A0A087YE76_POEFO Loading...

E2F transcription factor 3

AlphaFold DB , UniProt , Accession A0A087YE76, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 451 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.3Very low36.2Very low240 Ų240155.3 Ų155.3100%1.18283%0.833SS**  094.50-69.6166.3164.700106.1
2R33Very low35.4Very low226 Ų226150.7 Ų150.785%0.85382%0.815SS**  48.7126.582.2-94.1-166.1-152-1106.3111.1
3R37.8Very low34.9Very low222 Ų222151.2 Ų151.284%0.83881%0.814SS**  cis-151.7149.217.3-60179.9-168.71780.5107
4G35.4Very low34.3Very low68 Ų68150.7 Ų150.770%0.70181%0.81SS**  99.9149.560.100000108.4
5I38.2Very low33.8Very low170 Ų170146.4 Ų146.487%0.87280%0.803SS**  cis-173.9148.517.539.2172.3000105.3
6S33.7Very low33.1Very low109 Ų109141.9 Ų141.976%0.76280%0.801SS**  175.3114.995.1-166.70000107.2
7S32.6Very low32.9Very low112 Ų112141.7 Ų141.778%0.78380%0.803SS**  79.113586.7-1640000112.3
8A38.4Very low32.5Very low87 Ų87138.2 Ų138.272%0.71980%0.804SS**  cis-175.3170.8-800000106.2
9P50.4Low32.2Very low112 Ų112135.1 Ų135.173%0.72780%0.804SS**  trans-114.4172.5-156.841.3-30.7000115.2
10D31Very low32Very low157 Ų157134 Ų13484%0.8480%0.804SS**  trans169.3130.9138.3-94.9-20000107.4
11K29.6Very low31.8Very low205 Ų205132.1 Ų132.189%0.89180%0.797SS**  -161133.563.8-157175.5-174.7-175.60110.8
12V26.8Very low31.4Very low100 Ų100127.3 Ų127.361%0.60678%0.775SS**  trans-85.6144.7169166.80000109.5L14V12-L14 HydrophobicContact CG1-CD1 3.7Å; V12-L14 HydrophobicContact CG1-CG 3.93Å
13I28.8Very low31.2Very low157 Ų157122.3 Ų122.381%0.80577%0.765SS**  -161.5100.1124-58.4-158.3000104.2
14L26.1Very low30.8Very low145 Ų145117.7 Ų117.776%0.75976%0.757SS**  46.3142.292.5-75.1157.2000112.9V12V12-L14 HydrophobicContact CG1-CD1 3.7Å; V12-L14 HydrophobicContact CG1-CG 3.93Å
15A26.5Very low30.3Very low86 Ų86120.5 Ų120.571%0.71176%0.756SS**  cis-168140.1-6.300000104.2
16G23.8Very low29.7Very low74 Ų74120.8 Ų120.876%0.76376%0.757SS**  90.1149.5111.200000111.3
17V28.2Very low29.3Very low139 Ų139121.8 Ų121.884%0.84275%0.753SS**  cis-158.4137.211.9156.20000104.9
18G27Very low28.9Very low79 Ų79123.5 Ų123.581%0.81475%0.753SS**  trans-72.5136.5162.200000109.9
19G25.7Very low28.2Very low78 Ų78124.7 Ų124.780%0.80475%0.751SS**  trans-146.5110.4172.400000108.9
20S28.5Very low27.3Very low114 Ų114123.1 Ų123.180%0.79775%0.748SS**  trans-78.4157.6171.2172.50000110.3
21S28.4Very low27Very low94 Ų94124 Ų12466%0.65775%0.751SS**  trans102.3124.8138.8-125.20000119
22L30.3Very low27.1Very low139 Ų139119.3 Ų119.373%0.72875%0.745SS**  trans88.2107144.1-66.4156.2000118.9
23D27.3Very low27.1Very low121 Ų121120.8 Ų120.865%0.64775%0.749SS**  63.8113.6118.9-71.3-12.9000120.3
24N29.6Very low27.2Very low125 Ų125123.9 Ų123.967%0.66875%0.75SS**  86.1127.2121.2-66.7-20.6000120.4
25N25.5Very low27.3Very low128 Ų128125.3 Ų125.368%0.68476%0.758SS**  trans76.6118.2149.3-61.7-33.5000117.5
26I26.1Very low27.6Very low175 Ų175128.7 Ų128.790%0.89776%0.764SS**  -149.8120.4121.1-89.7141.1000108.5
27I25.4Very low28.2Very low131 Ų131130.6 Ų130.667%0.67276%0.763SS**  trans-76164.8170.2-69.4170.5000108.8
28L23.9Very low28.4Very low147 Ų147127.2 Ų127.277%0.7776%0.756SS**  trans101.8108.2155.5-70.3135.6000118.4
