N224 W229 T230 F231 V279 L283A223-V227 WeakPolarHBondContact O-CG2 3.39Å; A223-V227 PolarHBondContact O-N 2.91Å; N224-V227 PolarHBondContact O-N 3.24Å; V227-W229 VanDerWaalsContact C-N 3.35Å; V227-W229 PolarHBondContact O-N 3.13Å; V227-T230 PolarHBondContact O-N 2.84Å; V227-F231 HydrophobicContact CG1-CD2 3.84Å; V227-F231 HydrophobicContact CG1-CE2 4.14Å; V227-F231 WeakPolarHBondContact O-CD2 3.42Å; V227-F231 PolarHBondContact O-N 3.33Å; V227-V279 HydrophobicContact CB-CG1 3.7Å; V227-V279 HydrophobicContact CG1-CG1 3.42Å; V227-V279 VanDerWaalsContact CG1-CG1 3.42Å; V227-L283 HydrophobicContact CG1-CB 4.49Å; V227-L283 HydrophobicContact CG1-CD1 3.82Å
228L97.9Very high95.8Very high0 Ų048.5 Ų48.50%027%0.273CS..Hα-helixtrans-56.6-48.6176.9-17761.1000111.7A168 I171 N224 M225 T230 F231 S232 F244 Y248 V279 V282A168-L228 HydrophobicContact CB-CG 4.35Å; I171-L228 HydrophobicContact CB-CD2 4.03Å; I171-L228 HydrophobicContact CD1-CD2 4.25Å; I171-L228 HydrophobicContact CG2-CD2 3.59Å; N224-L228 WeakPolarHBondContact O-CB 3.36Å; N224-L228 PolarHBondContact O-N 3.46Å; M225-L228 PolarHBondContact O-N 3.08Å; M225-L228 HydrophobicContact SD-CD2 4.33Å; L228-T230 PolarHBondContact O-N 3.23Å; L228-F231 PolarHBondContact O-N 3.1Å; L228-S232 WeakPolarHBondContact O-CA 3.23Å; L228-S232 WeakPolarHBondContact O-CB 3.16Å; L228-S232 PolarHBondContact O-N 2.73Å; L228-F244 HydrophobicContact CD1-CE2 4.39Å; L228-F244 HydrophobicContact CD1-CZ 4.13Å; L228-Y248 HydrophobicContact CD1-CD2 4.1Å; L228-Y248 HydrophobicContact CD1-CE2 3.81Å; L228-Y248 HydrophobicContact CD2-CE2 4.04Å; L228-V279 HydrophobicContact CB-CG2 4.18Å; L228-V282 HydrophobicContact CD1-CG2 4.42Å
229W97.1Very high95.9Very high74 Ų7445 Ų4528%0.2826%0.255SS..Hα-helixtrans-57-49.5178.1179.9-93.6000111.6L161 Q165 T169 I172 M225 Y226 V227 F231 S232L161-W229 HydrophobicContact CD1-CH2 3.88Å; L161-W229 HydrophobicContact CD2-CH2 3.64Å; L161-W229 HydrophobicContact CD2-CZ2 3.79Å; L161-W229 HydrophobicContact CG-CH2 4.39Å; Q165-W229 HydrophobicContact CB-CE3 4.36Å; Q165-W229 HydrophobicContact CB-CH2 3.79Å; Q165-W229 HydrophobicContact CB-CZ2 4.04Å; Q165-W229 HydrophobicContact CB-CZ3 3.95Å; Q165-W229 HydrophobicContact CG-CD2 4.11Å; Q165-W229 HydrophobicContact CG-CE3 4.32Å; Q165-W229 HydrophobicContact CG-CH2 4.05Å; Q165-W229 HydrophobicContact CG-CZ2 3.78Å; Q165-W229 HydrophobicContact CG-CZ3 4.29Å; T169-W229 WeakPolarHBondContact OG1-CZ3 3.31Å; I172-W229 HydrophobicContact CD1-CE3 3.84Å; I172-W229 HydrophobicContact CD1-CZ3 4.49Å; M225-W229 WeakPolarHBondContact O-CB 3.23Å; M225-W229 PolarHBondContact O-N 3.38Å; Y226-W229 PolarHBondContact O-N 2.88Å; V227-W229 VanDerWaalsContact C-N 3.35Å; V227-W229 PolarHBondContact O-N 3.13Å; W229-F231 PolarHBondContact O-N 3.29Å; W229-S232 PolarHBondContact O-N 2.84Å; W229-S232 PolarHBondContact O-OG 2.92Å
230T94.2Very high96.1Very high64 Ų6439.3 Ų39.339%0.39323%0.232SC..Hα-helixtrans-60.8-42.8-177.3-58.20000112.3Y226 V227 L228Y226-T230 WeakPolarHBondContact O-CB 3.12Å; Y226-T230 PolarHBondContact O-N 3.45Å; Y226-T230 PolarHBondContact O-OG1 3.48Å; V227-T230 PolarHBondContact O-N 2.84Å; L228-T230 PolarHBondContact O-N 3.23Å
231F95.9Very high96.2Very high24 Ų2439.8 Ų39.811%0.10523%0.233CC..Hα-helixtrans-92.3-7.2-177.3-71.6-86000114V227 L228 W229 S233 G234 I235 V282 L283 V286 L295V227-F231 HydrophobicContact CG1-CD2 3.84Å; V227-F231 HydrophobicContact CG1-CE2 4.14Å; V227-F231 WeakPolarHBondContact O-CD2 3.42Å; V227-F231 PolarHBondContact O-N 3.33Å; L228-F231 PolarHBondContact O-N 3.1Å; W229-F231 PolarHBondContact O-N 3.29Å; F231-S233 PolarHBondContact O-N 2.89Å; F231-G234 PolarHBondContact O-N 3.14Å; F231-I235 WeakPolarHBondContact O-CG2 3.13Å; F231-I235 PolarHBondContact O-N 3.24Å; F231-V282 HydrophobicContact CB-CG1 3.99Å; F231-L283 HydrophobicContact CD2-CD1 4.48Å; F231-L283 HydrophobicContact CE2-CD1 3.94Å; F231-L283 HydrophobicContact CE2-CG 4.2Å; F231-L283 HydrophobicContact CZ-CD1 4.25Å; F231-L283 HydrophobicContact CZ-CG 4.19Å; F231-V286 HydrophobicContact CD1-CB 3.92Å; F231-V286 HydrophobicContact CD1-CG1 3.85Å; F231-V286 HydrophobicContact CD1-CG2 4.33Å; F231-V286 HydrophobicContact CE1-CG1 4.31Å; F231-L295 HydrophobicContact CE1-CD1 4.33Å; F231-L295 HydrophobicContact CE1-CD2 4.09Å; F231-L295 HydrophobicContact CZ-CD1 3.84Å; F231-L295 HydrophobicContact CZ-CD2 3.94Å
232S96.9Very high96.3Very high0 Ų039.7 Ų39.70%023%0.233CC..Hα-helixtrans-59.9-45.3-175.563.90000113.4G164 Q165 L228 W229 G234 I235 V236G164-S232 WeakPolarHBondContact O-CB 3.48Å; Q165-S232 PolarHBondContact N-OG 2.93Å; L228-S232 WeakPolarHBondContact O-CA 3.23Å; L228-S232 WeakPolarHBondContact O-CB 3.16Å; L228-S232 PolarHBondContact O-N 2.73Å; W229-S232 PolarHBondContact O-N 2.84Å; W229-S232 PolarHBondContact O-OG 2.92Å; S232-G234 VanDerWaalsContact C-N 3.34Å; S232-G234 PolarHBondContact O-N 3.32Å; S232-I235 VanDerWaalsContact O-CG2 3.31Å; S232-I235 WeakPolarHBondContact O-CG2 3.31Å; S232-I235 PolarHBondContact O-N 3.21Å; S232-V236 WeakPolarHBondContact O-CB 3.42Å; S232-V236 WeakPolarHBondContact O-CG2 3.48Å; S232-V236 PolarHBondContact O-N 3.16Å
233S96Very high96.4Very high37 Ų3735.9 Ų35.926%0.25921%0.209SC..Hα-helixtrans-63.3-41.7178.3-48.50000111.3T162 F231 S237T162-S233 PolarHBondContact OG1-OG 3.32Å; F231-S233 PolarHBondContact O-N 2.89Å; S233-S237 VanDerWaalsContact O-CB 3.22Å; S233-S237 WeakPolarHBondContact O-CB 3.23Å; S233-S237 PolarHBondContact O-N 3.23Å
234G95.8Very high96.6Very high29 Ų2933.3 Ų33.330%0.29919%0.188SC..Hα-helixtrans-62.6-51177.300000112F231 S232 V236 S237 L238F231-G234 PolarHBondContact O-N 3.14Å; S232-G234 VanDerWaalsContact C-N 3.34Å; S232-G234 PolarHBondContact O-N 3.32Å; G234-V236 PolarHBondContact O-N 3.29Å; G234-S237 PolarHBondContact O-N 3.19Å; G234-L238 VanDerWaalsContact O-CG 3.27Å; G234-L238 WeakPolarHBondContact O-CG 3.18Å; G234-L238 PolarHBondContact O-N 2.95Å
235I97.4Very high96.7Very high0 Ų036 Ų360%020%0.202CC..Hα-helixtrans-68.9-36.6-177.6-166.261.6000112.8F231 S232 L238 L239 F244 V282 A285 V286F231-I235 WeakPolarHBondContact O-CG2 3.13Å; F231-I235 PolarHBondContact O-N 3.24Å; S232-I235 VanDerWaalsContact O-CG2 3.31Å; S232-I235 WeakPolarHBondContact O-CG2 3.31Å; S232-I235 PolarHBondContact O-N 3.21Å; I235-L238 PolarHBondContact O-N 3.24Å; I235-L239 HydrophobicContact CD1-CD1 3.62Å; I235-L239 HydrophobicContact CD1-CG 4.06Å; I235-L239 HydrophobicContact CG1-CD1 3.95Å; I235-L239 HydrophobicContact CG1-CG 4.48Å; I235-L239 WeakPolarHBondContact O-CB 3.24Å; I235-L239 PolarHBondContact O-N 2.95Å; I235-F244 HydrophobicContact CB-CD2 4.33Å; I235-F244 HydrophobicContact CG1-CD2 3.97Å; I235-F244 HydrophobicContact CG2-CD2 3.36Å; I235-F244 HydrophobicContact CG2-CE2 3.57Å; I235-F244 HydrophobicContact CG2-CG 4.12Å; I235-F244 HydrophobicContact CG2-CZ 4.47Å; I235-V282 HydrophobicContact CB-CG1 3.97Å; I235-V282 HydrophobicContact CG1-CG1 4.29Å; I235-V282 HydrophobicContact CG2-CG1 3.75Å; I235-A285 HydrophobicContact CD1-CB 3.73Å; I235-V286 HydrophobicContact CB-CG2 3.78Å; I235-V286 HydrophobicContact CD1-CG2 4.11Å; I235-V286 HydrophobicContact CG1-CG2 4.49Å
236V97.8Very high96.7Very high8 Ų835.4 Ų35.45%0.04820%0.199CC..Hα-helixtrans-72-33.8176.8169.70000111.3E163 S232 G234 L238 L239 G240 K241 F244E163-V236 HydrophobicContact CB-CG1 4.32Å; E163-V236 HydrophobicContact CG-CG1 4.25Å; S232-V236 WeakPolarHBondContact O-CB 3.42Å; S232-V236 WeakPolarHBondContact O-CG2 3.48Å; S232-V236 PolarHBondContact O-N 3.16Å; G234-V236 PolarHBondContact O-N 3.29Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.47Å; V236-L239 PolarHBondContact O-N 3.11Å; V236-G240 WeakPolarHBondContact O-CA 3Å; V236-G240 PolarHBondContact O-N 3.18Å; V236-K241 HydrophobicContact CG1-CB 4.16Å; V236-F244 HydrophobicContact CG2-CB 3.75Å; V236-F244 HydrophobicContact CG2-CD1 3.51Å; V236-F244 HydrophobicContact CG2-CD2 4.38Å; V236-F244 HydrophobicContact CG2-CE1 4.2Å; V236-F244 HydrophobicContact CG2-CG 3.61Å
237S95.8Very high96.8Very high107 Ų10730.6 Ų30.675%0.74818%0.18SC*.Hα-helixtrans-62.5-38.3170-176.70000111.8S233 G234S233-S237 VanDerWaalsContact O-CB 3.22Å; S233-S237 WeakPolarHBondContact O-CB 3.23Å; S233-S237 PolarHBondContact O-N 3.23Å; G234-S237 PolarHBondContact O-N 3.19Å
238L94.9Very high97Very high73 Ų7328.8 Ų28.838%0.38217%0.169SC..Hα-helixtrans-72.6-35.1179.2-70.1170.7000114G234 I235 V236 V286 K289G234-L238 VanDerWaalsContact O-CG 3.27Å; G234-L238 WeakPolarHBondContact O-CG 3.18Å; G234-L238 PolarHBondContact O-N 2.95Å; I235-L238 PolarHBondContact O-N 3.24Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.47Å; L238-V286 HydrophobicContact CD1-CG2 4.33Å; L238-K289 HydrophobicContact CD1-CB 3.86Å; L238-K289 HydrophobicContact CD1-CG 4.1Å; L238-K289 HydrophobicContact CD2-CB 4.28Å; L238-K289 HydrophobicContact CD2-CG 4.47Å
239L96.4Very high97Very high16 Ų1630.8 Ų30.88%0.08418%0.18CC..Hα-helixtrans-120.8-21.7-167.7-59.2-176.1000114.5I235 V236 Q243 V247 Y344I235-L239 HydrophobicContact CD1-CD1 3.62Å; I235-L239 HydrophobicContact CD1-CG 4.06Å; I235-L239 HydrophobicContact CG1-CD1 3.95Å; I235-L239 HydrophobicContact CG1-CG 4.48Å; I235-L239 WeakPolarHBondContact O-CB 3.24Å; I235-L239 PolarHBondContact O-N 2.95Å; V236-L239 PolarHBondContact O-N 3.11Å; L239-Q243 HydrophobicContact CB-CB 3.97Å; L239-Q243 HydrophobicContact CB-CG 3.98Å; L239-Q243 HydrophobicContact CD1-CG 4.44Å; L239-Q243 VanDerWaalsContact O-CB 3.24Å; L239-Q243 WeakPolarHBondContact O-CB 3.28Å; L239-Q243 PolarHBondContact O-OE1 2.97Å; L239-V247 HydrophobicContact CD1-CG2 3.98Å; L239-Y344 HydrophobicContact CD1-CD1 4.43Å; L239-Y344 HydrophobicContact CD1-CE1 3.96Å; L239-Y344 HydrophobicContact CD2-CE1 4.13Å
240G96.8Very high97.1Very high22 Ų2227.2 Ų27.223%0.22717%0.166CC..  trans79158.4-161.100000112.2V236 E242 F244V236-G240 WeakPolarHBondContact O-CA 3Å; V236-G240 PolarHBondContact O-N 3.18Å; G240-E242 PolarHBondContact O-N 2.95Å; G240-F244 VanDerWaalsContact O-CB 3.26Å; G240-F244 WeakPolarHBondContact O-CB 3.33Å; G240-F244 PolarHBondContact O-N 3.41Å
241K96.8Very high97.3Very high50 Ų5024.2 Ų24.222%0.21715%0.148CC..Hα-helixtrans-67.4-37-170.965.9179170.4-148.70113.7E163 T167 V236 F244 L245E163-K241 HydrophobicContact CG-CB 4.42Å; E163-K241 HydrophobicContact CG-CD 4.16Å; E163-K241 VanDerWaalsContact OE1-CD 3.29Å; E163-K241 WeakPolarHBondContact OE1-CD 3.35Å; E163-K241 WeakPolarHBondContact OE1-CE 3.31Å; E163-K241 IonicContact OE1-NZ 3.78Å; E163-K241 PolarHBondContact OE1-NZ 3.22Å; T167-K241 HydrophobicContact CG2-CB 4.34Å; V236-K241 HydrophobicContact CG1-CB 4.16Å; K241-F244 PolarHBondContact O-N 2.82Å; K241-L245 PolarHBondContact O-N 2.98Å
242E97.2Very high97.4Very high26 Ų2623.1 Ų23.112%0.12114%0.143CC..Hα-helixtrans-70.6-45.6-177.5-59.780.4-174.400110.1A99 Q103 G240 F244 L245 A246A99-E242 HydrophobicContact CB-CB 4.33Å; A99-E242 WeakPolarHBondContact CB-O 3.36Å; Q103-E242 HydrophobicContact CB-CB 4.06Å; Q103-E242 HydrophobicContact CB-CG 3.96Å; G240-E242 PolarHBondContact O-N 2.95Å; E242-F244 VanDerWaalsContact C-N 3.35Å; E242-L245 PolarHBondContact O-N 3.12Å; E242-A246 PolarHBondContact O-N 3.42Å; E242-A246 VanDerWaalsContact O-N 3.11Å
