A0A087XMI4_POEFO Loading...

Ankyrin repeat domain-containing protein 54

Plays an important role in regulating intracellular signaling events associated with erythroid terminal differentiation.

AlphaFold DB , UniProt , Accession A0A087XMI4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 324 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M32.4Very low31.1Very low228 Ų228145 Ų145100%1.12383%0.833SS**  0111.50-67.1170.8107.200107.6
2D34.3Very low30.9Very low155 Ų155142.3 Ų142.383%0.82981%0.814SS**  cis-179.3147.8-16.9-80.3-32000101.5
3G32.5Very low30.8Very low77 Ų77142 Ų14279%0.79481%0.808SS**  trans155.952.516700000116.7
4W32.4Very low30.8Very low257 Ų257145.6 Ų145.697%0.97380%0.803SS**  trans-63.4139.9151.5-74.4-29.2000110.1
5S31.2Very low30.6Very low124 Ų124142.5 Ų142.587%0.86780%0.803SS**  trans-150.5113.6143.3-83.50000110.2
6S30.3Very low30.8Very low114 Ų114141.6 Ų141.680%0.79779%0.794SS**  trans-65141.6161.8-61.70000111
7V30.3Very low30.8Very low134 Ų134140.3 Ų140.381%0.81280%0.797SS**  trans-138.1105143.9155.50000109.4
8V30Very low30.7Very low118 Ų118139 Ų13972%0.71579%0.787SS**  trans46.4109.6130.2-146.10000120.7
9V28.1Very low30.7Very low102 Ų102135.8 Ų135.862%0.61879%0.788SS**  trans30.2123.1130.2-168.50000119.3E11V9-E11 HydrophobicContact CG1-CG 4.34Å
10S30.9Very low30.7Very low130 Ų130136.5 Ų136.591%0.90978%0.783SS**  trans-137.4114.4132.9-74.30000108.8
11E29.6Very low30.7Very low156 Ų156136.2 Ų136.273%0.72979%0.788SS**  trans-74.5160.3170.3-91.9164.5103.700111.9V9V9-E11 HydrophobicContact CG1-CG 4.34Å
12N28.7Very low30.6Very low112 Ų112132.9 Ų132.960%0.59977%0.772SS**  trans78.1130.8163.3-86.426.6000117.4
13D29.6Very low30.6Very low139 Ų139132 Ų13274%0.74377%0.766SS**  cis-138.2131.225-68.5-54.4000110.4
14R30.4Very low30.4Very low193 Ų193132.3 Ų132.373%0.72877%0.77SS**  48.197.274.2-82.3-164.5178.993.7-1.4117
15A28.5Very low30.3Very low98 Ų98130.2 Ų130.281%0.8176%0.763SS**  trans-169.184138.700000107.6
16I33.3Very low30.3Very low128 Ų128128.2 Ų128.266%0.65676%0.762SS**  27.8103.687-50.1-178.7000113.5
17S31.1Very low30.3Very low120 Ų120128 Ų12884%0.83977%0.767SS**  trans-14182148.5-170.50000107.5G19S17-G19 PolarHBondContact O-N 2.69Å
18D28.1Very low30.2Very low117 Ų117125.6 Ų125.663%0.62677%0.769SS**  trans-67.5113.4165.4-64.2-44.6000107.8E20D18-E20 HydrophobicContact CB-CG 4.06Å; D18-E20 PolarHBondContact O-N 3.39Å
19G31.3Very low30.2Very low78 Ų78123.7 Ų123.780%0.80477%0.774SS**  trans-7669.8167.800000109.4S17 C21S17-G19 PolarHBondContact O-N 2.69Å; G19-C21 PolarHBondContact O-N 3.18Å
20E31.3Very low30.2Very low149 Ų149128.3 Ų128.370%0.69679%0.789SS**  trans-64116.8173.9-66.8179.4141.700109.8D18 M22D18-E20 HydrophobicContact CB-CG 4.06Å; D18-E20 PolarHBondContact O-N 3.39Å; E20-M22 HydrophobicContact CB-CG 4.32Å; E20-M22 PolarHBondContact O-N 3.42Å
21C31.3Very low30.1Very low131 Ų131129 Ų12989%0.88579%0.788SS**  trans-72.579.3160.2-760000108.6G19 L23G19-C21 PolarHBondContact O-N 3.18Å; C21-L23 PolarHBondContact O-N 3.22Å
22M28.5Very low30.1Very low158 Ų158132.9 Ų132.978%0.77880%0.796SS**  trans-69.3113.4172.7-91.9-76.3-87.700110.8E20E20-M22 HydrophobicContact CB-CG 4.32Å; E20-M22 PolarHBondContact O-N 3.42Å
23L35.2Very low30.1Very low136 Ų136136.4 Ų136.471%0.71281%0.808SS**  trans-80115166-69167.6000108.6C21 Y25C21-L23 PolarHBondContact O-N 3.22Å; L23-Y25 HydrophobicContact CB-CE2 4.39Å; L23-Y25 PolarHBondContact O-N 3.45Å
24G28.6Very low30Very low84 Ų84134.8 Ų134.887%0.86682%0.815SS**  trans-75.5104.5171.300000110.9
25Y30.3Very low29.9Very low214 Ų214130.7 Ų130.784%0.83982%0.822SS**PPolyproline II helixtrans-83.5118.4161.7-78.4-87.5000109.4L23L23-Y25 HydrophobicContact CB-CE2 4.39Å; L23-Y25 PolarHBondContact O-N 3.45Å
26G29.8Very low29.8Very low82 Ų82129.7 Ų129.785%0.84582%0.821SS**PPolyproline II helixtrans-88.2119.9167.600000110.3
27A31.2Very low29.5Very low108 Ų108128.7 Ų128.789%0.89383%0.832SS**PPolyproline II helixtrans-87.1160.4-175.800000114.1
28G28.3Very low29.4Very low84 Ų84131.1 Ų131.187%0.86683%0.83SS**  trans137.3116154.400000112.1
29G29.3Very low29.8Very low78 Ų78130.5 Ų130.580%0.80483%0.832SS**  cis-178133.3-1.100000106.9
30E28.4Very low29.5Very low200 Ų200137.4 Ų137.494%0.93583%0.834SS**PPolyproline II helixtrans-101.8123.4174.5-71.3179137.700109.1
31T29.3Very low29.3Very low145 Ų145135.2 Ų135.289%0.8984%0.836SS**PPolyproline II helixtrans-100.9124.9162.646.90000108.6
32R29.9Very low29.1Very low236 Ų236134 Ų13489%0.89183%0.828SS**PPolyproline II helixtrans-81141.7175.9-86.5177150.2162.9-6112.7
33E28.1Very low29Very low186 Ų186130.7 Ų130.787%0.86983%0.827SS**  trans37.3127.2145.8-69.1-161.9136.700122.6
34A26.7Very low28.9Very low106 Ų106132.4 Ų132.488%0.87683%0.831SS**  -161.8143.6123.300000111.1
35A28.9Very low28.8Very low106 Ų106138 Ų13888%0.87683%0.826SS**  trans-90.2155.2-176.900000113.8
36G26.4Very low28.7Very low77 Ų77134.9 Ų134.979%0.79482%0.821SS**  trans103.7127.6139.300000119.8
37A27.5Very low29.1Very low108 Ų108138 Ų13889%0.89381%0.813SS**  trans92.9103.2149.900000120.7
38E29.3Very low28.9Very low170 Ų170139.8 Ų139.879%0.79481%0.808SS**  trans-67159137.5-81.4-88158.900109.3
39P36.9Very low29.1Very low104 Ų104144 Ų14468%0.67581%0.809SS**  cis-153169.143.439.8-17.2000119.1
40R24.8Very low29.1Very low223 Ų223143.5 Ų143.584%0.84281%0.805SS**  trans54.6126.3137.3-72.5178.8177.1-173.1-0.5122.7
41S27.6Very low29.4Very low104 Ų104138.8 Ų138.873%0.72780%0.8SS**  115.6139.1120.490.10000119.5
42S25.4Very low29.5Very low104 Ų104140.9 Ų140.973%0.72780%0.8SS**  trans74.7106.6143.3-37.50000117.2
43A28Very low29.5Very low90 Ų90134.5 Ų134.574%0.74480%0.797SS**  85.1140.269.900000113.8
44E31.3Very low29.8Very low171 Ų171130.7 Ų130.780%0.79980%0.798SS**  trans82.2135.9167.5-43.3-167.5164.200114.9
45R28.3Very low30Very low202 Ų202130.3 Ų130.376%0.76279%0.794SS**  cis-169.5131.826.1-156.9159.4178152.9-1.9107
46M27.8Very low30.3Very low149 Ų149130.1 Ų130.173%0.73479%0.793SS**  57130.895-113.5-169.2170.100112.1
47E38.2Very low30.6Very low147 Ų147131.9 Ų131.969%0.68779%0.793SS**  cis-159.3141.719-80.8-166.9167.100106.5
48D26.3Very low31.2Very low146 Ų146134 Ų13478%0.78179%0.794SS**  88.5154.273.7-140.3-1.6000113.8
49L32.2Very low31.4Very low171 Ų171129 Ų12990%0.89579%0.79SS**  trans90.4113.7-171.9-48.6-178.2000115.1
50G29.4Very low31.4Very low69 Ų69134.8 Ų134.871%0.71180%0.804SS**  cis147.8126.45.300000110.4
51A35Very low31.7Very low101 Ų101127.7 Ų127.784%0.83580%0.8SS**  trans68.6142.715800000118.4
52E31.5Very low32.8Very low188 Ų188131 Ų13188%0.87981%0.808SS**  cis-167.7142.79.8-137.2-179.7-170.700109.4
53A30.6Very low33.5Very low102 Ų102131.9 Ų131.984%0.84382%0.815SS**  trans171.3115134.300000111.7
54A33.3Very low33.8Very low106 Ų106131.1 Ų131.188%0.87682%0.816SS**  trans-70.2174.5175.600000112.7
55A31.7Very low34.5Very low98 Ų98131.8 Ų131.881%0.8182%0.822SS**  cis-162.817414.100000105.9
56A33.7Very low34.9Very low103 Ų103125.5 Ų125.585%0.85182%0.82SS**  cis-160.615217.500000108.8
57S34.5Very low35.8Very low113 Ų113128 Ų12879%0.7983%0.831SS**  trans-114151.1-178.253.70000112.2
58V39.8Very low36.1Very low152 Ų152124.6 Ų124.692%0.92184%0.835SS**  trans-151.9119.3151-169.80000104.7
59G33.3Very low36.7Very low67 Ų67127.2 Ų127.269%0.69184%0.839SS**  cis12484.218.300000108.2
60F35.8Very low36.7Very low224 Ų224128.7 Ų128.798%0.98284%0.844SS**  trans-87.6104.5169.5-105.9-89.3000108.4
61G32.9Very low37.1Very low74 Ų74131.1 Ų131.176%0.76385%0.845SS**  trans-94.8116.2176.100000111.4
62I48.7Very low37.1Very low174 Ų174134.9 Ų134.989%0.89285%0.85SS**  trans-93.6121.1152.743.5165.8000107.2
63S40.9Very low37.1Very low123 Ų123129 Ų12986%0.8684%0.839SS**  trans-132.2112.6170-80.50000110.6
64G35.3Very low37.4Very low74 Ų74136 Ų13676%0.76384%0.844SS**  60.297.812200000120
65I45.9Very low37.4Very low184 Ų184137.8 Ų137.894%0.94484%0.844SS**  trans14.8107.3135.5-50.7175.4000117
66G35.4Very low37.4Very low70 Ų70136.7 Ų136.772%0.72284%0.842SS**  trans-152.7135157.700000107.9
67E46.7Very low37.2Very low203 Ų203137.6 Ų137.695%0.94984%0.842SS**SBendtrans-51.1135.3-165.2-65.5173.7139.900115.4
68G44.4Very low37.5Very low75 Ų75141.9 Ų141.977%0.77384%0.841SS**SBendtrans88.1117.2153.800000117.4
69K39.4Very low37.3Very low201 Ų201141.5 Ų141.587%0.87483%0.834SS**  trans62.199.7163.8-86.8178.5170.7175.60117.3V71K69-V71 PolarHBondContact O-N 3.06Å
70M32Very low37.8Very low201 Ų201144.2 Ų144.299%0.9983%0.833SS**  trans-80.3110.8156.2-68.1-178.3-17900109.8
71V38Very low38.2Very low120 Ų120141.9 Ų141.973%0.72782%0.822SS**  trans-114.9106.5166.3175.50000107.1K69 G73K69-V71 PolarHBondContact O-N 3.06Å; V71-G73 PolarHBondContact O-N 3.49Å
72L35.2Very low38.9Very low180 Ų180147 Ų14794%0.94283%0.826SS**  trans-81.193.2163.4-83.2163.4000107.6R74L72-R74 PolarHBondContact O-N 3.19Å
73G31.3Very low38.9Very low64 Ų64146.6 Ų146.666%0.6683%0.825SS**  trans-72119172.800000110.9V71V71-G73 PolarHBondContact O-N 3.49Å
74R37.8Very low39.2Very low249 Ų249151.3 Ų151.394%0.9482%0.824SS**  trans-100.7109.4152.7-160.6-170.2-86.9-159.9-2106.4L72L72-R74 PolarHBondContact O-N 3.19Å
75V32.8Very low39.2Very low145 Ų145157.6 Ų157.688%0.87983%0.826SS**  trans-84126.8-178.81680000110.4
76G32.3Very low38.9Very low74 Ų74157 Ų15776%0.76382%0.824SS**  trans79.3138.4155.400000116.2
77S29.7Very low39.2Very low123 Ų123162.2 Ų162.286%0.8683%0.829SS**  cis-159.1141.6-9.9-179.50000104.8
78R39.5Very low38.9Very low202 Ų202160 Ų16076%0.76282%0.823SS**  trans-86.1118.3-174.4-174.6179.2175.9171.60.8109.2D80R78-D80 IonicContact CZ-OD1 3.55Å; R78-D80 IonicContact NE-OD1 2.8Å; R78-D80 PolarHBondContact NE-OD1 3.43Å; R78-D80 IonicContact NE-OD2 3.69Å; R78-D80 IonicContact NH2-OD1 3.42Å; R78-D80 PolarHBondContact NH2-OD1 3.1Å
79D36.4Very low38.4Very low145 Ų145164.3 Ų164.378%0.77583%0.827SS**  trans-113.8109.4158.4-85.8-29.1000108.6K81D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 PolarHBondContact O-N 3.02Å
80D44.2Very low38.7Very low124 Ų124165.6 Ų165.666%0.66383%0.826SS**  trans-69.973-176.8-67-55.3000112.5R78R78-D80 IonicContact CZ-OD1 3.55Å; R78-D80 IonicContact NE-OD1 2.8Å; R78-D80 PolarHBondContact NE-OD1 3.43Å; R78-D80 IonicContact NE-OD2 3.69Å; R78-D80 IonicContact NH2-OD1 3.42Å; R78-D80 PolarHBondContact NH2-OD1 3.1Å
81K43.9Very low38.7Very low175 Ų175165 Ų16576%0.76182%0.821SS**  trans-123.73.6172-70-178.6-176.1172.30115.1D79 L83D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 PolarHBondContact O-N 3.02Å; K81-L83 PolarHBondContact O-N 3.29Å
82E46.5Very low38.8Very low181 Ų181165 Ų16585%0.84682%0.824SS**  trans-89.812.1-172.4-80-162.2152.900116.7
83L49.9Very low39.3Very low165 Ų165159.9 Ų159.986%0.86481%0.814SS**SBendtrans-119.646.2179.2-68.1170.9000113.7K81K81-L83 PolarHBondContact O-N 3.29Å
84R45.8Very low39.3Very low222 Ų222168.7 Ų168.784%0.83883%0.828SS**SBendtrans-128.5-10.7167.5-77.2-170173.1-139.4-0.7115.6
85Y35.9Very low39.4Very low207 Ų207160.1 Ų160.181%0.81282%0.817SS**G310 helixtrans-87.8-16.1-174.4-77.9-80.6000115
86L40.2Very low39.3Very low171 Ų171162.7 Ų162.790%0.89582%0.819SS**G310 helixtrans-84.2-3.4-179.9-79.5170.9000114.8
87H40.8Very low39.5Very low179 Ų179168.6 Ų168.683%0.82982%0.824SS**G310 helixtrans-106.51.4-176.8-127.494000114.7
88L41Very low39.5Very low158 Ų158170.4 Ų170.483%0.82783%0.825SS**SBendtrans-112.511.1-174.1-140.983.3000114.5
89L33.9Very low39.4Very low164 Ų164166.6 Ų166.686%0.85982%0.824SS**SBendtrans-122.523.4-178.9-144.984.1000113.5
90W45.5Very low38.9Very low228 Ų228166.3 Ų166.386%0.86483%0.827SS**  trans-138.478.7166.4-156.2-75.8000110.4
91E32.6Very low38.3Very low189 Ų189164.6 Ų164.688%0.88383%0.83SS**  trans-126.6120.7149.6-71.9-154.6165.600109.1G93E91-G93 PolarHBondContact O-N 3.11Å
92P39.2Very low37.4Very low120 Ų120165.8 Ų165.878%0.77984%0.839SS**  trans-79.7116.9171.229.8-26.2000109.2
93G46.9Very low37.1Very low72 Ų72162.7 Ų162.774%0.74284%0.837SS**  trans112.491.5160.600000116E91E91-G93 PolarHBondContact O-N 3.11Å
94R30.3Very low36.2Very low249 Ų249159.8 Ų159.894%0.9483%0.83SS**  trans-150110.9141.6-98.3-171.7-154.8-82.3-4.5108.3
95G40.6Very low35.8Very low70 Ų70160.9 Ų160.972%0.72283%0.834SS**  trans-78.6139.1156.300000108.4
96E31.1Very low35.8Very low198 Ų198159.3 Ų159.393%0.92584%0.839SS**  trans-174.6137.7138.5-101.1165.9-163.900108.7
97F35.7Very low35.6Very low198 Ų198154.1 Ų154.187%0.86883%0.827SS**  trans-69.8142.3178.3-84.1-106.7000110.1
98D29Very low35.9Very low161 Ų161155.7 Ų155.786%0.86183%0.831SS**  -168.4153.6126.3-98.8-23.2000114.2
99T37.3Very low36Very low122 Ų122155.7 Ų155.775%0.74883%0.83SS**  trans-70.2149.1-169.252.40000115.3
100V27.5Very low36.6Very low140 Ų140150.8 Ų150.885%0.84881%0.814SS**  164.2141.5118.6166.80000109.6
101A31.3Very low36.6Very low88 Ų88141.6 Ų141.673%0.72779%0.79SS**  trans-65.1145.6-173.200000115.5
102E25.2Very low37.5Very low200 Ų200136.2 Ų136.294%0.93577%0.773SS**  -167.4148.1121.2-114.2178.5170.500113.5
103S39Very low38Very low115 Ų115140 Ų14080%0.80477%0.772SS**  trans-83.4133.3-172.4174.70000111.8
104S31.1Very low38Very low104 Ų104139.3 Ų139.373%0.72776%0.758SS**  trans-175.9123.1134.443.70000115
105R38.5Very low38.9Very low245 Ų245135.7 Ų135.793%0.92575%0.745SS**  trans52.979.9149.2-59-177.1-157.4-140.92.5118.1G107R105-G107 PolarHBondContact O-N 3.33Å
106L34.7Very low39.4Very low175 Ų175140.9 Ų140.992%0.91674%0.743SS**  trans-72.4105156.7-81.2162000110.7
107G37.4Very low39.9Very low61 Ų61138.6 Ų138.663%0.62973%0.732SS**  trans-58.5130.2160.300000110.1R105 I109R105-G107 PolarHBondContact O-N 3.33Å; G107-I109 PolarHBondContact O-N 3.28Å
108K47.1Very low40.2Very low212 Ų212133.2 Ų133.292%0.92271%0.709SS**  trans-64.891.7-175.9-66167.5180172.40110.6
109I41.9Very low41.1Very low159 Ų159135.7 Ų135.782%0.81571%0.706SS**  trans-71129.7164.7-57.3173.4000107.2G107 G111G107-I109 PolarHBondContact O-N 3.28Å; I109-G111 PolarHBondContact O-N 3.44Å
110A47.3Very low41.6Very low61 Ų61134.1 Ų134.150%0.50471%0.706SS.*  trans-47.496.5-169.800000113.6S112 R113A110-S112 PolarHBondContact O-N 3.44Å; A110-R113 PolarHBondContact O-N 3.07Å
111G44.6Very low42.6Very low35 Ų35132.9 Ų132.936%0.36170%0.699SS.*Hα-helixtrans-56.1-11.2170.200000113.1I109 R115I109-G111 PolarHBondContact O-N 3.44Å; G111-R115 WeakPolarHBondContact O-CB 3.31Å; G111-R115 WeakPolarHBondContact O-CD 3.35Å; G111-R115 WeakPolarHBondContact O-CG 3.44Å; G111-R115 PolarHBondContact O-N 3.04Å
112S52.6Low43.4Very low76 Ų76135.9 Ų135.953%0.53169%0.691SS.*Hα-helixtrans-76.3-20.1179.619.10000115.2A110A110-S112 PolarHBondContact O-N 3.44Å
113R48.4Very low44.3Very low200 Ų200133.5 Ų133.576%0.75569%0.685SS**Hα-helixtrans-92.3-43.4172.1-83.4-177179.61570.1112.1A110 R116 H117A110-R113 PolarHBondContact O-N 3.07Å; R113-R116 WeakPolarHBondContact O-CB 3.46Å; R113-R116 PolarHBondContact O-N 3.34Å; R113-R116 VanDerWaalsContact O-N 3.12Å; R113-H117 PolarHBondContact O-N 3.45Å; R113-H117 VanDerWaalsContact O-N 3.14Å
114A46.5Very low44.9Very low56 Ų56131.2 Ų131.246%0.46366%0.663SS.*Hα-helixtrans-65.9-38.7174.800000112.2R116 Q118A114-R116 PolarHBondContact O-N 3.27Å; A114-Q118 WeakPolarHBondContact O-CB 3.44Å; A114-Q118 VanDerWaalsContact O-CG 3.26Å; A114-Q118 WeakPolarHBondContact O-CG 3.41Å; A114-Q118 PolarHBondContact O-N 3.22Å
115R50.4Low45.5Very low173 Ų173132.2 Ų132.265%0.65366%0.66SS**Hα-helixtrans-69.1-20.1172.2-70.5173.4-176.2-160.50.7113.3G111 R119G111-R115 WeakPolarHBondContact O-CB 3.31Å; G111-R115 WeakPolarHBondContact O-CD 3.35Å; G111-R115 WeakPolarHBondContact O-CG 3.44Å; G111-R115 PolarHBondContact O-N 3.04Å; R115-R119 WeakPolarHBondContact O-CB 3.44Å; R115-R119 VanDerWaalsContact O-CG 3.26Å; R115-R119 WeakPolarHBondContact O-CG 3.37Å; R115-R119 PolarHBondContact O-N 3.11Å
116R50.2Low46.4Very low180 Ų180125.6 Ų125.668%0.67965%0.649SS**Hα-helixtrans-78.6-46.6177.2-137.3-178.5-69.8-179.4-7.9110.7R113 A114 R119 A120R113-R116 WeakPolarHBondContact O-CB 3.46Å; R113-R116 PolarHBondContact O-N 3.34Å; R113-R116 VanDerWaalsContact O-N 3.12Å; A114-R116 PolarHBondContact O-N 3.27Å; R116-R119 PolarHBondContact O-N 3.29Å; R116-A120 PolarHBondContact O-N 3.04Å; R116-A120 VanDerWaalsContact O-N 3.14Å
117H43.1Very low47.5Very low150 Ų150123.4 Ų123.469%0.69464%0.637SS**Hα-helixtrans-63.8-42.3169-88.5-78.4000111.8R113 R119 A120 V121R113-H117 PolarHBondContact O-N 3.45Å; R113-H117 VanDerWaalsContact O-N 3.14Å; H117-R119 VanDerWaalsContact C-N 3.34Å; H117-R119 PolarHBondContact O-N 3.22Å; H117-A120 PolarHBondContact O-N 2.98Å; H117-V121 WeakPolarHBondContact O-CG2 3.32Å; H117-V121 PolarHBondContact O-N 2.83Å; H117-V121 VanDerWaalsContact O-N 3.12Å
118Q41.3Very low48.5Very low85 Ų85121.2 Ų121.240%0.39761%0.614SS.*Hα-helixtrans-71.4-21.1175.2-73.3-179.8-16.600113.3A114 R122A114-Q118 WeakPolarHBondContact O-CB 3.44Å; A114-Q118 VanDerWaalsContact O-CG 3.26Å; A114-Q118 WeakPolarHBondContact O-CG 3.41Å; A114-Q118 PolarHBondContact O-N 3.22Å; Q118-R122 HydrophobicContact CB-CG 4.44Å; Q118-R122 WeakPolarHBondContact O-CA 3.47Å; Q118-R122 WeakPolarHBondContact O-CB 3.14Å; Q118-R122 WeakPolarHBondContact O-CD 3.47Å; Q118-R122 WeakPolarHBondContact O-CG 3.49Å; Q118-R122 PolarHBondContact O-N 3.18Å; Q118-R122 VanDerWaalsContact OE1-CZ 3.26Å