29T23.7Very low28.5Very low113 Ų113132.1 Ų132.169%0.69376%0.758SS**  88.5129.7109.5-56.70000118.5L31T29-L31 PolarHBondContact O-N 3.49Å
30A31Very low28.8Very low79 Ų79133 Ų13365%0.65375%0.752SS**  trans-23.7125.8159.500000114.7
31L25Very low28.9Very low175 Ų175135.2 Ų135.292%0.91676%0.755SS**  trans-111.998.2141.7-70.4177.1000107.7T29T29-L31 PolarHBondContact O-N 3.49Å
32S31.8Very low28.9Very low107 Ų107135.6 Ų135.675%0.74875%0.753SS**  trans-68.4117.5145.1-70.20000107.1
33D26.7Very low29.1Very low130 Ų130134.9 Ų134.970%0.69576%0.755SS**  -171.3115.8122.4-113.9-20.1000112.4
34R30.5Very low29.1Very low222 Ų222139 Ų13984%0.83876%0.763SS**  trans53.7112.2132.7-69.7174.7-178-110.5-3.5119.4
35L29.5Very low29.5Very low175 Ų175138.8 Ų138.892%0.91676%0.76SS**  -152.597.3114.6-99.4166.2000111.3
36N31.6Very low29.5Very low158 Ų158139.5 Ų139.585%0.84576%0.76SS**  trans58.8147.3151.7-110.318000123.9
37P37.6Very low29.8Very low113 Ų113137 Ų13773%0.73475%0.747SS**  trans-108.8166-153.743.4-36.3000113
38G30.7Very low29.9Very low68 Ų68135.8 Ų135.870%0.70174%0.741SS**  trans120.970.3160.200000113
39Q30.6Very low30.2Very low182 Ų182132.9 Ų132.985%0.8573%0.729SS**  trans-170.9122133.4-101.6163.415.500107.5N41Q39-N41 PolarHBondContact O-N 3.09Å; Q39-N41 VanDerWaalsContact O-N 3.17Å
40S32.2Very low30.6Very low98 Ų98133 Ų13369%0.68573%0.73SS**  trans-52.7115.3166.545.30000108.8T42S40-T42 PolarHBondContact O-N 2.95Å
41N29.5Very low30.7Very low160 Ų160134.6 Ų134.686%0.85673%0.733SS**  trans-68.485.6161.4-77.6-20.7000106.8Q39 T43Q39-N41 PolarHBondContact O-N 3.09Å; Q39-N41 VanDerWaalsContact O-N 3.17Å; N41-T43 PolarHBondContact O-N 2.92Å; N41-T43 VanDerWaalsContact O-N 3.08Å
42T29.8Very low31.5Very low101 Ų101131.4 Ų131.462%0.6272%0.723SS**  trans-63.5104.6164.746.10000106.8S40 Y44S40-T42 PolarHBondContact O-N 2.95Å; T42-Y44 VanDerWaalsContact C-N 3.34Å; T42-Y44 PolarHBondContact O-N 3.28Å
43T33.1Very low31.6Very low125 Ų125132.8 Ų132.877%0.76773%0.73SS**  trans-59.7100166.6-53.50000107.6N41 I45N41-T43 PolarHBondContact O-N 2.92Å; N41-T43 VanDerWaalsContact O-N 3.08Å; T43-I45 HydrophobicContact CG2-CG1 4.11Å; T43-I45 PolarHBondContact O-N 3.17Å
44Y27.3Very low31.8Very low208 Ų208131.8 Ų131.882%0.81673%0.732SS**  trans-79.897.6176.7-126.4-88.8000107.4T42 Q46T42-Y44 VanDerWaalsContact C-N 3.34Å; T42-Y44 PolarHBondContact O-N 3.28Å; Y44-Q46 PolarHBondContact O-N 3.34Å
45I37.5Very low31.9Very low119 Ų119128.9 Ų128.961%0.6173%0.733SS**  trans-82.4104.3170.6-57.7178.4000107T43 I47T43-I45 HydrophobicContact CG2-CG1 4.11Å; T43-I45 PolarHBondContact O-N 3.17Å; I45-I47 HydrophobicContact CG2-CG1 4.3Å; I45-I47 PolarHBondContact O-N 3.15Å
46Q26Very low31.9Very low143 Ų143126.5 Ų126.567%0.66873%0.725SS**  trans-88.499.8-180-164.6177.6-12.400109.8Y44 I48Y44-Q46 PolarHBondContact O-N 3.34Å; Q46-I48 HydrophobicContact CG-CD1 4.34Å; Q46-I48 HydrophobicContact CG-CG1 3.85Å; Q46-I48 PolarHBondContact O-N 2.87Å
47I31.9Very low31.8Very low123 Ų123124.2 Ų124.263%0.63172%0.717SS**  trans-84.299.8171.7-56.9175.4000107.8I45I45-I47 HydrophobicContact CG2-CG1 4.3Å; I45-I47 PolarHBondContact O-N 3.15Å
48I28.8Very low31.4Very low106 Ų106126.7 Ų126.754%0.54472%0.719SS.*  trans-89107.6176.5-53.3177.9000108.5Q46 T50Q46-I48 HydrophobicContact CG-CD1 4.34Å; Q46-I48 HydrophobicContact CG-CG1 3.85Å; Q46-I48 PolarHBondContact O-N 2.87Å; I48-T50 HydrophobicContact CG2-CG2 3.81Å