243Q97.5Very high97.4Very high2 Ų223.1 Ų23.11%0.00914%0.143CC..Hα-helixtrans-63.2-42.5174.9-169.4175.11700111.2L239 L245 A246 V247 Y344 H349 W353L239-Q243 HydrophobicContact CB-CB 3.97Å; L239-Q243 HydrophobicContact CB-CG 3.98Å; L239-Q243 HydrophobicContact CD1-CG 4.44Å; L239-Q243 VanDerWaalsContact O-CB 3.24Å; L239-Q243 WeakPolarHBondContact O-CB 3.28Å; L239-Q243 PolarHBondContact O-OE1 2.97Å; Q243-L245 VanDerWaalsContact C-N 3.34Å; Q243-L245 PolarHBondContact O-N 3.46Å; Q243-A246 PolarHBondContact O-N 3.48Å; Q243-V247 VanDerWaalsContact O-CG2 3.31Å; Q243-V247 WeakPolarHBondContact O-CG2 3.42Å; Q243-V247 PolarHBondContact O-N 3.36Å; Q243-Y344 VanDerWaalsContact CG-OH 3.26Å; Q243-Y344 WeakPolarHBondContact CG-OH 3.25Å; Q243-Y344 PolarHBondContact NE2-OH 2.79Å; Q243-H349 PolarHBondContact NE2-ND1 3.47Å; Q243-H349 PolarHBondContact OE1-ND1 2.74Å; Q243-W353 HydrophobicContact CB-CD2 4.07Å; Q243-W353 HydrophobicContact CB-CE3 4.2Å; Q243-W353 HydrophobicContact CB-CH2 3.72Å; Q243-W353 HydrophobicContact CB-CZ2 3.55Å; Q243-W353 HydrophobicContact CB-CZ3 4.04Å; Q243-W353 VanDerWaalsContact CD-CD1 3.46Å; Q243-W353 VanDerWaalsContact CD-CD2 3.43Å; Q243-W353 HydrophobicContact CG-CD2 3.62Å; Q243-W353 HydrophobicContact CG-CE3 3.76Å; Q243-W353 HydrophobicContact CG-CG 4.09Å; Q243-W353 HydrophobicContact CG-CH2 4.22Å; Q243-W353 HydrophobicContact CG-CZ2 4.09Å; Q243-W353 HydrophobicContact CG-CZ3 4.06Å; Q243-W353 VanDerWaalsContact NE2-CD1 3.34Å
244F98.3Very high97.6Very high0 Ų023.2 Ų23.20%014%0.141CC..Hα-helixtrans-56.1-47.6174.7157.3-111.5000111.7T167 I171 L228 I235 V236 G240 K241 E242 A246 V247 Y248 V282T167-F244 HydrophobicContact CG2-CD1 3.78Å; T167-F244 HydrophobicContact CG2-CE1 3.69Å; I171-F244 HydrophobicContact CD1-CE1 3.92Å; I171-F244 HydrophobicContact CD1-CZ 3.82Å; L228-F244 HydrophobicContact CD1-CE2 4.39Å; L228-F244 HydrophobicContact CD1-CZ 4.13Å; I235-F244 HydrophobicContact CB-CD2 4.33Å; I235-F244 HydrophobicContact CG1-CD2 3.97Å; I235-F244 HydrophobicContact CG2-CD2 3.36Å; I235-F244 HydrophobicContact CG2-CE2 3.57Å; I235-F244 HydrophobicContact CG2-CG 4.12Å; I235-F244 HydrophobicContact CG2-CZ 4.47Å; V236-F244 HydrophobicContact CG2-CB 3.75Å; V236-F244 HydrophobicContact CG2-CD1 3.51Å; V236-F244 HydrophobicContact CG2-CD2 4.38Å; V236-F244 HydrophobicContact CG2-CE1 4.2Å; V236-F244 HydrophobicContact CG2-CG 3.61Å; G240-F244 VanDerWaalsContact O-CB 3.26Å; G240-F244 WeakPolarHBondContact O-CB 3.33Å; G240-F244 PolarHBondContact O-N 3.41Å; K241-F244 PolarHBondContact O-N 2.82Å; E242-F244 VanDerWaalsContact C-N 3.35Å; F244-A246 VanDerWaalsContact C-N 3.33Å; F244-A246 PolarHBondContact O-N 3Å; F244-V247 PolarHBondContact O-N 3.47Å; F244-Y248 HydrophobicContact CE2-CD2 4.46Å; F244-Y248 WeakPolarHBondContact O-CB 3.43Å; F244-Y248 PolarHBondContact O-N 3.5Å; F244-V282 HydrophobicContact CD2-CG2 4.46Å; F244-V282 HydrophobicContact CE2-CG2 3.86Å
245L98.1Very high97.7Very high67 Ų6722 Ų2235%0.35113%0.127SC..Hα-helixtrans-63.1-40.8-179.9-17163.1000111.4I171 K241 E242 Q243 Y248 L249I171-L245 HydrophobicContact CD1-CD1 4.24Å; I171-L245 HydrophobicContact CG1-CD1 4.42Å; K241-L245 PolarHBondContact O-N 2.98Å; E242-L245 PolarHBondContact O-N 3.12Å; Q243-L245 VanDerWaalsContact C-N 3.34Å; Q243-L245 PolarHBondContact O-N 3.46Å; L245-Y248 PolarHBondContact O-N 3.27Å; L245-L249 HydrophobicContact CD1-CD1 4.43Å; L245-L249 HydrophobicContact CD1-CG 4.44Å; L245-L249 HydrophobicContact CG-CD1 4.1Å; L245-L249 HydrophobicContact CG-CG 4.5Å; L245-L249 WeakPolarHBondContact O-CB 3.41Å; L245-L249 VanDerWaalsContact O-CG 3.28Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 3.06Å
246A98.3Very high97.7Very high2 Ų222.4 Ų22.42%0.01713%0.13CC..Hα-helixtrans-63.5-41.617500000113S95 F96 A99 E242 Q243 F244 S250S95-A246 WeakPolarHBondContact OG-CA 3.21Å; F96-A246 HydrophobicContact CD1-CB 3.63Å; F96-A246 HydrophobicContact CE1-CB 3.74Å; F96-A246 HydrophobicContact CG-CB 4.22Å; F96-A246 HydrophobicContact CZ-CB 4.45Å; A99-A246 HydrophobicContact CB-CB 3.63Å; E242-A246 PolarHBondContact O-N 3.42Å; E242-A246 VanDerWaalsContact O-N 3.11Å; Q243-A246 PolarHBondContact O-N 3.48Å; F244-A246 VanDerWaalsContact C-N 3.33Å; F244-A246 PolarHBondContact O-N 3Å; A246-S250 WeakPolarHBondContact O-CB 3.25Å; A246-S250 PolarHBondContact O-N 3.5Å; A246-S250 PolarHBondContact O-OG 3.38Å
247V98.4Very high97.7Very high1 Ų122.8 Ų22.81%0.00613%0.131CC..Hα-helixtrans-62.6-46.7174.7170.50000110.6F96 L239 Q243 F244 S250 A251 F340 Y344F96-V247 HydrophobicContact CE1-CG2 3.87Å; F96-V247 HydrophobicContact CZ-CG2 3.89Å; L239-V247 HydrophobicContact CD1-CG2 3.98Å; Q243-V247 VanDerWaalsContact O-CG2 3.31Å; Q243-V247 WeakPolarHBondContact O-CG2 3.42Å; Q243-V247 PolarHBondContact O-N 3.36Å; F244-V247 PolarHBondContact O-N 3.47Å; V247-S250 PolarHBondContact O-N 2.74Å; V247-A251 WeakPolarHBondContact O-CB 3.43Å; V247-A251 PolarHBondContact O-N 2.97Å; V247-F340 HydrophobicContact CG1-CE1 4.1Å; V247-Y344 HydrophobicContact CG1-CD1 4.44Å; V247-Y344 HydrophobicContact CG2-CD1 3.63Å; V247-Y344 HydrophobicContact CG2-CD2 4.28Å; V247-Y344 HydrophobicContact CG2-CE1 3.17Å; V247-Y344 HydrophobicContact CG2-CE2 3.91Å; V247-Y344 HydrophobicContact CG2-CG 4.14Å
248Y98.6Very high97.8Very high2 Ų220.2 Ų20.21%0.00811%0.111CC..Hα-helixtrans-60.8-48.7-179.5-177.7-90.2000111.8I171 F213 L228 F244 L245 A251 G252 A275 A278 V279 V282I171-Y248 HydrophobicContact CD1-CD1 4Å; I171-Y248 HydrophobicContact CD1-CD2 4.36Å; I171-Y248 HydrophobicContact CD1-CE1 4.11Å; I171-Y248 HydrophobicContact CD1-CE2 4.46Å; I171-Y248 HydrophobicContact CD1-CG 4.13Å; I171-Y248 HydrophobicContact CG2-CE1 3.82Å; I171-Y248 HydrophobicContact CG2-CE2 4.5Å; I171-Y248 WeakPolarHBondContact CG2-OH 3.19Å; F213-Y248 HydrophobicContact CE1-CE1 4.26Å; F213-Y248 HydrophobicContact CZ-CE1 4.14Å; L228-Y248 HydrophobicContact CD1-CD2 4.1Å; L228-Y248 HydrophobicContact CD1-CE2 3.81Å; L228-Y248 HydrophobicContact CD2-CE2 4.04Å; F244-Y248 HydrophobicContact CE2-CD2 4.46Å; F244-Y248 WeakPolarHBondContact O-CB 3.43Å; F244-Y248 PolarHBondContact O-N 3.5Å; L245-Y248 PolarHBondContact O-N 3.27Å; Y248-A251 PolarHBondContact O-N 3.47Å; Y248-G252 PolarHBondContact O-N 3Å; Y248-G252 VanDerWaalsContact O-N 3.08Å; Y248-A275 WeakPolarHBondContact OH-CB 3.18Å; Y248-A278 HydrophobicContact CD1-CB 4.38Å; Y248-A278 HydrophobicContact CD2-CB 3.81Å; Y248-A278 HydrophobicContact CE1-CB 4.22Å; Y248-A278 HydrophobicContact CE2-CB 3.63Å; Y248-A278 HydrophobicContact CG-CB 4.19Å; Y248-A278 WeakPolarHBondContact O-CB 3.12Å; Y248-V279 HydrophobicContact CE2-CG2 4.32Å; Y248-V282 HydrophobicContact CD2-CG2 4.05Å
249L98.5Very high97.9Very high42 Ų4216.7 Ų16.722%0.229%0.093CC..Hα-helixtrans-65.3-44.9179-69174.6000111.8F91 F213 L245 A251 G252 V253F91-L249 HydrophobicContact CE1-CB 3.98Å; F91-L249 HydrophobicContact CZ-CB 4.25Å; F213-L249 HydrophobicContact CE2-CD2 3.88Å; F213-L249 HydrophobicContact CZ-CD2 3.67Å; L245-L249 HydrophobicContact CD1-CD1 4.43Å; L245-L249 HydrophobicContact CD1-CG 4.44Å; L245-L249 HydrophobicContact CG-CD1 4.1Å; L245-L249 HydrophobicContact CG-CG 4.5Å; L245-L249 WeakPolarHBondContact O-CB 3.41Å; L245-L249 VanDerWaalsContact O-CG 3.28Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 3.06Å; L249-A251 VanDerWaalsContact C-N 3.34Å; L249-A251 PolarHBondContact O-N 3.19Å; L249-G252 PolarHBondContact O-N 3.05Å; L249-V253 PolarHBondContact O-N 2.82Å
250S98.5Very high97.9Very high0 Ų016 Ų160%09%0.089CC..Hα-helixtrans-63.7-41.2177.3-59.60000111.4A246 V247 G252 V253 I254A246-S250 WeakPolarHBondContact O-CB 3.25Å; A246-S250 PolarHBondContact O-N 3.5Å; A246-S250 PolarHBondContact O-OG 3.38Å; V247-S250 PolarHBondContact O-N 2.74Å; S250-G252 VanDerWaalsContact C-N 3.33Å; S250-G252 PolarHBondContact O-N 3.47Å; S250-V253 PolarHBondContact O-N 2.94Å; S250-I254 WeakPolarHBondContact O-CB 3.4Å; S250-I254 WeakPolarHBondContact O-CD1 3.18Å; S250-I254 VanDerWaalsContact O-CG1 3.23Å; S250-I254 WeakPolarHBondContact O-CG1 3.45Å; S250-I254 PolarHBondContact O-N 2.99Å
251A98.6Very high97.8Very high0 Ų018.2 Ų18.20%010%0.098CC..Hα-helixtrans-60.9-39.8176.700000112.3V247 Y248 L249 V253 S255 A278 A281 F340V247-A251 WeakPolarHBondContact O-CB 3.43Å; V247-A251 PolarHBondContact O-N 2.97Å; Y248-A251 PolarHBondContact O-N 3.47Å; L249-A251 VanDerWaalsContact C-N 3.34Å; L249-A251 PolarHBondContact O-N 3.19Å; A251-V253 PolarHBondContact O-N 3.18Å; A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 3.35Å; A251-S255 PolarHBondContact O-OG 3.21Å; A251-A278 HydrophobicContact CB-CB 4.26Å; A251-A281 HydrophobicContact CB-CB 3.43Å; A251-A281 VanDerWaalsContact CB-CB 3.43Å; A251-F340 HydrophobicContact CB-CD1 3.59Å; A251-F340 HydrophobicContact CB-CE1 3.76Å
252G98.3Very high97.8Very high1 Ų117.3 Ų17.31%0.0110%0.098CC..Hα-helixtrans-59.8-45.1175.700000112.8S212 Y248 L249 S250 S255 T256S212-G252 VanDerWaalsContact OG-CA 3.3Å; S212-G252 WeakPolarHBondContact OG-CA 3.4Å; Y248-G252 PolarHBondContact O-N 3Å; Y248-G252 VanDerWaalsContact O-N 3.08Å; L249-G252 PolarHBondContact O-N 3.05Å; S250-G252 VanDerWaalsContact C-N 3.33Å; S250-G252 PolarHBondContact O-N 3.47Å; G252-S255 PolarHBondContact O-OG 3.46Å; G252-T256 WeakPolarHBondContact O-CB 3.39Å; G252-T256 PolarHBondContact O-N 2.87Å; G252-T256 VanDerWaalsContact O-N 3.15Å; G252-T256 PolarHBondContact O-OG1 3.47Å
253V98.4Very high97.6Very high1 Ų116.3 Ų16.31%0.0069%0.093CC..Hα-helixtrans-73.2-41.9179.3-175.70000111.7F87 T88 F91 M208 I209 L249 S250 A251 T256 M257F87-V253 HydrophobicContact CD1-CG1 4.1Å; F87-V253 HydrophobicContact CE1-CG1 4.17Å; T88-V253 HydrophobicContact CG2-CG1 3.99Å; F91-V253 HydrophobicContact CD1-CB 4.16Å; F91-V253 HydrophobicContact CD1-CG2 3.46Å; F91-V253 VanDerWaalsContact CD1-CG2 3.46Å; F91-V253 HydrophobicContact CE1-CG2 3.63Å; F91-V253 HydrophobicContact CG-CG2 4.22Å; M208-V253 HydrophobicContact CB-CG1 3.95Å; M208-V253 HydrophobicContact CB-CG2 4.48Å; M208-V253 HydrophobicContact CE-CG1 3.86Å; M208-V253 WeakPolarHBondContact CE-O 3.26Å; M208-V253 HydrophobicContact SD-CG1 4.41Å; I209-V253 HydrophobicContact CB-CG2 4.37Å; I209-V253 HydrophobicContact CG1-CG2 3.43Å; I209-V253 VanDerWaalsContact CG1-CG2 3.43Å; L249-V253 PolarHBondContact O-N 2.82Å; S250-V253 PolarHBondContact O-N 2.94Å; A251-V253 PolarHBondContact O-N 3.18Å; V253-T256 PolarHBondContact O-N 3.48Å; V253-M257 PolarHBondContact O-N 2.91Å
254I98.5Very high97.4Very high39 Ų3917.1 Ų17.120%0.210%0.098CC..Hα-helixtrans-64.6-45.4178.9-69.3166.6000111.2T88 S250 T256 M257 V258 F340T88-I254 HydrophobicContact CG2-CB 4.4Å; T88-I254 HydrophobicContact CG2-CG1 3.59Å; S250-I254 WeakPolarHBondContact O-CB 3.4Å; S250-I254 WeakPolarHBondContact O-CD1 3.18Å; S250-I254 VanDerWaalsContact O-CG1 3.23Å; S250-I254 WeakPolarHBondContact O-CG1 3.45Å; S250-I254 PolarHBondContact O-N 2.99Å; I254-T256 VanDerWaalsContact C-N 3.33Å; I254-T256 PolarHBondContact O-N 3.12Å; I254-M257 WeakPolarHBondContact O-CB 3.24Å; I254-M257 PolarHBondContact O-N 3.11Å; I254-M257 VanDerWaalsContact O-N 3.13Å; I254-V258 WeakPolarHBondContact O-CG2 3.36Å; I254-V258 PolarHBondContact O-N 3.16Å; I254-F340 HydrophobicContact CD1-CD1 4.5Å; I254-F340 HydrophobicContact CD1-CD2 3.42Å; I254-F340 VanDerWaalsContact CD1-CD2 3.42Å; I254-F340 HydrophobicContact CD1-CE1 4.38Å; I254-F340 HydrophobicContact CD1-CE2 3.26Å; I254-F340 HydrophobicContact CD1-CG 4.05Å; I254-F340 HydrophobicContact CD1-CZ 3.8Å; I254-F340 HydrophobicContact CG2-CB 4.18Å; I254-F340 HydrophobicContact CG2-CD2 4.37Å; I254-F340 HydrophobicContact CG2-CG 4.37Å