119R47.2Very low49.4Very low212 Ų212117 Ų11780%0.860%0.596SS**Hα-helixtrans-76.5-30169.4-90.8-178.1178.5-151.9-0.7112.4R115 R116 H117 V121R115-R119 WeakPolarHBondContact O-CB 3.44Å; R115-R119 VanDerWaalsContact O-CG 3.26Å; R115-R119 WeakPolarHBondContact O-CG 3.37Å; R115-R119 PolarHBondContact O-N 3.11Å; R116-R119 PolarHBondContact O-N 3.29Å; H117-R119 VanDerWaalsContact C-N 3.34Å; H117-R119 PolarHBondContact O-N 3.22Å; R119-V121 VanDerWaalsContact C-N 3.27Å
120A47.8Very low50.8Low89 Ų89114.7 Ų114.774%0.73659%0.585SS**Hα-helixtrans-70.8-26.2171.900000112.1R116 H117R116-A120 PolarHBondContact O-N 3.04Å; R116-A120 VanDerWaalsContact O-N 3.14Å; H117-A120 PolarHBondContact O-N 2.98Å
121V49.1Very low52.2Low115 Ų115117 Ų11770%0.69759%0.588SS**Hα-helixtrans-103.8-22.3-179.2-176.40000113.7H117 R119 N123H117-V121 WeakPolarHBondContact O-CG2 3.32Å; H117-V121 PolarHBondContact O-N 2.83Å; H117-V121 VanDerWaalsContact O-N 3.12Å; R119-V121 VanDerWaalsContact C-N 3.27Å; V121-N123 PolarHBondContact O-N 3.44Å
122R47.4Very low53.9Low151 Ų151121.2 Ų121.257%0.5759%0.594SS**THydrogen-bonded Turntrans-89.795.9174.3-68.5170.9177.6179.1-0.5109.2Q118Q118-R122 HydrophobicContact CB-CG 4.44Å; Q118-R122 WeakPolarHBondContact O-CA 3.47Å; Q118-R122 WeakPolarHBondContact O-CB 3.14Å; Q118-R122 WeakPolarHBondContact O-CD 3.47Å; Q118-R122 WeakPolarHBondContact O-CG 3.49Å; Q118-R122 PolarHBondContact O-N 3.18Å; Q118-R122 VanDerWaalsContact OE1-CZ 3.26Å
123N45.5Very low55.1Low150 Ų150118.5 Ų118.580%0.80258%0.576SS**THydrogen-bonded Turntrans16637.5130.8-79.9-4.9000111.7V121V121-N123 PolarHBondContact O-N 3.44Å
124L50.1Low56.8Low67 Ų67109.3 Ų109.335%0.35154%0.543SS..  trans-134.792.7171.4-61.6171.4000106.4G128 K129 Y132L124-G128 VanDerWaalsContact CD2-C 3.49Å; L124-G128 VanDerWaalsContact CD2-O 3.25Å; L124-G128 WeakPolarHBondContact CD2-O 3.41Å; L124-K129 HydrophobicContact CB-CB 4.35Å; L124-K129 HydrophobicContact CB-CG 3.54Å; L124-K129 WeakPolarHBondContact O-CE 3.27Å; L124-K129 WeakPolarHBondContact O-CG 3.47Å; L124-Y132 HydrophobicContact CD1-CD1 3.94Å; L124-Y132 HydrophobicContact CD1-CD2 4.49Å; L124-Y132 HydrophobicContact CD1-CG 3.73Å
125D45Very low58.7Low125 Ų125111.8 Ų111.867%0.66854%0.543SS*.  trans-48.6164.9158.2-65.8-47.5000109.3I127 G128 K129D125-I127 PolarHBondContact O-N 2.94Å; D125-G128 WeakPolarHBondContact O-CA 3.44Å; D125-G128 PolarHBondContact O-N 3.3Å; D125-K129 PolarHBondContact O-N 3.35Å; D125-K129 VanDerWaalsContact O-N 3.13Å
126P56.9Low60.3Low105 Ų105107.7 Ų107.768%0.68253%0.528SS*.Hα-helixtrans-46-36.4179.1-29.135.3000113.4
127I56.9Low62Low130 Ų13099.2 Ų99.267%0.66750%0.496SS*.Hα-helixtrans-73.1-33.6176.8-63156.9000112.9D125 I131D125-I127 PolarHBondContact O-N 2.94Å; I127-I131 HydrophobicContact CG2-CD1 3.98Å; I127-I131 VanDerWaalsContact O-CD1 3.23Å; I127-I131 WeakPolarHBondContact O-CD1 3.46Å; I127-I131 WeakPolarHBondContact O-CG1 3.35Å
128G59.8Low64.1Low15 Ų1593.7 Ų93.716%0.15547%0.469CS..Hα-helixtrans-74.1-33.5-18000000112.9L124 D125 D130 I131 Y132L124-G128 VanDerWaalsContact CD2-C 3.49Å; L124-G128 VanDerWaalsContact CD2-O 3.25Å; L124-G128 WeakPolarHBondContact CD2-O 3.41Å; D125-G128 WeakPolarHBondContact O-CA 3.44Å; D125-G128 PolarHBondContact O-N 3.3Å; G128-D130 VanDerWaalsContact C-N 3.32Å; G128-D130 PolarHBondContact O-N 3.03Å; G128-I131 PolarHBondContact O-N 3.49Å; G128-Y132 WeakPolarHBondContact O-CB 3.49Å; G128-Y132 PolarHBondContact O-N 3.35Å
129K64.9Low66.2Low124 Ų12494.2 Ų94.254%0.53947%0.472SS..Hα-helixtrans-62.9-44.9-176.3-71.9-178.3-177.2175.60110.4L124 D125 Y132 A133L124-K129 HydrophobicContact CB-CB 4.35Å; L124-K129 HydrophobicContact CB-CG 3.54Å; L124-K129 WeakPolarHBondContact O-CE 3.27Å; L124-K129 WeakPolarHBondContact O-CG 3.47Å; D125-K129 PolarHBondContact O-N 3.35Å; D125-K129 VanDerWaalsContact O-N 3.13Å; K129-Y132 PolarHBondContact O-N 2.7Å; K129-A133 WeakPolarHBondContact O-CB 3.15Å; K129-A133 PolarHBondContact O-N 3.46Å
130D71.4Confident68.1Low110 Ų11084.4 Ų84.459%0.58844%0.435SS*.Hα-helixtrans-68-39.4-178.8-54.3-18.9000110.9G128 A133 A134G128-D130 VanDerWaalsContact C-N 3.32Å; G128-D130 PolarHBondContact O-N 3.03Å; D130-A133 PolarHBondContact O-N 3.31Å; D130-A134 WeakPolarHBondContact O-CB 3.48Å; D130-A134 PolarHBondContact O-N 3.08Å
131I76.7Confident69.8Low110 Ų11080.1 Ų80.156%0.56440%0.4SS*.Hα-helixtrans-63.6-44.5175.6-63.5165.8000111.3I127 G128 K135I127-I131 HydrophobicContact CG2-CD1 3.98Å; I127-I131 VanDerWaalsContact O-CD1 3.23Å; I127-I131 WeakPolarHBondContact O-CD1 3.46Å; I127-I131 WeakPolarHBondContact O-CG1 3.35Å; G128-I131 PolarHBondContact O-N 3.49Å; I131-K135 WeakPolarHBondContact O-CB 3.3Å; I131-K135 PolarHBondContact O-N 3.26Å
132Y80.3Confident71.5Confident122 Ų12278.8 Ų78.848%0.47839%0.389SS..Hα-helixtrans-69.3-40.8178.3-178.8-99.5000111.8L124 G128 K129 K135 R136L124-Y132 HydrophobicContact CD1-CD1 3.94Å; L124-Y132 HydrophobicContact CD1-CD2 4.49Å; L124-Y132 HydrophobicContact CD1-CG 3.73Å; G128-Y132 WeakPolarHBondContact O-CB 3.49Å; G128-Y132 PolarHBondContact O-N 3.35Å; K129-Y132 PolarHBondContact O-N 2.7Å; Y132-K135 WeakPolarHBondContact O-CB 3.47Å; Y132-K135 PolarHBondContact O-N 2.83Å; Y132-R136 WeakPolarHBondContact O-CB 3.41Å; Y132-R136 PolarHBondContact O-N 3.41Å
133A79Confident73.2Confident19 Ų1975.3 Ų75.316%0.15739%0.388CS..Hα-helixtrans-68.2-40.1179.600000111.2K129 D130 R136 L137 I158K129-A133 WeakPolarHBondContact O-CB 3.15Å; K129-A133 PolarHBondContact O-N 3.46Å; D130-A133 PolarHBondContact O-N 3.31Å; A133-R136 PolarHBondContact O-N 2.69Å; A133-L137 WeakPolarHBondContact O-CB 3.5Å; A133-L137 PolarHBondContact O-N 3.18Å; A133-I158 HydrophobicContact CB-CD1 3.47Å; A133-I158 VanDerWaalsContact CB-CD1 3.47Å; A133-I158 HydrophobicContact CB-CG1 4.12Å
134A83.7Confident74.6Confident7 Ų771.2 Ų71.26%0.05837%0.366CS..Hα-helixtrans-62-41.7170.300000112.5D130 R136 L137 R138 A162D130-A134 WeakPolarHBondContact O-CB 3.48Å; D130-A134 PolarHBondContact O-N 3.08Å; A134-R136 VanDerWaalsContact C-N 3.34Å; A134-L137 PolarHBondContact O-N 3.37Å; A134-R138 WeakPolarHBondContact O-CG 3.5Å; A134-R138 PolarHBondContact O-N 2.75Å; A134-A162 HydrophobicContact CB-CB 3.47Å; A134-A162 VanDerWaalsContact CB-CB 3.47Å
135K85.5Confident75.8Confident108 Ų10871.4 Ų71.447%0.4737%0.368SS..Hα-helixtrans-61.1-45173.3-178.3178.2174.6177.80111.2I131 Y132 L137 R138 E139I131-K135 WeakPolarHBondContact O-CB 3.3Å; I131-K135 PolarHBondContact O-N 3.26Å; Y132-K135 WeakPolarHBondContact O-CB 3.47Å; Y132-K135 PolarHBondContact O-N 2.83Å; K135-L137 VanDerWaalsContact C-N 3.35Å; K135-R138 PolarHBondContact O-N 3.07Å; K135-E139 WeakPolarHBondContact CE-OE1 3.45Å; K135-E139 WeakPolarHBondContact O-CG 3.35Å; K135-E139 PolarHBondContact O-N 2.99Å
136R85.6Confident76.8Confident87 Ų8768 Ų6833%0.32835%0.349SS..Hα-helixtrans-64-39.2178-169.7170.2-177.882.7-0.5112.1Y132 A133 A134 R138 E139 A140 E149 L153Y132-R136 WeakPolarHBondContact O-CB 3.41Å; Y132-R136 PolarHBondContact O-N 3.41Å; A133-R136 PolarHBondContact O-N 2.69Å; A134-R136 VanDerWaalsContact C-N 3.34Å; R136-R138 VanDerWaalsContact C-N 3.33Å; R136-R138 PolarHBondContact O-N 2.9Å; R136-E139 PolarHBondContact O-N 3.17Å; R136-A140 WeakPolarHBondContact O-CB 3.31Å; R136-A140 PolarHBondContact O-N 3.42Å; R136-E149 IonicContact CZ-OE1 3.22Å; R136-E149 IonicContact CZ-OE2 3.69Å; R136-E149 IonicContact NE-OE1 2.83Å; R136-E149 IonicContact NE-OE2 3.83Å; R136-E149 PolarHBondContact NE-OE2 3.16Å; R136-E149 IonicContact NH2-OE1 2.75Å; R136-E149 PolarHBondContact NH2-OE1 3.04Å; R136-E149 IonicContact NH2-OE2 2.73Å; R136-E149 PolarHBondContact NH2-OE2 3.35Å; R136-L153 HydrophobicContact CB-CD1 4.38Å; R136-L153 HydrophobicContact CG-CD1 4.05Å
137L85.6Confident77Confident3 Ų367.7 Ų67.72%0.01634%0.342CS..Hα-helixtrans-59-44.8174.2-17968.5000111.2A133 A134 K135 A140 A141 V150 L153 L154 I158 A170 L186A133-L137 WeakPolarHBondContact O-CB 3.5Å; A133-L137 PolarHBondContact O-N 3.18Å; A134-L137 PolarHBondContact O-N 3.37Å; K135-L137 VanDerWaalsContact C-N 3.35Å; L137-A140 PolarHBondContact O-N 3.47Å; L137-A141 WeakPolarHBondContact O-CB 3.44Å; L137-A141 PolarHBondContact O-N 3Å; L137-V150 HydrophobicContact CD1-CB 4.43Å; L137-V150 HydrophobicContact CD1-CG1 3.87Å; L137-L153 HydrophobicContact CB-CD1 4.32Å; L137-L153 HydrophobicContact CD1-CB 4.07Å; L137-L153 HydrophobicContact CD1-CD1 4.42Å; L137-L154 HydrophobicContact CD1-CD2 4.25Å; L137-L154 HydrophobicContact CD1-CG 4.15Å; L137-L154 HydrophobicContact CD2-CD2 4.06Å; L137-I158 HydrophobicContact CD2-CG2 4.17Å; L137-A170 HydrophobicContact CD2-CB 4.12Å; L137-A170 HydrophobicContact CG-CB 3.96Å; L137-L186 HydrophobicContact CD2-CD2 4.42Å
138R87.5Confident77.4Confident33 Ų3365.2 Ų65.213%0.12533%0.333CS..Hα-helixtrans-65-42.8176-68.5-177.6-60.5-118.612.2112.3A134 K135 R136 A141 N142 A162 A163 R168 A170 F173A134-R138 WeakPolarHBondContact O-CG 3.5Å; A134-R138 PolarHBondContact O-N 2.75Å; K135-R138 PolarHBondContact O-N 3.07Å; R136-R138 VanDerWaalsContact C-N 3.33Å; R136-R138 PolarHBondContact O-N 2.9Å; R138-A141 PolarHBondContact O-N 3.32Å; R138-N142 WeakPolarHBondContact O-CB 3.2Å; R138-N142 PolarHBondContact O-N 3.38Å; R138-A162 PolarHBondContact NH1-O 2.84Å; R138-A163 PolarHBondContact NH1-O 3.49Å; R138-R168 WeakPolarHBondContact CD-O 3.49Å; R138-A170 HydrophobicContact CG-CB 4.3Å; R138-F173 HydrophobicContact CB-CD2 4.05Å; R138-F173 HydrophobicContact CB-CE2 4.01Å; R138-F173 HydrophobicContact CG-CD2 4.25Å; R138-F173 HydrophobicContact CG-CE2 4.17Å
139E84.7Confident78Confident97 Ų9767.1 Ų67.145%0.45334%0.338SS..Hα-helixtrans-61.6-43.7176.1-75173.1-175.700111.4K135 R136 N142 S143K135-E139 WeakPolarHBondContact CE-OE1 3.45Å; K135-E139 WeakPolarHBondContact O-CG 3.35Å; K135-E139 PolarHBondContact O-N 2.99Å; R136-E139 PolarHBondContact O-N 3.17Å; E139-N142 CarbonylContact O-C 3.53Å; E139-N142 WeakPolarHBondContact O-CB 3.39Å; E139-N142 PolarHBondContact O-N 3.07Å; E139-N142 VanDerWaalsContact O-N 3.16Å; E139-S143 PolarHBondContact O-N 3.47Å; E139-S143 PolarHBondContact O-OG 3.36Å
140A86Confident78.6Confident5 Ų561.2 Ų61.24%0.04131%0.312CS..Hα-helixtrans-64-41.4176.300000112.4R136 L137 N142 S143 N144 D145 E149 V150R136-A140 WeakPolarHBondContact O-CB 3.31Å; R136-A140 PolarHBondContact O-N 3.42Å; L137-A140 PolarHBondContact O-N 3.47Å; A140-N142 VanDerWaalsContact C-N 3.28Å; A140-N142 PolarHBondContact O-N 3.24Å; A140-S143 PolarHBondContact O-N 2.98Å; A140-S143 PolarHBondContact O-OG 3.24Å; A140-N144 PolarHBondContact O-N 2.97Å; A140-N144 VanDerWaalsContact O-N 3.17Å; A140-D145 PolarHBondContact O-N 3.41Å; A140-E149 HydrophobicContact CB-CB 4.26Å; A140-V150 HydrophobicContact CB-CG2 3.74Å
141A85Confident79Confident0 Ų061.5 Ų61.50%031%0.305CS..Hα-helixtrans-63.4-35.6173.100000112L137 R138 A170 F173 I182L137-A141 WeakPolarHBondContact O-CB 3.44Å; L137-A141 PolarHBondContact O-N 3Å; R138-A141 PolarHBondContact O-N 3.32Å; A141-A170 HydrophobicContact CB-CB 4.09Å; A141-F173 HydrophobicContact CB-CB 4.33Å; A141-I182 HydrophobicContact CB-CG2 4.29Å
142N84.9Confident79.1Confident86 Ų8662.2 Ų62.246%0.4630%0.304SS..Hα-helixtrans-74.4-35.1177.5-171.250.5000113.1R138 E139 A140 N144 F173 N177R138-N142 WeakPolarHBondContact O-CB 3.2Å; R138-N142 PolarHBondContact O-N 3.38Å; E139-N142 CarbonylContact O-C 3.53Å; E139-N142 WeakPolarHBondContact O-CB 3.39Å; E139-N142 PolarHBondContact O-N 3.07Å; E139-N142 VanDerWaalsContact O-N 3.16Å; A140-N142 VanDerWaalsContact C-N 3.28Å; A140-N142 PolarHBondContact O-N 3.24Å; N142-N144 VanDerWaalsContact C-N 3.26Å; N142-N144 PolarHBondContact O-N 3.15Å; N142-F173 HydrophobicContact CB-CB 4.24Å; N142-F173 HydrophobicContact CB-CD1 4.09Å; N142-F173 HydrophobicContact CB-CG 4.28Å; N142-N177 WeakPolarHBondContact CA-ND2 3.26Å; N142-N177 PolarHBondContact O-ND2 2.88Å; N142-N177 PolarHBondContact OD1-ND2 3.09Å
143S82.2Confident79.2Confident79 Ų7957.4 Ų57.455%0.55229%0.286SS*.THydrogen-bonded Turntrans-83.4-0.2176.962.20000113.8E139 A140 D145E139-S143 PolarHBondContact O-N 3.47Å; E139-S143 PolarHBondContact O-OG 3.36Å; A140-S143 PolarHBondContact O-N 2.98Å; A140-S143 PolarHBondContact O-OG 3.24Å; S143-D145 VanDerWaalsContact C-N 3.33Å; S143-D145 PolarHBondContact O-N 2.72Å
144N75.5Confident79.1Confident64 Ų6456.6 Ų56.634%0.34228%0.279SS..THydrogen-bonded Turntrans56.542.8-174.6-163.624.1000113A140 N142 I146 N179A140-N144 PolarHBondContact O-N 2.97Å; A140-N144 VanDerWaalsContact O-N 3.17Å; N142-N144 VanDerWaalsContact C-N 3.26Å; N142-N144 PolarHBondContact O-N 3.15Å; N144-I146 WeakPolarHBondContact O-CG1 3.31Å; N144-I146 PolarHBondContact O-N 2.68Å; N144-I146 VanDerWaalsContact O-N 3.15Å; N144-I146 WeakPolarHBondContact OD1-CD1 3.41Å; N144-I146 WeakPolarHBondContact OD1-CG1 3.32Å; N144-N179 WeakPolarHBondContact CB-ND2 3.31Å; N144-N179 PolarHBondContact ND2-OD1 2.96Å; N144-N179 VanDerWaalsContact ND2-OD1 3.09Å; N144-N179 WeakPolarHBondContact OD1-CB 3.14Å; N144-N179 PolarHBondContact OD1-ND2 2.94Å; N144-N179 PolarHBondContact OD1-OD1 3.39Å
145D75.5Confident78.9Confident71 Ų7161.6 Ų61.638%0.3830%0.301SS..  trans-87.680.8176.2-157-17.9000109.4A140 S143 D147 V150A140-D145 PolarHBondContact O-N 3.41Å; S143-D145 VanDerWaalsContact C-N 3.33Å; S143-D145 PolarHBondContact O-N 2.72Å; D145-D147 PolarHBondContact O-N 2.99Å; D145-V150 WeakPolarHBondContact O-CG2 3.24Å
146I64.9Low78.5Confident53 Ų5362 Ų6227%0.27231%0.309SS..THydrogen-bonded Turntrans-64.4-44.7-153.9-62.1161.2000113.7N144 I182N144-I146 WeakPolarHBondContact O-CG1 3.31Å; N144-I146 PolarHBondContact O-N 2.68Å; N144-I146 VanDerWaalsContact O-N 3.15Å; N144-I146 WeakPolarHBondContact OD1-CD1 3.41Å; N144-I146 WeakPolarHBondContact OD1-CG1 3.32Å; I146-I182 HydrophobicContact CB-CG1 4.37Å; I146-I182 HydrophobicContact CG1-CD1 4.13Å; I146-I182 HydrophobicContact CG1-CG1 4.28Å; I146-I182 HydrophobicContact CG2-CG1 4.2Å
147D60.8Low77.8Confident99 Ų9965.4 Ų65.453%0.52933%0.333SS..THydrogen-bonded Turntrans-117.5-24.7-155.7-77.8-50.6000116.1D145 R151D145-D147 PolarHBondContact O-N 2.99Å; D147-R151 WeakPolarHBondContact O-CB 3.4Å
148T66.9Low77.6Confident78 Ų7866.4 Ų66.448%0.47934%0.338SS..THydrogen-bonded Turntrans-109.3-38.5-173.372.10000113.8K152T148-K152 VanDerWaalsContact O-CB 3.25Å; T148-K152 WeakPolarHBondContact O-CB 3.44Å; T148-K152 WeakPolarHBondContact O-CD 3.29Å; T148-K152 WeakPolarHBondContact O-CE 3.44Å; T148-K152 WeakPolarHBondContact O-CG 3.28Å; T148-K152 PolarHBondContact O-N 2.89Å
149E72.4Confident77.4Confident55 Ų5569.2 Ų69.226%0.25736%0.356SS..Hα-helixtrans-81.8-53.7179.2-77.1-116.9168.900111.5R136 A140 R151 K152 L153R136-E149 IonicContact CZ-OE1 3.22Å; R136-E149 IonicContact CZ-OE2 3.69Å; R136-E149 IonicContact NE-OE1 2.83Å; R136-E149 IonicContact NE-OE2 3.83Å; R136-E149 PolarHBondContact NE-OE2 3.16Å; R136-E149 IonicContact NH2-OE1 2.75Å; R136-E149 PolarHBondContact NH2-OE1 3.04Å; R136-E149 IonicContact NH2-OE2 2.73Å; R136-E149 PolarHBondContact NH2-OE2 3.35Å; A140-E149 HydrophobicContact CB-CB 4.26Å; E149-R151 VanDerWaalsContact C-N 3.33Å; E149-R151 PolarHBondContact O-N 3.23Å; E149-K152 PolarHBondContact O-N 3.48Å; E149-L153 WeakPolarHBondContact O-CB 3.2Å; E149-L153 WeakPolarHBondContact O-CG 3.42Å; E149-L153 PolarHBondContact O-N 3.37Å
150V77Confident77.2Confident0 Ų065.2 Ų65.20%034%0.339CS..Hα-helixtrans-59.2-44.3-179.8178.90000111.2L137 A140 D145 L153 L154 I182 L185L137-V150 HydrophobicContact CD1-CB 4.43Å; L137-V150 HydrophobicContact CD1-CG1 3.87Å; A140-V150 HydrophobicContact CB-CG2 3.74Å; D145-V150 WeakPolarHBondContact O-CG2 3.24Å; V150-L153 PolarHBondContact O-N 3.15Å; V150-L154 HydrophobicContact CG1-CD1 3.85Å; V150-L154 HydrophobicContact CG1-CG 4.45Å; V150-L154 WeakPolarHBondContact O-CB 3.49Å; V150-L154 VanDerWaalsContact O-CG 3.3Å; V150-L154 WeakPolarHBondContact O-CG 3.49Å; V150-L154 PolarHBondContact O-N 3.43Å; V150-I182 HydrophobicContact CG1-CG2 4.31Å; V150-L185 HydrophobicContact CB-CD2 4.46Å; V150-L185 HydrophobicContact CG1-CD2 3.87Å
151R79.9Confident77.2Confident116 Ų11666.5 Ų66.544%0.43835%0.347SS..Hα-helixtrans-63.3-44178.2-177.7-178-79.9-100.60.9112.7D147 E149 Q155 L185D147-R151 WeakPolarHBondContact O-CB 3.4Å; E149-R151 VanDerWaalsContact C-N 3.33Å; E149-R151 PolarHBondContact O-N 3.23Å; R151-Q155 VanDerWaalsContact O-CG 3.3Å; R151-Q155 WeakPolarHBondContact O-CG 3.32Å; R151-Q155 PolarHBondContact O-N 3.32Å; R151-Q155 VanDerWaalsContact O-N 3.12Å; R151-L185 HydrophobicContact CB-CD2 4.19Å
152K79.1Confident77.3Confident125 Ų12567.6 Ų67.654%0.54336%0.356SS..Hα-helixtrans-65.3-44.1178.5-75.9172.5-162.9168.80111T148 E149 L154 Q155 D156T148-K152 VanDerWaalsContact O-CB 3.25Å; T148-K152 WeakPolarHBondContact O-CB 3.44Å; T148-K152 WeakPolarHBondContact O-CD 3.29Å; T148-K152 WeakPolarHBondContact O-CE 3.44Å; T148-K152 WeakPolarHBondContact O-CG 3.28Å; T148-K152 PolarHBondContact O-N 2.89Å; E149-K152 PolarHBondContact O-N 3.48Å; K152-L154 VanDerWaalsContact C-N 3.34Å; K152-L154 PolarHBondContact O-N 2.91Å; K152-Q155 WeakPolarHBondContact O-CB 3.35Å; K152-Q155 PolarHBondContact O-N 2.92Å; K152-Q155 VanDerWaalsContact O-N 3.13Å; K152-D156 PolarHBondContact O-N 3.46Å