49T29.2Very low31.3Very low86 Ų86129 Ų12953%0.52872%0.719SS.*  trans-95.1107164.8178.30000108.8
50T33Very low31.3Very low116 Ų116125.5 Ų125.571%0.71272%0.715SS**PPolyproline II helixtrans-91118.9174.653.10000109.9I48I48-T50 HydrophobicContact CG2-CG2 3.81Å
51P33.4Very low31.2Very low111 Ų111125.9 Ų125.972%0.72172%0.718SS**PPolyproline II helixtrans-71.3149.1168.428.9-31.8000110.6
52P40.3Very low31.1Very low109 Ų109124.7 Ų124.771%0.70872%0.716SS**PPolyproline II helixtrans-70.8145.8179.429.7-33.1000111C54P52-C54 PolarHBondContact O-N 2.85Å
53P35.5Very low30.9Very low135 Ų135125.8 Ų125.888%0.87773%0.726SS**PPolyproline II helixtrans-74.2124.9174.428.9-30.8000110.5
54C29.6Very low30.7Very low110 Ų110127.8 Ų127.874%0.74373%0.731SS**  trans-106149.2171.4-76.60000111.6P52P52-C54 PolarHBondContact O-N 2.85Å
55N33.2Very low30.7Very low160 Ų160123.9 Ų123.986%0.85674%0.735SS**  trans97.4128.2174.9-65.1-17.6000114.6
56V29.8Very low30.3Very low126 Ų126126.9 Ų126.976%0.76475%0.746SS**  cis-153.9142.934.9174.80000112.3
57T28.5Very low30.5Very low109 Ų109126.1 Ų126.167%0.66975%0.753SS**  trans-17.5157.6152.731.90000118.8
58Q30.6Very low30.5Very low166 Ų166129.4 Ų129.478%0.77677%0.766SS**  cis-176150.123.2-118.5167.655.900104.9
59T28.4Very low30.7Very low115 Ų115130.5 Ų130.571%0.70678%0.777SS**  -166.8149.457.452.40000112.3
60S29.9Very low30.6Very low109 Ų109133.7 Ų133.776%0.76279%0.791SS**  trans26131.6147.4560000120.4
61S30.4Very low30.5Very low106 Ų106133.5 Ų133.574%0.74180%0.795SS**  cis-171.8136.937.346.60000112.1
62V26.6Very low30.3Very low135 Ų135135.7 Ų135.782%0.81880%0.799SS**  trans37.8111.9135.9-1710000119.4
63C26.7Very low29.8Very low124 Ų124141.1 Ų141.184%0.83881%0.807SS**  164.8146.698.2-129.70000112.4
64L27.4Very low29.5Very low167 Ų167141.1 Ų141.187%0.87481%0.805SS**  trans-72147.5177.4-72.3152.4000113
65S28.7Very low29.6Very low126 Ų126142 Ų14288%0.88181%0.806SS**  trans-168.1138.2145.7-670000112.2
66E29Very low29.9Very low182 Ų182140.3 Ų140.385%0.8580%0.804SS**  trans-52.9163171.5-83.1157.4113.400115.9
67P30.4Very low29.9Very low127 Ų127143.8 Ų143.883%0.82581%0.812SS**  trans-87.2121.1169.733.9-26.4000110.8
68Q30.8Very low30.2Very low193 Ų193148 Ų14890%0.90282%0.824SS**  trans-108.4131.2155.8-76.5-133.7-34.600110.6
69V32.4Very low30.3Very low128 Ų128144.9 Ų144.978%0.77683%0.827SS**  trans-42.4128.8167.5179.40000111.6
70N29.1Very low30.4Very low154 Ų154144.4 Ų144.482%0.82483%0.834SS**  trans-174.5122.3134.7-93.4-25.4000112.8
71S29.5Very low30.6Very low112 Ų112144.2 Ų144.278%0.78384%0.84SS**  trans-68.2129.3164.5-600000111.2
72I30.4Very low30.7Very low157 Ų157147.6 Ų147.681%0.80585%0.85SS**  trans-144.8111.9149.2-54.8-177.9000109.2
73Y29.6Very low30.9Very low223 Ų223145 Ų14588%0.87585%0.85SS**  trans-69133.1162.9-90.9-96.4000110
74T28.8Very low31.4Very low135 Ų135146.4 Ų146.483%0.82886%0.855SS**  trans-145.2132.4162.7-1050000110.8
75T32.1Very low31.6Very low127 Ų127142.3 Ų142.378%0.77985%0.853SS**  trans-96.8155.3-172.7-39.70000109.5
76P38.1Very low31.9Very low126 Ų126145.8 Ų145.882%0.81886%0.856SS**  trans-91.1156.5-149.835.7-33.2000115