255S98.3Very high97.1Very high3 Ų321.2 Ų21.22%0.02113%0.132CC..Hα-helixtrans-60.8-42.3175.555.50000111.8A251 G252 M257 V258 S259 A333A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 3.35Å; A251-S255 PolarHBondContact O-OG 3.21Å; G252-S255 PolarHBondContact O-OG 3.46Å; S255-M257 VanDerWaalsContact C-N 3.3Å; S255-M257 PolarHBondContact O-N 3.41Å; S255-V258 PolarHBondContact O-N 3.33Å; S255-S259 PolarHBondContact O-N 2.93Å; S255-A333 WeakPolarHBondContact CB-O 3.38Å; S255-A333 WeakPolarHBondContact O-CA 3.35Å
256T97.8Very high96.7Very high9 Ų921.3 Ų21.36%0.05514%0.138CC..Hα-helixtrans-63.4-37.6174.3-560000111.8M208 G252 V253 I254 S259 Y260M208-T256 HydrophobicContact CB-CG2 4.03Å; M208-T256 HydrophobicContact CG-CG2 3.9Å; M208-T256 PolarHBondContact O-OG1 3.4Å; G252-T256 WeakPolarHBondContact O-CB 3.39Å; G252-T256 PolarHBondContact O-N 2.87Å; G252-T256 VanDerWaalsContact O-N 3.15Å; G252-T256 PolarHBondContact O-OG1 3.47Å; V253-T256 PolarHBondContact O-N 3.48Å; I254-T256 VanDerWaalsContact C-N 3.33Å; I254-T256 PolarHBondContact O-N 3.12Å; T256-S259 WeakPolarHBondContact O-CB 3.47Å; T256-S259 PolarHBondContact O-N 3.49Å; T256-Y260 HydrophobicContact CG2-CD1 4.02Å; T256-Y260 HydrophobicContact CG2-CE1 3.65Å; T256-Y260 WeakPolarHBondContact O-CD1 3.27Å; T256-Y260 PolarHBondContact O-N 3.43Å
257M97.9Very high96.3Very high15 Ų1523.5 Ų23.57%0.07416%0.161CC..Hα-helixtrans-62.2-45.1174.7-172.761.5-154.100111.7L81 P84 L85 T88 M208 V253 I254 S255 S259 Y260 V261L81-M257 HydrophobicContact CB-CE 4.05Å; P84-M257 HydrophobicContact CB-CE 4.37Å; P84-M257 HydrophobicContact CB-SD 3.59Å; P84-M257 VanDerWaalsContact CB-SD 3.59Å; L85-M257 HydrophobicContact CB-CE 3.86Å; L85-M257 HydrophobicContact CB-SD 4.38Å; L85-M257 HydrophobicContact CD1-CE 4.25Å; T88-M257 HydrophobicContact CG2-CB 4.27Å; M208-M257 HydrophobicContact CE-CB 3.66Å; M208-M257 HydrophobicContact CE-CG 4.37Å; M208-M257 HydrophobicContact CE-SD 3.98Å; V253-M257 PolarHBondContact O-N 2.91Å; I254-M257 WeakPolarHBondContact O-CB 3.24Å; I254-M257 PolarHBondContact O-N 3.11Å; I254-M257 VanDerWaalsContact O-N 3.13Å; S255-M257 VanDerWaalsContact C-N 3.3Å; S255-M257 PolarHBondContact O-N 3.41Å; M257-S259 VanDerWaalsContact C-N 3.31Å; M257-S259 PolarHBondContact O-N 2.73Å; M257-Y260 WeakPolarHBondContact O-CB 3.2Å; M257-Y260 PolarHBondContact O-N 2.89Å; M257-Y260 VanDerWaalsContact O-N 3.12Å; M257-V261 HydrophobicContact CE-CG2 3.86Å; M257-V261 WeakPolarHBondContact O-CG2 3.46Å; M257-V261 PolarHBondContact O-N 3.23Å
258V97.7Very high95.7Very high53 Ų5330.4 Ų30.432%0.32119%0.187SC..Hα-helixtrans-60.7-42.6175.6174.90000110.8I254 S255 Y260 V261 C262 A332I254-V258 WeakPolarHBondContact O-CG2 3.36Å; I254-V258 PolarHBondContact O-N 3.16Å; S255-V258 PolarHBondContact O-N 3.33Å; V258-Y260 VanDerWaalsContact C-N 3.35Å; V258-Y260 PolarHBondContact O-N 3.03Å; V258-V261 PolarHBondContact O-N 3.41Å; V258-C262 PolarHBondContact O-N 3.34Å; V258-A332 WeakPolarHBondContact CG1-O 3.45Å
259S96.9Very high95.2Very high0 Ų032.8 Ų32.80%020%0.197CC..Hα-helixtrans-59.4-42.6172.5175.70000112.5S255 T256 M257 C262 K263 D330S255-S259 PolarHBondContact O-N 2.93Å; T256-S259 WeakPolarHBondContact O-CB 3.47Å; T256-S259 PolarHBondContact O-N 3.49Å; M257-S259 VanDerWaalsContact C-N 3.31Å; M257-S259 PolarHBondContact O-N 2.73Å; S259-C262 PolarHBondContact O-N 2.88Å; S259-K263 WeakPolarHBondContact O-CB 3.37Å; S259-K263 VanDerWaalsContact O-CG 3.27Å; S259-K263 WeakPolarHBondContact O-CG 3.46Å; S259-K263 PolarHBondContact O-N 3.29Å; S259-K263 WeakPolarHBondContact OG-CE 3.26Å; S259-K263 PolarHBondContact OG-NZ 2.96Å; S259-D330 WeakPolarHBondContact CB-OD1 3.47Å; S259-D330 WeakPolarHBondContact CB-OD2 3.28Å; S259-D330 PolarHBondContact OG-OD1 3.09Å; S259-D330 PolarHBondContact OG-OD2 3.18Å
260Y96.4Very high94.7Very high0 Ų033.3 Ų33.30%020%0.197CC..Hα-helixtrans-63.3-43176.8-80.315.3000112.4P84 N198 P199 Q204 M208 T256 M257 V258 T264P84-Y260 HydrophobicContact CB-CD2 4Å; P84-Y260 HydrophobicContact CB-CE2 4.4Å; P84-Y260 HydrophobicContact CG-CD2 4.05Å; P84-Y260 HydrophobicContact CG-CE2 4.27Å; N198-Y260 PolarHBondContact N-OH 2.87Å; P199-Y260 HydrophobicContact CB-CD1 4.02Å; P199-Y260 HydrophobicContact CB-CD2 4.13Å; P199-Y260 HydrophobicContact CB-CE1 4.42Å; P199-Y260 HydrophobicContact CB-CG 3.85Å; P199-Y260 HydrophobicContact CG-CD1 4.22Å; P199-Y260 HydrophobicContact CG-CG 4.47Å; Q204-Y260 HydrophobicContact CB-CE2 4.12Å; Q204-Y260 PolarHBondContact O-OH 3.02Å; M208-Y260 HydrophobicContact CG-CE2 4.07Å; M208-Y260 HydrophobicContact SD-CE2 4.27Å; T256-Y260 HydrophobicContact CG2-CD1 4.02Å; T256-Y260 HydrophobicContact CG2-CE1 3.65Å; T256-Y260 WeakPolarHBondContact O-CD1 3.27Å; T256-Y260 PolarHBondContact O-N 3.43Å; M257-Y260 WeakPolarHBondContact O-CB 3.2Å; M257-Y260 PolarHBondContact O-N 2.89Å; M257-Y260 VanDerWaalsContact O-N 3.12Å; V258-Y260 VanDerWaalsContact C-N 3.35Å; V258-Y260 PolarHBondContact O-N 3.03Å; Y260-T264 VanDerWaalsContact O-CB 3.29Å; Y260-T264 WeakPolarHBondContact O-CB 3.4Å; Y260-T264 PolarHBondContact O-N 3.48Å; Y260-T264 PolarHBondContact O-OG1 3.25Å; Y260-T264 VanDerWaalsContact O-OG1 3.09Å
261V96.2Very high94.3Very high70 Ų7035.7 Ų35.742%0.42421%0.212SC..Hα-helixtrans-57.7-51174.6173.50000109.9L81 M257 V258 T264 A265L81-V261 HydrophobicContact CD1-CB 4.44Å; L81-V261 HydrophobicContact CD1-CG2 4.04Å; M257-V261 HydrophobicContact CE-CG2 3.86Å; M257-V261 WeakPolarHBondContact O-CG2 3.46Å; M257-V261 PolarHBondContact O-N 3.23Å; V258-V261 PolarHBondContact O-N 3.41Å; V261-T264 PolarHBondContact O-N 3.13Å; V261-A265 WeakPolarHBondContact O-CB 3.31Å; V261-A265 PolarHBondContact O-N 3.3Å
262C94.8Very high94.1Very high31 Ų3136.5 Ų36.521%0.20922%0.218CC..Hα-helixtrans-64.4-43.7-177.6-172.80000112.8V258 S259 A265 S266 A332V258-C262 PolarHBondContact O-N 3.34Å; S259-C262 PolarHBondContact O-N 2.88Å; C262-A265 PolarHBondContact O-N 3.2Å; C262-S266 VanDerWaalsContact O-CB 3.29Å; C262-S266 WeakPolarHBondContact O-CB 3.34Å; C262-S266 PolarHBondContact O-N 2.98Å; C262-S266 PolarHBondContact O-OG 3.41Å; C262-A332 HydrophobicContact CB-CB 3.71Å
263K94.2Very high93.9Very high4 Ų438.2 Ų38.22%0.01723%0.227CC..Hα-helixtrans-65.1-39.2178.1-73.4171.9-176.1169.40112.3P199 S259 G267 R268 Y270 S272 D330P199-K263 HydrophobicContact CG-CB 3.89Å; P199-K263 HydrophobicContact CG-CD 4.31Å; S259-K263 WeakPolarHBondContact O-CB 3.37Å; S259-K263 VanDerWaalsContact O-CG 3.27Å; S259-K263 WeakPolarHBondContact O-CG 3.46Å; S259-K263 PolarHBondContact O-N 3.29Å; S259-K263 WeakPolarHBondContact OG-CE 3.26Å; S259-K263 PolarHBondContact OG-NZ 2.96Å; K263-G267 PolarHBondContact O-N 2.87Å; K263-R268 WeakPolarHBondContact CB-O 3.43Å; K263-R268 PolarHBondContact O-N 3.2Å; K263-R268 VanDerWaalsContact O-N 3.13Å; K263-Y270 WeakPolarHBondContact CE-O 3.2Å; K263-Y270 HydrophobicContact CG-CE1 4.37Å; K263-Y270 PolarHBondContact NZ-O 3.45Å; K263-S272 PolarHBondContact NZ-OG 3.23Å; K263-D330 IonicContact NZ-OD2 2.82Å; K263-D330 PolarHBondContact NZ-OD2 3.43Å
264T93.6Very high93.7Very high19 Ų1938.7 Ų38.712%0.11723%0.231CC..Hα-helixtrans-69.3-39.9174.6-65.80000112.4L81 Y260 V261 G267L81-T264 HydrophobicContact CD1-CG2 4.15Å; L81-T264 HydrophobicContact CG-CG2 4.37Å; Y260-T264 VanDerWaalsContact O-CB 3.29Å; Y260-T264 WeakPolarHBondContact O-CB 3.4Å; Y260-T264 PolarHBondContact O-N 3.48Å; Y260-T264 PolarHBondContact O-OG1 3.25Å; Y260-T264 VanDerWaalsContact O-OG1 3.09Å; V261-T264 PolarHBondContact O-N 3.13Å; T264-G267 PolarHBondContact O-N 3.18Å
265A92.3Very high93.6Very high87 Ų8736.8 Ų36.872%0.71922%0.222SC*.Hα-helixtrans-65.1-41.7175.400000111.9V261 C262 G267V261-A265 WeakPolarHBondContact O-CB 3.31Å; V261-A265 PolarHBondContact O-N 3.3Å; C262-A265 PolarHBondContact O-N 3.2Å; A265-G267 VanDerWaalsContact C-N 3.35Å
266S89.5Confident93.6Very high69 Ų6937.3 Ų37.348%0.48323%0.225SC..Hα-helixtrans-80.3-13.5-178.9-53.30000113.9C262 R268C262-S266 VanDerWaalsContact O-CB 3.29Å; C262-S266 WeakPolarHBondContact O-CB 3.34Å; C262-S266 PolarHBondContact O-N 2.98Å; C262-S266 PolarHBondContact O-OG 3.41Å; S266-R268 PolarHBondContact O-N 3.48Å
267G88.6Confident93.6Very high47 Ų4737 Ų3749%0.48522%0.224SC..THydrogen-bonded Turntrans67.614.7-173.300000114.8K263 T264 A265K263-G267 PolarHBondContact O-N 2.87Å; T264-G267 PolarHBondContact O-N 3.18Å; A265-G267 VanDerWaalsContact C-N 3.35Å
268R86.3Confident93.6Very high147 Ų14736.3 Ų36.356%0.55522%0.22SC*.  trans-108.998.5-174.4-66.8178.8-177-176.71.6110.5K263 S266 Y270K263-R268 WeakPolarHBondContact CB-O 3.43Å; K263-R268 PolarHBondContact O-N 3.2Å; K263-R268 VanDerWaalsContact O-N 3.13Å; S266-R268 PolarHBondContact O-N 3.48Å; R268-Y270 HydrophobicContact CB-CD1 4.41Å; R268-Y270 PolarHBondContact O-N 2.69Å
269F88.4Confident93.6Very high52 Ų5234 Ų3423%0.22821%0.206CC..  trans-9861.6-170.7-54.8-59.2000114.5V76 P79 P199 A200V76-F269 HydrophobicContact CG1-CD2 4.35Å; V76-F269 HydrophobicContact CG1-CE2 4Å; P79-F269 VanDerWaalsContact CD-CZ 3.42Å; P79-F269 HydrophobicContact CG-CD1 4.26Å; P79-F269 HydrophobicContact CG-CE1 3.56Å; P79-F269 HydrophobicContact CG-CZ 3.85Å; P199-F269 HydrophobicContact CG-CD1 3.75Å; P199-F269 HydrophobicContact CG-CE1 4.23Å; A200-F269 HydrophobicContact CB-CB 3.98Å; A200-F269 HydrophobicContact CB-CD1 4.34Å; A200-F269 HydrophobicContact CB-CD2 4.38Å; A200-F269 HydrophobicContact CB-CG 3.98Å
270Y87.1Confident93.7Very high53 Ų5334.9 Ų34.921%0.20821%0.211CC..  trans-86.3139.6173.359.1-84.2000111.2K263 R268K263-Y270 WeakPolarHBondContact CE-O 3.2Å; K263-Y270 HydrophobicContact CG-CE1 4.37Å; K263-Y270 PolarHBondContact NZ-O 3.45Å; R268-Y270 HydrophobicContact CB-CD1 4.41Å; R268-Y270 PolarHBondContact O-N 2.69Å
271P91.1Very high93.8Very high50 Ų5034.9 Ų34.933%0.32521%0.211SC..  trans-67.8146.1176.528.2-32.6000110.5F39 S197 N198F39-P271 HydrophobicContact CE2-CG 4.12Å; F39-P271 HydrophobicContact CZ-CG 3.79Å; S197-P271 CarbonylContact O-C 3.57Å; S197-P271 VanDerWaalsContact O-CA 3.27Å; S197-P271 WeakPolarHBondContact O-CA 3.13Å; N198-P271 HydrophobicContact CB-CB 4.45Å
272S93.1Very high93.9Very high16 Ų1631.6 Ų31.611%0.11219%0.191CC..BIsolated β-bridgetrans-136.9155171.963.90000112S197 K263 D330S197-S272 PolarHBondContact N-O 3.24Å; S197-S272 PolarHBondContact O-N 3.23Å; S197-S272 PolarHBondContact OG-O 3.48Å; S197-S272 VanDerWaalsContact OG-O 3.05Å; S197-S272 PolarHBondContact OG-OG 2.94Å; K263-S272 PolarHBondContact NZ-OG 3.23Å; S272-D330 WeakPolarHBondContact CB-OD2 3.42Å; S272-D330 PolarHBondContact OG-OD2 2.93Å
273L94.5Very high94Very high38 Ų3830.8 Ų30.820%0.19918%0.184CC..  trans-156.3152.7-179.958.289.8000108.5W182 T196 S214W182-L273 HydrophobicContact CZ2-CD2 4.03Å; T196-L273 HydrophobicContact CG2-CD2 3.67Å; S214-L273 CarbonylContact O-C 3.58Å; S214-L273 WeakPolarHBondContact O-CD1 3.44Å
274G94.6Very high94.2Very high10 Ų1030.6 Ų30.610%0.10318%0.183CC..  trans141.3149.317900000111.9S211 S214 S276S211-G274 PolarHBondContact O-N 3.05Å; S214-G274 WeakPolarHBondContact O-CA 3.36Å; S214-G274 PolarHBondContact O-N 3.28Å; G274-S276 PolarHBondContact O-N 3.25Å