153L80.6Confident77.4Confident20 Ų2065.6 Ų65.611%0.10535%0.351CS..Hα-helixtrans-61.4-42.1178.9-72.2171.9000111.5R136 L137 E149 V150 Q155 D156 I158R136-L153 HydrophobicContact CB-CD1 4.38Å; R136-L153 HydrophobicContact CG-CD1 4.05Å; L137-L153 HydrophobicContact CB-CD1 4.32Å; L137-L153 HydrophobicContact CD1-CB 4.07Å; L137-L153 HydrophobicContact CD1-CD1 4.42Å; E149-L153 WeakPolarHBondContact O-CB 3.2Å; E149-L153 WeakPolarHBondContact O-CG 3.42Å; E149-L153 PolarHBondContact O-N 3.37Å; V150-L153 PolarHBondContact O-N 3.15Å; L153-Q155 VanDerWaalsContact C-N 3.31Å; L153-Q155 PolarHBondContact O-N 3.39Å; L153-D156 PolarHBondContact O-N 3.17Å; L153-I158 HydrophobicContact CB-CD1 3.75Å; L153-I158 HydrophobicContact CD2-CD1 3.77Å; L153-I158 HydrophobicContact CG-CD1 4.35Å; L153-I158 WeakPolarHBondContact O-CD1 3.09Å; L153-I158 WeakPolarHBondContact O-CG1 3.49Å
154L78.4Confident77.6Confident2 Ų263.3 Ų63.31%0.0133%0.333CS..Hα-helixtrans-70.7-24.9176.3-68171000113.7L137 V150 K152 D156 P160 L185 L186 Y189L137-L154 HydrophobicContact CD1-CD2 4.25Å; L137-L154 HydrophobicContact CD1-CG 4.15Å; L137-L154 HydrophobicContact CD2-CD2 4.06Å; V150-L154 HydrophobicContact CG1-CD1 3.85Å; V150-L154 HydrophobicContact CG1-CG 4.45Å; V150-L154 WeakPolarHBondContact O-CB 3.49Å; V150-L154 VanDerWaalsContact O-CG 3.3Å; V150-L154 WeakPolarHBondContact O-CG 3.49Å; V150-L154 PolarHBondContact O-N 3.43Å; K152-L154 VanDerWaalsContact C-N 3.34Å; K152-L154 PolarHBondContact O-N 2.91Å; L154-D156 VanDerWaalsContact C-N 3.29Å; L154-P160 HydrophobicContact CD2-CB 4.06Å; L154-L185 HydrophobicContact CD1-CD2 3.92Å; L154-L185 HydrophobicContact CD1-CG 3.77Å; L154-L186 HydrophobicContact CD1-CD2 3.97Å; L154-L186 HydrophobicContact CD2-CD2 4.07Å; L154-Y189 HydrophobicContact CB-CD1 3.86Å; L154-Y189 HydrophobicContact CB-CD2 4.3Å; L154-Y189 HydrophobicContact CB-CE1 3.87Å; L154-Y189 HydrophobicContact CB-CE2 4.32Å; L154-Y189 HydrophobicContact CB-CG 4.08Å; L154-Y189 HydrophobicContact CD1-CD2 4.08Å; L154-Y189 HydrophobicContact CD1-CG 4.25Å; L154-Y189 VanDerWaalsContact O-CE1 3.3Å; L154-Y189 WeakPolarHBondContact O-CE1 3.46Å
155Q78.9Confident78.2Confident112 Ų11268.7 Ų68.752%0.52336%0.362SS..Hα-helixtrans-72.6-22.5172.3-76175.2-17.300113R151 K152 L153 D157R151-Q155 VanDerWaalsContact O-CG 3.3Å; R151-Q155 WeakPolarHBondContact O-CG 3.32Å; R151-Q155 PolarHBondContact O-N 3.32Å; R151-Q155 VanDerWaalsContact O-N 3.12Å; K152-Q155 WeakPolarHBondContact O-CB 3.35Å; K152-Q155 PolarHBondContact O-N 2.92Å; K152-Q155 VanDerWaalsContact O-N 3.13Å; L153-Q155 VanDerWaalsContact C-N 3.31Å; L153-Q155 PolarHBondContact O-N 3.39Å; Q155-D157 PolarHBondContact O-N 3.35Å
156D77.5Confident78.7Confident118 Ų11871 Ų7163%0.63137%0.368SS*.THydrogen-bonded Turntrans-83.325.6178.1-65.9-24.8000112.4K152 L153 L154 I158K152-D156 PolarHBondContact O-N 3.46Å; L153-D156 PolarHBondContact O-N 3.17Å; L154-D156 VanDerWaalsContact C-N 3.29Å; D156-I158 VanDerWaalsContact C-N 3.26Å; D156-I158 HydrophobicContact CB-CG1 4.48Å; D156-I158 PolarHBondContact O-N 2.89Å
157D71.3Confident79.8Confident158 Ų15869.3 Ų69.385%0.84536%0.364SS*.THydrogen-bonded Turntrans54.631.4-179.5-70-37.8000115Q155Q155-D157 PolarHBondContact O-N 3.35Å
158I80.9Confident81.2Confident23 Ų2368.2 Ų68.212%0.11835%0.353CS..  trans-73134.5176.2-61173.5000110.4A133 L137 L153 D156 P160A133-I158 HydrophobicContact CB-CD1 3.47Å; A133-I158 VanDerWaalsContact CB-CD1 3.47Å; A133-I158 HydrophobicContact CB-CG1 4.12Å; L137-I158 HydrophobicContact CD2-CG2 4.17Å; L153-I158 HydrophobicContact CB-CD1 3.75Å; L153-I158 HydrophobicContact CD2-CD1 3.77Å; L153-I158 HydrophobicContact CG-CD1 4.35Å; L153-I158 WeakPolarHBondContact O-CD1 3.09Å; L153-I158 WeakPolarHBondContact O-CG1 3.49Å; D156-I158 VanDerWaalsContact C-N 3.26Å; D156-I158 HydrophobicContact CB-CG1 4.48Å; D156-I158 PolarHBondContact O-N 2.89Å; I158-P160 VanDerWaalsContact O-CD 3.23Å; I158-P160 WeakPolarHBondContact O-CD 3.31Å
159D82.1Confident82.4Confident92 Ų9264.6 Ų64.649%0.49233%0.331SS..  trans-61.9113172.8179.113.2000111.3C161 A162D159-C161 PolarHBondContact O-N 2.96Å; D159-C161 WeakPolarHBondContact OD1-CB 3.4Å; D159-C161 PolarHBondContact OD1-N 3.35Å; D159-A162 HydrophobicContact CB-CB 4.49Å; D159-A162 VanDerWaalsContact O-CB 3.3Å; D159-A162 WeakPolarHBondContact O-CB 3.35Å; D159-A162 PolarHBondContact O-N 3.08Å
160P82.2Confident83.3Confident14 Ų1462 Ų629%0.09132%0.319CS..THydrogen-bonded Turntrans-69.3-16.717931-36.8000113L154 I158 A162 L186 A191L154-P160 HydrophobicContact CD2-CB 4.06Å; I158-P160 VanDerWaalsContact O-CD 3.23Å; I158-P160 WeakPolarHBondContact O-CD 3.31Å; P160-A162 VanDerWaalsContact C-N 3.31Å; P160-L186 HydrophobicContact CB-CD2 4.25Å; P160-A191 HydrophobicContact CB-CB 4.06Å; P160-A191 HydrophobicContact CG-CB 4.4Å
161C85.6Confident84Confident32 Ų3262 Ų6222%0.21632%0.319CS..THydrogen-bonded Turntrans-86.51.4177.5-66.40000113.2D159 A163 T169 D192D159-C161 PolarHBondContact O-N 2.96Å; D159-C161 WeakPolarHBondContact OD1-CB 3.4Å; D159-C161 PolarHBondContact OD1-N 3.35Å; C161-A163 PolarHBondContact O-N 3.32Å; C161-T169 VanDerWaalsContact O-CG2 3.25Å; C161-T169 WeakPolarHBondContact O-CG2 3.44Å; C161-D192 PolarHBondContact SG-N 3.48Å
162A86.1Confident84.6Confident22 Ų2256.6 Ų56.618%0.18230%0.298CS..  trans-62.1111.9-178.700000112.5A134 R138 D159 P160A134-A162 HydrophobicContact CB-CB 3.47Å; A134-A162 VanDerWaalsContact CB-CB 3.47Å; R138-A162 PolarHBondContact NH1-O 2.84Å; D159-A162 HydrophobicContact CB-CB 4.49Å; D159-A162 VanDerWaalsContact O-CB 3.3Å; D159-A162 WeakPolarHBondContact O-CB 3.35Å; D159-A162 PolarHBondContact O-N 3.08Å; P160-A162 VanDerWaalsContact C-N 3.31Å
163A87.9Confident85.2Confident45 Ų4552 Ų5237%0.37228%0.278SS..  trans-89.8152.8-176.800000113.4R138 C161 R168 T169R138-A163 PolarHBondContact NH1-O 3.49Å; C161-A163 PolarHBondContact O-N 3.32Å; A163-R168 CarbonylContact C-O 3.57Å; A163-R168 WeakPolarHBondContact CA-O 3.45Å; A163-T169 HydrophobicContact CB-CG2 4.13Å
164D86.9Confident85.7Confident30 Ų3051 Ų5116%0.1627%0.273CS..  trans-79.3-179.5168.675.1-3.6000111.6K166 G167 R168D164-K166 PolarHBondContact O-N 3.19Å; D164-K166 VanDerWaalsContact OD1-CA 3.24Å; D164-K166 WeakPolarHBondContact OD1-CA 3.38Å; D164-K166 WeakPolarHBondContact OD1-CB 3.4Å; D164-K166 PolarHBondContact OD1-N 3.13Å; D164-G167 PolarHBondContact O-N 3.13Å; D164-G167 PolarHBondContact OD1-N 3.29Å; D164-G167 VanDerWaalsContact OD1-N 3.11Å; D164-R168 PolarHBondContact N-O 3.27Å; D164-R168 WeakPolarHBondContact OD1-CB 3.37Å; D164-R168 PolarHBondContact OD1-N 3.38Å; D164-R168 IonicContact OD1-NE 2.95Å; D164-R168 IonicContact OD2-CZ 3.08Å; D164-R168 VanDerWaalsContact OD2-CZ 3.29Å; D164-R168 IonicContact OD2-NE 2.75Å; D164-R168 PolarHBondContact OD2-NE 2.94Å; D164-R168 IonicContact OD2-NH2 2.82Å; D164-R168 PolarHBondContact OD2-NH2 2.81Å
165D87Confident86.3Confident178 Ų17850.9 Ų50.995%0.95227%0.273SS*.THydrogen-bonded Turntrans-59.7-16.1177.6-54.4-36.9000113.3
166K86.9Confident86.8Confident118 Ų11847.8 Ų47.851%0.51326%0.263SS..THydrogen-bonded Turntrans-99.911.3175.9-59.2-174.5179.9-176.60112.2D164 R168 S198D164-K166 PolarHBondContact O-N 3.19Å; D164-K166 VanDerWaalsContact OD1-CA 3.24Å; D164-K166 WeakPolarHBondContact OD1-CA 3.38Å; D164-K166 WeakPolarHBondContact OD1-CB 3.4Å; D164-K166 PolarHBondContact OD1-N 3.13Å; K166-R168 HydrophobicContact CB-CG 4.29Å; K166-R168 PolarHBondContact O-N 3.4Å; K166-S198 WeakPolarHBondContact O-CB 3.3Å; K166-S198 PolarHBondContact O-N 3.34Å; K166-S198 PolarHBondContact O-OG 3.14Å
167G88.2Confident87.3Confident19 Ų1945 Ų4520%0.19625%0.248CC..SBendtrans73.89.1-179.300000114.4D164 D197D164-G167 PolarHBondContact O-N 3.13Å; D164-G167 PolarHBondContact OD1-N 3.29Å; D164-G167 VanDerWaalsContact OD1-N 3.11Å; G167-D197 WeakPolarHBondContact O-CA 3.4Å
168R89.8Confident88Confident75 Ų7538.5 Ų38.528%0.28322%0.218SC..  trans-89.5126.4-176.3-59177.4-61.7169.65.6110.8R138 A163 D164 K166 H172 F173 D197R138-R168 WeakPolarHBondContact CD-O 3.49Å; A163-R168 CarbonylContact C-O 3.57Å; A163-R168 WeakPolarHBondContact CA-O 3.45Å; D164-R168 PolarHBondContact N-O 3.27Å; D164-R168 WeakPolarHBondContact OD1-CB 3.37Å; D164-R168 PolarHBondContact OD1-N 3.38Å; D164-R168 IonicContact OD1-NE 2.95Å; D164-R168 IonicContact OD2-CZ 3.08Å; D164-R168 VanDerWaalsContact OD2-CZ 3.29Å; D164-R168 IonicContact OD2-NE 2.75Å; D164-R168 PolarHBondContact OD2-NE 2.94Å; D164-R168 IonicContact OD2-NH2 2.82Å; D164-R168 PolarHBondContact OD2-NH2 2.81Å; K166-R168 HydrophobicContact CB-CG 4.29Å; K166-R168 PolarHBondContact O-N 3.4Å; R168-H172 HydrophobicContact CB-CB 4.15Å; R168-F173 HydrophobicContact CB-CE2 3.86Å; R168-F173 HydrophobicContact CB-CZ 4.06Å; R168-F173 VanDerWaalsContact CZ-CZ 3.49Å; R168-D197 HydrophobicContact CG-CB 3.87Å
169T92.3Very high88.4Confident3 Ų338.3 Ų38.32%0.01822%0.217CC..  trans-92.9171.117664.30000111.5C161 A163 L171 H172 F173 Q195C161-T169 VanDerWaalsContact O-CG2 3.25Å; C161-T169 WeakPolarHBondContact O-CG2 3.44Å; A163-T169 HydrophobicContact CB-CG2 4.13Å; T169-L171 PolarHBondContact O-N 3.29Å; T169-L171 PolarHBondContact OG1-N 3.45Å; T169-H172 PolarHBondContact N-ND1 3.44Å; T169-H172 VanDerWaalsContact N-ND1 3.18Å; T169-H172 WeakPolarHBondContact O-CB 3.44Å; T169-H172 PolarHBondContact O-N 2.71Å; T169-H172 PolarHBondContact OG1-ND1 3.28Å; T169-F173 WeakPolarHBondContact O-CD2 3.47Å; T169-F173 PolarHBondContact O-N 3.32Å; T169-Q195 HydrophobicContact CG2-CG 3.77Å
170A90.4Very high88.7Confident1 Ų135.6 Ų35.61%0.00820%0.203CC..Hα-helixtrans-54.8-35.5172.900000111.8L137 R138 A141 H172 F173 S174 L186L137-A170 HydrophobicContact CD2-CB 4.12Å; L137-A170 HydrophobicContact CG-CB 3.96Å; R138-A170 HydrophobicContact CG-CB 4.3Å; A141-A170 HydrophobicContact CB-CB 4.09Å; A170-H172 VanDerWaalsContact C-N 3.33Å; A170-H172 PolarHBondContact O-N 2.78Å; A170-F173 PolarHBondContact O-N 3.04Å; A170-S174 PolarHBondContact O-N 2.98Å; A170-S174 PolarHBondContact O-OG 3.33Å; A170-L186 HydrophobicContact CB-CD1 3.81Å; A170-L186 HydrophobicContact CB-CD2 3.98Å
171L92.8Very high89.1Confident0 Ų038.2 Ų38.20%022%0.222CC..Hα-helixtrans-62.6-37.8177.1-168.162.4000112.1T169 S174 S175 V183 L186 L187 A191 P203 L219T169-L171 PolarHBondContact O-N 3.29Å; T169-L171 PolarHBondContact OG1-N 3.45Å; L171-S174 WeakPolarHBondContact CA-OG 3.25Å; L171-S174 PolarHBondContact O-OG 3.33Å; L171-S174 VanDerWaalsContact O-OG 3.08Å; L171-S175 WeakPolarHBondContact O-CB 3.28Å; L171-S175 PolarHBondContact O-N 3.2Å; L171-S175 PolarHBondContact O-OG 3.09Å; L171-V183 HydrophobicContact CD1-CB 4.32Å; L171-V183 HydrophobicContact CD1-CG1 3.98Å; L171-V183 HydrophobicContact CD1-CG2 4.24Å; L171-L186 HydrophobicContact CB-CD1 4.32Å; L171-L186 HydrophobicContact CD1-CB 4.24Å; L171-L186 HydrophobicContact CD1-CD1 4.3Å; L171-L187 HydrophobicContact CD1-CD2 4.45Å; L171-L187 HydrophobicContact CD1-CG 4.25Å; L171-L187 HydrophobicContact CD2-CD2 3.98Å; L171-A191 HydrophobicContact CD2-CB 4.15Å; L171-P203 HydrophobicContact CB-CG 4.32Å; L171-P203 HydrophobicContact CD2-CB 4.19Å; L171-P203 HydrophobicContact CD2-CG 3.74Å; L171-P203 HydrophobicContact CG-CB 3.96Å; L171-P203 HydrophobicContact CG-CG 3.82Å; L171-L219 HydrophobicContact CD1-CD2 4.29Å; L171-L219 HydrophobicContact CD2-CD2 4.24Å; L171-L219 HydrophobicContact CG-CD2 4.42Å
172H92.6Very high89.3Confident1 Ų136.7 Ų36.71%0.00521%0.211CC..Hα-helixtrans-62.2-45175.3-72.182.7000111.8R168 T169 A170 C176 Q195 N201 L206R168-H172 HydrophobicContact CB-CB 4.15Å; T169-H172 PolarHBondContact N-ND1 3.44Å; T169-H172 VanDerWaalsContact N-ND1 3.18Å; T169-H172 WeakPolarHBondContact O-CB 3.44Å; T169-H172 PolarHBondContact O-N 2.71Å; T169-H172 PolarHBondContact OG1-ND1 3.28Å; A170-H172 VanDerWaalsContact C-N 3.33Å; A170-H172 PolarHBondContact O-N 2.78Å; H172-C176 WeakPolarHBondContact O-CB 3.38Å; H172-C176 PolarHBondContact O-N 2.95Å; H172-Q195 PolarHBondContact CE1-O 3.01Å; H172-Q195 VanDerWaalsContact CE1-O 3.26Å; H172-Q195 PolarHBondContact NE2-O 3.04Å; H172-N201 PolarHBondContact NE2-O 3.48Å; H172-L206 HydrophobicContact CB-CD1 3.61Å; H172-L206 WeakPolarHBondContact O-CD1 3.46Å
173F90.8Very high89.5Confident28 Ų2835.6 Ų35.612%0.12320%0.203CC..Hα-helixtrans-67.2-47.8179.3-67.6-76000111.8R138 A141 N142 R168 T169 A170 S175 C176 N177R138-F173 HydrophobicContact CB-CD2 4.05Å; R138-F173 HydrophobicContact CB-CE2 4.01Å; R138-F173 HydrophobicContact CG-CD2 4.25Å; R138-F173 HydrophobicContact CG-CE2 4.17Å; A141-F173 HydrophobicContact CB-CB 4.33Å; N142-F173 HydrophobicContact CB-CB 4.24Å; N142-F173 HydrophobicContact CB-CD1 4.09Å; N142-F173 HydrophobicContact CB-CG 4.28Å; R168-F173 HydrophobicContact CB-CE2 3.86Å; R168-F173 HydrophobicContact CB-CZ 4.06Å; R168-F173 VanDerWaalsContact CZ-CZ 3.49Å; T169-F173 WeakPolarHBondContact O-CD2 3.47Å; T169-F173 PolarHBondContact O-N 3.32Å; A170-F173 PolarHBondContact O-N 3.04Å; F173-S175 VanDerWaalsContact C-N 3.26Å; F173-S175 PolarHBondContact O-N 2.73Å; F173-C176 PolarHBondContact O-N 2.96Å; F173-N177 WeakPolarHBondContact O-CB 3.28Å; F173-N177 PolarHBondContact O-N 2.93Å
174S91.1Very high89.7Confident0 Ų038.4 Ų38.40%021%0.208CC..Hα-helixtrans-62.9-35.3178.258.70000112.2A170 L171 N177 G178 N179 V183A170-S174 PolarHBondContact O-N 2.98Å; A170-S174 PolarHBondContact O-OG 3.33Å; L171-S174 WeakPolarHBondContact CA-OG 3.25Å; L171-S174 PolarHBondContact O-OG 3.33Å; L171-S174 VanDerWaalsContact O-OG 3.08Å; S174-N177 PolarHBondContact O-N 3.41Å; S174-G178 PolarHBondContact O-N 2.98Å; S174-G178 VanDerWaalsContact O-N 3.07Å; S174-N179 PolarHBondContact O-N 3.31Å; S174-V183 WeakPolarHBondContact OG-CG2 3.37Å
175S91.3Very high89.8Confident0 Ų038 Ų380%021%0.206CC..Hα-helixtrans-70.7-39.4176.5-69.40000113L171 F173 N177 G178 P203L171-S175 WeakPolarHBondContact O-CB 3.28Å; L171-S175 PolarHBondContact O-N 3.2Å; L171-S175 PolarHBondContact O-OG 3.09Å; F173-S175 VanDerWaalsContact C-N 3.26Å; F173-S175 PolarHBondContact O-N 2.73Å; S175-N177 VanDerWaalsContact C-N 3.31Å; S175-N177 PolarHBondContact O-N 3.16Å; S175-G178 PolarHBondContact O-N 3.29Å; S175-P203 WeakPolarHBondContact CB-O 3.25Å
176C89.6Confident90Very high46 Ų4629.6 Ų29.631%0.31116%0.161SC..Hα-helixtrans-63.1-39.2174.2-171.40000111.8H172 F173 L206 T210 H212H172-C176 WeakPolarHBondContact O-CB 3.38Å; H172-C176 PolarHBondContact O-N 2.95Å; F173-C176 PolarHBondContact O-N 2.96Å; C176-L206 HydrophobicContact CB-CB 4.27Å; C176-L206 HydrophobicContact CB-CD1 4.46Å; C176-T210 WeakPolarHBondContact O-CB 3.44Å; C176-T210 WeakPolarHBondContact O-CG2 3.49Å; C176-T210 PolarHBondContact O-OG1 2.77Å; C176-H212 PolarHBondContact O-CD2 3.25Å; C176-H212 VanDerWaalsContact O-CD2 3.31Å; C176-H212 PolarHBondContact O-NE2 3.43Å
177N88.1Confident90.2Very high59 Ų5925.1 Ų25.132%0.31614%0.142SC..Hα-helixtrans-84.1-10.7-177.2-69-14.6000114.4N142 F173 S174 S175 N179N142-N177 WeakPolarHBondContact CA-ND2 3.26Å; N142-N177 PolarHBondContact O-ND2 2.88Å; N142-N177 PolarHBondContact OD1-ND2 3.09Å; F173-N177 WeakPolarHBondContact O-CB 3.28Å; F173-N177 PolarHBondContact O-N 2.93Å; S174-N177 PolarHBondContact O-N 3.41Å; S175-N177 VanDerWaalsContact C-N 3.31Å; S175-N177 PolarHBondContact O-N 3.16Å; N177-N179 WeakPolarHBondContact CB-ND2 3.44Å
178G86Confident90.3Very high22 Ų2228.4 Ų28.423%0.22716%0.162CC..THydrogen-bonded Turntrans82.518.4177.700000115.1S174 S175 D180 H212S174-G178 PolarHBondContact O-N 2.98Å; S174-G178 VanDerWaalsContact O-N 3.07Å; S175-G178 PolarHBondContact O-N 3.29Å; G178-D180 PolarHBondContact O-N 3.26Å; G178-D180 VanDerWaalsContact O-N 3.08Å; G178-H212 WeakPolarHBondContact CA-CD2 3.36Å; G178-H212 PolarHBondContact N-CD2 3.01Å; G178-H212 PolarHBondContact N-NE2 3.24Å
179N88.1Confident90.2Very high19 Ų1929.5 Ų29.510%0.10217%0.167CC..  trans-86.482.4-173.1-58.9-32000111N144 S174 N177 S181 I182 V183N144-N179 WeakPolarHBondContact CB-ND2 3.31Å; N144-N179 PolarHBondContact ND2-OD1 2.96Å; N144-N179 VanDerWaalsContact ND2-OD1 3.09Å; N144-N179 WeakPolarHBondContact OD1-CB 3.14Å; N144-N179 PolarHBondContact OD1-ND2 2.94Å; N144-N179 PolarHBondContact OD1-OD1 3.39Å; S174-N179 PolarHBondContact O-N 3.31Å; N177-N179 WeakPolarHBondContact CB-ND2 3.44Å; N179-S181 VanDerWaalsContact C-N 3.3Å; N179-S181 PolarHBondContact O-N 3.46Å; N179-I182 HydrophobicContact CB-CB 4.18Å; N179-I182 HydrophobicContact CB-CD1 3.96Å; N179-I182 HydrophobicContact CB-CG1 4.22Å; N179-I182 PolarHBondContact O-N 2.97Å; N179-I182 VanDerWaalsContact O-N 3.16Å; N179-V183 WeakPolarHBondContact O-CG2 3.41Å; N179-V183 PolarHBondContact O-N 3.45Å
180D89.1Confident89.9Confident35 Ų3532 Ų3219%0.18719%0.194CC..Hα-helixtrans-57.7-39.2-175.9-17155.4000113.3G178 I182 V183 Q184 P214 V215 T218G178-D180 PolarHBondContact O-N 3.26Å; G178-D180 VanDerWaalsContact O-N 3.08Å; D180-I182 PolarHBondContact O-N 3.07Å; D180-V183 WeakPolarHBondContact O-CB 3.16Å; D180-V183 PolarHBondContact O-N 3.22Å; D180-Q184 WeakPolarHBondContact O-CG 3.42Å; D180-Q184 PolarHBondContact O-N 2.97Å; D180-Q184 PolarHBondContact OD2-NE2 3.2Å; D180-P214 HydrophobicContact CB-CB 4.02Å; D180-V215 HydrophobicContact CB-CG2 4.23Å; D180-T218 VanDerWaalsContact OD1-CB 3.31Å; D180-T218 WeakPolarHBondContact OD1-CB 3.44Å; D180-T218 PolarHBondContact OD1-OG1 3.48Å
181S89.9Confident89.9Confident69 Ų6932.2 Ų32.248%0.48320%0.196SC..Hα-helixtrans-59.3-43.3177-52.80000112.9N179 L185N179-S181 VanDerWaalsContact C-N 3.3Å; N179-S181 PolarHBondContact O-N 3.46Å; S181-L185 WeakPolarHBondContact O-CB 3.49Å; S181-L185 PolarHBondContact O-N 2.9Å