77Q29.6Very low32.1Very low198 Ų198147.5 Ų147.593%0.92585%0.854SS**  trans-105131.5-179.3-162.3161.1000111.6
78Q35.2Very low32.7Very low198 Ų198147.5 Ų147.593%0.92585%0.854SS**PPolyproline II helixtrans-89.2150.3-172.7-158.3169.423.400112.5
79A32.3Very low32.9Very low101 Ų101141.7 Ų141.784%0.83584%0.839SS**PPolyproline II helixtrans-72.5156.4-171.400000115.8
80A31.9Very low33.3Very low104 Ų104144.4 Ų144.486%0.8685%0.848SS**PPolyproline II helixtrans-94.6143.9176.600000112.7
81A33.8Very low33.5Very low105 Ų105140.7 Ų140.787%0.86885%0.847SS**  trans-148.5145.3161.400000111.1
82N33.4Very low33.9Very low178 Ų178146.8 Ų146.895%0.95285%0.853SS**  trans-70.4157.5-166.5-68.9-36.8000116.2
83G30.6Very low34.6Very low81 Ų81144.9 Ų144.984%0.83585%0.85SS**  trans178.2123.2161.800000114.7
84T36.3Very low35.3Very low152 Ų152140 Ų14093%0.93385%0.846SS**  trans-75.3148.3-173.847.70000115.9
85G31.6Very low35.6Very low81 Ų81138.5 Ų138.584%0.83585%0.847SS**  trans166.3146.1163.800000115.7
86Q34.9Very low36Very low200 Ų200141.7 Ų141.794%0.93585%0.85SS**  trans-71.6160.3-162.6-67-178.6-32.800118.6
87R33.7Very low36.4Very low218 Ų218147.7 Ų147.782%0.82386%0.856SS**  trans-62.8164.5167.4-128.1-162162.5158.7-7112.3
88P43.2Very low37.1Very low127 Ų127149.9 Ų149.983%0.82586%0.856SS**  -139.6178.65030.3-5.7000117.7
89A35.3Very low37.3Very low71 Ų71148.3 Ų148.359%0.58785%0.853SS**  trans-73.7161.5-161.900000117.7
90L39.6Very low37.8Very low184 Ų184148.1 Ų148.196%0.96385%0.852SS**  trans-162.2130.2134.2-97.9169000109.3
91G33.1Very low38Very low77 Ų77151.3 Ų151.379%0.79485%0.853SS**  trans-93.2158.8-164.400000116.4
92R39.3Very low38.3Very low240 Ų240153.3 Ų153.391%0.90685%0.85SS**  trans-163.3134146.7-152.7172.3-153.8-167.85.5110.3
93P44.4Very low38.5Very low117 Ų117151.9 Ų151.976%0.7684%0.842SS**  trans-83.1143.5-179.832.1-32.4000111.9
94P43.6Very low38.9Very low120 Ų120152.8 Ų152.878%0.77984%0.835SS**  trans-83.2122.6171.330.6-30.1000111.2K96P94-K96 PolarHBondContact O-N 3.13Å
95A36.7Very low38.9Very low103 Ų103152.2 Ų152.285%0.85183%0.827SS**  trans-75.2111.4173.400000110.4
96K40.1Very low39.4Very low195 Ų195157 Ų15785%0.84883%0.827SS**  trans-82.8124165.1-68.2179.7176.5179.70108.8P94P94-K96 PolarHBondContact O-N 3.13Å
97R45.1Very low39.4Very low251 Ų251156.5 Ų156.595%0.94783%0.825SS**  trans-122.1105.3155.1-85.2-174.7166.6159.1-3.4108.4
98R45.4Very low39.3Very low244 Ų244157.3 Ų157.392%0.92183%0.829SS**PPolyproline II helixtrans-68.5126.8163.8-71.2171.866.2-173.70.7107.1
99L39.6Very low38.7Very low165 Ų165160.8 Ų160.886%0.86483%0.834SS**PPolyproline II helixtrans-82.3117.2166.5-147.583.4000106.5
100A41.9Very low38.5Very low97 Ų97162.7 Ų162.780%0.80284%0.843SS**PPolyproline II helixtrans-91.9121.3164.900000106.9
101L37.5Very low38.3Very low171 Ų171162.7 Ų162.790%0.89584%0.839SS**PPolyproline II helixtrans-78.6117.1165.7-90.2150.6000106.6
102D39.8Very low38.7Very low148 Ų148164 Ų16479%0.79183%0.833SS**  trans-112.8123.8167.7-154.5-97.1000107.1
103D37.1Very low38.4Very low147 Ų147157.1 Ų157.179%0.78683%0.828SS**  trans-92.2118-178.2-173-102.1000107.4
104S39.3Very low38Very low100 Ų100161.3 Ų161.370%0.69983%0.834SS**  trans-162.9109.2165.8-79.80000110.5
105D36.1Very low37.8Very low140 Ų140162.1 Ų162.175%0.74984%0.837SS**  trans-43.3135.5159.9-75.6-56.2000112.2