275A97Very high94.4Very high0 Ų029.7 Ų29.70%018%0.178CC..THydrogen-bonded Turntrans-71.1-6.4172.700000113.4S212 H215 N224 M225 Y248 G277 A278 V279S212-A275 WeakPolarHBondContact O-CA 3.49Å; S212-A275 VanDerWaalsContact O-CB 3.25Å; S212-A275 WeakPolarHBondContact O-CB 3.43Å; S212-A275 PolarHBondContact O-N 2.99Å; H215-A275 PolarHBondContact CE1-N 3.45Å; H215-A275 PolarHBondContact NE2-N 2.83Å; N224-A275 HydrophobicContact CB-CB 4.38Å; M225-A275 HydrophobicContact CE-CB 3.76Å; Y248-A275 WeakPolarHBondContact OH-CB 3.18Å; A275-G277 VanDerWaalsContact C-N 3.32Å; A275-G277 PolarHBondContact O-N 2.94Å; A275-A278 WeakPolarHBondContact O-CB 3.37Å; A275-A278 PolarHBondContact O-N 3.41Å; A275-V279 HydrophobicContact CB-CG2 4.06Å; A275-V279 WeakPolarHBondContact O-CG2 3.37Å; A275-V279 PolarHBondContact O-N 3.43Å
276S96.9Very high94.7Very high13 Ų1326.1 Ų26.19%0.09115%0.147CC..Hα-helixtrans-61-34.4-163.760.10000114.2N224 G274 V279 M280 H334N224-S276 WeakPolarHBondContact OD1-CA 3.33Å; N224-S276 VanDerWaalsContact OD1-CB 3.23Å; N224-S276 WeakPolarHBondContact OD1-CB 3.26Å; N224-S276 PolarHBondContact OD1-N 3.48Å; N224-S276 VanDerWaalsContact OD1-N 3.08Å; G274-S276 PolarHBondContact O-N 3.25Å; S276-V279 PolarHBondContact O-N 3.05Å; S276-M280 VanDerWaalsContact O-CB 3.23Å; S276-M280 WeakPolarHBondContact O-CB 3.26Å; S276-M280 WeakPolarHBondContact O-CG 3.42Å; S276-M280 PolarHBondContact O-N 2.81Å; S276-H334 WeakPolarHBondContact CB-NE2 3.46Å; S276-H334 PolarHBondContact OG-CD2 3.09Å; S276-H334 PolarHBondContact OG-NE2 3.44Å
277G97.6Very high95Very high3 Ų322.9 Ų22.93%0.03113%0.125CC..Hα-helixtrans-61-44.5172.500000112.9A275 A281 G337A275-G277 VanDerWaalsContact C-N 3.32Å; A275-G277 PolarHBondContact O-N 2.94Å; G277-A281 PolarHBondContact O-N 3.27Å; G277-A281 VanDerWaalsContact O-N 3.16Å; G277-G337 VanDerWaalsContact O-CA 3.3Å; G277-G337 WeakPolarHBondContact O-CA 3.08Å
278A98.4Very high95.4Very high0 Ų023.1 Ų23.10%012%0.117CC..Hα-helixtrans-69.6-40.3176.400000112.2Y248 A251 A275 A281 V282Y248-A278 HydrophobicContact CD1-CB 4.38Å; Y248-A278 HydrophobicContact CD2-CB 3.81Å; Y248-A278 HydrophobicContact CE1-CB 4.22Å; Y248-A278 HydrophobicContact CE2-CB 3.63Å; Y248-A278 HydrophobicContact CG-CB 4.19Å; Y248-A278 WeakPolarHBondContact O-CB 3.12Å; A251-A278 HydrophobicContact CB-CB 4.26Å; A275-A278 WeakPolarHBondContact O-CB 3.37Å; A275-A278 PolarHBondContact O-N 3.41Å; A278-A281 WeakPolarHBondContact O-CB 3.17Å; A278-A281 PolarHBondContact O-N 2.99Å; A278-V282 PolarHBondContact O-N 3.39Å; A278-V282 VanDerWaalsContact O-N 3.1Å
279V98.4Very high95.9Very high5 Ų521.3 Ų21.33%0.0311%0.113CC..Hα-helixtrans-64.3-40.8176.2174.60000111.2N224 V227 L228 Y248 A275 S276 A281 V282 L283N224-V279 HydrophobicContact CB-CG2 4.49Å; V227-V279 HydrophobicContact CB-CG1 3.7Å; V227-V279 HydrophobicContact CG1-CG1 3.42Å; V227-V279 VanDerWaalsContact CG1-CG1 3.42Å; L228-V279 HydrophobicContact CB-CG2 4.18Å; Y248-V279 HydrophobicContact CE2-CG2 4.32Å; A275-V279 HydrophobicContact CB-CG2 4.06Å; A275-V279 WeakPolarHBondContact O-CG2 3.37Å; A275-V279 PolarHBondContact O-N 3.43Å; S276-V279 PolarHBondContact O-N 3.05Å; V279-A281 VanDerWaalsContact C-N 3.29Å; V279-A281 PolarHBondContact O-N 3.46Å; V279-V282 PolarHBondContact O-N 3.23Å; V279-L283 WeakPolarHBondContact O-CB 3.18Å; V279-L283 PolarHBondContact O-N 3.08Å
280M98.2Very high96.2Very high18 Ų1822 Ų229%0.08912%0.122CC..Hα-helixtrans-63.2-35174.6-77-57.3-66.400112.1S276 A284 L314 H334 A338S276-M280 VanDerWaalsContact O-CB 3.23Å; S276-M280 WeakPolarHBondContact O-CB 3.26Å; S276-M280 WeakPolarHBondContact O-CG 3.42Å; S276-M280 PolarHBondContact O-N 2.81Å; M280-A284 WeakPolarHBondContact O-CB 3.37Å; M280-A284 PolarHBondContact O-N 3.34Å; M280-L314 HydrophobicContact CE-CB 4.05Å; M280-L314 HydrophobicContact CE-CD1 4.26Å; M280-H334 HydrophobicContact CG-CB 4.02Å; M280-A338 HydrophobicContact CE-CB 4.4Å
281A98.6Very high96.6Very high0 Ų022 Ų220%013%0.128CC..Hα-helixtrans-65-42.9172.500000112.2A251 G277 A278 V279 A285 G337 F340 G341A251-A281 HydrophobicContact CB-CB 3.43Å; A251-A281 VanDerWaalsContact CB-CB 3.43Å; G277-A281 PolarHBondContact O-N 3.27Å; G277-A281 VanDerWaalsContact O-N 3.16Å; A278-A281 WeakPolarHBondContact O-CB 3.17Å; A278-A281 PolarHBondContact O-N 2.99Å; V279-A281 VanDerWaalsContact C-N 3.29Å; V279-A281 PolarHBondContact O-N 3.46Å; A281-A285 WeakPolarHBondContact O-CB 3.38Å; A281-A285 PolarHBondContact O-N 2.88Å; A281-G337 WeakPolarHBondContact CA-O 3.11Å; A281-G337 WeakPolarHBondContact CB-O 3.34Å; A281-F340 HydrophobicContact CB-CD1 4.21Å; A281-G341 WeakPolarHBondContact O-CA 3.24Å
282V98.4Very high96.7Very high1 Ų126.6 Ų26.61%0.00615%0.145CC..Hα-helixtrans-62.5-49.7176.3171.70000111L228 F231 I235 F244 Y248 A278 V279 A285 V286L228-V282 HydrophobicContact CD1-CG2 4.42Å; F231-V282 HydrophobicContact CB-CG1 3.99Å; I235-V282 HydrophobicContact CB-CG1 3.97Å; I235-V282 HydrophobicContact CG1-CG1 4.29Å; I235-V282 HydrophobicContact CG2-CG1 3.75Å; F244-V282 HydrophobicContact CD2-CG2 4.46Å; F244-V282 HydrophobicContact CE2-CG2 3.86Å; Y248-V282 HydrophobicContact CD2-CG2 4.05Å; A278-V282 PolarHBondContact O-N 3.39Å; A278-V282 VanDerWaalsContact O-N 3.1Å; V279-V282 PolarHBondContact O-N 3.23Å; V282-A285 PolarHBondContact O-N 3.42Å; V282-V286 WeakPolarHBondContact O-CG2 3.31Å; V282-V286 PolarHBondContact O-N 2.82Å
283L97.7Very high96.6Very high14 Ų1427.7 Ų27.77%0.07316%0.155CC..Hα-helixtrans-58.7-50.9177.6-178.2153.6000110.5V227 F231 V279 A285 V286 C287 L311 L314V227-L283 HydrophobicContact CG1-CB 4.49Å; V227-L283 HydrophobicContact CG1-CD1 3.82Å; F231-L283 HydrophobicContact CD2-CD1 4.48Å; F231-L283 HydrophobicContact CE2-CD1 3.94Å; F231-L283 HydrophobicContact CE2-CG 4.2Å; F231-L283 HydrophobicContact CZ-CD1 4.25Å; F231-L283 HydrophobicContact CZ-CG 4.19Å; V279-L283 WeakPolarHBondContact O-CB 3.18Å; V279-L283 PolarHBondContact O-N 3.08Å; L283-A285 VanDerWaalsContact C-N 3.34Å; L283-A285 PolarHBondContact O-N 3.42Å; L283-V286 PolarHBondContact O-N 3.47Å; L283-C287 VanDerWaalsContact O-CB 3.31Å; L283-C287 WeakPolarHBondContact O-CB 3.38Å; L283-C287 PolarHBondContact O-N 3.18Å; L283-C287 PolarHBondContact O-SG 2.7Å; L283-L311 HydrophobicContact CD2-CD1 4.11Å; L283-L314 HydrophobicContact CD1-CD1 3.86Å; L283-L314 HydrophobicContact CD2-CD1 3.73Å
284A98.1Very high96.4Very high0 Ų033.7 Ų33.70%018%0.179CC..Hα-helixtrans-63.1-39.7-178.600000112.5M280 T288 L311 A338 V342M280-A284 WeakPolarHBondContact O-CB 3.37Å; M280-A284 PolarHBondContact O-N 3.34Å; A284-T288 VanDerWaalsContact O-CB 3.23Å; A284-T288 WeakPolarHBondContact O-CB 3.22Å; A284-T288 PolarHBondContact O-N 3.18Å; A284-T288 PolarHBondContact O-OG1 2.83Å; A284-L311 HydrophobicContact CB-CD1 3.61Å; A284-L311 HydrophobicContact CB-CD2 4.19Å; A284-A338 HydrophobicContact CB-CB 4.05Å; A284-V342 HydrophobicContact CB-CG2 4.13Å
285A98.1Very high96Very high1 Ų134.9 Ų34.91%0.00818%0.183CC..Hα-helixtrans-59-48.5175.100000112I235 A281 V282 L283 K289 V345I235-A285 HydrophobicContact CD1-CB 3.73Å; A281-A285 WeakPolarHBondContact O-CB 3.38Å; A281-A285 PolarHBondContact O-N 2.88Å; V282-A285 PolarHBondContact O-N 3.42Å; L283-A285 VanDerWaalsContact C-N 3.34Å; L283-A285 PolarHBondContact O-N 3.42Å; A285-K289 PolarHBondContact O-N 3.42Å; A285-V345 HydrophobicContact CB-CG1 3.44Å; A285-V345 VanDerWaalsContact CB-CG1 3.44Å
286V97.2Very high95.2Very high11 Ų1137 Ų377%0.06721%0.205CC..Hα-helixtrans-67.7-50.5178.8177.90000110.8F231 I235 L238 V282 L283 T288 K289 V290F231-V286 HydrophobicContact CD1-CB 3.92Å; F231-V286 HydrophobicContact CD1-CG1 3.85Å; F231-V286 HydrophobicContact CD1-CG2 4.33Å; F231-V286 HydrophobicContact CE1-CG1 4.31Å; I235-V286 HydrophobicContact CB-CG2 3.78Å; I235-V286 HydrophobicContact CD1-CG2 4.11Å; I235-V286 HydrophobicContact CG1-CG2 4.49Å; L238-V286 HydrophobicContact CD1-CG2 4.33Å; V282-V286 WeakPolarHBondContact O-CG2 3.31Å; V282-V286 PolarHBondContact O-N 2.82Å; L283-V286 PolarHBondContact O-N 3.47Å; V286-T288 PolarHBondContact O-N 3.5Å; V286-K289 PolarHBondContact O-N 2.87Å; V286-V290 HydrophobicContact CG1-CG2 3.77Å; V286-V290 WeakPolarHBondContact O-CG2 3.42Å; V286-V290 PolarHBondContact O-N 2.95Å
287C96.8Very high94.3Very high1 Ų139.8 Ų39.81%0.00722%0.218CC..Hα-helixtrans-58.3-32.1179.3-720000113.1L283 P291 A307 L311L283-C287 VanDerWaalsContact O-CB 3.31Å; L283-C287 WeakPolarHBondContact O-CB 3.38Å; L283-C287 PolarHBondContact O-N 3.18Å; L283-C287 PolarHBondContact O-SG 2.7Å; C287-P291 VanDerWaalsContact O-CA 3.24Å; C287-P291 WeakPolarHBondContact O-CA 3.22Å; C287-A307 HydrophobicContact CB-CB 4.16Å; C287-A307 WeakPolarHBondContact CB-O 3.43Å; C287-A307 PolarHBondContact SG-O 2.82Å; C287-A307 VanDerWaalsContact SG-O 3.41Å; C287-L311 HydrophobicContact CB-CB 3.88Å; C287-L311 HydrophobicContact CB-CD2 3.99Å; C287-L311 HydrophobicContact CB-CG 4.47Å
288T97Very high93.1Very high53 Ų5344.4 Ų44.433%0.32524%0.241SC..Hα-helixtrans-72.9-34.5175.7-59.20000112.1A284 V286 V342 V345A284-T288 VanDerWaalsContact O-CB 3.23Å; A284-T288 WeakPolarHBondContact O-CB 3.22Å; A284-T288 PolarHBondContact O-N 3.18Å; A284-T288 PolarHBondContact O-OG1 2.83Å; V286-T288 PolarHBondContact O-N 3.5Å; T288-V342 HydrophobicContact CG2-CG1 4.4Å; T288-V345 HydrophobicContact CG2-CG2 3.84Å
289K96.4Very high91.9Very high109 Ų10953 Ų5347%0.47428%0.279SS..Hα-helixtrans-80.9-31.8-179-78-72.4172.8-175.10113.4L238 A285 V286 V345L238-K289 HydrophobicContact CD1-CB 3.86Å; L238-K289 HydrophobicContact CD1-CG 4.1Å; L238-K289 HydrophobicContact CD2-CB 4.28Å; L238-K289 HydrophobicContact CD2-CG 4.47Å; A285-K289 PolarHBondContact O-N 3.42Å; V286-K289 PolarHBondContact O-N 2.87Å; K289-V345 HydrophobicContact CD-CB 4.43Å; K289-V345 WeakPolarHBondContact CE-O 3.39Å; K289-V345 HydrophobicContact CG-CB 4.02Å; K289-V345 HydrophobicContact CG-CG1 4.33Å; K289-V345 HydrophobicContact CG-CG2 4.22Å; K289-V345 PolarHBondContact NZ-O 2.88Å
290V94.9Very high91.2Very high67 Ų6757.3 Ų57.341%0.40630%0.302SS..  trans-129.364.9179.9-70.80000110.8V286 E292 A293 A307V286-V290 HydrophobicContact CG1-CG2 3.77Å; V286-V290 WeakPolarHBondContact O-CG2 3.42Å; V286-V290 PolarHBondContact O-N 2.95Å; V290-E292 PolarHBondContact O-N 3.4Å; V290-A293 HydrophobicContact CB-CB 4.16Å; V290-A293 HydrophobicContact CG2-CB 4.12Å; V290-A293 VanDerWaalsContact O-CB 3.28Å; V290-A293 WeakPolarHBondContact O-CB 3.5Å; V290-A293 PolarHBondContact O-N 3.38Å; V290-A293 VanDerWaalsContact O-N 3.12Å; V290-A307 WeakPolarHBondContact O-CB 3.21Å
291P95.1Very high90Very high52 Ų5261.2 Ų61.234%0.33833%0.328SS..THydrogen-bonded Turntrans-63.1-30.4-172.525.8-34.9000113.4C287 A293 T306 A307 G308C287-P291 VanDerWaalsContact O-CA 3.24Å; C287-P291 WeakPolarHBondContact O-CA 3.22Å; P291-A293 VanDerWaalsContact C-N 3.29Å; P291-A293 PolarHBondContact O-N 3.35Å; P291-T306 WeakPolarHBondContact O-CB 3.35Å; P291-A307 PolarHBondContact O-N 3.46Å; P291-A307 VanDerWaalsContact O-N 3.11Å; P291-G308 PolarHBondContact O-N 3.3Å
292E94.3Very high89.3Confident147 Ų14769.8 Ų69.869%0.68737%0.37SS*.THydrogen-bonded Turntrans-80.8-6.1-179.8-55.4-48.3132.200113.7V290 K294V290-E292 PolarHBondContact O-N 3.4Å; E292-K294 PolarHBondContact O-N 2.82Å