182I89.4Confident89.9Confident0 Ų035.3 Ų35.30%021%0.212CC..Hα-helixtrans-69.7-40178.4-63.4175.9000110A141 I146 V150 N179 D180 L185 L186A141-I182 HydrophobicContact CB-CG2 4.29Å; I146-I182 HydrophobicContact CB-CG1 4.37Å; I146-I182 HydrophobicContact CG1-CD1 4.13Å; I146-I182 HydrophobicContact CG1-CG1 4.28Å; I146-I182 HydrophobicContact CG2-CG1 4.2Å; V150-I182 HydrophobicContact CG1-CG2 4.31Å; N179-I182 HydrophobicContact CB-CB 4.18Å; N179-I182 HydrophobicContact CB-CD1 3.96Å; N179-I182 HydrophobicContact CB-CG1 4.22Å; N179-I182 PolarHBondContact O-N 2.97Å; N179-I182 VanDerWaalsContact O-N 3.16Å; D180-I182 PolarHBondContact O-N 3.07Å; I182-L185 PolarHBondContact O-N 3.44Å; I182-L186 HydrophobicContact CG2-CD1 3.76Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 WeakPolarHBondContact O-CB 3.31Å; I182-L186 VanDerWaalsContact O-CG 3.3Å; I182-L186 WeakPolarHBondContact O-CG 3.35Å; I182-L186 PolarHBondContact O-N 2.92Å
183V91.5Very high89.8Confident0 Ų035.9 Ų35.90%022%0.216CC..Hα-helixtrans-60.4-50176.7169.40000110.6L171 S174 N179 D180 L185 L186 L187 V215 T218 L219L171-V183 HydrophobicContact CD1-CB 4.32Å; L171-V183 HydrophobicContact CD1-CG1 3.98Å; L171-V183 HydrophobicContact CD1-CG2 4.24Å; S174-V183 WeakPolarHBondContact OG-CG2 3.37Å; N179-V183 WeakPolarHBondContact O-CG2 3.41Å; N179-V183 PolarHBondContact O-N 3.45Å; D180-V183 WeakPolarHBondContact O-CB 3.16Å; D180-V183 PolarHBondContact O-N 3.22Å; V183-L185 VanDerWaalsContact C-N 3.3Å; V183-L185 PolarHBondContact O-N 2.93Å; V183-L186 PolarHBondContact O-N 3.27Å; V183-L187 HydrophobicContact CG1-CD1 3.61Å; V183-L187 HydrophobicContact CG1-CG 4.47Å; V183-L187 WeakPolarHBondContact O-CB 3.5Å; V183-L187 WeakPolarHBondContact O-CD1 3.41Å; V183-L187 WeakPolarHBondContact O-CG 3.33Å; V183-L187 PolarHBondContact O-N 3.2Å; V183-V215 HydrophobicContact CG1-CG1 4.44Å; V183-V215 HydrophobicContact CG2-CG1 4.04Å; V183-V215 HydrophobicContact CG2-CG2 4.1Å; V183-T218 HydrophobicContact CG1-CG2 3.92Å; V183-L219 HydrophobicContact CG1-CD2 4.16Å; V183-L219 HydrophobicContact CG1-CG 4.29Å
184Q91.8Very high89.8Confident104 Ų10436.5 Ų36.549%0.48622%0.22SC..Hα-helixtrans-58-43.8175.8-71.2-176.828.500111.8D180 L187 S188 T218D180-Q184 WeakPolarHBondContact O-CG 3.42Å; D180-Q184 PolarHBondContact O-N 2.97Å; D180-Q184 PolarHBondContact OD2-NE2 3.2Å; Q184-L187 PolarHBondContact O-N 3.24Å; Q184-S188 WeakPolarHBondContact O-CB 3.39Å; Q184-S188 PolarHBondContact O-N 3.17Å; Q184-S188 PolarHBondContact O-OG 3.45Å; Q184-T218 HydrophobicContact CG-CG2 3.55Å
185L89.8Confident89.8Confident22 Ų2239.7 Ų39.712%0.11524%0.235CC..Hα-helixtrans-62-52.6179.1-173.265.7000110.9V150 R151 L154 S181 I182 V183 L187 S188 Y189V150-L185 HydrophobicContact CB-CD2 4.46Å; V150-L185 HydrophobicContact CG1-CD2 3.87Å; R151-L185 HydrophobicContact CB-CD2 4.19Å; L154-L185 HydrophobicContact CD1-CD2 3.92Å; L154-L185 HydrophobicContact CD1-CG 3.77Å; S181-L185 WeakPolarHBondContact O-CB 3.49Å; S181-L185 PolarHBondContact O-N 2.9Å; I182-L185 PolarHBondContact O-N 3.44Å; V183-L185 VanDerWaalsContact C-N 3.3Å; V183-L185 PolarHBondContact O-N 2.93Å; L185-L187 VanDerWaalsContact C-N 3.3Å; L185-L187 PolarHBondContact O-N 3.34Å; L185-S188 PolarHBondContact O-N 3.06Å; L185-S188 VanDerWaalsContact O-N 3.11Å; L185-S188 PolarHBondContact O-OG 3.42Å; L185-Y189 HydrophobicContact CD1-CD2 4.12Å; L185-Y189 HydrophobicContact CD1-CE2 3.71Å; L185-Y189 HydrophobicContact CG-CD2 4.44Å; L185-Y189 HydrophobicContact CG-CE2 4.4Å; L185-Y189 WeakPolarHBondContact O-CD2 3.39Å; L185-Y189 PolarHBondContact O-N 2.96Å
186L89.8Confident89.9Confident0 Ų045.8 Ų45.80%026%0.258CS..Hα-helixtrans-58-42.1179.1-71.5168.7000112.2L137 L154 P160 A170 L171 I182 V183 S188 Y189 G190 A191L137-L186 HydrophobicContact CD2-CD2 4.42Å; L154-L186 HydrophobicContact CD1-CD2 3.97Å; L154-L186 HydrophobicContact CD2-CD2 4.07Å; P160-L186 HydrophobicContact CB-CD2 4.25Å; A170-L186 HydrophobicContact CB-CD1 3.81Å; A170-L186 HydrophobicContact CB-CD2 3.98Å; L171-L186 HydrophobicContact CB-CD1 4.32Å; L171-L186 HydrophobicContact CD1-CB 4.24Å; L171-L186 HydrophobicContact CD1-CD1 4.3Å; I182-L186 HydrophobicContact CG2-CD1 3.76Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 WeakPolarHBondContact O-CB 3.31Å; I182-L186 VanDerWaalsContact O-CG 3.3Å; I182-L186 WeakPolarHBondContact O-CG 3.35Å; I182-L186 PolarHBondContact O-N 2.92Å; V183-L186 PolarHBondContact O-N 3.27Å; L186-S188 PolarHBondContact O-N 3.23Å; L186-Y189 PolarHBondContact O-N 3.37Å; L186-G190 PolarHBondContact O-N 3.42Å; L186-A191 HydrophobicContact CB-CB 4.02Å; L186-A191 WeakPolarHBondContact O-CB 3.35Å; L186-A191 PolarHBondContact O-N 2.65Å
187L91.2Very high90Very high25 Ų2544.4 Ų44.413%0.13125%0.248CC..Hα-helixtrans-65.6-37.5177.6-68.1164.5000112.1L171 V183 Q184 L185 Y189 G190 P193 T218 L219 S222L171-L187 HydrophobicContact CD1-CD2 4.45Å; L171-L187 HydrophobicContact CD1-CG 4.25Å; L171-L187 HydrophobicContact CD2-CD2 3.98Å; V183-L187 HydrophobicContact CG1-CD1 3.61Å; V183-L187 HydrophobicContact CG1-CG 4.47Å; V183-L187 WeakPolarHBondContact O-CB 3.5Å; V183-L187 WeakPolarHBondContact O-CD1 3.41Å; V183-L187 WeakPolarHBondContact O-CG 3.33Å; V183-L187 PolarHBondContact O-N 3.2Å; Q184-L187 PolarHBondContact O-N 3.24Å; L185-L187 VanDerWaalsContact C-N 3.3Å; L185-L187 PolarHBondContact O-N 3.34Å; L187-Y189 PolarHBondContact O-N 3.28Å; L187-G190 PolarHBondContact O-N 3.39Å; L187-P193 HydrophobicContact CD2-CB 3.98Å; L187-P193 HydrophobicContact CD2-CG 4.4Å; L187-T218 HydrophobicContact CD1-CG2 3.85Å; L187-L219 HydrophobicContact CD1-CD2 4.28Å; L187-S222 WeakPolarHBondContact CD1-OG 3.49Å
188S90.1Very high90.1Very high88 Ų8843.7 Ų43.762%0.61525%0.247SC*.Hα-helixtrans-67-24.3175.868.40000113.9Q184 L185 L186 G190Q184-S188 WeakPolarHBondContact O-CB 3.39Å; Q184-S188 PolarHBondContact O-N 3.17Å; Q184-S188 PolarHBondContact O-OG 3.45Å; L185-S188 PolarHBondContact O-N 3.06Å; L185-S188 VanDerWaalsContact O-N 3.11Å; L185-S188 PolarHBondContact O-OG 3.42Å; L186-S188 PolarHBondContact O-N 3.23Å; S188-G190 VanDerWaalsContact C-N 3.31Å
189Y88Confident90.3Very high97 Ų9747.5 Ų47.538%0.3826%0.262SS..THydrogen-bonded Turntrans-89.98.3172.2-79.4-101.8000112.9L154 L185 L186 L187L154-Y189 HydrophobicContact CB-CD1 3.86Å; L154-Y189 HydrophobicContact CB-CD2 4.3Å; L154-Y189 HydrophobicContact CB-CE1 3.87Å; L154-Y189 HydrophobicContact CB-CE2 4.32Å; L154-Y189 HydrophobicContact CB-CG 4.08Å; L154-Y189 HydrophobicContact CD1-CD2 4.08Å; L154-Y189 HydrophobicContact CD1-CG 4.25Å; L154-Y189 VanDerWaalsContact O-CE1 3.3Å; L154-Y189 WeakPolarHBondContact O-CE1 3.46Å; L185-Y189 HydrophobicContact CD1-CD2 4.12Å; L185-Y189 HydrophobicContact CD1-CE2 3.71Å; L185-Y189 HydrophobicContact CG-CD2 4.44Å; L185-Y189 HydrophobicContact CG-CE2 4.4Å; L185-Y189 WeakPolarHBondContact O-CD2 3.39Å; L185-Y189 PolarHBondContact O-N 2.96Å; L186-Y189 PolarHBondContact O-N 3.37Å; L187-Y189 PolarHBondContact O-N 3.28Å
190G86.9Confident90.4Very high56 Ų5647 Ų4758%0.57726%0.262SS*.THydrogen-bonded Turntrans89.820.417300000115.3L186 L187 S188 D192L186-G190 PolarHBondContact O-N 3.42Å; L187-G190 PolarHBondContact O-N 3.39Å; S188-G190 VanDerWaalsContact C-N 3.31Å; G190-D192 PolarHBondContact O-N 3.43Å
191A90.5Very high90.5Very high6 Ų646 Ų465%0.0526%0.256CS..  trans-58.1135.7170.400000111.3P160 L171 L186 P193P160-A191 HydrophobicContact CB-CB 4.06Å; P160-A191 HydrophobicContact CG-CB 4.4Å; L171-A191 HydrophobicContact CD2-CB 4.15Å; L186-A191 HydrophobicContact CB-CB 4.02Å; L186-A191 WeakPolarHBondContact O-CB 3.35Å; L186-A191 PolarHBondContact O-N 2.65Å; A191-P193 VanDerWaalsContact O-CD 3.26Å; A191-P193 WeakPolarHBondContact O-CD 3.3Å
192D91.5Very high90.7Very high64 Ų6442.7 Ų42.734%0.34223%0.233SC..  trans-76.3114.8175.9-1798.2000111.1C161 G190 N194 Q195C161-D192 PolarHBondContact SG-N 3.48Å; G190-D192 PolarHBondContact O-N 3.43Å; D192-N194 PolarHBondContact O-N 3.5Å; D192-N194 WeakPolarHBondContact OD1-CB 3.5Å; D192-N194 PolarHBondContact OD1-N 2.91Å; D192-Q195 HydrophobicContact CB-CB 4.31Å; D192-Q195 PolarHBondContact O-N 3.19Å
193P91.7Very high90.8Very high14 Ų1442.7 Ų42.79%0.09123%0.233CC..THydrogen-bonded Turntrans-68.8-11.417729.8-35.9000113.9L187 A191 P203 L219 A224L187-P193 HydrophobicContact CD2-CB 3.98Å; L187-P193 HydrophobicContact CD2-CG 4.4Å; A191-P193 VanDerWaalsContact O-CD 3.26Å; A191-P193 WeakPolarHBondContact O-CD 3.3Å; P193-P203 WeakPolarHBondContact O-CD 3.49Å; P193-L219 HydrophobicContact CB-CD2 4.25Å; P193-A224 HydrophobicContact CB-CB 4.11Å
194N91.1Very high90.8Very high40 Ų4042.8 Ų42.821%0.21423%0.234CC..THydrogen-bonded Turntrans-106.12.3-177.5-63.8-58.8000113.7D192 R196 G223 A224 R225D192-N194 PolarHBondContact O-N 3.5Å; D192-N194 WeakPolarHBondContact OD1-CB 3.5Å; D192-N194 PolarHBondContact OD1-N 2.91Å; N194-R196 PolarHBondContact O-N 3.33Å; N194-G223 PolarHBondContact ND2-O 3.49Å; N194-G223 VanDerWaalsContact ND2-O 3.11Å; N194-A224 WeakPolarHBondContact OD1-CA 3.41Å; N194-R225 VanDerWaalsContact OD1-CB 3.31Å; N194-R225 WeakPolarHBondContact OD1-CB 3.46Å; N194-R225 WeakPolarHBondContact OD1-CG 3.39Å; N194-R225 PolarHBondContact OD1-N 3.28Å
195Q91.3Very high90.7Very high67 Ų6737.9 Ų37.931%0.31321%0.211SC..  trans-55.9132.1177.9-176.258.854.200109.9T169 H172 D192 T202 P203T169-Q195 HydrophobicContact CG2-CG 3.77Å; H172-Q195 PolarHBondContact CE1-O 3.01Å; H172-Q195 VanDerWaalsContact CE1-O 3.26Å; H172-Q195 PolarHBondContact NE2-O 3.04Å; D192-Q195 HydrophobicContact CB-CB 4.31Å; D192-Q195 PolarHBondContact O-N 3.19Å; Q195-T202 WeakPolarHBondContact O-CA 3.33Å; Q195-P203 VanDerWaalsContact O-CD 3.25Å; Q195-P203 WeakPolarHBondContact O-CD 3.26Å
196R92.2Very high90.7Very high128 Ų12838.3 Ų38.348%0.48321%0.213SC..  trans-99.3138.2179.3-66.6-177.4178.8-173.9-3.6111N194 N201 T202N194-R196 PolarHBondContact O-N 3.33Å; R196-N201 CarbonylContact C-O 3.58Å; R196-N201 WeakPolarHBondContact CA-O 3.25Å; R196-T202 HydrophobicContact CG-CG2 3.98Å
197D92.2Very high90.7Very high17 Ų1738.3 Ų38.39%0.09121%0.213CC..  trans-79.9-179.7168.6782.1000112.2G167 R168 L199 G200 N201G167-D197 WeakPolarHBondContact O-CA 3.4Å; R168-D197 HydrophobicContact CG-CB 3.87Å; D197-L199 PolarHBondContact O-N 3.18Å; D197-L199 VanDerWaalsContact O-N 3.16Å; D197-L199 VanDerWaalsContact OD1-CA 3.29Å; D197-L199 WeakPolarHBondContact OD1-CA 3.42Å; D197-L199 WeakPolarHBondContact OD1-CB 3.44Å; D197-L199 PolarHBondContact OD1-N 3.07Å; D197-G200 PolarHBondContact O-N 2.85Å; D197-G200 PolarHBondContact OD1-N 3.11Å; D197-N201 PolarHBondContact N-O 2.83Å; D197-N201 WeakPolarHBondContact OD1-CB 3.29Å; D197-N201 PolarHBondContact OD1-N 3.21Å; D197-N201 PolarHBondContact OD2-ND2 3.46Å
198S90.6Very high90.4Very high44 Ų4437.1 Ų37.131%0.30821%0.207SC..THydrogen-bonded Turntrans-62.1-16.817757.60000114.2K166 R231K166-S198 WeakPolarHBondContact O-CB 3.3Å; K166-S198 PolarHBondContact O-N 3.34Å; K166-S198 PolarHBondContact O-OG 3.14Å; S198-R231 WeakPolarHBondContact O-CD 3.26Å; S198-R231 PolarHBondContact O-NE 3.39Å; S198-R231 PolarHBondContact O-NH1 2.91Å; S198-R231 PolarHBondContact O-NH2 3.08Å; S198-R231 VanDerWaalsContact O-NH2 3.16Å
199L89.3Confident90.1Very high102 Ų10235.1 Ų35.153%0.53419%0.193SC..THydrogen-bonded Turntrans-95.92.5173.2-63.2178.5000112.1D197 N201 R231D197-L199 PolarHBondContact O-N 3.18Å; D197-L199 VanDerWaalsContact O-N 3.16Å; D197-L199 VanDerWaalsContact OD1-CA 3.29Å; D197-L199 WeakPolarHBondContact OD1-CA 3.42Å; D197-L199 WeakPolarHBondContact OD1-CB 3.44Å; D197-L199 PolarHBondContact OD1-N 3.07Å; L199-N201 WeakPolarHBondContact CB-ND2 3.34Å; L199-N201 PolarHBondContact O-N 2.8Å; L199-R231 VanDerWaalsContact O-CB 3.26Å; L199-R231 WeakPolarHBondContact O-CB 3.49Å; L199-R231 VanDerWaalsContact O-CG 3.3Å; L199-R231 WeakPolarHBondContact O-CG 3.42Å; L199-R231 PolarHBondContact O-N 3.25Å
200G90.1Very high89.8Confident9 Ų932.9 Ų32.99%0.09319%0.189CC..SBendtrans77.24.7-174.400000113.4D197D197-G200 PolarHBondContact O-N 2.85Å; D197-G200 PolarHBondContact OD1-N 3.11Å
201N91.9Very high89.4Confident13 Ų1332 Ų327%0.0717%0.171CC..  trans-71.6140177.1-60.9-48.2000109.5H172 R196 D197 L199 H205 L206H172-N201 PolarHBondContact NE2-O 3.48Å; R196-N201 CarbonylContact C-O 3.58Å; R196-N201 WeakPolarHBondContact CA-O 3.25Å; D197-N201 PolarHBondContact N-O 2.83Å; D197-N201 WeakPolarHBondContact OD1-CB 3.29Å; D197-N201 PolarHBondContact OD1-N 3.21Å; D197-N201 PolarHBondContact OD2-ND2 3.46Å; L199-N201 WeakPolarHBondContact CB-ND2 3.34Å; L199-N201 PolarHBondContact O-N 2.8Å; N201-H205 HydrophobicContact CB-CB 3.81Å; N201-L206 HydrophobicContact CB-CD2 4.37Å
202T93.5Very high89.1Confident1 Ų134.5 Ų34.51%0.00618%0.181CC..  trans-93.3166.4166.662.80000110Q195 R196 L204 H205 L206 A228Q195-T202 WeakPolarHBondContact O-CA 3.33Å; R196-T202 HydrophobicContact CG-CG2 3.98Å; T202-L204 PolarHBondContact O-N 3.09Å; T202-L204 VanDerWaalsContact O-N 3.08Å; T202-H205 PolarHBondContact N-ND1 3.09Å; T202-H205 VanDerWaalsContact O-CB 3.31Å; T202-H205 WeakPolarHBondContact O-CB 3.4Å; T202-H205 PolarHBondContact O-N 3.34Å; T202-H205 PolarHBondContact OG1-N 3.44Å; T202-H205 PolarHBondContact OG1-ND1 3.22Å; T202-L206 PolarHBondContact O-N 3.03Å; T202-A228 HydrophobicContact CG2-CB 3.74Å
203P92.8Very high88.7Confident0 Ų032 Ų320%017%0.168CC..Hα-helixtrans-50.2-34.6170.7-28.633.2000113.1L171 S175 P193 Q195 L206 A207 L219L171-P203 HydrophobicContact CB-CG 4.32Å; L171-P203 HydrophobicContact CD2-CB 4.19Å; L171-P203 HydrophobicContact CD2-CG 3.74Å; L171-P203 HydrophobicContact CG-CB 3.96Å; L171-P203 HydrophobicContact CG-CG 3.82Å; S175-P203 WeakPolarHBondContact CB-O 3.25Å; P193-P203 WeakPolarHBondContact O-CD 3.49Å; Q195-P203 VanDerWaalsContact O-CD 3.25Å; Q195-P203 WeakPolarHBondContact O-CD 3.26Å; P203-L206 PolarHBondContact O-N 2.82Å; P203-A207 WeakPolarHBondContact O-CB 3.5Å; P203-A207 PolarHBondContact O-N 3.29Å; P203-L219 HydrophobicContact CB-CD1 4.05Å; P203-L219 HydrophobicContact CB-CD2 4.06Å
204L91Very high88.4Confident2 Ų234.9 Ų34.91%0.0119%0.187CC..Hα-helixtrans-66.9-36.7176.4-171.463.3000112.9T202 L206 A208 I216 L219 L220 A224 V226 P236T202-L204 PolarHBondContact O-N 3.09Å; T202-L204 VanDerWaalsContact O-N 3.08Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L204-L206 PolarHBondContact O-N 3.3Å; L204-A208 WeakPolarHBondContact O-CB 3.38Å; L204-A208 PolarHBondContact O-N 3.12Å; L204-I216 HydrophobicContact CD1-CB 4.37Å; L204-I216 HydrophobicContact CD1-CG1 4.28Å; L204-I216 HydrophobicContact CD1-CG2 3.98Å; L204-L219 HydrophobicContact CB-CD1 4.34Å; L204-L219 HydrophobicContact CD1-CB 4.33Å; L204-L219 HydrophobicContact CD1-CD1 4.29Å; L204-L220 HydrophobicContact CD1-CD2 4.37Å; L204-L220 HydrophobicContact CD1-CG 4.47Å; L204-L220 HydrophobicContact CD2-CD2 3.96Å; L204-A224 HydrophobicContact CB-CB 4.42Å; L204-A224 HydrophobicContact CD2-CB 4.15Å; L204-V226 HydrophobicContact CD2-CB 4.45Å; L204-V226 HydrophobicContact CD2-CG1 3.91Å; L204-P236 HydrophobicContact CB-CG 4.27Å; L204-P236 HydrophobicContact CD2-CB 4.44Å; L204-P236 HydrophobicContact CD2-CG 4.01Å; L204-P236 HydrophobicContact CG-CB 4.03Å; L204-P236 HydrophobicContact CG-CG 3.94Å
205H89.9Confident88.3Confident0 Ų033 Ų330%018%0.177CC..Hα-helixtrans-60.6-43.9173.3-76.187.2000111.5N201 T202 A208 C209 A228 R234 P236 L239N201-H205 HydrophobicContact CB-CB 3.81Å; T202-H205 PolarHBondContact N-ND1 3.09Å; T202-H205 VanDerWaalsContact O-CB 3.31Å; T202-H205 WeakPolarHBondContact O-CB 3.4Å; T202-H205 PolarHBondContact O-N 3.34Å; T202-H205 PolarHBondContact OG1-N 3.44Å; T202-H205 PolarHBondContact OG1-ND1 3.22Å; H205-A208 PolarHBondContact O-N 2.95Å; H205-C209 WeakPolarHBondContact O-CB 3.31Å; H205-C209 PolarHBondContact O-N 3.02Å; H205-A228 PolarHBondContact CE1-O 2.83Å; H205-A228 PolarHBondContact NE2-O 3.34Å; H205-R234 PolarHBondContact NE2-O 3.45Å; H205-R234 VanDerWaalsContact NE2-O 3.14Å; H205-P236 WeakPolarHBondContact NE2-CD 3.42Å; H205-L239 HydrophobicContact CB-CD1 3.67Å
206L89.9Confident88.1Confident31 Ų3129.8 Ų29.816%0.16216%0.162CC..Hα-helixtrans-67.7-47179.6-61.2-177.7000111.3H172 C176 N201 T202 P203 L204 A208 C209 T210H172-L206 HydrophobicContact CB-CD1 3.61Å; H172-L206 WeakPolarHBondContact O-CD1 3.46Å; C176-L206 HydrophobicContact CB-CB 4.27Å; C176-L206 HydrophobicContact CB-CD1 4.46Å; N201-L206 HydrophobicContact CB-CD2 4.37Å; T202-L206 PolarHBondContact O-N 3.03Å; P203-L206 PolarHBondContact O-N 2.82Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L204-L206 PolarHBondContact O-N 3.3Å; L206-A208 VanDerWaalsContact C-N 3.26Å; L206-A208 PolarHBondContact O-N 3.17Å; L206-C209 PolarHBondContact O-N 3.28Å; L206-C209 VanDerWaalsContact O-N 3.17Å; L206-T210 PolarHBondContact O-N 2.95Å; L206-T210 PolarHBondContact O-OG1 2.96Å; L206-T210 VanDerWaalsContact O-OG1 3.05Å
207A88.9Confident87.8Confident0 Ų024.7 Ų24.70%015%0.145CC..Hα-helixtrans-61.1-35.3176.700000112.7P203 N211 H212 V215 I216 L219P203-A207 WeakPolarHBondContact O-CB 3.5Å; P203-A207 PolarHBondContact O-N 3.29Å; A207-N211 WeakPolarHBondContact O-CA 3.29Å; A207-N211 PolarHBondContact O-N 3.4Å; A207-H212 PolarHBondContact O-N 3.49Å; A207-H212 VanDerWaalsContact O-N 3.08Å; A207-V215 HydrophobicContact CB-CB 4.43Å; A207-V215 HydrophobicContact CB-CG1 3.67Å; A207-I216 HydrophobicContact CB-CG1 3.75Å; A207-L219 HydrophobicContact CB-CD1 4.18Å