106H40.9Very low37.8Very low183 Ų183163.3 Ų163.385%0.84784%0.836SS**  trans-170.4108.6141.5-80.3-41.6000112.1
107Q35.6Very low37.8Very low188 Ų188166.1 Ų166.188%0.87984%0.841SS**  trans39.7114.5130.8-129.7157.334.700120.4
108Y31.8Very low37.2Very low236 Ų236158 Ų15893%0.92584%0.836SS**  trans-66.6121.3169-90.9-100000112.7
109Q30.3Very low36.8Very low199 Ų199158.6 Ų158.693%0.9384%0.838SS**  trans-141.5138.9148-83.1-165.5-11.600111.2
110S32.3Very low36.5Very low111 Ų111154.5 Ų154.578%0.77684%0.835SS**  trans-88.4134.6-172.747.70000113.4
111E34.4Very low36Very low184 Ų184153.4 Ų153.486%0.8683%0.834SS**  trans169.8159.6134.7-93.4-94121.300112.2
112P42.6Very low35.8Very low104 Ų104149.5 Ų149.568%0.67584%0.835SS**  trans-106.4143.8-150.138.1-31.7000114.9
113A32.4Very low35.4Very low97 Ų97146.2 Ų146.280%0.80284%0.836SS**  trans-153.3114.2164.700000115.1
114K36.1Very low35.2Very low205 Ų205143.2 Ų143.289%0.89184%0.84SS**  trans28.3115.6137.6-72170.8177.9169.50119.6
115T38.2Very low34.8Very low137 Ų137142.4 Ų142.484%0.8485%0.847SS**PPolyproline II helixtrans-64.3137.6159.442.30000113.8
116P37.8Very low34.6Very low128 Ų128139.8 Ų139.883%0.83185%0.854SS**PPolyproline II helixtrans-92.5131.4161.432.4-25.3000111.3
117R39.3Very low34.1Very low253 Ų253135.1 Ų135.196%0.95585%0.854SS**PPolyproline II helixtrans-72134.9174.3-101.3176.9145.6172.7-6.5111
118G33Very low33.8Very low81 Ų81129.9 Ų129.984%0.83585%0.851SS**PPolyproline II helixtrans-68151.9174.100000114.2
119R37.8Very low33.9Very low257 Ų257123.4 Ų123.497%0.9785%0.847SS**PPolyproline II helixtrans-87.3137.4-173.4180-179.3-179.1-166.91.2111.4
120G31.7Very low33.9Very low78 Ų78118.4 Ų118.480%0.80484%0.839SS**  trans-158.5138.6157.600000106.8
121G32.3Very low33.9Very low74 Ų74117.9 Ų117.976%0.76384%0.842SS**  cis174.7155.33.600000106.3
122G32.9Very low33.9Very low89 Ų89113.5 Ų113.592%0.91884%0.837SS**  trans80.4135.8175.700000113.7
123G31.9Very low33.6Very low80 Ų80112.8 Ų112.883%0.82584%0.84SS**  cis141.3117.912.300000107.3
124G31.8Very low33.7Very low83 Ų83116.5 Ų116.586%0.85685%0.846SS**  trans87.1114.1155.100000118.9
125G31.8Very low33.7Very low83 Ų83110.4 Ų110.486%0.85684%0.842SS**  87.898.3121.200000119.4
126G31Very low33.6Very low86 Ų86110.5 Ų110.589%0.88784%0.842SS**  69.1115.6119.700000120.5
127G30.5Very low34Very low84 Ų84115.1 Ų115.187%0.86684%0.843SS**  trans107119.2134.300000118
128G30.6Very low34Very low78 Ų78110.7 Ų110.780%0.80484%0.837SS**  trans87.7100.6130.600000119.5
129A32.6Very low34.9Very low101 Ų101116.1 Ų116.184%0.83584%0.838SS**  56118.9127.600000122.1
130A31.7Very low35.1Very low94 Ų94110.3 Ų110.378%0.77783%0.831SS**  75.2133.4122.200000121.9
131A32.2Very low35.8Very low100 Ų100111.7 Ų111.783%0.82683%0.826SS**  trans67.9151.3147.300000116.7
132A34Very low36.8Very low91 Ų91120.2 Ų120.275%0.75284%0.835SS**  cis-173.5168.6-15.900000104.7
133A36.8Very low37.4Very low90 Ų90122 Ų12274%0.74483%0.828SS**  trans82.5113.8150.800000120
134N34Very low38.2Very low174 Ų174124.1 Ų124.193%0.9383%0.828SS**  60.5118.2127.2-82-17.1000120.7
135G35.4Very low38.8Very low78 Ų78130.3 Ų130.380%0.80483%0.831SS**  trans-160.3105158.800000110.9
136T36.9Very low39.8Very low139 Ų139131.1 Ų131.185%0.85382%0.824SS**  trans-56.2136.7-175.939.60000116.8