293A91.4Very high88.6Confident39 Ų3973.3 Ų73.332%0.32239%0.391SS..PPolyproline II helixtrans-61.2127.9177.500000110.1V290 P291 L295 T306 A307V290-A293 HydrophobicContact CB-CB 4.16Å; V290-A293 HydrophobicContact CG2-CB 4.12Å; V290-A293 VanDerWaalsContact O-CB 3.28Å; V290-A293 WeakPolarHBondContact O-CB 3.5Å; V290-A293 PolarHBondContact O-N 3.38Å; V290-A293 VanDerWaalsContact O-N 3.12Å; P291-A293 VanDerWaalsContact C-N 3.29Å; P291-A293 PolarHBondContact O-N 3.35Å; A293-L295 PolarHBondContact O-N 2.76Å; A293-T306 CarbonylContact O-C 3.56Å; A293-A307 HydrophobicContact CB-CB 4.2Å; A293-A307 WeakPolarHBondContact O-CB 3.14Å; A293-A307 PolarHBondContact O-N 3.47Å
294K89.3Confident88.1Confident163 Ų16376.1 Ų76.171%0.70941%0.409SS*.EExtended strand (participates in β ladder)trans-79.7117.6177.8-67.7-175.4-180179.40109.8E292E292-K294 PolarHBondContact O-N 2.82Å
295L85.9Confident87.7Confident36 Ų3679.6 Ų79.619%0.18843%0.425CS..EExtended strand (participates in β ladder)trans-98.2134.4172.5-60.1178.2000109.1F231 A293 T304 F305 A307 A310F231-L295 HydrophobicContact CE1-CD1 4.33Å; F231-L295 HydrophobicContact CE1-CD2 4.09Å; F231-L295 HydrophobicContact CZ-CD1 3.84Å; F231-L295 HydrophobicContact CZ-CD2 3.94Å; A293-L295 PolarHBondContact O-N 2.76Å; L295-T304 VanDerWaalsContact O-CA 3.22Å; L295-T304 WeakPolarHBondContact O-CA 3.43Å; L295-F305 HydrophobicContact CB-CD2 4.03Å; L295-F305 HydrophobicContact CB-CE2 3.6Å; L295-F305 HydrophobicContact CB-CZ 4.15Å; L295-F305 HydrophobicContact CD1-CE2 3.92Å; L295-F305 HydrophobicContact CG-CE2 4.37Å; L295-F305 PolarHBondContact N-O 2.86Å; L295-F305 PolarHBondContact O-N 3.5Å; L295-A307 HydrophobicContact CD1-CB 3.93Å; L295-A307 HydrophobicContact CG-CB 4.13Å; L295-A310 HydrophobicContact CD1-CB 3.96Å
296G79.9Confident87.5Confident45 Ų4581.3 Ų81.346%0.46444%0.435SS..EExtended strand (participates in β ladder)trans-101.8152.3174.100000111.8
297I77.9Confident87.4Confident70 Ų7080.8 Ų80.836%0.35943%0.432SS..EExtended strand (participates in β ladder)trans-88.8128.6167.2-55.7175.8000107.3F299 L300 F305I297-F299 PolarHBondContact O-N 3.23Å; I297-L300 HydrophobicContact CB-CB 4.27Å; I297-L300 CarbonylContact O-C 3.17Å; I297-L300 PolarHBondContact O-N 3.11Å; I297-F305 HydrophobicContact CD1-CE1 4.03Å; I297-F305 HydrophobicContact CG1-CE1 3.65Å; I297-F305 HydrophobicContact CG1-CZ 4.45Å
298I72.9Confident87.3Confident100 Ų10081.4 Ų81.451%0.51344%0.438SS..THydrogen-bonded Turntrans-47.9-43.4-177.2-62.9169000112.5Y226Y226-I298 HydrophobicContact CD1-CD1 4.43Å; Y226-I298 HydrophobicContact CD2-CD1 4.22Å; Y226-I298 HydrophobicContact CE1-CD1 3.67Å; Y226-I298 HydrophobicContact CE1-CG1 4.37Å; Y226-I298 HydrophobicContact CE2-CD1 3.43Å; Y226-I298 VanDerWaalsContact CE2-CD1 3.43Å; Y226-I298 HydrophobicContact CE2-CG1 4.28Å; Y226-I298 WeakPolarHBondContact OH-CD1 3.46Å; Y226-I298 WeakPolarHBondContact OH-CG1 3.18Å
299F73.4Confident87.2Confident180 Ų18083 Ų8379%0.78945%0.445SS*.THydrogen-bonded Turntrans-88.1-7.1-175.2-59.4-69.9000114.2I297I297-F299 PolarHBondContact O-N 3.23Å
300L82.9Confident87.1Confident97 Ų9778.4 Ų78.451%0.50843%0.427SS..EExtended strand (participates in β ladder)trans-137.368.7179-65.4170.8000109I297 M302 V303I297-L300 HydrophobicContact CB-CB 4.27Å; I297-L300 CarbonylContact O-C 3.17Å; I297-L300 PolarHBondContact O-N 3.11Å; L300-M302 PolarHBondContact O-N 3.36Å; L300-M302 VanDerWaalsContact O-N 3.08Å; L300-V303 HydrophobicContact CB-CB 4.23Å; L300-V303 HydrophobicContact CB-CG2 4.2Å; L300-V303 PolarHBondContact O-N 3.38Å
301P74.1Confident87.1Confident99 Ų9976.1 Ų76.164%0.64341%0.412SS*.EExtended strand (participates in β ladder)trans-63.1-19.4-175.125.5-34.6000113.3V303P301-V303 VanDerWaalsContact C-N 3.3Å
302M82.7Confident87.2Confident180 Ų18080.5 Ų80.589%0.88743%0.426SS*.EExtended strand (participates in β ladder)trans-75.8-18.1175.2-58-54.9-69.800113.1L300L300-M302 PolarHBondContact O-N 3.36Å; L300-M302 VanDerWaalsContact O-N 3.08Å
303V84.3Confident87.3Confident75 Ų7575.9 Ų75.946%0.45541%0.413SS..EExtended strand (participates in β ladder)trans-101.3112.3178.9-177.50000108.3L300 P301L300-V303 HydrophobicContact CB-CB 4.23Å; L300-V303 HydrophobicContact CB-CG2 4.2Å; L300-V303 PolarHBondContact O-N 3.38Å; P301-V303 VanDerWaalsContact C-N 3.3Å
304T87.4Confident87.4Confident73 Ų7376.8 Ų76.845%0.44841%0.412SS..EExtended strand (participates in β ladder)trans-118.9147.3172.859.50000110.2L295L295-T304 VanDerWaalsContact O-CA 3.22Å; L295-T304 WeakPolarHBondContact O-CA 3.43Å
305F90.4Very high87.8Confident74 Ų7471.4 Ų71.433%0.32539%0.393SS..EExtended strand (participates in β ladder)trans-132.1156.917450.1-99.2000109.7L295 I297 A310L295-F305 HydrophobicContact CB-CD2 4.03Å; L295-F305 HydrophobicContact CB-CE2 3.6Å; L295-F305 HydrophobicContact CB-CZ 4.15Å; L295-F305 HydrophobicContact CD1-CE2 3.92Å; L295-F305 HydrophobicContact CG-CE2 4.37Å; L295-F305 PolarHBondContact N-O 2.86Å; L295-F305 PolarHBondContact O-N 3.5Å; I297-F305 HydrophobicContact CD1-CE1 4.03Å; I297-F305 HydrophobicContact CG1-CE1 3.65Å; I297-F305 HydrophobicContact CG1-CZ 4.45Å; F305-A310 HydrophobicContact CD2-CB 3.55Å; F305-A310 HydrophobicContact CE2-CB 3.28Å; F305-A310 HydrophobicContact CZ-CB 4.41Å
306T94.3Very high88.4Confident36 Ų3672.5 Ų72.522%0.22141%0.407CS..EExtended strand (participates in β ladder)trans-71.3142.6177620000110.3P291 A293 G308 N309 A310P291-T306 WeakPolarHBondContact O-CB 3.35Å; A293-T306 CarbonylContact O-C 3.56Å; T306-G308 PolarHBondContact O-N 3.04Å; T306-N309 PolarHBondContact O-N 3.27Å; T306-N309 WeakPolarHBondContact OG1-CB 3.34Å; T306-N309 PolarHBondContact OG1-N 2.85Å; T306-N309 PolarHBondContact OG1-ND2 3.18Å; T306-A310 PolarHBondContact O-N 3.26Å
307A93.8Very high89.2Confident1 Ų174.9 Ų74.91%0.00841%0.408CS..Hα-helixtrans-56.6-34.9178.900000112.2C287 V290 P291 A293 L295 A310 L311C287-A307 HydrophobicContact CB-CB 4.16Å; C287-A307 WeakPolarHBondContact CB-O 3.43Å; C287-A307 PolarHBondContact SG-O 2.82Å; C287-A307 VanDerWaalsContact SG-O 3.41Å; V290-A307 WeakPolarHBondContact O-CB 3.21Å; P291-A307 PolarHBondContact O-N 3.46Å; P291-A307 VanDerWaalsContact O-N 3.11Å; A293-A307 HydrophobicContact CB-CB 4.2Å; A293-A307 WeakPolarHBondContact O-CB 3.14Å; A293-A307 PolarHBondContact O-N 3.47Å; L295-A307 HydrophobicContact CD1-CB 3.93Å; L295-A307 HydrophobicContact CG-CB 4.13Å; A307-A310 WeakPolarHBondContact O-CB 3.29Å; A307-A310 PolarHBondContact O-N 2.82Å; A307-L311 PolarHBondContact O-N 3Å
308G94.3Very high90.1Very high13 Ų1372 Ų7213%0.13439%0.394CS..Hα-helixtrans-63.1-43.5173.600000113P291 T306 L311 K312P291-G308 PolarHBondContact O-N 3.3Å; T306-G308 PolarHBondContact O-N 3.04Å; G308-L311 PolarHBondContact O-N 3.19Å; G308-K312 WeakPolarHBondContact O-CG 3.28Å; G308-K312 PolarHBondContact O-N 2.99Å; G308-K312 VanDerWaalsContact O-N 3.1Å
309N95.1Very high91.2Very high87 Ų8769.8 Ų69.847%0.46539%0.385SS..Hα-helixtrans-69.8-35.5177.2-71.9-11.2000111.9T306 L311 K312 A313T306-N309 PolarHBondContact O-N 3.27Å; T306-N309 WeakPolarHBondContact OG1-CB 3.34Å; T306-N309 PolarHBondContact OG1-N 2.85Å; T306-N309 PolarHBondContact OG1-ND2 3.18Å; N309-L311 VanDerWaalsContact C-N 3.35Å; N309-L311 PolarHBondContact O-N 3.23Å; N309-K312 PolarHBondContact O-N 2.95Å; N309-A313 WeakPolarHBondContact O-CB 3.44Å; N309-A313 PolarHBondContact O-N 3.01Å
310A93.8Very high92.3Very high12 Ų1263 Ų6310%0.09936%0.362CS..Hα-helixtrans-56.4-49.4172.300000111.7L295 F305 T306 A307 A313 L314L295-A310 HydrophobicContact CD1-CB 3.96Å; F305-A310 HydrophobicContact CD2-CB 3.55Å; F305-A310 HydrophobicContact CE2-CB 3.28Å; F305-A310 HydrophobicContact CZ-CB 4.41Å; T306-A310 PolarHBondContact O-N 3.26Å; A307-A310 WeakPolarHBondContact O-CB 3.29Å; A307-A310 PolarHBondContact O-N 2.82Å; A310-A313 PolarHBondContact O-N 3.5Å; A310-L314 WeakPolarHBondContact O-CG 3.5Å; A310-L314 PolarHBondContact O-N 3.1Å
311L96.3Very high92.9Very high19 Ų1958.3 Ų58.310%0.09934%0.338CS..Hα-helixtrans-63.2-45.2-179.7178.658.7000111.4L283 A284 C287 A307 G308 N309 A313 L314 V315 V342L283-L311 HydrophobicContact CD2-CD1 4.11Å; A284-L311 HydrophobicContact CB-CD1 3.61Å; A284-L311 HydrophobicContact CB-CD2 4.19Å; C287-L311 HydrophobicContact CB-CB 3.88Å; C287-L311 HydrophobicContact CB-CD2 3.99Å; C287-L311 HydrophobicContact CB-CG 4.47Å; A307-L311 PolarHBondContact O-N 3Å; G308-L311 PolarHBondContact O-N 3.19Å; N309-L311 VanDerWaalsContact C-N 3.35Å; N309-L311 PolarHBondContact O-N 3.23Å; L311-A313 VanDerWaalsContact C-N 3.34Å; L311-A313 PolarHBondContact O-N 3.5Å; L311-L314 PolarHBondContact O-N 3.28Å; L311-V315 HydrophobicContact CD1-CG2 4.12Å; L311-V315 WeakPolarHBondContact O-CG2 3.47Å; L311-V315 PolarHBondContact O-N 3.43Å; L311-V342 HydrophobicContact CD2-CG2 4.29Å
312K96.7Very high93.8Very high144 Ų14456.7 Ų56.763%0.62632%0.323SS*.Hα-helixtrans-58.3-45.5175.8-69.9171.1-170170.50111.6G308 N309 V315 A316G308-K312 WeakPolarHBondContact O-CG 3.28Å; G308-K312 PolarHBondContact O-N 2.99Å; G308-K312 VanDerWaalsContact O-N 3.1Å; N309-K312 PolarHBondContact O-N 2.95Å; K312-V315 PolarHBondContact O-N 3.47Å; K312-A316 WeakPolarHBondContact O-CB 3.24Å; K312-A316 PolarHBondContact O-N 3.31Å
313A95.6Very high94.3Very high50 Ų5054.5 Ų54.541%0.41331%0.314SS..Hα-helixtrans-63.1-45.2178.700000112N309 A310 L311 A316 I317N309-A313 WeakPolarHBondContact O-CB 3.44Å; N309-A313 PolarHBondContact O-N 3.01Å; A310-A313 PolarHBondContact O-N 3.5Å; L311-A313 VanDerWaalsContact C-N 3.34Å; L311-A313 PolarHBondContact O-N 3.5Å; A313-A316 PolarHBondContact O-N 3.46Å; A313-I317 VanDerWaalsContact O-CG1 3.27Å; A313-I317 WeakPolarHBondContact O-CG1 3.45Å; A313-I317 PolarHBondContact O-N 2.83Å
314L95.4Very high94.8Very high58 Ų5856.5 Ų56.530%0.30432%0.321SS..Hα-helixtrans-61.2-47.3176.8-73169.7000111.9M280 L283 A310 L311 A316 I317 D318M280-L314 HydrophobicContact CE-CB 4.05Å; M280-L314 HydrophobicContact CE-CD1 4.26Å; L283-L314 HydrophobicContact CD1-CD1 3.86Å; L283-L314 HydrophobicContact CD2-CD1 3.73Å; A310-L314 WeakPolarHBondContact O-CG 3.5Å; A310-L314 PolarHBondContact O-N 3.1Å; L311-L314 PolarHBondContact O-N 3.28Å; L314-A316 VanDerWaalsContact C-N 3.3Å; L314-A316 PolarHBondContact O-N 2.85Å; L314-I317 PolarHBondContact O-N 2.89Å; L314-D318 PolarHBondContact O-N 3.39Å
315V97.7Very high94.8Very high51 Ų5154.2 Ų54.231%0.30931%0.312SS..Hα-helixtrans-60.9-40176.7169.30000111.3L311 K312 T319 L335 A338L311-V315 HydrophobicContact CD1-CG2 4.12Å; L311-V315 WeakPolarHBondContact O-CG2 3.47Å; L311-V315 PolarHBondContact O-N 3.43Å; K312-V315 PolarHBondContact O-N 3.47Å; V315-T319 VanDerWaalsContact O-CB 3.24Å; V315-T319 WeakPolarHBondContact O-CB 3.28Å; V315-T319 PolarHBondContact O-N 2.84Å; V315-T319 PolarHBondContact O-OG1 2.93Å; V315-L335 HydrophobicContact CB-CD2 4.47Å; V315-L335 HydrophobicContact CG1-CD2 3.95Å; V315-A338 HydrophobicContact CG2-CB 4.31Å
316A97.4Very high94.8Very high59 Ų5956.8 Ų56.849%0.48832%0.32SS..Hα-helixtrans-64.9-44.4176.600000111.8K312 A313 L314 T319 A320K312-A316 WeakPolarHBondContact O-CB 3.24Å; K312-A316 PolarHBondContact O-N 3.31Å; A313-A316 PolarHBondContact O-N 3.46Å; L314-A316 VanDerWaalsContact C-N 3.3Å; L314-A316 PolarHBondContact O-N 2.85Å; A316-T319 PolarHBondContact O-N 3.33Å; A316-A320 WeakPolarHBondContact O-CB 3.35Å; A316-A320 PolarHBondContact O-N 3.43Å