208A86.1Confident87.7Confident1 Ų124.5 Ų24.51%0.00815%0.145CC..Hα-helixtrans-71.1-37.117600000112.4L204 H205 L206 N211 P236 A240 M268L204-A208 WeakPolarHBondContact O-CB 3.38Å; L204-A208 PolarHBondContact O-N 3.12Å; H205-A208 PolarHBondContact O-N 2.95Å; L206-A208 VanDerWaalsContact C-N 3.26Å; L206-A208 PolarHBondContact O-N 3.17Å; A208-N211 PolarHBondContact O-N 2.86Å; A208-P236 HydrophobicContact CB-CB 3.85Å; A208-P236 VanDerWaalsContact CB-O 3.25Å; A208-P236 WeakPolarHBondContact CB-O 3.38Å; A208-A240 HydrophobicContact CB-CB 4.19Å; A208-A240 WeakPolarHBondContact O-CA 3.37Å; A208-A240 WeakPolarHBondContact O-CB 3.42Å; A208-M268 HydrophobicContact CB-SD 4.17Å
209C83.5Confident87.7Confident46 Ų4622.4 Ų22.431%0.31113%0.13SC..Hα-helixtrans-68.5-32.9175.5-172.20000112.8H205 L206 L239 K243H205-C209 WeakPolarHBondContact O-CB 3.31Å; H205-C209 PolarHBondContact O-N 3.02Å; L206-C209 PolarHBondContact O-N 3.28Å; L206-C209 VanDerWaalsContact O-N 3.17Å; C209-L239 HydrophobicContact CB-CB 4.38Å; C209-K243 WeakPolarHBondContact O-CG 3.17Å
210T81.4Confident87.5Confident49 Ų4917.9 Ų17.930%0.30111%0.106SC..Hα-helixtrans-96.6-117856.30000113.9C176 L206 H212C176-T210 WeakPolarHBondContact O-CB 3.44Å; C176-T210 WeakPolarHBondContact O-CG2 3.49Å; C176-T210 PolarHBondContact O-OG1 2.77Å; L206-T210 PolarHBondContact O-N 2.95Å; L206-T210 PolarHBondContact O-OG1 2.96Å; L206-T210 VanDerWaalsContact O-OG1 3.05Å; T210-H212 PolarHBondContact O-N 2.87Å; T210-H212 PolarHBondContact OG1-CD2 2.9Å
211N78.9Confident87.3Confident37 Ų3726.2 Ų26.220%0.19814%0.135CC..THydrogen-bonded Turntrans59.340.2175.1-165.640.1000114.9A207 A208 V213 E261 Q264A207-N211 WeakPolarHBondContact O-CA 3.29Å; A207-N211 PolarHBondContact O-N 3.4Å; A208-N211 PolarHBondContact O-N 2.86Å; N211-V213 PolarHBondContact O-N 3.3Å; N211-E261 WeakPolarHBondContact ND2-CA 3.24Å; N211-Q264 WeakPolarHBondContact OD1-CB 3.16Å; N211-Q264 WeakPolarHBondContact OD1-CG 3.46Å
212H84Confident87Confident59 Ų5928.2 Ų28.227%0.27315%0.15SC..  trans-93.388.5178.3-64.8-50.4000112C176 G178 A207 T210 V215 I216C176-H212 PolarHBondContact O-CD2 3.25Å; C176-H212 VanDerWaalsContact O-CD2 3.31Å; C176-H212 PolarHBondContact O-NE2 3.43Å; G178-H212 WeakPolarHBondContact CA-CD2 3.36Å; G178-H212 PolarHBondContact N-CD2 3.01Å; G178-H212 PolarHBondContact N-NE2 3.24Å; A207-H212 PolarHBondContact O-N 3.49Å; A207-H212 VanDerWaalsContact O-N 3.08Å; T210-H212 PolarHBondContact O-N 2.87Å; T210-H212 PolarHBondContact OG1-CD2 2.9Å; H212-V215 HydrophobicContact CB-CB 4.19Å; H212-V215 HydrophobicContact CB-CG2 4.3Å; H212-V215 WeakPolarHBondContact O-CB 3.38Å; H212-V215 PolarHBondContact O-N 3.39Å; H212-I216 WeakPolarHBondContact O-CG1 3.41Å; H212-I216 PolarHBondContact O-N 3.44Å
213V81.9Confident86.6Confident12 Ų1230.4 Ų30.47%0.07317%0.173CC..Hα-helixtrans-65.7-36.9-175.2155.20000117.2N211 V215 I216 T217 Q264 Q267N211-V213 PolarHBondContact O-N 3.3Å; V213-V215 PolarHBondContact O-N 2.82Å; V213-I216 HydrophobicContact CG2-CB 4.46Å; V213-I216 HydrophobicContact CG2-CD1 3.89Å; V213-I216 PolarHBondContact O-N 3.02Å; V213-I216 VanDerWaalsContact O-N 3.07Å; V213-T217 HydrophobicContact CG1-CG2 3.84Å; V213-T217 WeakPolarHBondContact O-CG2 3.48Å; V213-T217 PolarHBondContact O-N 2.93Å; V213-T217 PolarHBondContact O-OG1 3.4Å; V213-Q264 HydrophobicContact CB-CG 3.72Å; V213-Q264 HydrophobicContact CG2-CB 4.41Å; V213-Q264 VanDerWaalsContact CG2-CD 3.41Å; V213-Q264 HydrophobicContact CG2-CG 3.3Å; V213-Q267 HydrophobicContact CG1-CG 4.25Å
214P86.4Confident86.3Confident74 Ų7430.9 Ų30.948%0.48118%0.177SC..Hα-helixtrans-51.9-49.6174.1-2836.2000111.1D180 I216 T217 T218D180-P214 HydrophobicContact CB-CB 4.02Å; P214-I216 PolarHBondContact O-N 3.07Å; P214-T217 PolarHBondContact O-N 2.88Å; P214-T217 PolarHBondContact O-OG1 3.19Å; P214-T218 PolarHBondContact O-N 3.07Å; P214-T218 PolarHBondContact O-OG1 3.3Å; P214-T218 VanDerWaalsContact O-OG1 3.07Å
215V89.2Confident85.9Confident0 Ų038.2 Ų38.20%020%0.204CC..Hα-helixtrans-59-47174.6170.20000112.3D180 V183 A207 H212 V213 T217 T218 L219D180-V215 HydrophobicContact CB-CG2 4.23Å; V183-V215 HydrophobicContact CG1-CG1 4.44Å; V183-V215 HydrophobicContact CG2-CG1 4.04Å; V183-V215 HydrophobicContact CG2-CG2 4.1Å; A207-V215 HydrophobicContact CB-CB 4.43Å; A207-V215 HydrophobicContact CB-CG1 3.67Å; H212-V215 HydrophobicContact CB-CB 4.19Å; H212-V215 HydrophobicContact CB-CG2 4.3Å; H212-V215 WeakPolarHBondContact O-CB 3.38Å; H212-V215 PolarHBondContact O-N 3.39Å; V213-V215 PolarHBondContact O-N 2.82Å; V215-T217 VanDerWaalsContact C-N 3.33Å; V215-T217 PolarHBondContact O-N 3.1Å; V215-T218 PolarHBondContact O-N 2.62Å; V215-L219 HydrophobicContact CG1-CD1 3.76Å; V215-L219 HydrophobicContact CG1-CG 4.2Å; V215-L219 WeakPolarHBondContact O-CB 3.09Å; V215-L219 VanDerWaalsContact O-CG 3.31Å; V215-L219 WeakPolarHBondContact O-CG 3.42Å; V215-L219 PolarHBondContact O-N 3.01Å
216I87.5Confident85.4Confident1 Ų139.7 Ų39.71%0.00521%0.213CC..Hα-helixtrans-57.4-48.3178.3-68.9167.1000110L204 A207 H212 V213 P214 T218 L219 L220 M268L204-I216 HydrophobicContact CD1-CB 4.37Å; L204-I216 HydrophobicContact CD1-CG1 4.28Å; L204-I216 HydrophobicContact CD1-CG2 3.98Å; A207-I216 HydrophobicContact CB-CG1 3.75Å; H212-I216 WeakPolarHBondContact O-CG1 3.41Å; H212-I216 PolarHBondContact O-N 3.44Å; V213-I216 HydrophobicContact CG2-CB 4.46Å; V213-I216 HydrophobicContact CG2-CD1 3.89Å; V213-I216 PolarHBondContact O-N 3.02Å; V213-I216 VanDerWaalsContact O-N 3.07Å; P214-I216 PolarHBondContact O-N 3.07Å; I216-T218 VanDerWaalsContact C-N 3.31Å; I216-T218 PolarHBondContact O-N 2.73Å; I216-L219 PolarHBondContact O-N 3.4Å; I216-L220 HydrophobicContact CG2-CD1 3.83Å; I216-L220 HydrophobicContact CG2-CG 4.25Å; I216-L220 WeakPolarHBondContact O-CB 3.36Å; I216-L220 WeakPolarHBondContact O-CG 3.35Å; I216-L220 PolarHBondContact O-N 2.97Å; I216-M268 HydrophobicContact CD1-SD 3.97Å; I216-M268 HydrophobicContact CG2-CB 3.98Å; I216-M268 HydrophobicContact CG2-CG 3.58Å; I216-M268 HydrophobicContact CG2-SD 4.08Å
217T85.6Confident84.8Confident21 Ų2141.7 Ų41.713%0.12922%0.224CC..Hα-helixtrans-61.5-40.9179.665.30000112.1V213 P214 V215 L220 R221 E271V213-T217 HydrophobicContact CG1-CG2 3.84Å; V213-T217 WeakPolarHBondContact O-CG2 3.48Å; V213-T217 PolarHBondContact O-N 2.93Å; V213-T217 PolarHBondContact O-OG1 3.4Å; P214-T217 PolarHBondContact O-N 2.88Å; P214-T217 PolarHBondContact O-OG1 3.19Å; V215-T217 VanDerWaalsContact C-N 3.33Å; V215-T217 PolarHBondContact O-N 3.1Å; T217-L220 PolarHBondContact O-N 3.5Å; T217-R221 WeakPolarHBondContact O-CB 3.18Å; T217-R221 VanDerWaalsContact O-CG 3.29Å; T217-R221 WeakPolarHBondContact O-CG 3.36Å; T217-R221 PolarHBondContact O-N 3.26Å; T217-E271 HydrophobicContact CG2-CG 4.11Å
218T90.1Very high84.6Confident13 Ų1341.9 Ų41.98%0.0823%0.226CC..Hα-helixtrans-65.1-44.5177.9-60.60000111.6D180 V183 Q184 L187 P214 V215 I216 R221 S222D180-T218 VanDerWaalsContact OD1-CB 3.31Å; D180-T218 WeakPolarHBondContact OD1-CB 3.44Å; D180-T218 PolarHBondContact OD1-OG1 3.48Å; V183-T218 HydrophobicContact CG1-CG2 3.92Å; Q184-T218 HydrophobicContact CG-CG2 3.55Å; L187-T218 HydrophobicContact CD1-CG2 3.85Å; P214-T218 PolarHBondContact O-N 3.07Å; P214-T218 PolarHBondContact O-OG1 3.3Å; P214-T218 VanDerWaalsContact O-OG1 3.07Å; V215-T218 PolarHBondContact O-N 2.62Å; I216-T218 VanDerWaalsContact C-N 3.31Å; I216-T218 PolarHBondContact O-N 2.73Å; T218-R221 PolarHBondContact O-N 2.88Å; T218-S222 WeakPolarHBondContact O-CB 3.37Å; T218-S222 PolarHBondContact O-N 2.97Å; T218-S222 VanDerWaalsContact O-N 3.07Å; T218-S222 PolarHBondContact O-OG 2.92Å
219L89Confident84.6Confident0 Ų045.2 Ų45.20%024%0.243CC..Hα-helixtrans-62.5-45176-72.9173000111.5L171 V183 L187 P193 P203 L204 A207 V215 I216 S222 G223 A224L171-L219 HydrophobicContact CD1-CD2 4.29Å; L171-L219 HydrophobicContact CD2-CD2 4.24Å; L171-L219 HydrophobicContact CG-CD2 4.42Å; V183-L219 HydrophobicContact CG1-CD2 4.16Å; V183-L219 HydrophobicContact CG1-CG 4.29Å; L187-L219 HydrophobicContact CD1-CD2 4.28Å; P193-L219 HydrophobicContact CB-CD2 4.25Å; P203-L219 HydrophobicContact CB-CD1 4.05Å; P203-L219 HydrophobicContact CB-CD2 4.06Å; L204-L219 HydrophobicContact CB-CD1 4.34Å; L204-L219 HydrophobicContact CD1-CB 4.33Å; L204-L219 HydrophobicContact CD1-CD1 4.29Å; A207-L219 HydrophobicContact CB-CD1 4.18Å; V215-L219 HydrophobicContact CG1-CD1 3.76Å; V215-L219 HydrophobicContact CG1-CG 4.2Å; V215-L219 WeakPolarHBondContact O-CB 3.09Å; V215-L219 VanDerWaalsContact O-CG 3.31Å; V215-L219 WeakPolarHBondContact O-CG 3.42Å; V215-L219 PolarHBondContact O-N 3.01Å; I216-L219 PolarHBondContact O-N 3.4Å; L219-S222 CarbonylContact O-C 3.57Å; L219-S222 PolarHBondContact O-N 2.94Å; L219-S222 VanDerWaalsContact O-N 3.12Å; L219-G223 PolarHBondContact O-N 3.47Å; L219-A224 HydrophobicContact CB-CB 3.91Å; L219-A224 WeakPolarHBondContact O-CB 3.49Å; L219-A224 PolarHBondContact O-N 2.87Å
220L86.1Confident84.8Confident6 Ų643.6 Ų43.63%0.03123%0.231CC..Hα-helixtrans-61.5-45.6178.1-71178.1000112.1L204 I216 T217 S222 G223 V226 E271 L275L204-L220 HydrophobicContact CD1-CD2 4.37Å; L204-L220 HydrophobicContact CD1-CG 4.47Å; L204-L220 HydrophobicContact CD2-CD2 3.96Å; I216-L220 HydrophobicContact CG2-CD1 3.83Å; I216-L220 HydrophobicContact CG2-CG 4.25Å; I216-L220 WeakPolarHBondContact O-CB 3.36Å; I216-L220 WeakPolarHBondContact O-CG 3.35Å; I216-L220 PolarHBondContact O-N 2.97Å; T217-L220 PolarHBondContact O-N 3.5Å; L220-S222 PolarHBondContact O-N 3.42Å; L220-G223 PolarHBondContact O-N 2.84Å; L220-G223 VanDerWaalsContact O-N 3.09Å; L220-V226 HydrophobicContact CD2-CG1 3.14Å; L220-E271 HydrophobicContact CD1-CB 3.68Å; L220-L275 HydrophobicContact CB-CD1 3.96Å; L220-L275 HydrophobicContact CD2-CD1 4.41Å
221R85.9Confident85.1Confident184 Ų18450.5 Ų50.569%0.69425%0.252SS*.Hα-helixtrans-61.6-28.3175.1-75175.3-178.7156.73.5113T217 T218 G223T217-R221 WeakPolarHBondContact O-CB 3.18Å; T217-R221 VanDerWaalsContact O-CG 3.29Å; T217-R221 WeakPolarHBondContact O-CG 3.36Å; T217-R221 PolarHBondContact O-N 3.26Å; T218-R221 PolarHBondContact O-N 2.88Å; R221-G223 VanDerWaalsContact C-N 3.28Å
222S86.4Confident85.4Confident56 Ų5652.1 Ų52.139%0.39227%0.27SS..THydrogen-bonded Turntrans-88.16.8179.4-52.70000113.1L187 T218 L219 L220L187-S222 WeakPolarHBondContact CD1-OG 3.49Å; T218-S222 WeakPolarHBondContact O-CB 3.37Å; T218-S222 PolarHBondContact O-N 2.97Å; T218-S222 VanDerWaalsContact O-N 3.07Å; T218-S222 PolarHBondContact O-OG 2.92Å; L219-S222 CarbonylContact O-C 3.57Å; L219-S222 PolarHBondContact O-N 2.94Å; L219-S222 VanDerWaalsContact O-N 3.12Å; L220-S222 PolarHBondContact O-N 3.42Å
223G83.6Confident85.4Confident47 Ų4751.1 Ų51.149%0.48528%0.276SS..THydrogen-bonded Turntrans89.324.9175.600000114.8N194 L219 L220 R221N194-G223 PolarHBondContact ND2-O 3.49Å; N194-G223 VanDerWaalsContact ND2-O 3.11Å; L219-G223 PolarHBondContact O-N 3.47Å; L220-G223 PolarHBondContact O-N 2.84Å; L220-G223 VanDerWaalsContact O-N 3.09Å; R221-G223 VanDerWaalsContact C-N 3.28Å
224A86.7Confident85.4Confident9 Ų955.2 Ų55.27%0.07429%0.29CS..  trans-65.1134.3172.200000112P193 N194 L204 L219 V226P193-A224 HydrophobicContact CB-CB 4.11Å; N194-A224 WeakPolarHBondContact OD1-CA 3.41Å; L204-A224 HydrophobicContact CB-CB 4.42Å; L204-A224 HydrophobicContact CD2-CB 4.15Å; L219-A224 HydrophobicContact CB-CB 3.91Å; L219-A224 WeakPolarHBondContact O-CB 3.49Å; L219-A224 PolarHBondContact O-N 2.87Å; A224-V226 PolarHBondContact O-N 2.81Å
225R82.3Confident85.4Confident156 Ų15652.2 Ų52.259%0.58927%0.27SS*.  trans-79.5103.5175.6-70.8-175.1-171.8-174.13.1110.7N194 D227 A228N194-R225 VanDerWaalsContact OD1-CB 3.31Å; N194-R225 WeakPolarHBondContact OD1-CB 3.46Å; N194-R225 WeakPolarHBondContact OD1-CG 3.39Å; N194-R225 PolarHBondContact OD1-N 3.28Å; R225-D227 WeakPolarHBondContact CB-OD1 3.5Å; R225-D227 PolarHBondContact O-N 3.03Å; R225-A228 HydrophobicContact CB-CB 4.15Å; R225-A228 VanDerWaalsContact O-CB 3.31Å; R225-A228 WeakPolarHBondContact O-CB 3.1Å; R225-A228 PolarHBondContact O-N 2.75Å
226V79.9Confident85.1Confident31 Ų3152.4 Ų52.419%0.18827%0.271CS..THydrogen-bonded Turntrans-58.3-25.7166.6-70.90000115.8L204 L220 A224 P236 Y272L204-V226 HydrophobicContact CD2-CB 4.45Å; L204-V226 HydrophobicContact CD2-CG1 3.91Å; L220-V226 HydrophobicContact CD2-CG1 3.14Å; A224-V226 PolarHBondContact O-N 2.81Å; V226-P236 WeakPolarHBondContact O-CD 3.36Å; V226-Y272 HydrophobicContact CB-CD2 3.57Å; V226-Y272 HydrophobicContact CB-CE2 3.74Å; V226-Y272 HydrophobicContact CB-CG 4.2Å; V226-Y272 HydrophobicContact CG1-CD2 3.54Å; V226-Y272 HydrophobicContact CG1-CE2 4.21Å; V226-Y272 HydrophobicContact CG1-CG 4.05Å; V226-Y272 HydrophobicContact CG2-CD2 3.21Å; V226-Y272 HydrophobicContact CG2-CE2 2.95Å; V226-Y272 HydrophobicContact CG2-CG 4.26Å
227D77.2Confident84.7Confident73 Ų7353.3 Ų53.339%0.3928%0.276SS..THydrogen-bonded Turntrans-98.53.9-178.863.8-24.3000112.2R225 L229 Q319R225-D227 WeakPolarHBondContact CB-OD1 3.5Å; R225-D227 PolarHBondContact O-N 3.03Å; D227-L229 PolarHBondContact O-N 2.91Å; D227-Q319 VanDerWaalsContact CB-NE2 3.31Å
228A84Confident84.4Confident5 Ų554.2 Ų54.24%0.04128%0.279CS..  trans-57.7133.8172.900000109.6T202 H205 R225 P236T202-A228 HydrophobicContact CG2-CB 3.74Å; H205-A228 PolarHBondContact CE1-O 2.83Å; H205-A228 PolarHBondContact NE2-O 3.34Å; R225-A228 HydrophobicContact CB-CB 4.15Å; R225-A228 VanDerWaalsContact O-CB 3.31Å; R225-A228 WeakPolarHBondContact O-CB 3.1Å; R225-A228 PolarHBondContact O-N 2.75Å; A228-P236 WeakPolarHBondContact O-CD 3.29Å
229L86.3Confident84Confident71 Ų7154.3 Ų54.337%0.37228%0.279SS..  trans-100.9133.3176.7-59.2175.7000109.9D227 R234 T235D227-L229 PolarHBondContact O-N 2.91Å; L229-R234 WeakPolarHBondContact CA-O 3.2Å; L229-T235 HydrophobicContact CD2-CG2 3.62Å
230D87.9Confident83.6Confident11 Ų1154.6 Ų54.66%0.05928%0.281CS..  trans-73.1179.6166.779-2.5000111.5A232 G233 R234D230-A232 PolarHBondContact O-N 3.46Å; D230-A232 VanDerWaalsContact OD1-C 3.29Å; D230-A232 VanDerWaalsContact OD1-CA 3.29Å; D230-A232 WeakPolarHBondContact OD1-CA 3.4Å; D230-A232 WeakPolarHBondContact OD1-CB 3.32Å; D230-A232 PolarHBondContact OD1-N 3.3Å; D230-G233 PolarHBondContact O-N 3.26Å; D230-G233 PolarHBondContact OD1-N 3.5Å; D230-R234 PolarHBondContact N-O 2.99Å; D230-R234 WeakPolarHBondContact OD1-CB 3.25Å; D230-R234 PolarHBondContact OD1-N 3.34Å; D230-R234 IonicContact OD1-NE 3.26Å; D230-R234 IonicContact OD2-CZ 3.66Å; D230-R234 IonicContact OD2-NE 3.9Å; D230-R234 PolarHBondContact OD2-NE 2.89Å; D230-R234 IonicContact OD2-NH2 2.7Å; D230-R234 PolarHBondContact OD2-NH2 3.4Å
231R88.4Confident83.2Confident195 Ų19557.5 Ų57.574%0.73629%0.291SS*.THydrogen-bonded Turntrans-62.1-21.4177.5-82-173.9173.2175.61.8114.5S198 L199 G233S198-R231 WeakPolarHBondContact O-CD 3.26Å; S198-R231 PolarHBondContact O-NE 3.39Å; S198-R231 PolarHBondContact O-NH1 2.91Å; S198-R231 PolarHBondContact O-NH2 3.08Å; S198-R231 VanDerWaalsContact O-NH2 3.16Å; L199-R231 VanDerWaalsContact O-CB 3.26Å; L199-R231 WeakPolarHBondContact O-CB 3.49Å; L199-R231 VanDerWaalsContact O-CG 3.3Å; L199-R231 WeakPolarHBondContact O-CG 3.42Å; L199-R231 PolarHBondContact O-N 3.25Å; R231-G233 VanDerWaalsContact C-N 3.32Å
232A84.6Confident82.8Confident70 Ų7051 Ų5158%0.57927%0.274SS*.THydrogen-bonded Turntrans-91.45.6176.600000112.4D230 R234D230-A232 PolarHBondContact O-N 3.46Å; D230-A232 VanDerWaalsContact OD1-C 3.29Å; D230-A232 VanDerWaalsContact OD1-CA 3.29Å; D230-A232 WeakPolarHBondContact OD1-CA 3.4Å; D230-A232 WeakPolarHBondContact OD1-CB 3.32Å; D230-A232 PolarHBondContact OD1-N 3.3Å; A232-R234 VanDerWaalsContact C-N 3.27Å; A232-R234 HydrophobicContact CB-CG 4.04Å; A232-R234 PolarHBondContact O-N 2.92Å
233G83.6Confident82.3Confident38 Ų3852.3 Ų52.339%0.39227%0.273SS..SBendtrans72.121.2-177.500000113.2D230 R231D230-G233 PolarHBondContact O-N 3.26Å; D230-G233 PolarHBondContact OD1-N 3.5Å; R231-G233 VanDerWaalsContact C-N 3.32Å
234R83Confident81.7Confident99 Ų9950.3 Ų50.337%0.37425%0.251SS..  trans-96.5141.3179.6-58.5178.1-59.9-174.70.3109.3H205 L229 D230 A232 H238 L239H205-R234 PolarHBondContact NE2-O 3.45Å; H205-R234 VanDerWaalsContact NE2-O 3.14Å; L229-R234 WeakPolarHBondContact CA-O 3.2Å; D230-R234 PolarHBondContact N-O 2.99Å; D230-R234 WeakPolarHBondContact OD1-CB 3.25Å; D230-R234 PolarHBondContact OD1-N 3.34Å; D230-R234 IonicContact OD1-NE 3.26Å; D230-R234 IonicContact OD2-CZ 3.66Å; D230-R234 IonicContact OD2-NE 3.9Å; D230-R234 PolarHBondContact OD2-NE 2.89Å; D230-R234 IonicContact OD2-NH2 2.7Å; D230-R234 PolarHBondContact OD2-NH2 3.4Å; A232-R234 VanDerWaalsContact C-N 3.27Å; A232-R234 HydrophobicContact CB-CG 4.04Å; A232-R234 PolarHBondContact O-N 2.92Å; R234-H238 HydrophobicContact CB-CB 3.85Å; R234-H238 HydrophobicContact CG-CB 4.37Å; R234-L239 HydrophobicContact CB-CD2 4.47Å