137R44.5Very low41.1Very low224 Ų224132.2 Ų132.285%0.84582%0.815SS**  trans33.3124.1131-171.8-177.8-167.3-101.65.4118
138L40.5Very low42.2Very low160 Ų160134 Ų13484%0.83881%0.812SS**  trans-161.6120.6132.2-95168.4000110.2
139K51.8Low43.3Very low196 Ų196139.1 Ų139.185%0.85282%0.815SS**  trans-92.9134165.3-74.9-179.6175.11790107.8
140T42.9Very low44.5Very low134 Ų134142 Ų14282%0.82281%0.808SS**  trans175.1166.6146.143.50000108.6
141P45Very low46.3Very low107 Ų107141.3 Ų141.370%0.69580%0.795SS**  -119.7161.5-53.830.2-13.7000110.9T143P141-T143 PolarHBondContact O-N 2.92Å
142R52.8Low48.2Very low253 Ų253147.7 Ų147.796%0.95580%0.797SS**PPolyproline II helixtrans-54.3121.8173.8-74.4175.4160.2177.8-5.8111
143T46.1Very low50.2Low126 Ų126150.9 Ų150.977%0.77379%0.791SS**PPolyproline II helixtrans-96154.4163.1490000110.5P141P141-T143 PolarHBondContact O-N 2.92Å
144P48.8Very low51.8Low125 Ų125150.3 Ų150.381%0.81278%0.776SS**PPolyproline II helixtrans-77.7149.1-164.34.612.3000111.8S146P144-S146 PolarHBondContact O-N 3.48Å
145K44.8Very low54.1Low213 Ų213146.7 Ų146.793%0.92676%0.76SS**PPolyproline II helixtrans-58126.1175.3-65-179176.5179.90110.7
146S53.3Low56.7Low100 Ų100144.6 Ų144.670%0.69973%0.733SS**PPolyproline II helixtrans-69156.8163.851.80000111P144P144-S146 PolarHBondContact O-N 3.48Å
147P56.9Low59.3Low110 Ų110141.5 Ų141.571%0.71471%0.711SS**PPolyproline II helixtrans-61.8154.5179.7-13.427.7000111E149P147-E149 PolarHBondContact O-N 3.21Å
148P55.1Low61.6Low122 Ų122133.3 Ų133.379%0.79270%0.696SS**PPolyproline II helixtrans-57.6124.3-173.925.2-33.3000110.4K150P148-K150 PolarHBondContact O-N 3.08Å
149E52.1Low64Low185 Ų185127.3 Ų127.386%0.86467%0.665SS**  trans-58.1104.8168.9-82.5177.7138.200108.2P147 T151P147-E149 PolarHBondContact O-N 3.21Å; E149-T151 PolarHBondContact O-N 2.83Å
150K59.8Low66Low161 Ų161118.5 Ų118.570%0.763%0.627SS**  trans-55.4122.4164.7-65.4-179.5179.8-177.90106.6P148P148-K150 PolarHBondContact O-N 3.08Å
151T69Low68.4Low80 Ų80114 Ų11449%0.49160%0.599SS.*  trans-65.6150.1-173.167.80000109.4E149 Y153 D154E149-T151 PolarHBondContact O-N 2.83Å; T151-Y153 PolarHBondContact O-N 3.41Å; T151-D154 PolarHBondContact N-OD2 3.32Å; T151-D154 WeakPolarHBondContact O-CB 3.48Å; T151-D154 PolarHBondContact O-N 3.26Å; T151-D154 VanDerWaalsContact OG1-CG 3.26Å; T151-D154 PolarHBondContact OG1-OD2 2.97Å
152R71.9Confident70.6Confident233 Ų233115.4 Ų115.488%0.87959%0.594SS**G310 helixtrans-52.4-27.3-179.7-172.8-177.9179.5-159.50.5113T155R152-T155 PolarHBondContact O-OG1 3.23Å
153Y75.6Confident72.5Confident158 Ų158108.3 Ų108.362%0.6257%0.57SS**G310 helixtrans-68.8-33.5178.3-175.1-101.6000113.3T151 T155 S156 L159T151-Y153 PolarHBondContact O-N 3.41Å; Y153-T155 PolarHBondContact O-N 3.28Å; Y153-T155 VanDerWaalsContact O-N 3.11Å; Y153-S156 VanDerWaalsContact O-CB 3.26Å; Y153-S156 WeakPolarHBondContact O-CB 3.42Å; Y153-S156 PolarHBondContact O-N 3.26Å; Y153-S156 PolarHBondContact O-OG 3.07Å; Y153-L159 HydrophobicContact CE1-CD2 4.46Å
154D71.5Confident74.7Confident79 Ų79102.3 Ų102.342%0.42253%0.534SS..G310 helixtrans-66.6-15.9-178-60.4-43.2000113T151T151-D154 PolarHBondContact N-OD2 3.32Å; T151-D154 WeakPolarHBondContact O-CB 3.48Å; T151-D154 PolarHBondContact O-N 3.26Å; T151-D154 VanDerWaalsContact OG1-CG 3.26Å; T151-D154 PolarHBondContact OG1-OD2 2.97Å