317I96.6Very high94.4Very high94 Ų9462.4 Ų62.448%0.48234%0.337SS..Hα-helixtrans-62.7-46.1177.4-69.7165000111A313 L314 T319 A320 G321 W326A313-I317 VanDerWaalsContact O-CG1 3.27Å; A313-I317 WeakPolarHBondContact O-CG1 3.45Å; A313-I317 PolarHBondContact O-N 2.83Å; L314-I317 PolarHBondContact O-N 2.89Å; I317-T319 VanDerWaalsContact C-N 3.33Å; I317-T319 PolarHBondContact O-N 2.93Å; I317-A320 PolarHBondContact O-N 2.69Å; I317-G321 PolarHBondContact O-N 2.93Å; I317-W326 HydrophobicContact CG2-CZ3 4.41Å
318D96.4Very high93.8Very high9 Ų968 Ų685%0.04837%0.366CS..Hα-helixtrans-67.5-35.9178.3-78.8-44.4000111.9L314 G321 L322 H331 H334 L335L314-D318 PolarHBondContact O-N 3.39Å; D318-G321 PolarHBondContact O-N 3.33Å; D318-L322 WeakPolarHBondContact O-CB 3.42Å; D318-L322 PolarHBondContact O-N 2.93Å; D318-H331 HydrophobicContact CB-CB 4.37Å; D318-H331 WeakPolarHBondContact O-CB 3.32Å; D318-H331 IonicContact OD1-CE1 3.73Å; D318-H331 IonicContact OD1-CG 3.71Å; D318-H331 IonicContact OD1-ND1 3.33Å; D318-H331 PolarHBondContact OD1-ND1 2.73Å; D318-H334 HydrophobicContact CB-CB 4.4Å; D318-H334 IonicContact OD1-CE1 3.26Å; D318-H334 IonicContact OD1-CG 3.64Å; D318-H334 IonicContact OD1-ND1 3.98Å; D318-H334 PolarHBondContact OD1-ND1 3.13Å; D318-H334 WeakPolarHBondContact OD2-CB 3.36Å; D318-H334 IonicContact OD2-CG 2.67Å; D318-H334 IonicContact OD2-ND1 2.77Å; D318-H334 PolarHBondContact OD2-ND1 3.35Å; D318-L335 HydrophobicContact CB-CD1 4.39Å; D318-L335 HydrophobicContact CB-CD2 3.89Å; D318-L335 HydrophobicContact CB-CG 3.84Å
319T96.8Very high93.4Very high54 Ų5471.5 Ų71.533%0.33138%0.378SS..Hα-helixtrans-65.3-45.7175.3-60.90000111.1V315 A316 I317 L322 I323V315-T319 VanDerWaalsContact O-CB 3.24Å; V315-T319 WeakPolarHBondContact O-CB 3.28Å; V315-T319 PolarHBondContact O-N 2.84Å; V315-T319 PolarHBondContact O-OG1 2.93Å; A316-T319 PolarHBondContact O-N 3.33Å; I317-T319 VanDerWaalsContact C-N 3.33Å; I317-T319 PolarHBondContact O-N 2.93Å; T319-L322 PolarHBondContact O-N 2.93Å; T319-I323 HydrophobicContact CG2-CD1 3.88Å; T319-I323 WeakPolarHBondContact O-CG1 3.4Å; T319-I323 PolarHBondContact O-N 3.06Å
320A96.7Very high93.3Very high37 Ų3768 Ų6831%0.30636%0.359SS..Hα-helixtrans-60.6-45.6173.700000111.1A316 I317 L322 I323 L324A316-A320 WeakPolarHBondContact O-CB 3.35Å; A316-A320 PolarHBondContact O-N 3.43Å; I317-A320 PolarHBondContact O-N 2.69Å; A320-L322 VanDerWaalsContact C-N 3.28Å; A320-L322 PolarHBondContact O-N 2.99Å; A320-I323 PolarHBondContact O-N 3.23Å; A320-L324 VanDerWaalsContact O-CB 3.24Å; A320-L324 WeakPolarHBondContact O-CB 3.49Å; A320-L324 VanDerWaalsContact O-CG 3.23Å; A320-L324 WeakPolarHBondContact O-CG 3.4Å; A320-L324 PolarHBondContact O-N 2.83Å
321G94.5Very high93.4Very high0 Ų067.6 Ų67.60%036%0.355CS..Hα-helixtrans-60.7-36.5176.500000113.1I317 D318 G325 W326I317-G321 PolarHBondContact O-N 2.93Å; D318-G321 PolarHBondContact O-N 3.33Å; G321-G325 PolarHBondContact O-N 2.96Å; G321-W326 PolarHBondContact O-N 3.07Å
322L93.6Very high93.4Very high64 Ų6466.9 Ų66.934%0.33535%0.352SS..Hα-helixtrans-68.2-47.3175.6-170.563.7000112.2D318 T319 A320 G325 H331 A332 L335D318-L322 WeakPolarHBondContact O-CB 3.42Å; D318-L322 PolarHBondContact O-N 2.93Å; T319-L322 PolarHBondContact O-N 2.93Å; A320-L322 VanDerWaalsContact C-N 3.28Å; A320-L322 PolarHBondContact O-N 2.99Å; L322-G325 PolarHBondContact O-N 3.08Å; L322-H331 HydrophobicContact CB-CB 4.15Å; L322-H331 HydrophobicContact CD1-CB 4.46Å; L322-A332 HydrophobicContact CD1-CB 4Å; L322-L335 HydrophobicContact CB-CD1 4.5Å; L322-L335 HydrophobicContact CD2-CD1 3.93Å
323I94.3Very high93.4Very high135 Ų13560.3 Ų60.369%0.69233%0.325SS*.Hα-helixtrans-66.6-45.1-179.5-67.5168.6000110.9T319 A320 G325T319-I323 HydrophobicContact CG2-CD1 3.88Å; T319-I323 WeakPolarHBondContact O-CG1 3.4Å; T319-I323 PolarHBondContact O-N 3.06Å; A320-I323 PolarHBondContact O-N 3.23Å; I323-G325 PolarHBondContact O-N 3.17Å
324L93.4Very high93.5Very high117 Ų11758.8 Ų58.861%0.61331%0.309SS*.Hα-helixtrans-77.9-8.4-179.9-60.8175.6000112.8A320 W326A320-L324 VanDerWaalsContact O-CB 3.24Å; A320-L324 WeakPolarHBondContact O-CB 3.49Å; A320-L324 VanDerWaalsContact O-CG 3.23Å; A320-L324 WeakPolarHBondContact O-CG 3.4Å; A320-L324 PolarHBondContact O-N 2.83Å; L324-W326 HydrophobicContact CD1-CZ2 3.79Å
325G88.5Confident93.6Very high25 Ų2557.2 Ų57.226%0.25830%0.3SS..THydrogen-bonded Turntrans72.132.7175.900000114.5G321 L322 I323 R327G321-G325 PolarHBondContact O-N 2.96Å; L322-G325 PolarHBondContact O-N 3.08Å; I323-G325 PolarHBondContact O-N 3.17Å; G325-R327 WeakPolarHBondContact O-CG 3.33Å
326W90.3Very high93.7Very high128 Ų12854.9 Ų54.949%0.48529%0.287SS..  trans-61.4144.6172.3-65.3-7.9000111I317 G321 L324 H331I317-W326 HydrophobicContact CG2-CZ3 4.41Å; G321-W326 PolarHBondContact O-N 3.07Å; L324-W326 HydrophobicContact CD1-CZ2 3.79Å; W326-H331 WeakPolarHBondContact CB-NE2 3.48Å
327R84.8Confident93.7Very high153 Ų15352 Ų5258%0.57726%0.263SS*.  trans-1224.8-170.1-49.2-18094.5163.37.1113.5Q35 G325 F329Q35-R327 PolarHBondContact NE2-O 3.25Å; Q35-R327 VanDerWaalsContact NE2-O 3.14Å; G325-R327 WeakPolarHBondContact O-CG 3.33Å; R327-F329 VanDerWaalsContact C-N 3.33Å
328L81.9Confident93.8Very high118 Ų11847.8 Ų47.862%0.61824%0.242SC*.SBendtrans-70.5-36.3178.9-173.662000110.6
329F85.8Confident93.9Very high87 Ų8753.2 Ų53.238%0.38227%0.27SS..SBendtrans-128.9160.5-179.6-55.4-66.5000111.9R327 H331R327-F329 VanDerWaalsContact C-N 3.33Å; F329-H331 VanDerWaalsContact C-N 3.29Å; F329-H331 PolarHBondContact O-N 2.85Å; F329-H331 VanDerWaalsContact O-N 3.13Å
330D92.3Very high94Very high14 Ų1451.3 Ų51.38%0.07526%0.258CS..  trans-8576.6169.8-162.9-28.4000109.7S259 K263 S272 A332 A333 H334S259-D330 WeakPolarHBondContact CB-OD1 3.47Å; S259-D330 WeakPolarHBondContact CB-OD2 3.28Å; S259-D330 PolarHBondContact OG-OD1 3.09Å; S259-D330 PolarHBondContact OG-OD2 3.18Å; K263-D330 IonicContact NZ-OD2 2.82Å; K263-D330 PolarHBondContact NZ-OD2 3.43Å; S272-D330 WeakPolarHBondContact CB-OD2 3.42Å; S272-D330 PolarHBondContact OG-OD2 2.93Å; D330-A332 PolarHBondContact O-N 3.45Å; D330-A333 HydrophobicContact CB-CB 3.89Å; D330-A333 WeakPolarHBondContact O-CA 3.49Å; D330-A333 WeakPolarHBondContact O-CB 3.36Å; D330-A333 PolarHBondContact O-N 3.37Å; D330-A333 PolarHBondContact OD1-N 3.29Å; D330-A333 VanDerWaalsContact OD1-N 3.13Å; D330-H334 PolarHBondContact O-CD2 2.91Å; D330-H334 PolarHBondContact O-N 3.32Å
331H95.4Very high94.1Very high4 Ų449.6 Ų49.62%0.01924%0.243CC..Hα-helixtrans-56.1-35.6-176.6-64.2-62.1000113D318 L322 W326 F329 H334 L335D318-H331 HydrophobicContact CB-CB 4.37Å; D318-H331 WeakPolarHBondContact O-CB 3.32Å; D318-H331 IonicContact OD1-CE1 3.73Å; D318-H331 IonicContact OD1-CG 3.71Å; D318-H331 IonicContact OD1-ND1 3.33Å; D318-H331 PolarHBondContact OD1-ND1 2.73Å; L322-H331 HydrophobicContact CB-CB 4.15Å; L322-H331 HydrophobicContact CD1-CB 4.46Å; W326-H331 WeakPolarHBondContact CB-NE2 3.48Å; F329-H331 VanDerWaalsContact C-N 3.29Å; F329-H331 PolarHBondContact O-N 2.85Å; F329-H331 VanDerWaalsContact O-N 3.13Å; H331-H334 PolarHBondContact O-N 3.08Å; H331-L335 WeakPolarHBondContact O-CG 3.49Å; H331-L335 PolarHBondContact O-N 3.36Å
332A96.8Very high94.2Very high3 Ų352.1 Ų52.13%0.02526%0.259CS..Hα-helixtrans-65.7-40.7175.400000111.9V258 C262 L322 D330 G336V258-A332 WeakPolarHBondContact CG1-O 3.45Å; C262-A332 HydrophobicContact CB-CB 3.71Å; L322-A332 HydrophobicContact CD1-CB 4Å; D330-A332 PolarHBondContact O-N 3.45Å; A332-G336 PolarHBondContact O-N 2.84Å
333A97.3Very high94.5Very high7 Ų754 Ų546%0.05826%0.261CS..Hα-helixtrans-64-42173.300000111.7S255 D330 G336 G337S255-A333 WeakPolarHBondContact CB-O 3.38Å; S255-A333 WeakPolarHBondContact O-CA 3.35Å; D330-A333 HydrophobicContact CB-CB 3.89Å; D330-A333 WeakPolarHBondContact O-CA 3.49Å; D330-A333 WeakPolarHBondContact O-CB 3.36Å; D330-A333 PolarHBondContact O-N 3.37Å; D330-A333 PolarHBondContact OD1-N 3.29Å; D330-A333 VanDerWaalsContact OD1-N 3.13Å; A333-G336 PolarHBondContact O-N 2.77Å; A333-G337 PolarHBondContact O-N 3.46Å
334H97.6Very high94.7Very high18 Ų1847.6 Ų47.68%0.08323%0.229CC..Hα-helixtrans-60.9-48.1177.6-65.8-178.3000112.1S276 M280 D318 D330 H331 G337 A338S276-H334 WeakPolarHBondContact CB-NE2 3.46Å; S276-H334 PolarHBondContact OG-CD2 3.09Å; S276-H334 PolarHBondContact OG-NE2 3.44Å; M280-H334 HydrophobicContact CG-CB 4.02Å; D318-H334 HydrophobicContact CB-CB 4.4Å; D318-H334 IonicContact OD1-CE1 3.26Å; D318-H334 IonicContact OD1-CG 3.64Å; D318-H334 IonicContact OD1-ND1 3.98Å; D318-H334 PolarHBondContact OD1-ND1 3.13Å; D318-H334 WeakPolarHBondContact OD2-CB 3.36Å; D318-H334 IonicContact OD2-CG 2.67Å; D318-H334 IonicContact OD2-ND1 2.77Å; D318-H334 PolarHBondContact OD2-ND1 3.35Å; D330-H334 PolarHBondContact O-CD2 2.91Å; D330-H334 PolarHBondContact O-N 3.32Å; H331-H334 PolarHBondContact O-N 3.08Å; H334-G337 PolarHBondContact O-N 3.37Å; H334-A338 WeakPolarHBondContact O-CB 3.49Å; H334-A338 PolarHBondContact O-N 3.31Å
335L98.2Very high94.8Very high24 Ų2442.4 Ų42.413%0.12620%0.202CC..Hα-helixtrans-62.6-43.3176.6-69.7170.6000111.6V315 D318 L322 H331 G337 A338 L339V315-L335 HydrophobicContact CB-CD2 4.47Å; V315-L335 HydrophobicContact CG1-CD2 3.95Å; D318-L335 HydrophobicContact CB-CD1 4.39Å; D318-L335 HydrophobicContact CB-CD2 3.89Å; D318-L335 HydrophobicContact CB-CG 3.84Å; L322-L335 HydrophobicContact CB-CD1 4.5Å; L322-L335 HydrophobicContact CD2-CD1 3.93Å; H331-L335 WeakPolarHBondContact O-CG 3.49Å; H331-L335 PolarHBondContact O-N 3.36Å; L335-G337 VanDerWaalsContact C-N 3.31Å; L335-G337 PolarHBondContact O-N 3.33Å; L335-A338 PolarHBondContact O-N 2.8Å; L335-L339 WeakPolarHBondContact O-CB 3.46Å; L335-L339 VanDerWaalsContact O-CG 3.23Å; L335-L339 WeakPolarHBondContact O-CG 3.46Å; L335-L339 PolarHBondContact O-N 3.21Å
336G98.2Very high95.2Very high2 Ų243.6 Ų43.62%0.02121%0.209CC..Hα-helixtrans-59.9-41.5175.500000112.8A332 A333 F340A332-G336 PolarHBondContact O-N 2.84Å; A333-G336 PolarHBondContact O-N 2.77Å; G336-F340 WeakPolarHBondContact O-CB 3.47Å; G336-F340 PolarHBondContact O-N 3.31Å
337G98.3Very high95.5Very high0 Ų044.5 Ų44.50%021%0.213CC..Hα-helixtrans-63.2-50.8173.600000112.4G277 A281 A333 H334 L335 L339 F340 G341G277-G337 VanDerWaalsContact O-CA 3.3Å; G277-G337 WeakPolarHBondContact O-CA 3.08Å; A281-G337 WeakPolarHBondContact CA-O 3.11Å; A281-G337 WeakPolarHBondContact CB-O 3.34Å; A333-G337 PolarHBondContact O-N 3.46Å; H334-G337 PolarHBondContact O-N 3.37Å; L335-G337 VanDerWaalsContact C-N 3.31Å; L335-G337 PolarHBondContact O-N 3.33Å; G337-L339 PolarHBondContact O-N 2.9Å; G337-F340 PolarHBondContact O-N 3.45Å; G337-G341 PolarHBondContact O-N 3.42Å
338A98.5Very high96Very high4 Ų437.2 Ų37.23%0.03319%0.186CC..Hα-helixtrans-58.8-47.4178.800000111.8M280 A284 V315 H334 L335 F340 G341 V342M280-A338 HydrophobicContact CE-CB 4.4Å; A284-A338 HydrophobicContact CB-CB 4.05Å; V315-A338 HydrophobicContact CG2-CB 4.31Å; H334-A338 WeakPolarHBondContact O-CB 3.49Å; H334-A338 PolarHBondContact O-N 3.31Å; L335-A338 PolarHBondContact O-N 2.8Å; A338-F340 PolarHBondContact O-N 3.47Å; A338-G341 PolarHBondContact O-N 2.86Å; A338-V342 VanDerWaalsContact O-CG2 3.29Å; A338-V342 WeakPolarHBondContact O-CG2 3.45Å; A338-V342 PolarHBondContact O-N 2.63Å