235T85.3Confident81Confident11 Ų1152.1 Ų52.17%0.06726%0.26CS..  trans-85.4166169.1710000110.5L229 L237 H238 L239 L316L229-T235 HydrophobicContact CD2-CG2 3.62Å; T235-L237 PolarHBondContact O-N 3.14Å; T235-L237 VanDerWaalsContact O-N 3.09Å; T235-H238 PolarHBondContact N-ND1 3.37Å; T235-H238 VanDerWaalsContact N-ND1 3.2Å; T235-H238 WeakPolarHBondContact O-CB 3.23Å; T235-H238 PolarHBondContact O-N 3.25Å; T235-H238 PolarHBondContact OG1-ND1 3.03Å; T235-L239 PolarHBondContact O-N 2.98Å; T235-L316 HydrophobicContact CG2-CD1 4.39Å
236P83.9Confident80.1Confident3 Ų349.4 Ų49.42%0.01926%0.255CS..Hα-helixtrans-51-36.5173.6-27.334.7000113L204 H205 A208 V226 A228 L239 A240L204-P236 HydrophobicContact CB-CG 4.27Å; L204-P236 HydrophobicContact CD2-CB 4.44Å; L204-P236 HydrophobicContact CD2-CG 4.01Å; L204-P236 HydrophobicContact CG-CB 4.03Å; L204-P236 HydrophobicContact CG-CG 3.94Å; H205-P236 WeakPolarHBondContact NE2-CD 3.42Å; A208-P236 HydrophobicContact CB-CB 3.85Å; A208-P236 VanDerWaalsContact CB-O 3.25Å; A208-P236 WeakPolarHBondContact CB-O 3.38Å; V226-P236 WeakPolarHBondContact O-CD 3.36Å; A228-P236 WeakPolarHBondContact O-CD 3.29Å; P236-L239 WeakPolarHBondContact O-CB 3.39Å; P236-L239 PolarHBondContact O-N 2.93Å; P236-A240 PolarHBondContact O-N 3.08Å
237L79.9Confident79.3Confident20 Ų2049 Ų4911%0.10525%0.252CS..Hα-helixtrans-66-37.8178.2-178.767.8000113T235 L239 A240 R241 I265 M268 L269 T312T235-L237 PolarHBondContact O-N 3.14Å; T235-L237 VanDerWaalsContact O-N 3.09Å; L237-L239 VanDerWaalsContact C-N 3.27Å; L237-L239 PolarHBondContact O-N 3.34Å; L237-A240 PolarHBondContact O-N 2.93Å; L237-R241 PolarHBondContact O-N 3.39Å; L237-I265 HydrophobicContact CD1-CG2 3.89Å; L237-M268 HydrophobicContact CB-CE 4.17Å; L237-M268 HydrophobicContact CD1-CE 3.33Å; L237-M268 HydrophobicContact CG-CE 4.34Å; L237-L269 HydrophobicContact CD1-CD1 4.08Å; L237-L269 HydrophobicContact CD1-CD2 3.67Å; L237-L269 HydrophobicContact CD1-CG 3.82Å; L237-L269 HydrophobicContact CD2-CD2 3.57Å; L237-L269 HydrophobicContact CG-CD2 4.25Å; L237-T312 HydrophobicContact CD2-CG2 3.34Å; L237-T312 HydrophobicContact CG-CG2 3.66Å
238H79.3Confident78.4Confident41 Ų4147 Ų4719%0.1924%0.241CC..Hα-helixtrans-63.4-37.1174.4-69.589.9000111.2R234 T235 R241 S242 L316R234-H238 HydrophobicContact CB-CB 3.85Å; R234-H238 HydrophobicContact CG-CB 4.37Å; T235-H238 PolarHBondContact N-ND1 3.37Å; T235-H238 VanDerWaalsContact N-ND1 3.2Å; T235-H238 WeakPolarHBondContact O-CB 3.23Å; T235-H238 PolarHBondContact O-N 3.25Å; T235-H238 PolarHBondContact OG1-ND1 3.03Å; H238-R241 PolarHBondContact O-N 3.03Å; H238-S242 VanDerWaalsContact O-CB 3.28Å; H238-S242 WeakPolarHBondContact O-CB 3.39Å; H238-S242 PolarHBondContact O-N 3.21Å; H238-L316 WeakPolarHBondContact CE1-CD1 3.18Å
239L80.4Confident77.2Confident15 Ų1554 Ų548%0.07927%0.272CS..Hα-helixtrans-67.4-43.7175.7-62.7-175000112H205 C209 R234 T235 P236 L237 R241 S242 K243H205-L239 HydrophobicContact CB-CD1 3.67Å; C209-L239 HydrophobicContact CB-CB 4.38Å; R234-L239 HydrophobicContact CB-CD2 4.47Å; T235-L239 PolarHBondContact O-N 2.98Å; P236-L239 WeakPolarHBondContact O-CB 3.39Å; P236-L239 PolarHBondContact O-N 2.93Å; L237-L239 VanDerWaalsContact C-N 3.27Å; L237-L239 PolarHBondContact O-N 3.34Å; L239-R241 VanDerWaalsContact C-N 3.29Å; L239-R241 PolarHBondContact O-N 2.93Å; L239-S242 PolarHBondContact O-N 3.1Å; L239-K243 WeakPolarHBondContact O-CB 3.36Å; L239-K243 PolarHBondContact O-N 3.31Å
240A80.3Confident75.9Confident5 Ų553.5 Ų53.54%0.04128%0.284CS..Hα-helixtrans-58.3-42.6175.800000111.9A208 P236 L237 L244 I265 M268A208-A240 HydrophobicContact CB-CB 4.19Å; A208-A240 WeakPolarHBondContact O-CA 3.37Å; A208-A240 WeakPolarHBondContact O-CB 3.42Å; P236-A240 PolarHBondContact O-N 3.08Å; L237-A240 PolarHBondContact O-N 2.93Å; A240-L244 PolarHBondContact O-N 3.05Å; A240-I265 HydrophobicContact CB-CD1 4.16Å; A240-I265 HydrophobicContact CB-CG1 4.07Å; A240-M268 HydrophobicContact CB-CE 4.32Å
241R78.3Confident74.2Confident68 Ų6861 Ų6126%0.25732%0.319SS..Hα-helixtrans-68.7-46.5174.9-178.4-175.6168.8-138.9-5.9112.6L237 H238 L239 K243 L244 N245L237-R241 PolarHBondContact O-N 3.39Å; H238-R241 PolarHBondContact O-N 3.03Å; L239-R241 VanDerWaalsContact C-N 3.29Å; L239-R241 PolarHBondContact O-N 2.93Å; R241-K243 PolarHBondContact O-N 3.04Å; R241-L244 WeakPolarHBondContact O-CA 3.3Å; R241-L244 VanDerWaalsContact O-CB 3.28Å; R241-L244 WeakPolarHBondContact O-CB 3.3Å; R241-L244 PolarHBondContact O-N 3.17Å; R241-N245 PolarHBondContact O-N 3.47Å; R241-N245 PolarHBondContact O-OD1 3.14Å
242S77.9Confident72.5Confident48 Ų4857.6 Ų57.634%0.33633%0.325SS..Hα-helixtrans-59.3-37.2179.4-177.80000111H238 L239 N245 I246H238-S242 VanDerWaalsContact O-CB 3.28Å; H238-S242 WeakPolarHBondContact O-CB 3.39Å; H238-S242 PolarHBondContact O-N 3.21Å; L239-S242 PolarHBondContact O-N 3.1Å; S242-N245 PolarHBondContact O-N 3.12Å; S242-I246 WeakPolarHBondContact O-CD1 3.3Å; S242-I246 VanDerWaalsContact O-CG1 3.29Å; S242-I246 WeakPolarHBondContact O-CG1 3.5Å; S242-I246 PolarHBondContact O-N 3.02Å; S242-I246 VanDerWaalsContact O-N 3.14Å
243K75Confident71.3Confident83 Ų8358.4 Ų58.436%0.36131%0.313SS..Hα-helixtrans-58.7-50.9171.2-174.164.7174-178.40109.7C209 L239 R241 N245 I246 L247C209-K243 WeakPolarHBondContact O-CG 3.17Å; L239-K243 WeakPolarHBondContact O-CB 3.36Å; L239-K243 PolarHBondContact O-N 3.31Å; R241-K243 PolarHBondContact O-N 3.04Å; K243-N245 VanDerWaalsContact C-N 3.32Å; K243-N245 PolarHBondContact O-N 3.16Å; K243-I246 PolarHBondContact O-N 3.18Å; K243-L247 HydrophobicContact CD-CD1 4.21Å; K243-L247 HydrophobicContact CD-CG 4.5Å; K243-L247 HydrophobicContact CG-CD1 3.77Å; K243-L247 HydrophobicContact CG-CG 4.47Å; K243-L247 WeakPolarHBondContact O-CB 3.39Å; K243-L247 WeakPolarHBondContact O-CD1 3.41Å; K243-L247 WeakPolarHBondContact O-CG 3.46Å; K243-L247 PolarHBondContact O-N 3.11Å; K243-L247 VanDerWaalsContact O-N 3.1Å
244L71.8Confident70.7Confident4 Ų459.6 Ų59.62%0.02132%0.315CS..Hα-helixtrans-55.4-41.8177.8-174145.2000113.7A240 R241 L247 Q248 L258 V262 I265 T305A240-L244 PolarHBondContact O-N 3.05Å; R241-L244 WeakPolarHBondContact O-CA 3.3Å; R241-L244 VanDerWaalsContact O-CB 3.28Å; R241-L244 WeakPolarHBondContact O-CB 3.3Å; R241-L244 PolarHBondContact O-N 3.17Å; L244-L247 WeakPolarHBondContact O-CB 3.44Å; L244-L247 PolarHBondContact O-N 2.96Å; L244-Q248 HydrophobicContact CD2-CG 4.15Å; L244-Q248 PolarHBondContact O-N 2.98Å; L244-L258 HydrophobicContact CD1-CD1 3.8Å; L244-L258 HydrophobicContact CD2-CD1 4.14Å; L244-L258 HydrophobicContact CG-CD1 3.68Å; L244-V262 HydrophobicContact CD1-CB 4.49Å; L244-V262 HydrophobicContact CD1-CG2 3.35Å; L244-I265 HydrophobicContact CD1-CD1 4.08Å; L244-T305 HydrophobicContact CD1-CG2 3.83Å; L244-T305 HydrophobicContact CD2-CG2 3.37Å; L244-T305 HydrophobicContact CG-CG2 4.28Å
245N71.1Confident70Confident48 Ų4857.7 Ų57.726%0.25731%0.313SS..Hα-helixtrans-64.7-46.6178.1-7116.3000112.2R241 S242 K243 L247 Q248 E249R241-N245 PolarHBondContact O-N 3.47Å; R241-N245 PolarHBondContact O-OD1 3.14Å; S242-N245 PolarHBondContact O-N 3.12Å; K243-N245 VanDerWaalsContact C-N 3.32Å; K243-N245 PolarHBondContact O-N 3.16Å; N245-L247 PolarHBondContact O-N 3.32Å; N245-L247 VanDerWaalsContact O-N 3.14Å; N245-Q248 WeakPolarHBondContact O-CB 3.13Å; N245-Q248 PolarHBondContact O-N 3.35Å; N245-E249 PolarHBondContact O-N 3.24Å; N245-E249 VanDerWaalsContact O-N 3.12Å
246I65.3Low69.4Low98 Ų9864.3 Ų64.350%0.50334%0.343SS..Hα-helixtrans-56.7-33.9176-66.7164.1000110.5S242 K243 G250S242-I246 WeakPolarHBondContact O-CD1 3.3Å; S242-I246 VanDerWaalsContact O-CG1 3.29Å; S242-I246 WeakPolarHBondContact O-CG1 3.5Å; S242-I246 PolarHBondContact O-N 3.02Å; S242-I246 VanDerWaalsContact O-N 3.14Å; K243-I246 PolarHBondContact O-N 3.18Å; I246-G250 PolarHBondContact O-N 3.5Å
247L61.7Low69Low23 Ų2367.2 Ų67.212%0.1236%0.361CS..Hα-helixtrans-79.4-25.6-179.5-65.4172.3000113.4K243 L244 N245 R253K243-L247 HydrophobicContact CD-CD1 4.21Å; K243-L247 HydrophobicContact CD-CG 4.5Å; K243-L247 HydrophobicContact CG-CD1 3.77Å; K243-L247 HydrophobicContact CG-CG 4.47Å; K243-L247 WeakPolarHBondContact O-CB 3.39Å; K243-L247 WeakPolarHBondContact O-CD1 3.41Å; K243-L247 WeakPolarHBondContact O-CG 3.46Å; K243-L247 PolarHBondContact O-N 3.11Å; K243-L247 VanDerWaalsContact O-N 3.1Å; L244-L247 WeakPolarHBondContact O-CB 3.44Å; L244-L247 PolarHBondContact O-N 2.96Å; N245-L247 PolarHBondContact O-N 3.32Å; N245-L247 VanDerWaalsContact O-N 3.14Å; L247-R253 VanDerWaalsContact CD1-NH2 3.34Å; L247-R253 VanDerWaalsContact CD2-NE 3.33Å
248Q59.8Low68.8Low31 Ų3166.8 Ų66.815%0.14536%0.358CS..Hα-helixtrans-72.2-36.8171.2-77.3169.5-37.400112.2L244 N245 L258 R298 D302 T305L244-Q248 HydrophobicContact CD2-CG 4.15Å; L244-Q248 PolarHBondContact O-N 2.98Å; N245-Q248 WeakPolarHBondContact O-CB 3.13Å; N245-Q248 PolarHBondContact O-N 3.35Å; Q248-L258 HydrophobicContact CG-CD1 4.25Å; Q248-L258 HydrophobicContact CG-CD2 4.28Å; Q248-R298 PolarHBondContact O-NH2 3.45Å; Q248-R298 VanDerWaalsContact O-NH2 3.16Å; Q248-D302 PolarHBondContact NE2-OD1 3Å; Q248-T305 PolarHBondContact NE2-OG1 3.23Å
249E58.6Low68.5Low152 Ų15268.6 Ų68.671%0.7136%0.363SS*.Hα-helixtrans-79.3-27.4-177.8-68.5173.8-170.600113.1N245 E251N245-E249 PolarHBondContact O-N 3.24Å; N245-E249 VanDerWaalsContact O-N 3.12Å; E249-E251 PolarHBondContact O-N 2.65Å
250G57.4Low68.3Low60 Ų6069.6 Ų69.662%0.61938%0.378SS*.SBendtrans-76.621.8-177.600000117I246 S252I246-G250 PolarHBondContact O-N 3.5Å; G250-S252 PolarHBondContact O-N 2.99Å
251E52.7Low68.1Low168 Ų16870.9 Ų70.979%0.78538%0.383SS*.SBendtrans34.276.5170.4-63.6-169.9168.500116E249E249-E251 PolarHBondContact O-N 2.65Å
252S52.8Low68Low125 Ų12567.7 Ų67.787%0.87437%0.371SS*.  trans166.525.6153-800000115.6G250G250-S252 PolarHBondContact O-N 2.99Å
253R59.9Low67.9Low87 Ų8768.4 Ų68.433%0.32837%0.373SS..  trans-82.5130.1175.1-72.7-178.6167.8-128.7-4.2111.4L247 L255 E261L247-R253 VanDerWaalsContact CD1-NH2 3.34Å; L247-R253 VanDerWaalsContact CD2-NE 3.33Å; R253-L255 PolarHBondContact O-N 2.85Å; R253-E261 IonicContact CZ-OE1 2.97Å; R253-E261 IonicContact CZ-OE2 3.77Å; R253-E261 IonicContact NH1-OE1 3.2Å; R253-E261 PolarHBondContact NH1-OE1 3.44Å; R253-E261 IonicContact NH1-OE2 3.29Å; R253-E261 PolarHBondContact NH1-OE2 3.32Å; R253-E261 IonicContact NH2-OE1 2.77Å
254S69.9Low68Low62 Ų6267.5 Ų67.543%0.43437%0.37SS..  trans-58.9136.9166.972.10000108.3E256 T257 L258S254-E256 PolarHBondContact O-N 3.38Å; S254-T257 PolarHBondContact O-N 3.39Å; S254-T257 PolarHBondContact O-OG1 3.41Å; S254-T257 PolarHBondContact OG-OG1 3.32Å; S254-L258 PolarHBondContact O-N 3.5Å
255L68.7Low68.2Low60 Ų6067.8 Ų67.831%0.31437%0.372SS..Hα-helixtrans-50.6-30.5179.2-175.7117.9000111.9R253 R259 R298 V301R253-L255 PolarHBondContact O-N 2.85Å; L255-R259 HydrophobicContact CD2-CG 4.47Å; L255-R259 WeakPolarHBondContact O-CB 3.39Å; L255-R259 VanDerWaalsContact O-CG 3.25Å; L255-R259 WeakPolarHBondContact O-CG 3.33Å; L255-R259 PolarHBondContact O-N 2.63Å; L255-R298 HydrophobicContact CD1-CB 4.17Å; L255-V301 HydrophobicContact CD1-CG2 4.47Å
256E72.3Confident68.3Low149 Ų14965.6 Ų65.670%0.69636%0.36SS*.Hα-helixtrans-65.1-39.4176.3-61.7180166.200113.3S254 R259 G260S254-E256 PolarHBondContact O-N 3.38Å; E256-R259 PolarHBondContact O-N 3.04Å; E256-G260 PolarHBondContact O-N 2.74Å
257T76.8Confident68.9Low65 Ų6563.6 Ų63.640%0.39935%0.348SS..Hα-helixtrans-65.9-44.8178.9-32.40000110.4S254 G260 E261S254-T257 PolarHBondContact O-N 3.39Å; S254-T257 PolarHBondContact O-OG1 3.41Å; S254-T257 PolarHBondContact OG-OG1 3.32Å; T257-G260 PolarHBondContact O-N 3.39Å; T257-E261 WeakPolarHBondContact O-CG 3.37Å; T257-E261 PolarHBondContact O-N 3.47Å
258L74.7Confident69.7Low10 Ų1063 Ų635%0.05235%0.345CS..Hα-helixtrans-63.9-44.3177.1-174.665.6000111.2L244 Q248 S254 G260 E261 V262 V301L244-L258 HydrophobicContact CD1-CD1 3.8Å; L244-L258 HydrophobicContact CD2-CD1 4.14Å; L244-L258 HydrophobicContact CG-CD1 3.68Å; Q248-L258 HydrophobicContact CG-CD1 4.25Å; Q248-L258 HydrophobicContact CG-CD2 4.28Å; S254-L258 PolarHBondContact O-N 3.5Å; L258-G260 VanDerWaalsContact C-N 3.3Å; L258-G260 PolarHBondContact O-N 3.39Å; L258-E261 PolarHBondContact O-N 2.79Å; L258-V262 VanDerWaalsContact O-CG2 3.3Å; L258-V262 WeakPolarHBondContact O-CG2 3.41Å; L258-V262 PolarHBondContact O-N 3.16Å; L258-V301 HydrophobicContact CD2-CB 4.28Å; L258-V301 HydrophobicContact CD2-CG1 3.43Å; L258-V301 VanDerWaalsContact CD2-CG1 3.43Å; L258-V301 HydrophobicContact CG-CG1 3.76Å
259R72.8Confident70.3Confident79 Ų7961.7 Ų61.730%0.29834%0.339SS..Hα-helixtrans-60.1-40.9174.6-74.8177.873.9-152.45.1111.9L255 E256 T263 L292 V301L255-R259 HydrophobicContact CD2-CG 4.47Å; L255-R259 WeakPolarHBondContact O-CB 3.39Å; L255-R259 VanDerWaalsContact O-CG 3.25Å; L255-R259 WeakPolarHBondContact O-CG 3.33Å; L255-R259 PolarHBondContact O-N 2.63Å; E256-R259 PolarHBondContact O-N 3.04Å; R259-T263 WeakPolarHBondContact O-CB 3.22Å; R259-T263 PolarHBondContact O-N 3.16Å; R259-T263 PolarHBondContact O-OG1 2.79Å; R259-L292 PolarHBondContact NH2-O 3.44Å; R259-V301 HydrophobicContact CG-CG2 4.22Å
260G76.9Confident71.1Confident37 Ų3757.4 Ų57.438%0.38132%0.317SS..Hα-helixtrans-57.7-50173.500000111.4E256 T257 L258 T263 Q264E256-G260 PolarHBondContact O-N 2.74Å; T257-G260 PolarHBondContact O-N 3.39Å; L258-G260 VanDerWaalsContact C-N 3.3Å; L258-G260 PolarHBondContact O-N 3.39Å; G260-T263 PolarHBondContact O-N 2.85Å; G260-Q264 VanDerWaalsContact O-CB 3.26Å; G260-Q264 WeakPolarHBondContact O-CB 3.41Å; G260-Q264 PolarHBondContact O-N 3.42Å
261E76.4Confident71.9Confident32 Ų3256.6 Ų56.615%0.1530%0.297CS..Hα-helixtrans-62.5-45.5178.9-69177.5156.900113.1N211 R253 T257 L258 T263 Q264 I265N211-E261 WeakPolarHBondContact ND2-CA 3.24Å; R253-E261 IonicContact CZ-OE1 2.97Å; R253-E261 IonicContact CZ-OE2 3.77Å; R253-E261 IonicContact NH1-OE1 3.2Å; R253-E261 PolarHBondContact NH1-OE1 3.44Å; R253-E261 IonicContact NH1-OE2 3.29Å; R253-E261 PolarHBondContact NH1-OE2 3.32Å; R253-E261 IonicContact NH2-OE1 2.77Å; T257-E261 WeakPolarHBondContact O-CG 3.37Å; T257-E261 PolarHBondContact O-N 3.47Å; L258-E261 PolarHBondContact O-N 2.79Å; E261-T263 PolarHBondContact O-N 2.89Å; E261-Q264 WeakPolarHBondContact O-CA 3.3Å; E261-Q264 WeakPolarHBondContact O-CB 3.18Å; E261-Q264 PolarHBondContact O-N 3.01Å; E261-Q264 VanDerWaalsContact O-N 3.1Å; E261-I265 WeakPolarHBondContact O-CG1 3.43Å; E261-I265 PolarHBondContact O-N 2.9Å
262V75.3Confident72.8Confident0 Ų049.9 Ų49.90%026%0.264CS..Hα-helixtrans-63.7-44.8177.9-177.40000111.4L244 L258 Q264 I265 I266 L292 V301 V304 T305 L308L244-V262 HydrophobicContact CD1-CB 4.49Å; L244-V262 HydrophobicContact CD1-CG2 3.35Å; L258-V262 VanDerWaalsContact O-CG2 3.3Å; L258-V262 WeakPolarHBondContact O-CG2 3.41Å; L258-V262 PolarHBondContact O-N 3.16Å; V262-Q264 PolarHBondContact O-N 3.02Å; V262-I265 PolarHBondContact O-N 2.79Å; V262-I266 HydrophobicContact CG1-CD1 3.96Å; V262-I266 HydrophobicContact CG1-CG1 4.43Å; V262-I266 VanDerWaalsContact O-CG1 3.32Å; V262-I266 WeakPolarHBondContact O-CG1 3.35Å; V262-I266 PolarHBondContact O-N 3.23Å; V262-L292 HydrophobicContact CB-CD1 3.78Å; V262-L292 HydrophobicContact CB-CD2 4.09Å; V262-L292 HydrophobicContact CG1-CD1 3.27Å; V262-L292 HydrophobicContact CG1-CD2 4.04Å; V262-L292 HydrophobicContact CG1-CG 4.29Å; V262-L292 HydrophobicContact CG2-CD1 4.41Å; V262-V301 HydrophobicContact CG2-CG1 4.31Å; V262-V304 HydrophobicContact CG1-CG1 4.05Å; V262-T305 HydrophobicContact CG2-CG2 3.82Å; V262-L308 HydrophobicContact CG1-CD1 3.65Å
263T76.5Confident73.6Confident64 Ų6444 Ų4439%0.39322%0.223SC..Hα-helixtrans-57-35.9175.7-52.40000110.4R259 G260 E261 I266 Q267 L292R259-T263 WeakPolarHBondContact O-CB 3.22Å; R259-T263 PolarHBondContact O-N 3.16Å; R259-T263 PolarHBondContact O-OG1 2.79Å; G260-T263 PolarHBondContact O-N 2.85Å; E261-T263 PolarHBondContact O-N 2.89Å; T263-I266 PolarHBondContact O-N 3.06Å; T263-Q267 PolarHBondContact O-N 3.26Å; T263-L292 WeakPolarHBondContact OG1-CD2 3.44Å
264Q77.3Confident74.3Confident63 Ų6344.9 Ų44.929%0.29423%0.234SC..Hα-helixtrans-74.3-39.7-177.5-155.862.193.100112.7N211 V213 G260 E261 V262 I266 Q267 M268N211-Q264 WeakPolarHBondContact OD1-CB 3.16Å; N211-Q264 WeakPolarHBondContact OD1-CG 3.46Å; V213-Q264 HydrophobicContact CB-CG 3.72Å; V213-Q264 HydrophobicContact CG2-CB 4.41Å; V213-Q264 VanDerWaalsContact CG2-CD 3.41Å; V213-Q264 HydrophobicContact CG2-CG 3.3Å; G260-Q264 VanDerWaalsContact O-CB 3.26Å; G260-Q264 WeakPolarHBondContact O-CB 3.41Å; G260-Q264 PolarHBondContact O-N 3.42Å; E261-Q264 WeakPolarHBondContact O-CA 3.3Å; E261-Q264 WeakPolarHBondContact O-CB 3.18Å; E261-Q264 PolarHBondContact O-N 3.01Å; E261-Q264 VanDerWaalsContact O-N 3.1Å; V262-Q264 PolarHBondContact O-N 3.02Å; Q264-I266 VanDerWaalsContact C-N 3.33Å; Q264-Q267 WeakPolarHBondContact O-CB 3.47Å; Q264-Q267 PolarHBondContact O-N 2.85Å; Q264-M268 PolarHBondContact O-N 3.02Å
265I75.1Confident74Confident11 Ų1147 Ų476%0.05624%0.24CC..Hα-helixtrans-60.5-43.5169.2-66.3170.9000110.7L237 A240 L244 E261 V262 Q267 M268 L269L237-I265 HydrophobicContact CD1-CG2 3.89Å; A240-I265 HydrophobicContact CB-CD1 4.16Å; A240-I265 HydrophobicContact CB-CG1 4.07Å; L244-I265 HydrophobicContact CD1-CD1 4.08Å; E261-I265 WeakPolarHBondContact O-CG1 3.43Å; E261-I265 PolarHBondContact O-N 2.9Å; V262-I265 PolarHBondContact O-N 2.79Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.18Å; I265-M268 HydrophobicContact CG2-CE 4.45Å; I265-M268 WeakPolarHBondContact O-CB 3.35Å; I265-M268 PolarHBondContact O-N 3.2Å; I265-L269 HydrophobicContact CG2-CD1 4.35Å; I265-L269 WeakPolarHBondContact O-CG 3.3Å; I265-L269 PolarHBondContact O-N 3.4Å