155T80.8Confident76.6Confident98 Ų9898.7 Ų98.760%0.60151%0.509SS*.G310 helixtrans-113.610.2177.759.40000113.1R152 Y153R152-T155 PolarHBondContact O-OG1 3.23Å; Y153-T155 PolarHBondContact O-N 3.28Å; Y153-T155 VanDerWaalsContact O-N 3.11Å
156S90.3Very high78.7Confident34 Ų3491.9 Ų91.924%0.23848%0.482CS..  trans-68.9144.9-178.867.50000112Y153 G158 L159 L160Y153-S156 VanDerWaalsContact O-CB 3.26Å; Y153-S156 WeakPolarHBondContact O-CB 3.42Å; Y153-S156 PolarHBondContact O-N 3.26Å; Y153-S156 PolarHBondContact O-OG 3.07Å; S156-G158 VanDerWaalsContact C-N 3.26Å; S156-G158 PolarHBondContact O-N 2.92Å; S156-L159 PolarHBondContact O-N 2.95Å; S156-L159 WeakPolarHBondContact OG-CB 3.44Å; S156-L159 PolarHBondContact OG-N 3.03Å; S156-L160 WeakPolarHBondContact O-CG 3.25Å; S156-L160 PolarHBondContact O-N 3.18Å; S156-L160 VanDerWaalsContact O-N 3.14Å
157L91.9Very high80.4Confident74 Ų7488.8 Ų88.839%0.38746%0.458SS..Hα-helixtrans-60.1-38.6178.2-169.967000111.4L159 L160 T161 D194 I195L157-L159 PolarHBondContact O-N 3.18Å; L157-L160 CarbonylContact O-C 3.59Å; L157-L160 WeakPolarHBondContact O-CB 3.43Å; L157-L160 PolarHBondContact O-N 3.25Å; L157-T161 PolarHBondContact O-N 3.35Å; L157-T161 PolarHBondContact O-OG1 3.23Å; L157-D194 HydrophobicContact CD1-CB 3.94Å; L157-D194 HydrophobicContact CD2-CB 4.17Å; L157-I195 HydrophobicContact CD1-CD1 4.16Å; L157-I195 HydrophobicContact CD1-CG1 3.63Å; L157-I195 HydrophobicContact CG-CG1 4.32Å
158G92.4Very high81.9Confident52 Ų5283.9 Ų83.954%0.53643%0.426SS..Hα-helixtrans-62.1-41.8178.400000113.5S156 L160 T161 K162S156-G158 VanDerWaalsContact C-N 3.26Å; S156-G158 PolarHBondContact O-N 2.92Å; G158-L160 VanDerWaalsContact C-N 3.33Å; G158-T161 PolarHBondContact O-N 3.21Å; G158-K162 PolarHBondContact O-N 3.19Å
159L91.7Very high83.3Confident34 Ų3482 Ų8218%0.17842%0.421CS..Hα-helixtrans-66.6-38.2175.5-175.664000111.5Y153 S156 L157 K162 K163Y153-L159 HydrophobicContact CE1-CD2 4.46Å; S156-L159 PolarHBondContact O-N 2.95Å; S156-L159 WeakPolarHBondContact OG-CB 3.44Å; S156-L159 PolarHBondContact OG-N 3.03Å; L157-L159 PolarHBondContact O-N 3.18Å; L159-K162 PolarHBondContact O-N 3.32Å; L159-K163 WeakPolarHBondContact O-CG 3.26Å; L159-K163 PolarHBondContact O-N 2.95Å; L159-K163 VanDerWaalsContact O-N 3.11Å
160L94.1Very high84.7Confident10 Ų1080.5 Ų80.55%0.05241%0.414CS..Hα-helixtrans-65.8-41.1174.7-65.3173.7000111.7S156 L157 G158 K162 K163 F164 L185 V187 R191 I195S156-L160 WeakPolarHBondContact O-CG 3.25Å; S156-L160 PolarHBondContact O-N 3.18Å; S156-L160 VanDerWaalsContact O-N 3.14Å; L157-L160 CarbonylContact O-C 3.59Å; L157-L160 WeakPolarHBondContact O-CB 3.43Å; L157-L160 PolarHBondContact O-N 3.25Å; G158-L160 VanDerWaalsContact C-N 3.33Å; L160-K162 VanDerWaalsContact C-N 3.34Å; L160-K162 PolarHBondContact O-N 2.56Å; L160-K163 PolarHBondContact O-N 3.44Å; L160-F164 WeakPolarHBondContact O-CB 3.48Å; L160-F164 PolarHBondContact O-N 3Å; L160-L185 HydrophobicContact CD2-CB 4.48Å; L160-V187 HydrophobicContact CD1-CG1 3.81Å; L160-V187 HydrophobicContact CD2-CG1 3.43Å; L160-V187 VanDerWaalsContact CD2-CG1 3.43Å; L160-V187 HydrophobicContact CG-CG1 4.27Å; L160-R191 HydrophobicContact CD1-CB 4.29Å; L160-R191 HydrophobicContact CD1-CG 4.45Å; L160-I195 HydrophobicContact CB-CD1 3.89Å