339L98.4Very high96.7Very high123 Ų12333.8 Ų33.864%0.64417%0.167SC*.Hα-helixtrans-58.5-45.7176-73.4171.7000111.7L335 G337 W343L335-L339 WeakPolarHBondContact O-CB 3.46Å; L335-L339 VanDerWaalsContact O-CG 3.23Å; L335-L339 WeakPolarHBondContact O-CG 3.46Å; L335-L339 PolarHBondContact O-N 3.21Å; G337-L339 PolarHBondContact O-N 2.9Å; L339-W343 WeakPolarHBondContact O-CB 3.43Å; L339-W343 PolarHBondContact O-N 2.96Å
340F98.6Very high97.1Very high15 Ų1536.3 Ų36.37%0.06618%0.178CC..Hα-helixtrans-62.6-43.7176.2175.4-106.2000112.1F96 V247 A251 I254 A281 G336 G337 A338 W343 Y344F96-F340 HydrophobicContact CZ-CZ 4.5Å; V247-F340 HydrophobicContact CG1-CE1 4.1Å; A251-F340 HydrophobicContact CB-CD1 3.59Å; A251-F340 HydrophobicContact CB-CE1 3.76Å; I254-F340 HydrophobicContact CD1-CD1 4.5Å; I254-F340 HydrophobicContact CD1-CD2 3.42Å; I254-F340 VanDerWaalsContact CD1-CD2 3.42Å; I254-F340 HydrophobicContact CD1-CE1 4.38Å; I254-F340 HydrophobicContact CD1-CE2 3.26Å; I254-F340 HydrophobicContact CD1-CG 4.05Å; I254-F340 HydrophobicContact CD1-CZ 3.8Å; I254-F340 HydrophobicContact CG2-CB 4.18Å; I254-F340 HydrophobicContact CG2-CD2 4.37Å; I254-F340 HydrophobicContact CG2-CG 4.37Å; A281-F340 HydrophobicContact CB-CD1 4.21Å; G336-F340 WeakPolarHBondContact O-CB 3.47Å; G336-F340 PolarHBondContact O-N 3.31Å; G337-F340 PolarHBondContact O-N 3.45Å; A338-F340 PolarHBondContact O-N 3.47Å; F340-W343 AromaticContact CD2-CE3 3.78Å; F340-W343 HydrophobicContact CD2-CE3 3.78Å; F340-W343 AromaticContact CD2-CZ3 3.94Å; F340-W343 HydrophobicContact CD2-CZ3 3.94Å; F340-W343 AromaticContact CE2-CE3 3.88Å; F340-W343 HydrophobicContact CE2-CE3 3.88Å; F340-W343 AromaticContact CE2-CZ3 3.58Å; F340-W343 HydrophobicContact CE2-CZ3 3.58Å; F340-W343 PolarHBondContact O-N 2.91Å; F340-Y344 HydrophobicContact CZ-CD2 4.26Å; F340-Y344 WeakPolarHBondContact O-CB 3.3Å; F340-Y344 PolarHBondContact O-N 2.72Å
341G98.3Very high97.2Very high0 Ų040 Ų400%020%0.196CC..Hα-helixtrans-58.9-50.7177.600000112.6A281 G337 A338 Y344 V345A281-G341 WeakPolarHBondContact O-CA 3.24Å; G337-G341 PolarHBondContact O-N 3.42Å; A338-G341 PolarHBondContact O-N 2.86Å; G341-Y344 PolarHBondContact O-N 3.41Å; G341-V345 WeakPolarHBondContact O-CG2 3.37Å; G341-V345 PolarHBondContact O-N 3.1Å
342V98.4Very high97.2Very high54 Ų5442.7 Ų42.733%0.32721%0.211SC..Hα-helixtrans-58.3-52.3175.6174.80000110.6A284 T288 L311 A338 Y344 V345 A346A284-V342 HydrophobicContact CB-CG2 4.13Å; T288-V342 HydrophobicContact CG2-CG1 4.4Å; L311-V342 HydrophobicContact CD2-CG2 4.29Å; A338-V342 VanDerWaalsContact O-CG2 3.29Å; A338-V342 WeakPolarHBondContact O-CG2 3.45Å; A338-V342 PolarHBondContact O-N 2.63Å; V342-Y344 VanDerWaalsContact C-N 3.29Å; V342-Y344 PolarHBondContact O-N 3.48Å; V342-V345 WeakPolarHBondContact O-CG2 3.44Å; V342-V345 PolarHBondContact O-N 3.48Å; V342-A346 VanDerWaalsContact O-CB 3.31Å; V342-A346 WeakPolarHBondContact O-CB 3.37Å; V342-A346 PolarHBondContact O-N 2.95Å
343W98.4Very high97.1Very high103 Ų10343 Ų4339%0.3921%0.211SC..Hα-helixtrans-59.7-40.3-179.8168.583.8000111.9L339 F340 A346 Y347 G348 I352L339-W343 WeakPolarHBondContact O-CB 3.43Å; L339-W343 PolarHBondContact O-N 2.96Å; F340-W343 AromaticContact CD2-CE3 3.78Å; F340-W343 HydrophobicContact CD2-CE3 3.78Å; F340-W343 AromaticContact CD2-CZ3 3.94Å; F340-W343 HydrophobicContact CD2-CZ3 3.94Å; F340-W343 AromaticContact CE2-CE3 3.88Å; F340-W343 HydrophobicContact CE2-CE3 3.88Å; F340-W343 AromaticContact CE2-CZ3 3.58Å; F340-W343 HydrophobicContact CE2-CZ3 3.58Å; F340-W343 PolarHBondContact O-N 2.91Å; W343-A346 PolarHBondContact O-N 3.35Å; W343-Y347 AromaticContact CD1-CD2 3.81Å; W343-Y347 PolarHBondContact O-N 3.34Å; W343-G348 PolarHBondContact O-N 3.31Å; W343-G348 VanDerWaalsContact O-N 3.13Å; W343-I352 HydrophobicContact CH2-CD1 3.97Å
344Y98.4Very high97Very high1 Ų150.6 Ų50.60%0.00424%0.238CC..Iπ-helixtrans-66.5-44.2-176.5-174.5-95.3000111.6F96 L239 Q243 V247 F340 G341 V342 A346 G348 H349F96-Y344 AromaticContact CE1-CE2 3.59Å; F96-Y344 HydrophobicContact CE1-CE2 3.59Å; F96-Y344 AromaticContact CE1-CZ 3.65Å; F96-Y344 WeakPolarHBondContact CE1-OH 3.49Å; F96-Y344 HydrophobicContact CE2-CE2 4.25Å; F96-Y344 HydrophobicContact CZ-CD2 4.08Å; F96-Y344 AromaticContact CZ-CE2 3.33Å; F96-Y344 HydrophobicContact CZ-CE2 3.33Å; F96-Y344 AromaticContact CZ-CZ 3.84Å; L239-Y344 HydrophobicContact CD1-CD1 4.43Å; L239-Y344 HydrophobicContact CD1-CE1 3.96Å; L239-Y344 HydrophobicContact CD2-CE1 4.13Å; Q243-Y344 VanDerWaalsContact CG-OH 3.26Å; Q243-Y344 WeakPolarHBondContact CG-OH 3.25Å; Q243-Y344 PolarHBondContact NE2-OH 2.79Å; V247-Y344 HydrophobicContact CG1-CD1 4.44Å; V247-Y344 HydrophobicContact CG2-CD1 3.63Å; V247-Y344 HydrophobicContact CG2-CD2 4.28Å; V247-Y344 HydrophobicContact CG2-CE1 3.17Å; V247-Y344 HydrophobicContact CG2-CE2 3.91Å; V247-Y344 HydrophobicContact CG2-CG 4.14Å; F340-Y344 HydrophobicContact CZ-CD2 4.26Å; F340-Y344 WeakPolarHBondContact O-CB 3.3Å; F340-Y344 PolarHBondContact O-N 2.72Å; G341-Y344 PolarHBondContact O-N 3.41Å; V342-Y344 VanDerWaalsContact C-N 3.29Å; V342-Y344 PolarHBondContact O-N 3.48Å; Y344-A346 VanDerWaalsContact C-N 3.35Å; Y344-G348 CarbonylContact O-C 3.49Å; Y344-G348 WeakPolarHBondContact O-CA 3.46Å; Y344-G348 PolarHBondContact O-N 3Å; Y344-H349 HydrophobicContact CE1-CB 4.4Å; Y344-H349 PolarHBondContact O-N 3.31Å
345V97.1Very high96.8Very high8 Ų858.6 Ų58.65%0.04827%0.268CS..Iπ-helixtrans-74.9-26.1179.8-61.50000113.3A285 T288 K289 G341 V342A285-V345 HydrophobicContact CB-CG1 3.44Å; A285-V345 VanDerWaalsContact CB-CG1 3.44Å; T288-V345 HydrophobicContact CG2-CG2 3.84Å; K289-V345 HydrophobicContact CD-CB 4.43Å; K289-V345 WeakPolarHBondContact CE-O 3.39Å; K289-V345 HydrophobicContact CG-CB 4.02Å; K289-V345 HydrophobicContact CG-CG1 4.33Å; K289-V345 HydrophobicContact CG-CG2 4.22Å; K289-V345 PolarHBondContact NZ-O 2.88Å; G341-V345 WeakPolarHBondContact O-CG2 3.37Å; G341-V345 PolarHBondContact O-N 3.1Å; V342-V345 WeakPolarHBondContact O-CG2 3.44Å; V342-V345 PolarHBondContact O-N 3.48Å
346A96.9Very high96.6Very high50 Ų5061.1 Ų61.141%0.41328%0.276SS..Iπ-helixtrans-77.4-43.7174.500000112.1V342 W343 Y344V342-A346 VanDerWaalsContact O-CB 3.31Å; V342-A346 WeakPolarHBondContact O-CB 3.37Å; V342-A346 PolarHBondContact O-N 2.95Å; W343-A346 PolarHBondContact O-N 3.35Å; Y344-A346 VanDerWaalsContact C-N 3.35Å
347Y96.8Very high96.4Very high146 Ų14666.3 Ų66.357%0.57330%0.3SS*.Iπ-helixtrans-131.9-46.6-169.7-52.6-73.3000113.2W343 H349 K350 L351W343-Y347 AromaticContact CD1-CD2 3.81Å; W343-Y347 PolarHBondContact O-N 3.34Å; Y347-H349 VanDerWaalsContact C-N 3.33Å; Y347-H349 PolarHBondContact O-N 3.36Å; Y347-K350 PolarHBondContact O-N 2.84Å; Y347-L351 WeakPolarHBondContact O-CG 3.48Å; Y347-L351 PolarHBondContact O-N 2.81Å
348G95.4Very high96.3Very high0 Ų070.7 Ų70.70%033%0.328CS..Iπ-helixtrans-55.6-40-172.200000114.5W343 Y344 K350 L351 I352W343-G348 PolarHBondContact O-N 3.31Å; W343-G348 VanDerWaalsContact O-N 3.13Å; Y344-G348 CarbonylContact O-C 3.49Å; Y344-G348 WeakPolarHBondContact O-CA 3.46Å; Y344-G348 PolarHBondContact O-N 3Å; G348-K350 VanDerWaalsContact C-N 3.34Å; G348-K350 PolarHBondContact O-N 3.42Å; G348-L351 PolarHBondContact O-N 3.46Å; G348-I352 WeakPolarHBondContact O-CB 3.32Å; G348-I352 PolarHBondContact O-N 3.37Å
349H95.2Very high96.1Very high46 Ų4673.9 Ų73.921%0.21334%0.344CS..Iπ-helixtrans-59.1-43.6175176.394.9000111.8Q243 Y344 Y347 W353 R354Q243-H349 PolarHBondContact NE2-ND1 3.47Å; Q243-H349 PolarHBondContact OE1-ND1 2.74Å; Y344-H349 HydrophobicContact CE1-CB 4.4Å; Y344-H349 PolarHBondContact O-N 3.31Å; Y347-H349 VanDerWaalsContact C-N 3.33Å; Y347-H349 PolarHBondContact O-N 3.36Å; H349-W353 AromaticContact CE1-CD1 3.88Å; H349-W353 WeakPolarHBondContact O-CB 3.33Å; H349-W353 PolarHBondContact O-N 2.91Å; H349-R354 PolarHBondContact NE2-NE 3.31Å; H349-R354 PolarHBondContact O-N 3.25Å
350K94.9Very high95.9Very high141 Ų14169 Ų6961%0.61332%0.319SS*.Iπ-helixtrans-72-39.7179.1-175.7-179.8178.1-178.30111.8Y347 G348Y347-K350 PolarHBondContact O-N 2.84Å; G348-K350 VanDerWaalsContact C-N 3.34Å; G348-K350 PolarHBondContact O-N 3.42Å
351L94.7Very high95.7Very high90 Ų9073.6 Ų73.647%0.47134%0.339SS..Iπ-helixtrans-77.4-42.6-174.6-67.2175.6000112.7Y347 G348 R355Y347-L351 WeakPolarHBondContact O-CG 3.48Å; Y347-L351 PolarHBondContact O-N 2.81Å; G348-L351 PolarHBondContact O-N 3.46Å; L351-R355 WeakPolarHBondContact O-CD 3.25Å
352I94.9Very high95.5Very high62 Ų6278 Ų7832%0.31836%0.362SS..Iπ-helixtrans-98.7-61.4-173.2-57.5173.1000109.5F96 W343 G348 R355F96-I352 HydrophobicContact CB-CG2 4.04Å; F96-I352 HydrophobicContact CD1-CG2 4.23Å; F96-I352 HydrophobicContact CD2-CD1 4.49Å; F96-I352 HydrophobicContact CD2-CG2 4.21Å; F96-I352 HydrophobicContact CE2-CD1 4.39Å; F96-I352 HydrophobicContact CG-CG2 3.89Å; W343-I352 HydrophobicContact CH2-CD1 3.97Å; G348-I352 WeakPolarHBondContact O-CB 3.32Å; G348-I352 PolarHBondContact O-N 3.37Å; I352-R355 PolarHBondContact O-N 3.48Å
353W95.6Very high95.3Very high10 Ų1079.8 Ų79.84%0.03836%0.363CS..Iπ-helixtrans-73.7-40.7-166.4-166.8-106.3000113.9F96 A99 A100 Q243 H349 R355 R356F96-W353 HydrophobicContact CD1-CE3 4.15Å; F96-W353 HydrophobicContact CD1-CZ3 4.34Å; A99-W353 HydrophobicContact CB-CH2 4.08Å; A99-W353 HydrophobicContact CB-CZ3 4.03Å; A100-W353 HydrophobicContact CB-CZ3 4.4Å; Q243-W353 HydrophobicContact CB-CD2 4.07Å; Q243-W353 HydrophobicContact CB-CE3 4.2Å; Q243-W353 HydrophobicContact CB-CH2 3.72Å; Q243-W353 HydrophobicContact CB-CZ2 3.55Å; Q243-W353 HydrophobicContact CB-CZ3 4.04Å; Q243-W353 VanDerWaalsContact CD-CD1 3.46Å; Q243-W353 VanDerWaalsContact CD-CD2 3.43Å; Q243-W353 HydrophobicContact CG-CD2 3.62Å; Q243-W353 HydrophobicContact CG-CE3 3.76Å; Q243-W353 HydrophobicContact CG-CG 4.09Å; Q243-W353 HydrophobicContact CG-CH2 4.22Å; Q243-W353 HydrophobicContact CG-CZ2 4.09Å; Q243-W353 HydrophobicContact CG-CZ3 4.06Å; Q243-W353 VanDerWaalsContact NE2-CD1 3.34Å; H349-W353 AromaticContact CE1-CD1 3.88Å; H349-W353 WeakPolarHBondContact O-CB 3.33Å; H349-W353 PolarHBondContact O-N 2.91Å; W353-R355 PolarHBondContact O-N 2.86Å; W353-R356 WeakPolarHBondContact O-CB 3.33Å; W353-R356 WeakPolarHBondContact O-CD 3.49Å; W353-R356 WeakPolarHBondContact O-CG 3.48Å; W353-R356 PolarHBondContact O-N 3.02Å; W353-R356 PolarHBondContact O-NH1 3.34Å
354R93.8Very high95.1Very high165 Ų16578.9 Ų78.962%0.62336%0.363SS*.THydrogen-bonded Turntrans-66.7-22.1175.9-69.7-170.2179.9-171.6-3.1112.9H349H349-R354 PolarHBondContact NE2-NE 3.31Å; H349-R354 PolarHBondContact O-N 3.25Å
355R93.9Very high94.9Very high186 Ų18683.4 Ų83.470%0.70238%0.384SS*.THydrogen-bonded Turntrans-95.317.1178.1-61.5-169.2179.3-159.6-1.2113.6L351 I352 W353 E357 P358L351-R355 WeakPolarHBondContact O-CD 3.25Å; I352-R355 PolarHBondContact O-N 3.48Å; W353-R355 PolarHBondContact O-N 2.86Å; R355-E357 VanDerWaalsContact C-N 3.3Å; R355-E357 PolarHBondContact O-N 3.24Å; R355-P358 VanDerWaalsContact O-CD 3.26Å; R355-P358 WeakPolarHBondContact O-CD 3.47Å