266I74.4Confident73.8Confident1 Ų148.9 Ų48.91%0.00525%0.248CC..Hα-helixtrans-61-41.4175.2-70.6169.3000110.6V262 T263 Q264 L269 R270 L285 I288 L292 L308V262-I266 HydrophobicContact CG1-CD1 3.96Å; V262-I266 HydrophobicContact CG1-CG1 4.43Å; V262-I266 VanDerWaalsContact O-CG1 3.32Å; V262-I266 WeakPolarHBondContact O-CG1 3.35Å; V262-I266 PolarHBondContact O-N 3.23Å; T263-I266 PolarHBondContact O-N 3.06Å; Q264-I266 VanDerWaalsContact C-N 3.33Å; I266-L269 WeakPolarHBondContact O-CB 3.42Å; I266-L269 PolarHBondContact O-N 3.42Å; I266-R270 WeakPolarHBondContact O-CG 3.45Å; I266-R270 PolarHBondContact O-N 3.17Å; I266-L285 HydrophobicContact CB-CD1 4.44Å; I266-L285 HydrophobicContact CG1-CD1 4.23Å; I266-L285 HydrophobicContact CG2-CD1 4.04Å; I266-L285 HydrophobicContact CG2-CD2 4.49Å; I266-L285 HydrophobicContact CG2-CG 4.07Å; I266-I288 HydrophobicContact CD1-CG2 4.07Å; I266-L292 HydrophobicContact CD1-CB 4.43Å; I266-L292 HydrophobicContact CD1-CD2 4.26Å; I266-L308 HydrophobicContact CG1-CD1 4.42Å; I266-L308 HydrophobicContact CG1-CD2 4.2Å
267Q77Confident73.4Confident56 Ų5644.9 Ų44.926%0.26225%0.247SC..Hα-helixtrans-64.5-41.8176.9-171.960.12900111.9V213 T263 Q264 I265 L269 R270 E271V213-Q267 HydrophobicContact CG1-CG 4.25Å; T263-Q267 PolarHBondContact O-N 3.26Å; Q264-Q267 WeakPolarHBondContact O-CB 3.47Å; Q264-Q267 PolarHBondContact O-N 2.85Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.18Å; Q267-L269 VanDerWaalsContact C-N 3.31Å; Q267-L269 PolarHBondContact O-N 3.47Å; Q267-R270 WeakPolarHBondContact O-CB 3.2Å; Q267-R270 PolarHBondContact O-N 2.96Å; Q267-E271 PolarHBondContact NE2-OE1 2.99Å; Q267-E271 WeakPolarHBondContact O-CG 2.99Å; Q267-E271 PolarHBondContact O-N 3.26Å; Q267-E271 VanDerWaalsContact O-N 3.08Å
268M78Confident72.9Confident12 Ų1245.4 Ų45.46%0.05925%0.245CC..Hα-helixtrans-58.1-45172171.1-177.377.300111.3A208 I216 L237 A240 Q264 I265 R270 E271 Y272A208-M268 HydrophobicContact CB-SD 4.17Å; I216-M268 HydrophobicContact CD1-SD 3.97Å; I216-M268 HydrophobicContact CG2-CB 3.98Å; I216-M268 HydrophobicContact CG2-CG 3.58Å; I216-M268 HydrophobicContact CG2-SD 4.08Å; L237-M268 HydrophobicContact CB-CE 4.17Å; L237-M268 HydrophobicContact CD1-CE 3.33Å; L237-M268 HydrophobicContact CG-CE 4.34Å; A240-M268 HydrophobicContact CB-CE 4.32Å; Q264-M268 PolarHBondContact O-N 3.02Å; I265-M268 HydrophobicContact CG2-CE 4.45Å; I265-M268 WeakPolarHBondContact O-CB 3.35Å; I265-M268 PolarHBondContact O-N 3.2Å; M268-R270 VanDerWaalsContact C-N 3.34Å; M268-R270 PolarHBondContact O-N 3.23Å; M268-E271 PolarHBondContact O-N 2.91Å; M268-Y272 PolarHBondContact O-N 3.02Å
269L72.6Confident72.3Confident3 Ų349 Ų492%0.01627%0.271CS..Hα-helixtrans-63.1-39.3177.6-77.8174.5000112.5L237 I265 I266 Q267 Y272 L273 L285 L308 F311L237-L269 HydrophobicContact CD1-CD1 4.08Å; L237-L269 HydrophobicContact CD1-CD2 3.67Å; L237-L269 HydrophobicContact CD1-CG 3.82Å; L237-L269 HydrophobicContact CD2-CD2 3.57Å; L237-L269 HydrophobicContact CG-CD2 4.25Å; I265-L269 HydrophobicContact CG2-CD1 4.35Å; I265-L269 WeakPolarHBondContact O-CG 3.3Å; I265-L269 PolarHBondContact O-N 3.4Å; I266-L269 WeakPolarHBondContact O-CB 3.42Å; I266-L269 PolarHBondContact O-N 3.42Å; Q267-L269 VanDerWaalsContact C-N 3.31Å; Q267-L269 PolarHBondContact O-N 3.47Å; L269-Y272 HydrophobicContact CD2-CD1 4.49Å; L269-Y272 PolarHBondContact O-N 3.21Å; L269-L273 WeakPolarHBondContact O-CB 3.45Å; L269-L273 VanDerWaalsContact O-CG 3.27Å; L269-L273 WeakPolarHBondContact O-CG 3.42Å; L269-L273 PolarHBondContact O-N 2.88Å; L269-L285 HydrophobicContact CB-CD1 3.96Å; L269-L285 HydrophobicContact CB-CD2 3.49Å; L269-L285 VanDerWaalsContact CB-CD2 3.49Å; L269-L285 HydrophobicContact CB-CG 4.39Å; L269-L285 HydrophobicContact CD1-CD1 3.75Å; L269-L308 HydrophobicContact CD1-CD2 3.76Å; L269-F311 HydrophobicContact CD1-CD1 4.46Å; L269-F311 HydrophobicContact CD2-CD1 4.33Å; L269-F311 HydrophobicContact CD2-CE1 3.95Å
270R74.9Confident72Confident62 Ų6250.4 Ų50.423%0.23428%0.281CS..Hα-helixtrans-59-48.4174.9-81.2-179.6166.9152.61.8110.8I266 Q267 M268 L273 N274 L285 E286 S289I266-R270 WeakPolarHBondContact O-CG 3.45Å; I266-R270 PolarHBondContact O-N 3.17Å; Q267-R270 WeakPolarHBondContact O-CB 3.2Å; Q267-R270 PolarHBondContact O-N 2.96Å; M268-R270 VanDerWaalsContact C-N 3.34Å; M268-R270 PolarHBondContact O-N 3.23Å; R270-L273 PolarHBondContact O-N 3.21Å; R270-N274 VanDerWaalsContact O-CB 3.3Å; R270-N274 WeakPolarHBondContact O-CB 3.23Å; R270-N274 PolarHBondContact O-N 3.05Å; R270-L285 HydrophobicContact CB-CD2 4.21Å; R270-L285 HydrophobicContact CG-CD2 3.54Å; R270-L285 HydrophobicContact CG-CG 4.37Å; R270-E286 IonicContact CZ-OE1 3.68Å; R270-E286 VanDerWaalsContact CZ-OE1 3.26Å; R270-E286 IonicContact CZ-OE2 3.77Å; R270-E286 IonicContact NE-OE1 2.63Å; R270-E286 PolarHBondContact NE-OE1 3.29Å; R270-E286 IonicContact NE-OE2 2.79Å; R270-E286 IonicContact NH2-OE1 3.85Å; R270-E286 PolarHBondContact NH2-OE1 2.95Å; R270-E286 VanDerWaalsContact NH2-OE1 3.08Å; R270-E286 IonicContact NH2-OE2 3.97Å; R270-E286 PolarHBondContact NH2-OE2 2.97Å; R270-S289 PolarHBondContact NH2-OG 2.97Å
271E74.3Confident71.4Confident42 Ų4249.3 Ų49.320%0.19627%0.268CS..Hα-helixtrans-64-41.1179-66.6-61.9166.600111.8T217 L220 Q267 M268 N274 L275T217-E271 HydrophobicContact CG2-CG 4.11Å; L220-E271 HydrophobicContact CD1-CB 3.68Å; Q267-E271 PolarHBondContact NE2-OE1 2.99Å; Q267-E271 WeakPolarHBondContact O-CG 2.99Å; Q267-E271 PolarHBondContact O-N 3.26Å; Q267-E271 VanDerWaalsContact O-N 3.08Å; M268-E271 PolarHBondContact O-N 2.91Å; E271-N274 WeakPolarHBondContact O-CB 3.22Å; E271-N274 PolarHBondContact O-N 3.08Å; E271-L275 WeakPolarHBondContact O-CG 3.41Å; E271-L275 PolarHBondContact O-N 3.29Å; E271-L275 VanDerWaalsContact O-N 3.17Å
272Y72.6Confident71Confident27 Ų2752.4 Ų52.411%0.10628%0.282CS..Hα-helixtrans-58.2-51.2173.3167.8-128.8000112.2V226 M268 L269 N274 L275 M276V226-Y272 HydrophobicContact CB-CD2 3.57Å; V226-Y272 HydrophobicContact CB-CE2 3.74Å; V226-Y272 HydrophobicContact CB-CG 4.2Å; V226-Y272 HydrophobicContact CG1-CD2 3.54Å; V226-Y272 HydrophobicContact CG1-CE2 4.21Å; V226-Y272 HydrophobicContact CG1-CG 4.05Å; V226-Y272 HydrophobicContact CG2-CD2 3.21Å; V226-Y272 HydrophobicContact CG2-CE2 2.95Å; V226-Y272 HydrophobicContact CG2-CG 4.26Å; M268-Y272 PolarHBondContact O-N 3.02Å; L269-Y272 HydrophobicContact CD2-CD1 4.49Å; L269-Y272 PolarHBondContact O-N 3.21Å; Y272-N274 VanDerWaalsContact C-N 3.27Å; Y272-N274 PolarHBondContact O-N 3.04Å; Y272-L275 WeakPolarHBondContact O-CB 3.17Å; Y272-L275 PolarHBondContact O-N 3.39Å; Y272-L275 VanDerWaalsContact O-N 3.15Å; Y272-M276 HydrophobicContact CD2-CG 3.82Å; Y272-M276 HydrophobicContact CE2-CG 3.23Å; Y272-M276 HydrophobicContact CE2-SD 3.98Å; Y272-M276 PolarHBondContact O-N 3.02Å; Y272-M276 VanDerWaalsContact O-N 3.11Å
273L69.9Low70.9Confident3 Ų359 Ų592%0.01631%0.312CS..Hα-helixtrans-67.1-30.3-178.8-68.6176.3000112.6L269 R270 L275 M276 G277 Q278 A281 L285 F311L269-L273 WeakPolarHBondContact O-CB 3.45Å; L269-L273 VanDerWaalsContact O-CG 3.27Å; L269-L273 WeakPolarHBondContact O-CG 3.42Å; L269-L273 PolarHBondContact O-N 2.88Å; R270-L273 PolarHBondContact O-N 3.21Å; L273-L275 VanDerWaalsContact C-N 3.3Å; L273-M276 PolarHBondContact O-N 3.07Å; L273-G277 PolarHBondContact O-N 3.45Å; L273-Q278 HydrophobicContact CD2-CB 4.25Å; L273-A281 HydrophobicContact CD1-CB 3.83Å; L273-A281 HydrophobicContact CD2-CB 3.63Å; L273-A281 HydrophobicContact CG-CB 4.37Å; L273-L285 HydrophobicContact CD1-CB 4.32Å; L273-L285 HydrophobicContact CD1-CD2 3.9Å; L273-F311 HydrophobicContact CD1-CZ 4.01Å; L273-F311 HydrophobicContact CD2-CZ 4.22Å
274N74.2Confident70.5Confident105 Ų10561.8 Ų61.856%0.56132%0.315SS*.Hα-helixtrans-63.1-38.7173.7-161.533.7000111.2R270 E271 Y272R270-N274 VanDerWaalsContact O-CB 3.3Å; R270-N274 WeakPolarHBondContact O-CB 3.23Å; R270-N274 PolarHBondContact O-N 3.05Å; E271-N274 WeakPolarHBondContact O-CB 3.22Å; E271-N274 PolarHBondContact O-N 3.08Å; Y272-N274 VanDerWaalsContact C-N 3.27Å; Y272-N274 PolarHBondContact O-N 3.04Å
275L64.1Low70.3Confident105 Ų10558.8 Ų58.855%0.5530%0.301SS..Hα-helixtrans-70.3-35.1174.5-68.5171.2000112.8L220 E271 Y272 L273L220-L275 HydrophobicContact CB-CD1 3.96Å; L220-L275 HydrophobicContact CD2-CD1 4.41Å; E271-L275 WeakPolarHBondContact O-CG 3.41Å; E271-L275 PolarHBondContact O-N 3.29Å; E271-L275 VanDerWaalsContact O-N 3.17Å; Y272-L275 WeakPolarHBondContact O-CB 3.17Å; Y272-L275 PolarHBondContact O-N 3.39Å; Y272-L275 VanDerWaalsContact O-N 3.15Å; L273-L275 VanDerWaalsContact C-N 3.3Å
276M63.3Low70.2Confident100 Ų10061.4 Ų61.449%0.49331%0.314SS..Hα-helixtrans-84.8-9.3-178.9-63.8-58.9-69.700114.4Y272 L273 Q278Y272-M276 HydrophobicContact CD2-CG 3.82Å; Y272-M276 HydrophobicContact CE2-CG 3.23Å; Y272-M276 HydrophobicContact CE2-SD 3.98Å; Y272-M276 PolarHBondContact O-N 3.02Å; Y272-M276 VanDerWaalsContact O-N 3.11Å; L273-M276 PolarHBondContact O-N 3.07Å; M276-Q278 HydrophobicContact CB-CG 4.13Å; M276-Q278 PolarHBondContact O-N 3.49Å
277G64.9Low70.4Confident65 Ų6566.6 Ų66.667%0.6734%0.338SS*.THydrogen-bonded Turntrans6616.7179.700000115.2L273 S279L273-G277 PolarHBondContact O-N 3.45Å; G277-S279 PolarHBondContact O-N 3.15Å
278Q65.4Low70.2Confident76 Ų7664.6 Ų64.636%0.35533%0.328SS..  trans-8491.2-176.1-66.3-174.50.600111.5L273 M276 E280 A281 K282L273-Q278 HydrophobicContact CD2-CB 4.25Å; M276-Q278 HydrophobicContact CB-CG 4.13Å; M276-Q278 PolarHBondContact O-N 3.49Å; Q278-E280 PolarHBondContact O-N 3.49Å; Q278-A281 HydrophobicContact CB-CB 4.12Å; Q278-K282 PolarHBondContact O-N 3.21Å
279S62Low70.1Confident85 Ų8564.2 Ų64.259%0.59433%0.327SS*.Hα-helixtrans-62.3-39.8-176.759.30000114G277 K282 E283G277-S279 PolarHBondContact O-N 3.15Å; S279-K282 VanDerWaalsContact O-CB 3.31Å; S279-K282 WeakPolarHBondContact O-CB 3.48Å; S279-K282 PolarHBondContact O-N 3.31Å; S279-E283 PolarHBondContact O-N 3.47Å
280E66Low70.3Confident109 Ų10966.7 Ų66.751%0.50934%0.342SS..Hα-helixtrans-68-40.4-177.4-166.5-170.5170.400112Q278 K282 E283 R284Q278-E280 PolarHBondContact O-N 3.49Å; E280-K282 VanDerWaalsContact C-N 3.25Å; E280-K282 PolarHBondContact O-N 3.16Å; E280-E283 PolarHBondContact O-N 3.3Å; E280-R284 WeakPolarHBondContact O-CG 3.07Å; E280-R284 PolarHBondContact O-N 3.08Å; E280-R284 IonicContact OE1-CZ 3.55Å; E280-R284 IonicContact OE1-NE 3.81Å; E280-R284 IonicContact OE1-NH2 2.69Å; E280-R284 PolarHBondContact OE1-NH2 3.35Å
281A65.4Low70.3Confident14 Ų1467.2 Ų67.212%0.11635%0.348CS..Hα-helixtrans-65.7-32.917500000111.4L273 Q278 L285 F311L273-A281 HydrophobicContact CD1-CB 3.83Å; L273-A281 HydrophobicContact CD2-CB 3.63Å; L273-A281 HydrophobicContact CG-CB 4.37Å; Q278-A281 HydrophobicContact CB-CB 4.12Å; A281-L285 WeakPolarHBondContact O-CB 3.37Å; A281-L285 PolarHBondContact O-N 2.75Å; A281-F311 HydrophobicContact CB-CE2 3.97Å; A281-F311 HydrophobicContact CB-CZ 4.03Å
282K67.7Low70.1Confident98 Ų9865.4 Ų65.443%0.42634%0.339SS..Hα-helixtrans-65.4-46175.7-174.5-178.6179.5177.40111.3Q278 S279 E280 R284 L285 E286Q278-K282 PolarHBondContact O-N 3.21Å; S279-K282 VanDerWaalsContact O-CB 3.31Å; S279-K282 WeakPolarHBondContact O-CB 3.48Å; S279-K282 PolarHBondContact O-N 3.31Å; E280-K282 VanDerWaalsContact C-N 3.25Å; E280-K282 PolarHBondContact O-N 3.16Å; K282-R284 VanDerWaalsContact C-N 3.34Å; K282-R284 PolarHBondContact O-N 2.78Å; K282-L285 PolarHBondContact O-N 3.33Å; K282-E286 WeakPolarHBondContact O-CG 3.44Å; K282-E286 PolarHBondContact O-N 2.83Å
283E72.3Confident69.9Low138 Ų13870.3 Ų70.365%0.64536%0.363SS*.Hα-helixtrans-61.1-41.9177.3-72.2177.9-174.200112.5S279 E280 L285 E286 H287S279-E283 PolarHBondContact O-N 3.47Å; E280-E283 PolarHBondContact O-N 3.3Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.11Å; E283-E286 PolarHBondContact O-N 2.88Å; E283-H287 PolarHBondContact O-N 2.77Å
284R70.1Confident69.7Low122 Ų12276.7 Ų76.746%0.4639%0.393SS..Hα-helixtrans-62.5-40.6175-66.7178.2-171.3-170.92.6111.7E280 K282 H287 I288E280-R284 WeakPolarHBondContact O-CG 3.07Å; E280-R284 PolarHBondContact O-N 3.08Å; E280-R284 IonicContact OE1-CZ 3.55Å; E280-R284 IonicContact OE1-NE 3.81Å; E280-R284 IonicContact OE1-NH2 2.69Å; E280-R284 PolarHBondContact OE1-NH2 3.35Å; K282-R284 VanDerWaalsContact C-N 3.34Å; K282-R284 PolarHBondContact O-N 2.78Å; R284-H287 WeakPolarHBondContact O-CB 3.48Å; R284-H287 PolarHBondContact O-N 3.24Å; R284-I288 VanDerWaalsContact O-CG1 3.32Å; R284-I288 WeakPolarHBondContact O-CG1 3.32Å; R284-I288 PolarHBondContact O-N 2.78Å
285L71.8Confident69.2Low0 Ų072 Ų720%037%0.368CS..Hα-helixtrans-69.1-37.2176.6-171.668.3000112.4I266 L269 R270 L273 A281 K282 E283 H287 I288 S289 L308I266-L285 HydrophobicContact CB-CD1 4.44Å; I266-L285 HydrophobicContact CG1-CD1 4.23Å; I266-L285 HydrophobicContact CG2-CD1 4.04Å; I266-L285 HydrophobicContact CG2-CD2 4.49Å; I266-L285 HydrophobicContact CG2-CG 4.07Å; L269-L285 HydrophobicContact CB-CD1 3.96Å; L269-L285 HydrophobicContact CB-CD2 3.49Å; L269-L285 VanDerWaalsContact CB-CD2 3.49Å; L269-L285 HydrophobicContact CB-CG 4.39Å; L269-L285 HydrophobicContact CD1-CD1 3.75Å; R270-L285 HydrophobicContact CB-CD2 4.21Å; R270-L285 HydrophobicContact CG-CD2 3.54Å; R270-L285 HydrophobicContact CG-CG 4.37Å; L273-L285 HydrophobicContact CD1-CB 4.32Å; L273-L285 HydrophobicContact CD1-CD2 3.9Å; A281-L285 WeakPolarHBondContact O-CB 3.37Å; A281-L285 PolarHBondContact O-N 2.75Å; K282-L285 PolarHBondContact O-N 3.33Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.11Å; L285-H287 VanDerWaalsContact C-N 3.32Å; L285-I288 PolarHBondContact O-N 3Å; L285-S289 WeakPolarHBondContact O-CB 3.47Å; L285-S289 PolarHBondContact O-N 2.85Å; L285-L308 HydrophobicContact CD1-CD2 4.35Å
286E73.7Confident69.2Low67 Ų6777.6 Ų77.631%0.31338%0.381SS..Hα-helixtrans-61.1-42.6171.7-72.7-55.4141.200111R270 K282 E283 I288 S289 T290R270-E286 IonicContact CZ-OE1 3.68Å; R270-E286 VanDerWaalsContact CZ-OE1 3.26Å; R270-E286 IonicContact CZ-OE2 3.77Å; R270-E286 IonicContact NE-OE1 2.63Å; R270-E286 PolarHBondContact NE-OE1 3.29Å; R270-E286 IonicContact NE-OE2 2.79Å; R270-E286 IonicContact NH2-OE1 3.85Å; R270-E286 PolarHBondContact NH2-OE1 2.95Å; R270-E286 VanDerWaalsContact NH2-OE1 3.08Å; R270-E286 IonicContact NH2-OE2 3.97Å; R270-E286 PolarHBondContact NH2-OE2 2.97Å; K282-E286 WeakPolarHBondContact O-CG 3.44Å; K282-E286 PolarHBondContact O-N 2.83Å; E283-E286 PolarHBondContact O-N 2.88Å; E286-I288 PolarHBondContact O-N 3.22Å; E286-S289 WeakPolarHBondContact O-CB 3.19Å; E286-S289 PolarHBondContact O-N 3Å; E286-T290 WeakPolarHBondContact O-CG2 3.07Å; E286-T290 PolarHBondContact O-N 2.89Å; E286-T290 PolarHBondContact O-OG1 2.96Å
287H78.1Confident69.5Low110 Ų11075.6 Ų75.651%0.50938%0.375SS..Hα-helixtrans-60-47.8174.6-17061000111.5E283 R284 L285 S289 T290 Q291E283-H287 PolarHBondContact O-N 2.77Å; R284-H287 WeakPolarHBondContact O-CB 3.48Å; R284-H287 PolarHBondContact O-N 3.24Å; L285-H287 VanDerWaalsContact C-N 3.32Å; H287-S289 VanDerWaalsContact C-N 3.34Å; H287-S289 PolarHBondContact O-N 3.2Å; H287-T290 PolarHBondContact O-N 3.43Å; H287-T290 PolarHBondContact O-OG1 3.12Å; H287-Q291 PolarHBondContact NE2-NE2 3.35Å; H287-Q291 WeakPolarHBondContact O-CG 3.44Å; H287-Q291 PolarHBondContact O-N 2.93Å
288I74Confident69.7Low13 Ų1378.7 Ų78.77%0.06737%0.366CS..Hα-helixtrans-60.9-42.5176.2-66.3167000111.2I266 R284 L285 E286 T290 Q291 L292 V304 L307 L308I266-I288 HydrophobicContact CD1-CG2 4.07Å; R284-I288 VanDerWaalsContact O-CG1 3.32Å; R284-I288 WeakPolarHBondContact O-CG1 3.32Å; R284-I288 PolarHBondContact O-N 2.78Å; L285-I288 PolarHBondContact O-N 3Å; E286-I288 PolarHBondContact O-N 3.22Å; I288-T290 VanDerWaalsContact C-N 3.33Å; I288-T290 PolarHBondContact O-N 3.21Å; I288-Q291 PolarHBondContact O-N 3.43Å; I288-L292 PolarHBondContact O-N 3.43Å; I288-V304 HydrophobicContact CG2-CG1 3.6Å; I288-L307 HydrophobicContact CD1-CB 4.29Å; I288-L307 HydrophobicContact CG1-CB 4.43Å; I288-L308 HydrophobicContact CG2-CD2 4.23Å; I288-L308 HydrophobicContact CG2-CG 4.34Å
289S73.9Confident70Confident4 Ų481.7 Ų81.73%0.02838%0.381CS..Hα-helixtrans-61.3-41.7175.7-174.40000111.9R270 L285 E286 H287 L292 Q293R270-S289 PolarHBondContact NH2-OG 2.97Å; L285-S289 WeakPolarHBondContact O-CB 3.47Å; L285-S289 PolarHBondContact O-N 2.85Å; E286-S289 WeakPolarHBondContact O-CB 3.19Å; E286-S289 PolarHBondContact O-N 3Å; H287-S289 VanDerWaalsContact C-N 3.34Å; H287-S289 PolarHBondContact O-N 3.2Å; S289-L292 PolarHBondContact O-N 2.97Å; S289-Q293 WeakPolarHBondContact O-CG 3.32Å; S289-Q293 PolarHBondContact O-N 3.15Å; S289-Q293 VanDerWaalsContact O-N 3.13Å
290T78.1Confident70.4Confident56 Ų5681 Ų8134%0.34437%0.368SS..Hα-helixtrans-67.1-42.3177.764.90000110.2E286 H287 I288 L292 Q293 H294E286-T290 WeakPolarHBondContact O-CG2 3.07Å; E286-T290 PolarHBondContact O-N 2.89Å; E286-T290 PolarHBondContact O-OG1 2.96Å; H287-T290 PolarHBondContact O-N 3.43Å; H287-T290 PolarHBondContact O-OG1 3.12Å; I288-T290 VanDerWaalsContact C-N 3.33Å; I288-T290 PolarHBondContact O-N 3.21Å; T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 2.86Å; T290-Q293 WeakPolarHBondContact O-CB 3.39Å; T290-Q293 PolarHBondContact O-N 2.98Å; T290-Q293 VanDerWaalsContact O-N 3.13Å; T290-H294 PolarHBondContact O-N 3.44Å; T290-H294 PolarHBondContact O-ND1 3.13Å
291Q73.4Confident70.6Confident73 Ų7375.9 Ų75.934%0.34134%0.344SS..Hα-helixtrans-58.5-44.4174.7-72.9-169.2-2900111.2H287 I288 Q293 H294 T295 V304H287-Q291 PolarHBondContact NE2-NE2 3.35Å; H287-Q291 WeakPolarHBondContact O-CG 3.44Å; H287-Q291 PolarHBondContact O-N 2.93Å; I288-Q291 PolarHBondContact O-N 3.43Å; Q291-Q293 VanDerWaalsContact C-N 3.29Å; Q291-Q293 PolarHBondContact O-N 3.09Å; Q291-H294 CarbonylContact O-C 3.5Å; Q291-H294 WeakPolarHBondContact O-CA 2.99Å; Q291-H294 PolarHBondContact O-N 2.98Å; Q291-T295 WeakPolarHBondContact O-CG2 3.25Å; Q291-T295 PolarHBondContact O-N 2.92Å; Q291-V304 HydrophobicContact CB-CG2 4.33Å
292L71Confident71.1Confident4 Ų477.5 Ų77.52%0.02135%0.351CS..Hα-helixtrans-59.2-34.4175.7-156.495.8000114.2R259 V262 T263 I266 I288 S289 T290 H294 T295 V304R259-L292 PolarHBondContact NH2-O 3.44Å; V262-L292 HydrophobicContact CB-CD1 3.78Å; V262-L292 HydrophobicContact CB-CD2 4.09Å; V262-L292 HydrophobicContact CG1-CD1 3.27Å; V262-L292 HydrophobicContact CG1-CD2 4.04Å; V262-L292 HydrophobicContact CG1-CG 4.29Å; V262-L292 HydrophobicContact CG2-CD1 4.41Å; T263-L292 WeakPolarHBondContact OG1-CD2 3.44Å; I266-L292 HydrophobicContact CD1-CB 4.43Å; I266-L292 HydrophobicContact CD1-CD2 4.26Å; I288-L292 PolarHBondContact O-N 3.43Å; S289-L292 PolarHBondContact O-N 2.97Å; T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 2.86Å; L292-H294 PolarHBondContact O-N 3.16Å; L292-T295 PolarHBondContact O-N 3.38Å; L292-T295 PolarHBondContact O-OG1 3.45Å; L292-V304 HydrophobicContact CD1-CB 3.99Å; L292-V304 HydrophobicContact CD1-CG1 3.42Å; L292-V304 VanDerWaalsContact CD1-CG1 3.42Å; L292-V304 HydrophobicContact CD1-CG2 4.23Å
293Q68.4Low71.5Confident129 Ų12978.7 Ų78.760%0.60336%0.358SS*.Hα-helixtrans-68.5-27.7176.2-73.1177.6-400112S289 T290 Q291S289-Q293 WeakPolarHBondContact O-CG 3.32Å; S289-Q293 PolarHBondContact O-N 3.15Å; S289-Q293 VanDerWaalsContact O-N 3.13Å; T290-Q293 WeakPolarHBondContact O-CB 3.39Å; T290-Q293 PolarHBondContact O-N 2.98Å; T290-Q293 VanDerWaalsContact O-N 3.13Å; Q291-Q293 VanDerWaalsContact C-N 3.29Å; Q291-Q293 PolarHBondContact O-N 3.09Å
294H65.7Low71.6Confident138 Ų13872.2 Ų72.264%0.63933%0.328SS*.Hα-helixtrans-97.8-2.9-179.1-60.580.5000113.4T290 Q291 L292 R296T290-H294 PolarHBondContact O-N 3.44Å; T290-H294 PolarHBondContact O-ND1 3.13Å; Q291-H294 CarbonylContact O-C 3.5Å; Q291-H294 WeakPolarHBondContact O-CA 2.99Å; Q291-H294 PolarHBondContact O-N 2.98Å; L292-H294 PolarHBondContact O-N 3.16Å; H294-R296 PolarHBondContact O-N 2.93Å
295T63.6Low71.8Confident7 Ų766.7 Ų66.74%0.04331%0.308CS..  trans-71.7119176.960.70000111.2Q291 L292 Q300 V304Q291-T295 WeakPolarHBondContact O-CG2 3.25Å; Q291-T295 PolarHBondContact O-N 2.92Å; L292-T295 PolarHBondContact O-N 3.38Å; L292-T295 PolarHBondContact O-OG1 3.45Å; T295-Q300 VanDerWaalsContact CA-OE1 3.23Å; T295-Q300 HydrophobicContact CG2-CB 3.44Å; T295-Q300 VanDerWaalsContact CG2-CB 3.44Å; T295-V304 HydrophobicContact CG2-CG2 4.21Å
296R64.5Low72.2Confident221 Ų22171.8 Ų71.883%0.83434%0.335SS*.  trans-107.5-17.2176.8-64.3-178.6-1781740.7112.6H294H294-R296 PolarHBondContact O-N 2.93Å
297T70.2Confident72.4Confident59 Ų5971.8 Ų71.836%0.36234%0.337SS..SBendtrans-120160.1-176.866.30000111.6E299 Q300T297-E299 VanDerWaalsContact C-N 3.34Å; T297-Q300 PolarHBondContact O-N 2.95Å; T297-Q300 WeakPolarHBondContact OG1-CG 3.35Å; T297-Q300 PolarHBondContact OG1-OE1 2.84Å
298R68.4Low72.3Confident129 Ų12967.1 Ų67.149%0.48732%0.315SS..Hα-helixtrans-62.1-41.1179.5-178.7178.8168.4112.3-2.2112.2Q248 L255 Q300 V301 D302Q248-R298 PolarHBondContact O-NH2 3.45Å; Q248-R298 VanDerWaalsContact O-NH2 3.16Å; L255-R298 HydrophobicContact CD1-CB 4.17Å; R298-Q300 VanDerWaalsContact C-N 3.27Å; R298-Q300 PolarHBondContact O-N 3.44Å; R298-V301 WeakPolarHBondContact O-CA 3.5Å; R298-V301 WeakPolarHBondContact O-CB 3.47Å; R298-V301 PolarHBondContact O-N 3.33Å; R298-D302 PolarHBondContact O-N 3.33Å
299E71.3Confident72.3Confident140 Ų14067 Ų6765%0.65432%0.316SS*.Hα-helixtrans-56.1-41.2179.3-64.8147.1174.800112T297 V301 D302 E303T297-E299 VanDerWaalsContact C-N 3.34Å; E299-V301 VanDerWaalsContact C-N 3.28Å; E299-V301 PolarHBondContact O-N 2.93Å; E299-D302 PolarHBondContact O-N 3.43Å; E299-E303 WeakPolarHBondContact O-CG 3.25Å; E299-E303 PolarHBondContact O-N 3.28Å
300Q70Confident72.4Confident71 Ų7170 Ų7033%0.33234%0.338SS..Hα-helixtrans-69.2-27.2178.5-62.8174.9-41.300112.6T295 T297 R298 V304T295-Q300 VanDerWaalsContact CA-OE1 3.23Å; T295-Q300 HydrophobicContact CG2-CB 3.44Å; T295-Q300 VanDerWaalsContact CG2-CB 3.44Å; T297-Q300 PolarHBondContact O-N 2.95Å; T297-Q300 WeakPolarHBondContact OG1-CG 3.35Å; T297-Q300 PolarHBondContact OG1-OE1 2.84Å; R298-Q300 VanDerWaalsContact C-N 3.27Å; R298-Q300 PolarHBondContact O-N 3.44Å; Q300-V304 VanDerWaalsContact O-CG2 3.31Å; Q300-V304 WeakPolarHBondContact O-CG2 3Å; Q300-V304 PolarHBondContact O-N 2.82Å; Q300-V304 VanDerWaalsContact O-N 3.17Å
301V71.2Confident72.1Confident0 Ų068.2 Ų68.20%033%0.325CS..Hα-helixtrans-74.7-36.9174.3-177.60000110.6L255 L258 R259 V262 R298 E299 V304 T305L255-V301 HydrophobicContact CD1-CG2 4.47Å; L258-V301 HydrophobicContact CD2-CB 4.28Å; L258-V301 HydrophobicContact CD2-CG1 3.43Å; L258-V301 VanDerWaalsContact CD2-CG1 3.43Å; L258-V301 HydrophobicContact CG-CG1 3.76Å; R259-V301 HydrophobicContact CG-CG2 4.22Å; V262-V301 HydrophobicContact CG2-CG1 4.31Å; R298-V301 WeakPolarHBondContact O-CA 3.5Å; R298-V301 WeakPolarHBondContact O-CB 3.47Å; R298-V301 PolarHBondContact O-N 3.33Å; E299-V301 VanDerWaalsContact C-N 3.28Å; E299-V301 PolarHBondContact O-N 2.93Å; V301-V304 PolarHBondContact O-N 2.86Å; V301-T305 WeakPolarHBondContact O-CG2 3.4Å; V301-T305 PolarHBondContact O-N 3.28Å; V301-T305 PolarHBondContact O-OG1 2.85Å
302D75.2Confident71.9Confident48 Ų4865 Ų6526%0.25731%0.31SS..Hα-helixtrans-64.4-42.6174.1-63.5-23.7000110.6Q248 R298 E299 V304 T305 D306Q248-D302 PolarHBondContact NE2-OD1 3Å; R298-D302 PolarHBondContact O-N 3.33Å; E299-D302 PolarHBondContact O-N 3.43Å; D302-V304 PolarHBondContact O-N 2.82Å; D302-T305 VanDerWaalsContact CA-OG1 3.28Å; D302-T305 WeakPolarHBondContact CA-OG1 3.4Å; D302-T305 PolarHBondContact O-N 3.46Å; D302-T305 VanDerWaalsContact O-N 3.16Å; D302-T305 PolarHBondContact O-OG1 3.07Å; D302-D306 PolarHBondContact O-N 2.95Å
303E76.3Confident71.8Confident123 Ų12367.9 Ų67.958%0.57533%0.331SS*.Hα-helixtrans-58.5-44.2172.4-72.5173.9-168.600112.9E299 T305 D306 L307E299-E303 WeakPolarHBondContact O-CG 3.25Å; E299-E303 PolarHBondContact O-N 3.28Å; E303-T305 VanDerWaalsContact C-N 3.31Å; E303-T305 PolarHBondContact O-N 3.29Å; E303-D306 PolarHBondContact O-N 3.38Å; E303-L307 WeakPolarHBondContact O-CG 2.98Å; E303-L307 PolarHBondContact O-N 2.89Å
304V74.1Confident71.8Confident3 Ų365.1 Ų65.12%0.01832%0.32CS..Hα-helixtrans-65.8-36.2177.6170.70000111.5V262 I288 Q291 L292 T295 Q300 V301 D302 L307 L308V262-V304 HydrophobicContact CG1-CG1 4.05Å; I288-V304 HydrophobicContact CG2-CG1 3.6Å; Q291-V304 HydrophobicContact CB-CG2 4.33Å; L292-V304 HydrophobicContact CD1-CB 3.99Å; L292-V304 HydrophobicContact CD1-CG1 3.42Å; L292-V304 VanDerWaalsContact CD1-CG1 3.42Å; L292-V304 HydrophobicContact CD1-CG2 4.23Å; T295-V304 HydrophobicContact CG2-CG2 4.21Å; Q300-V304 VanDerWaalsContact O-CG2 3.31Å; Q300-V304 WeakPolarHBondContact O-CG2 3Å; Q300-V304 PolarHBondContact O-N 2.82Å; Q300-V304 VanDerWaalsContact O-N 3.17Å; V301-V304 PolarHBondContact O-N 2.86Å; D302-V304 PolarHBondContact O-N 2.82Å; V304-L307 PolarHBondContact O-N 3.26Å; V304-L308 HydrophobicContact CG1-CD1 4.34Å; V304-L308 WeakPolarHBondContact O-CG 3.26Å; V304-L308 PolarHBondContact O-N 3.48Å
305T75.9Confident71.6Confident6 Ų659.8 Ų59.84%0.03730%0.298CS..Hα-helixtrans-72.5-32.3178.746.60000112.4L244 Q248 V262 V301 D302 E303 L308 A309L244-T305 HydrophobicContact CD1-CG2 3.83Å; L244-T305 HydrophobicContact CD2-CG2 3.37Å; L244-T305 HydrophobicContact CG-CG2 4.28Å; Q248-T305 PolarHBondContact NE2-OG1 3.23Å; V262-T305 HydrophobicContact CG2-CG2 3.82Å; V301-T305 WeakPolarHBondContact O-CG2 3.4Å; V301-T305 PolarHBondContact O-N 3.28Å; V301-T305 PolarHBondContact O-OG1 2.85Å; D302-T305 VanDerWaalsContact CA-OG1 3.28Å; D302-T305 WeakPolarHBondContact CA-OG1 3.4Å; D302-T305 PolarHBondContact O-N 3.46Å; D302-T305 VanDerWaalsContact O-N 3.16Å; D302-T305 PolarHBondContact O-OG1 3.07Å; E303-T305 VanDerWaalsContact C-N 3.31Å; E303-T305 PolarHBondContact O-N 3.29Å; T305-L308 PolarHBondContact O-N 3.35Å; T305-A309 PolarHBondContact O-N 3.24Å
306D79.9Confident71.5Confident106 Ų10661.9 Ų61.957%0.56731%0.309SS*.Hα-helixtrans-68.2-37.8167.9-78-18.5000112.7D302 E303 A309 S310D302-D306 PolarHBondContact O-N 2.95Å; E303-D306 PolarHBondContact O-N 3.38Å; D306-A309 WeakPolarHBondContact O-CB 3.01Å; D306-A309 PolarHBondContact O-N 3.37Å; D306-A309 VanDerWaalsContact O-N 3.16Å; D306-S310 PolarHBondContact O-N 3.04Å
307L77.4Confident71.4Confident68 Ų6857.5 Ų57.536%0.35630%0.298SS..Hα-helixtrans-63.1-43.1172.4-75.2168.1000111.3I288 E303 V304 A309 S310 F311I288-L307 HydrophobicContact CD1-CB 4.29Å; I288-L307 HydrophobicContact CG1-CB 4.43Å; E303-L307 WeakPolarHBondContact O-CG 2.98Å; E303-L307 PolarHBondContact O-N 2.89Å; V304-L307 PolarHBondContact O-N 3.26Å; L307-A309 VanDerWaalsContact C-N 3.28Å; L307-A309 PolarHBondContact O-N 3.25Å; L307-S310 PolarHBondContact O-N 3.17Å; L307-S310 PolarHBondContact O-OG 2.84Å; L307-F311 PolarHBondContact O-N 3.48Å; L307-F311 VanDerWaalsContact O-N 3.15Å
308L75.5Confident71Confident11 Ų1160 Ų606%0.05830%0.304CS..Hα-helixtrans-61.2-37.5172.4-72171.3000111.7V262 I266 L269 L285 I288 V304 T305 S310 F311 T312V262-L308 HydrophobicContact CG1-CD1 3.65Å; I266-L308 HydrophobicContact CG1-CD1 4.42Å; I266-L308 HydrophobicContact CG1-CD2 4.2Å; L269-L308 HydrophobicContact CD1-CD2 3.76Å; L285-L308 HydrophobicContact CD1-CD2 4.35Å; I288-L308 HydrophobicContact CG2-CD2 4.23Å; I288-L308 HydrophobicContact CG2-CG 4.34Å; V304-L308 HydrophobicContact CG1-CD1 4.34Å; V304-L308 WeakPolarHBondContact O-CG 3.26Å; V304-L308 PolarHBondContact O-N 3.48Å; T305-L308 PolarHBondContact O-N 3.35Å; L308-S310 PolarHBondContact O-N 3.4Å; L308-F311 WeakPolarHBondContact O-CB 3.39Å; L308-F311 PolarHBondContact O-N 3.47Å; L308-T312 VanDerWaalsContact O-CG2 3.24Å; L308-T312 WeakPolarHBondContact O-CG2 3.26Å; L308-T312 PolarHBondContact O-N 3.13Å; L308-T312 VanDerWaalsContact O-N 3.09Å
309A74Confident70.5Confident10 Ų1056.4 Ų56.48%0.08329%0.292CS..Hα-helixtrans-58-47.4173.500000112.6T305 D306 L307 F311 T312 S313T305-A309 PolarHBondContact O-N 3.24Å; D306-A309 WeakPolarHBondContact O-CB 3.01Å; D306-A309 PolarHBondContact O-N 3.37Å; D306-A309 VanDerWaalsContact O-N 3.16Å; L307-A309 VanDerWaalsContact C-N 3.28Å; L307-A309 PolarHBondContact O-N 3.25Å; A309-F311 PolarHBondContact O-N 2.76Å; A309-T312 PolarHBondContact O-N 3.25Å; A309-T312 PolarHBondContact O-OG1 3.17Å; A309-S313 PolarHBondContact O-N 2.95Å; A309-S313 PolarHBondContact O-OG 2.73Å
310S76.9Confident70Confident69 Ų6954.5 Ų54.548%0.48329%0.286SS..Hα-helixtrans-60.5-38.5178.879.50000111.3D306 L307 L308 S313 L314D306-S310 PolarHBondContact O-N 3.04Å; L307-S310 PolarHBondContact O-N 3.17Å; L307-S310 PolarHBondContact O-OG 2.84Å; L308-S310 PolarHBondContact O-N 3.4Å; S310-S313 PolarHBondContact O-N 2.82Å; S310-L314 WeakPolarHBondContact O-CB 3.15Å; S310-L314 PolarHBondContact O-N 3.36Å
311F71.8Confident69.4Low17 Ų1756.8 Ų56.88%0.07530%0.301CS..Hα-helixtrans-64-44.1177.7-172.2-90.7000112.2L269 L273 A281 L307 L308 A309 L314 S315L269-F311 HydrophobicContact CD1-CD1 4.46Å; L269-F311 HydrophobicContact CD2-CD1 4.33Å; L269-F311 HydrophobicContact CD2-CE1 3.95Å; L273-F311 HydrophobicContact CD1-CZ 4.01Å; L273-F311 HydrophobicContact CD2-CZ 4.22Å; A281-F311 HydrophobicContact CB-CE2 3.97Å; A281-F311 HydrophobicContact CB-CZ 4.03Å; L307-F311 PolarHBondContact O-N 3.48Å; L307-F311 VanDerWaalsContact O-N 3.15Å; L308-F311 WeakPolarHBondContact O-CB 3.39Å; L308-F311 PolarHBondContact O-N 3.47Å; A309-F311 PolarHBondContact O-N 2.76Å; F311-L314 PolarHBondContact O-N 3.47Å; F311-S315 PolarHBondContact O-N 3.44Å
312T69.2Low68.6Low5 Ų563.5 Ų63.53%0.03134%0.336CS..Hα-helixtrans-63.4-42.8177.766.10000112.2L237 L308 A309 S315 L316L237-T312 HydrophobicContact CD2-CG2 3.34Å; L237-T312 HydrophobicContact CG-CG2 3.66Å; L308-T312 VanDerWaalsContact O-CG2 3.24Å; L308-T312 WeakPolarHBondContact O-CG2 3.26Å; L308-T312 PolarHBondContact O-N 3.13Å; L308-T312 VanDerWaalsContact O-N 3.09Å; A309-T312 PolarHBondContact O-N 3.25Å; A309-T312 PolarHBondContact O-OG1 3.17Å; T312-S315 PolarHBondContact O-N 2.81Å; T312-L316 PolarHBondContact O-N 3.29Å
313S69.3Low67.6Low65 Ų6565.4 Ų65.446%0.45536%0.359SS..Hα-helixtrans-66.1-42-179.3-55.40000111.1A309 S310 L316 Q317A309-S313 PolarHBondContact O-N 2.95Å; A309-S313 PolarHBondContact O-OG 2.73Å; S310-S313 PolarHBondContact O-N 2.82Å; S313-L316 PolarHBondContact O-N 3.24Å; S313-Q317 PolarHBondContact O-N 2.78Å
314L66.6Low66Low71 Ų7172.7 Ų72.737%0.37238%0.381SS..Hα-helixtrans-66.5-41.4177.1-172.971.6000112.1S310 F311 L316 Q317 K318S310-L314 WeakPolarHBondContact O-CB 3.15Å; S310-L314 PolarHBondContact O-N 3.36Å; F311-L314 PolarHBondContact O-N 3.47Å; L314-L316 VanDerWaalsContact C-N 3.3Å; L314-L316 PolarHBondContact O-N 2.73Å; L314-Q317 PolarHBondContact O-N 3.12Å; L314-K318 PolarHBondContact O-N 2.91Å
315S63.3Low65.6Low26 Ų2676.2 Ų76.218%0.18240%0.399CS..Hα-helixtrans-57.8-44.1173.3-900000111.5F311 T312 Q317 K318 Q319F311-S315 PolarHBondContact O-N 3.44Å; T312-S315 PolarHBondContact O-N 2.81Å; S315-Q317 VanDerWaalsContact C-N 3.34Å; S315-Q317 PolarHBondContact O-N 3.37Å; S315-K318 PolarHBondContact O-N 3.14Å; S315-Q319 WeakPolarHBondContact O-CG 3.33Å; S315-Q319 PolarHBondContact O-N 3.25Å
316L61.6Low65.1Low51 Ų5179.8 Ų79.827%0.26742%0.418SS..Hα-helixtrans-65.9-37.3178.9-149110.4000112.2T235 H238 T312 S313 L314 Q319 N320T235-L316 HydrophobicContact CG2-CD1 4.39Å; H238-L316 WeakPolarHBondContact CE1-CD1 3.18Å; T312-L316 PolarHBondContact O-N 3.29Å; S313-L316 PolarHBondContact O-N 3.24Å; L314-L316 VanDerWaalsContact C-N 3.3Å; L314-L316 PolarHBondContact O-N 2.73Å; L316-Q319 PolarHBondContact O-N 3.14Å; L316-N320 PolarHBondContact O-N 2.85Å; L316-N320 PolarHBondContact O-ND2 3.45Å
317Q61.3Low64.2Low130 Ų13078.4 Ų78.461%0.60741%0.41SS*.Hα-helixtrans-62.8-43.9175.1-112.9179.9-22.500112.3S313 L314 S315 N320 L321S313-Q317 PolarHBondContact O-N 2.78Å; L314-Q317 PolarHBondContact O-N 3.12Å; S315-Q317 VanDerWaalsContact C-N 3.34Å; S315-Q317 PolarHBondContact O-N 3.37Å; Q317-N320 PolarHBondContact O-N 3.12Å; Q317-L321 WeakPolarHBondContact O-CG 2.99Å; Q317-L321 PolarHBondContact O-N 2.89Å
318K62Low63.5Low112 Ų11279 Ų7949%0.48741%0.413SS..Hα-helixtrans-62-43174.8-81.4-172.7165.7-1740111.7L314 S315 N320 L321 D322L314-K318 PolarHBondContact O-N 2.91Å; S315-K318 PolarHBondContact O-N 3.14Å; K318-N320 PolarHBondContact O-N 2.91Å; K318-L321 WeakPolarHBondContact O-CB 3.48Å; K318-L321 PolarHBondContact O-N 3.42Å; K318-L321 VanDerWaalsContact O-N 3.11Å; K318-D322 PolarHBondContact O-N 3.22Å
319Q58.8Low62.7Low53 Ų5383.3 Ų83.325%0.24844%0.435CS..Hα-helixtrans-63.1-40178.2-73.3178-18.200113.4D227 S315 L316 L321 D322 A323D227-Q319 VanDerWaalsContact CB-NE2 3.31Å; S315-Q319 WeakPolarHBondContact O-CG 3.33Å; S315-Q319 PolarHBondContact O-N 3.25Å; L316-Q319 PolarHBondContact O-N 3.14Å; Q319-L321 PolarHBondContact O-N 2.8Å; Q319-D322 PolarHBondContact O-N 2.9Å; Q319-A323 WeakPolarHBondContact O-CB 3Å; Q319-A323 PolarHBondContact O-N 3.43Å; Q319-A323 VanDerWaalsContact O-N 3.1Å
320N59.3Low62Low99 Ų9988.1 Ų88.153%0.52946%0.459SS..Hα-helixtrans-66.8-23.3175.7-79-46.1000113.4L316 Q317 K318L316-N320 PolarHBondContact O-N 2.85Å; L316-N320 PolarHBondContact O-ND2 3.45Å; Q317-N320 PolarHBondContact O-N 3.12Å; K318-N320 PolarHBondContact O-N 2.91Å
321L58.6Low60.9Low120 Ų12089.5 Ų89.563%0.62846%0.457SS*.Hα-helixtrans-80.5-38.8173.9-71.4167.5000111.5Q317 K318 Q319 A323 R324Q317-L321 WeakPolarHBondContact O-CG 2.99Å; Q317-L321 PolarHBondContact O-N 2.89Å; K318-L321 WeakPolarHBondContact O-CB 3.48Å; K318-L321 PolarHBondContact O-N 3.42Å; K318-L321 VanDerWaalsContact O-N 3.11Å; Q319-L321 PolarHBondContact O-N 2.8Å; L321-A323 VanDerWaalsContact C-N 3.28Å; L321-A323 PolarHBondContact O-N 3.26Å; L321-R324 PolarHBondContact O-N 3.46Å
322D54.5Low60.1Low140 Ų14095.1 Ų95.175%0.74949%0.486SS*.Hα-helixtrans-73.2-18.8178.8-67.4-23.8000113.2K318 Q319K318-D322 PolarHBondContact O-N 3.22Å; Q319-D322 PolarHBondContact O-N 2.9Å
323A54.1Low59.3Low88 Ų88102.6 Ų102.673%0.72752%0.524SS*.THydrogen-bonded Turntrans-89.82.2178.400000114.8Q319 L321Q319-A323 WeakPolarHBondContact O-CB 3Å; Q319-A323 PolarHBondContact O-N 3.43Å; Q319-A323 VanDerWaalsContact O-N 3.1Å; L321-A323 VanDerWaalsContact C-N 3.28Å; L321-A323 PolarHBondContact O-N 3.26Å
324R42.3Very low58.4Low276 Ų276106 Ų106100%1.04253%0.531SS*.  trans-107.40178-79.1-177.3171.6-175.2-1.1111.8L321L321-R324 PolarHBondContact O-N 3.46Å

Retrieved 324 of 324 residues in 186.6 ms (Link to these results)