356R94.6Very high94.7Very high77 Ų7788.2 Ų88.229%0.29141%0.409SS..  trans-76.6-12-17876.8-166.7-179.8-67.6-0.7114.8A100 Q103 W353 L359 V360A100-R356 HydrophobicContact CB-CB 3.97Å; A100-R356 HydrophobicContact CB-CG 4.24Å; Q103-R356 VanDerWaalsContact OE1-NE 3.07Å; W353-R356 WeakPolarHBondContact O-CB 3.33Å; W353-R356 WeakPolarHBondContact O-CD 3.49Å; W353-R356 WeakPolarHBondContact O-CG 3.48Å; W353-R356 PolarHBondContact O-N 3.02Å; W353-R356 PolarHBondContact O-NH1 3.34Å; R356-L359 WeakPolarHBondContact O-CB 3.33Å; R356-L359 PolarHBondContact O-N 2.92Å; R356-V360 PolarHBondContact O-N 2.92Å; R356-V360 VanDerWaalsContact O-N 3.13Å
357E93.6Very high94.3Very high112 Ų11292.2 Ų92.252%0.52341%0.413SS..Hα-helixtrans-57.9-44.7-174.5-172-175.9169.400114.2R355 L359 V360 K361R355-E357 VanDerWaalsContact C-N 3.3Å; R355-E357 PolarHBondContact O-N 3.24Å; E357-L359 VanDerWaalsContact C-N 3.27Å; E357-L359 PolarHBondContact O-N 2.91Å; E357-V360 PolarHBondContact O-N 3.24Å; E357-K361 HydrophobicContact CG-CD 4.24Å; E357-K361 HydrophobicContact CG-CG 4.42Å; E357-K361 WeakPolarHBondContact O-CG 3.3Å; E357-K361 PolarHBondContact O-N 3.41Å; E357-K361 WeakPolarHBondContact OE1-CE 3.35Å; E357-K361 IonicContact OE1-NZ 2.93Å; E357-K361 PolarHBondContact OE1-NZ 3.49Å
358P95.4Very high93.8Very high91 Ų9188 Ų8859%0.59141%0.405SS*.Hα-helixtrans-59.8-37.7177.5-23.535.5000112.8R355 K361 L362R355-P358 VanDerWaalsContact O-CD 3.26Å; R355-P358 WeakPolarHBondContact O-CD 3.47Å; P358-K361 PolarHBondContact O-N 3.31Å; P358-L362 WeakPolarHBondContact O-CB 3.46Å; P358-L362 PolarHBondContact O-N 3.22Å
359L94.7Very high93.1Very high71 Ų7195.4 Ų95.437%0.37244%0.437SS..Hα-helixtrans-65.6-44.7177.1-179.671.2000111.4G97 A100 R356 E357 L362 W363G97-L359 VanDerWaalsContact CA-CD2 3.48Å; A100-L359 HydrophobicContact CB-CD2 4.4Å; R356-L359 WeakPolarHBondContact O-CB 3.33Å; R356-L359 PolarHBondContact O-N 2.92Å; E357-L359 VanDerWaalsContact C-N 3.27Å; E357-L359 PolarHBondContact O-N 2.91Å; L359-L362 PolarHBondContact O-N 3.37Å; L359-W363 PolarHBondContact O-N 3.03Å
360V94.2Very high91.3Very high21 Ų2196.2 Ų96.213%0.12746%0.459CS..Hα-helixtrans-66.8-38.6179.2174.90000111A100 Y104 R356 E357 W363 H364A100-V360 HydrophobicContact CB-CG2 4.29Å; Y104-V360 HydrophobicContact CD1-CG1 4.13Å; Y104-V360 HydrophobicContact CD2-CG1 3.32Å; Y104-V360 HydrophobicContact CE2-CG1 3.97Å; Y104-V360 HydrophobicContact CG-CG1 3.42Å; Y104-V360 VanDerWaalsContact CG-CG1 3.42Å; R356-V360 PolarHBondContact O-N 2.92Å; R356-V360 VanDerWaalsContact O-N 3.13Å; E357-V360 PolarHBondContact O-N 3.24Å; V360-W363 PolarHBondContact O-N 3.49Å; V360-H364 WeakPolarHBondContact O-CB 3.36Å; V360-H364 PolarHBondContact O-N 2.99Å
361K94.4Very high89.3Confident111 Ų11192.6 Ų92.648%0.48346%0.461SS..Hα-helixtrans-61.7-48.5173.4-75.7180178.8169.90111.6E357 P358 W363 H364 E365E357-K361 HydrophobicContact CG-CD 4.24Å; E357-K361 HydrophobicContact CG-CG 4.42Å; E357-K361 WeakPolarHBondContact O-CG 3.3Å; E357-K361 PolarHBondContact O-N 3.41Å; E357-K361 WeakPolarHBondContact OE1-CE 3.35Å; E357-K361 IonicContact OE1-NZ 2.93Å; E357-K361 PolarHBondContact OE1-NZ 3.49Å; P358-K361 PolarHBondContact O-N 3.31Å; K361-W363 VanDerWaalsContact C-N 3.3Å; K361-W363 PolarHBondContact O-N 3.1Å; K361-H364 WeakPolarHBondContact O-CB 3.46Å; K361-H364 PolarHBondContact O-N 3.26Å; K361-H364 VanDerWaalsContact O-N 3.16Å; K361-E365 WeakPolarHBondContact O-CG 3.44Å; K361-E365 PolarHBondContact O-N 3.28Å
362L94.9Very high87.2Confident94 Ų9497.4 Ų97.449%0.49248%0.478SS..Hα-helixtrans-55.7-45.9175.3178.464.5000111.4P358 L359 E365 L366P358-L362 WeakPolarHBondContact O-CB 3.46Å; P358-L362 PolarHBondContact O-N 3.22Å; L359-L362 PolarHBondContact O-N 3.37Å; L362-E365 PolarHBondContact O-N 3.49Å; L362-L366 HydrophobicContact CD1-CD1 4.33Å; L362-L366 HydrophobicContact CD1-CG 4.43Å; L362-L366 HydrophobicContact CG-CD1 4.14Å; L362-L366 VanDerWaalsContact O-CG 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 2.99Å
363W94.2Very high84.8Confident90 Ų9097.7 Ų97.734%0.34150%0.497SS..Hα-helixtrans-60.7-46176.2174.9-103000112.6I101 E105 L359 V360 K361 E365 L366 R367I101-W363 HydrophobicContact CD1-CB 4.44Å; I101-W363 HydrophobicContact CD1-CD2 4.14Å; I101-W363 HydrophobicContact CD1-CE3 4.08Å; I101-W363 HydrophobicContact CD1-CG 4.29Å; I101-W363 HydrophobicContact CG1-CB 4.25Å; I101-W363 HydrophobicContact CG1-CD2 4.35Å; I101-W363 HydrophobicContact CG1-CG 4.09Å; I101-W363 HydrophobicContact CG2-CD2 3.9Å; I101-W363 HydrophobicContact CG2-CG 4.05Å; I101-W363 HydrophobicContact CG2-CZ2 4.13Å; E105-W363 PolarHBondContact OE1-NE1 3.28Å; L359-W363 PolarHBondContact O-N 3.03Å; V360-W363 PolarHBondContact O-N 3.49Å; K361-W363 VanDerWaalsContact C-N 3.3Å; K361-W363 PolarHBondContact O-N 3.1Å; W363-E365 PolarHBondContact O-N 3.39Å; W363-L366 PolarHBondContact O-N 3.23Å; W363-R367 PolarHBondContact O-N 3.43Å; W363-R367 VanDerWaalsContact O-N 3.08Å
364H93.5Very high82.3Confident85 Ų85102.4 Ų102.439%0.39453%0.532SS..Hα-helixtrans-59.1-46.3177.4179.977000111.8Y104 V360 K361 R367 S368Y104-H364 AromaticContact CZ-ND1 3.83Å; Y104-H364 PolarHBondContact OH-ND1 3.35Å; V360-H364 WeakPolarHBondContact O-CB 3.36Å; V360-H364 PolarHBondContact O-N 2.99Å; K361-H364 WeakPolarHBondContact O-CB 3.46Å; K361-H364 PolarHBondContact O-N 3.26Å; K361-H364 VanDerWaalsContact O-N 3.16Å; H364-R367 PolarHBondContact O-N 3.3Å; H364-S368 VanDerWaalsContact O-CB 3.31Å; H364-S368 WeakPolarHBondContact O-CB 3.46Å; H364-S368 PolarHBondContact O-N 3.19Å; H364-S368 PolarHBondContact O-OG 3.44Å
365E93.9Very high79.8Confident96 Ų96105.9 Ų105.945%0.44955%0.545SS..Hα-helixtrans-61.2-48.6178.4-74.5179.5-162.100112K361 L362 W363 R367 S368 K369K361-E365 WeakPolarHBondContact O-CG 3.44Å; K361-E365 PolarHBondContact O-N 3.28Å; L362-E365 PolarHBondContact O-N 3.49Å; W363-E365 PolarHBondContact O-N 3.39Å; E365-R367 VanDerWaalsContact C-N 3.3Å; E365-R367 PolarHBondContact O-N 3.2Å; E365-S368 WeakPolarHBondContact CA-OG 3.33Å; E365-S368 PolarHBondContact O-N 2.95Å; E365-S368 PolarHBondContact O-OG 3.13Å; E365-K369 WeakPolarHBondContact O-CG 3.46Å; E365-K369 PolarHBondContact O-N 3.44Å
366L92.6Very high77.5Confident108 Ų108103.1 Ų103.157%0.56555%0.551SS**Hα-helixtrans-56.1-45.7177.9-73.1170.4000111.5L362 W363 G370L362-L366 HydrophobicContact CD1-CD1 4.33Å; L362-L366 HydrophobicContact CD1-CG 4.43Å; L362-L366 HydrophobicContact CG-CD1 4.14Å; L362-L366 VanDerWaalsContact O-CG 3.28Å; L362-L366 WeakPolarHBondContact O-CG 3.35Å; L362-L366 PolarHBondContact O-N 2.99Å; W363-L366 PolarHBondContact O-N 3.23Å; L366-G370 PolarHBondContact O-N 3.28Å; L366-G370 VanDerWaalsContact O-N 3.12Å
367R89.3Confident75.2Confident134 Ų134103.4 Ų103.451%0.50658%0.577SS.*Hα-helixtrans-70.7-37179.8-166.8176.3-178.61631.5112.7E105 W363 H364 E365 G371E105-R367 IonicContact OE1-CZ 2.72Å; E105-R367 IonicContact OE1-NH1 3.41Å; E105-R367 PolarHBondContact OE1-NH1 2.84Å; E105-R367 IonicContact OE2-CZ 2.91Å; E105-R367 IonicContact OE2-NH1 3.68Å; E105-R367 PolarHBondContact OE2-NH1 2.95Å; W363-R367 PolarHBondContact O-N 3.43Å; W363-R367 VanDerWaalsContact O-N 3.08Å; H364-R367 PolarHBondContact O-N 3.3Å; E365-R367 VanDerWaalsContact C-N 3.3Å; E365-R367 PolarHBondContact O-N 3.2Å; R367-G371 PolarHBondContact O-N 3.48Å
368S87Confident72.5Confident57 Ų57101.5 Ų101.540%0.39959%0.588SS.*Hα-helixtrans-67.7-37.2178.372.40000112.6H364 E365H364-S368 VanDerWaalsContact O-CB 3.31Å; H364-S368 WeakPolarHBondContact O-CB 3.46Å; H364-S368 PolarHBondContact O-N 3.19Å; H364-S368 PolarHBondContact O-OG 3.44Å; E365-S368 WeakPolarHBondContact CA-OG 3.33Å; E365-S368 PolarHBondContact O-N 2.95Å; E365-S368 PolarHBondContact O-OG 3.13Å
369K79.2Confident69.8Low156 Ų156100.4 Ų100.468%0.67859%0.593SS**Hα-helixtrans-71.7-40.2176.1-73178.4179.2173.40111.8E365 G371 K372E365-K369 WeakPolarHBondContact O-CG 3.46Å; E365-K369 PolarHBondContact O-N 3.44Å; K369-G371 PolarHBondContact O-N 3.1Å; K369-K372 PolarHBondContact O-N 2.85Å
370G58.9Low67.4Low64 Ų64103 Ų10366%0.6662%0.615SS**Hα-helixtrans-63.8-23.4175.700000114.6L366L366-G370 PolarHBondContact O-N 3.28Å; L366-G370 VanDerWaalsContact O-N 3.12Å
371G52.5Low64.9Low65 Ų65110.3 Ų110.367%0.6765%0.647SS**THydrogen-bonded Turntrans-84.5-12.5178.700000115.7R367 K369R367-G371 PolarHBondContact O-N 3.48Å; K369-G371 PolarHBondContact O-N 3.1Å
372K49.7Very low62.5Low190 Ų190111.8 Ų111.883%0.82667%0.665SS**THydrogen-bonded Turntrans-93.63.7-178.4-78-172.6175.9-176.80114.5K369 S374K369-K372 PolarHBondContact O-N 2.85Å; K372-S374 PolarHBondContact O-N 3.21Å
373G46.1Very low59.8Low69 Ų69117.7 Ų117.771%0.71168%0.681SS**SBendtrans-83.29.3-177.900000116.8
374S42.8Very low57.6Low109 Ų109117 Ų11776%0.76270%0.702SS**SBendtrans-14240.5-171.8-48.80000115.3K372K372-S374 PolarHBondContact O-N 3.21Å
375R41.2Very low55.1Low238 Ų238124.8 Ų124.890%0.89873%0.728SS**  trans-136.199160.2-75.5-171.1175.3-177.1-2110.3G377R375-G377 PolarHBondContact O-N 2.94Å; R375-G377 VanDerWaalsContact O-N 3.14Å
376P44.6Very low52.7Low128 Ų128124 Ų12483%0.83175%0.745SS**  trans-72.9100.8155.726.2-18.6000106.8G378P376-G378 PolarHBondContact O-N 3.36Å; P376-G378 VanDerWaalsContact O-N 3.16Å
377G45.9Very low50.1Low82 Ų82122.9 Ų122.985%0.84576%0.76SS**  trans-71.196.7160.700000108.2R375R375-G377 PolarHBondContact O-N 2.94Å; R375-G377 VanDerWaalsContact O-N 3.14Å
378G37.7Very low47.9Very low72 Ų72119.9 Ų119.974%0.74277%0.771SS**  trans-114.883.4162.800000107.9P376P376-G378 PolarHBondContact O-N 3.36Å; P376-G378 VanDerWaalsContact O-N 3.16Å
379G39.1Very low45.7Very low69 Ų69126.3 Ų126.371%0.71180%0.795SS**  trans-71.9135.9165.200000108.6E381G379-E381 PolarHBondContact O-N 3.42Å
380P43.6Very low43.9Very low126 Ų126131.3 Ų131.382%0.81882%0.82SS**  trans-69118.8174.526.3-29.9000109.4V382P380-V382 PolarHBondContact O-N 3.14Å
381E41.9Very low43.1Very low174 Ų174134.7 Ų134.781%0.81383%0.828SS**  trans-59.7111.3168.8-167.5178.5-173.500109G379 R383G379-E381 PolarHBondContact O-N 3.42Å; E381-R383 PolarHBondContact O-N 3.29Å
382V43.5Very low42.6Very low141 Ų141138.4 Ų138.486%0.85584%0.837SS**  trans-7094.3173.8177.10000107.9P380 G384P380-V382 PolarHBondContact O-N 3.14Å; V382-G384 PolarHBondContact O-N 3.35Å
383R39.7Very low42.3Very low219 Ų219135.5 Ų135.583%0.82684%0.837SS**  trans-68.7106.4165.5-96.9-175.7177.8-161.5-1.3108.9E381 R385E381-R383 PolarHBondContact O-N 3.29Å; R383-R385 PolarHBondContact O-N 3.37Å
384G46Very low42Very low76 Ų76139.4 Ų139.478%0.78485%0.845SS**  trans-58.2117.3162.700000110.2V382V382-G384 PolarHBondContact O-N 3.35Å
385R41.6Very low42Very low248 Ų248141.3 Ų141.394%0.93685%0.85SS**  trans-93.2112.2161.3-94-173.3175-165-1107.9R383R383-R385 PolarHBondContact O-N 3.37Å
386G44.9Very low42Very low79 Ų79134.9 Ų134.981%0.81485%0.847SS**  trans-77.2157.415600000111.4
387G37.8Very low41.9Very low84 Ų84135.4 Ų135.487%0.86685%0.848SS**  trans118.3117.1178.700000109.8
388G41.3Very low41.5Very low72 Ų72139.5 Ų139.574%0.74285%0.848SS**  cis126.6123.318.500000107.9
389Q42Very low41.9Very low192 Ų192145.1 Ų145.190%0.89786%0.857SS**  trans64.6139.4169.9-59.1173.8-200115.3
390Q41.1Very low42.1Very low261 Ų261152 Ų152100%1.2287%0.87SS**  cis-137.9020.7-71.2174.9-7.700110.8

Retrieved 390 of 390 residues in 116.1 ms (Link to these results)