161T93.5Very high85.9Confident39 Ų3974.2 Ų74.224%0.23939%0.39CS..Hα-helixtrans-60.3-44.4174.9-57.50000110.8L157 G158 F164 V165 I195L157-T161 PolarHBondContact O-N 3.35Å; L157-T161 PolarHBondContact O-OG1 3.23Å; G158-T161 PolarHBondContact O-N 3.21Å; T161-F164 PolarHBondContact O-N 3.35Å; T161-V165 HydrophobicContact CG2-CG2 4.37Å; T161-V165 WeakPolarHBondContact O-CB 3.44Å; T161-V165 VanDerWaalsContact O-CG2 3.28Å; T161-V165 WeakPolarHBondContact O-CG2 3.49Å; T161-V165 PolarHBondContact O-N 3.46Å; T161-I195 HydrophobicContact CG2-CG2 4.15Å
162K91.3Very high85.8Confident138 Ų13876.8 Ų76.860%0.641%0.411SS*.Hα-helixtrans-58.4-53.4176.9-174.3177177.7177.70111.4G158 L159 L160 F164 V165 D166G158-K162 PolarHBondContact O-N 3.19Å; L159-K162 PolarHBondContact O-N 3.32Å; L160-K162 VanDerWaalsContact C-N 3.34Å; L160-K162 PolarHBondContact O-N 2.56Å; K162-F164 VanDerWaalsContact C-N 3.29Å; K162-F164 PolarHBondContact O-N 3.47Å; K162-V165 PolarHBondContact O-N 3.17Å; K162-D166 PolarHBondContact O-N 3.02Å
163K91.3Very high85.9Confident104 Ų10470.5 Ų70.545%0.45240%0.395SS..Hα-helixtrans-64.1-33.7178.7-65.2-178175.9-176.30112.9L159 L160 D166 L167 L185L159-K163 WeakPolarHBondContact O-CG 3.26Å; L159-K163 PolarHBondContact O-N 2.95Å; L159-K163 VanDerWaalsContact O-N 3.11Å; L160-K163 PolarHBondContact O-N 3.44Å; K163-D166 PolarHBondContact O-N 3.02Å; K163-L167 WeakPolarHBondContact O-CG 3.47Å; K163-L167 PolarHBondContact O-N 3.33Å; K163-L185 HydrophobicContact CB-CD2 3.3Å; K163-L185 HydrophobicContact CD-CD2 4Å; K163-L185 HydrophobicContact CG-CD2 4.31Å
164F91.8Very high86.1Confident0 Ų064 Ų640%038%0.376CS..Hα-helixtrans-65.9-43.4175.9-178.5-92.5000111.7L160 T161 K162 D166 L167 L168 L176 L178 A181 L185 L192 I195 T196 L199 I213L160-F164 WeakPolarHBondContact O-CB 3.48Å; L160-F164 PolarHBondContact O-N 3Å; T161-F164 PolarHBondContact O-N 3.35Å; K162-F164 VanDerWaalsContact C-N 3.29Å; K162-F164 PolarHBondContact O-N 3.47Å; F164-D166 VanDerWaalsContact C-N 3.35Å; F164-L167 PolarHBondContact O-N 3.07Å; F164-L168 WeakPolarHBondContact O-CB 3.22Å; F164-L168 PolarHBondContact O-N 3.32Å; F164-L176 HydrophobicContact CD1-CD2 4.45Å; F164-L176 HydrophobicContact CD2-CD2 3.84Å; F164-L176 HydrophobicContact CE1-CD2 4.12Å; F164-L176 HydrophobicContact CE2-CD2 3.46Å; F164-L176 VanDerWaalsContact CE2-CD2 3.46Å; F164-L176 HydrophobicContact CG-CD2 4.34Å; F164-L176 HydrophobicContact CZ-CD2 3.65Å; F164-L178 HydrophobicContact CE2-CD2 4.17Å; F164-L178 HydrophobicContact CZ-CD2 4.28Å; F164-A181 HydrophobicContact CD2-CB 4.34Å; F164-A181 HydrophobicContact CE2-CB 4.27Å; F164-L185 HydrophobicContact CB-CD1 4.01Å; F164-L185 HydrophobicContact CD2-CD1 4.16Å; F164-L192 HydrophobicContact CD2-CD2 3.69Å; F164-L192 HydrophobicContact CE2-CD2 3.8Å; F164-I195 HydrophobicContact CB-CD1 4.31Å; F164-I195 HydrophobicContact CD1-CG2 3.74Å; F164-I195 HydrophobicContact CE1-CG2 4.07Å; F164-I195 HydrophobicContact CG-CG2 4.15Å; F164-T196 HydrophobicContact CE1-CG2 4.48Å; F164-T196 HydrophobicContact CZ-CG2 3.86Å; F164-L199 HydrophobicContact CD1-CD1 4.29Å; F164-L199 HydrophobicContact CE1-CD1 4.12Å; F164-I213 HydrophobicContact CE1-CD1 3.73Å; F164-I213 HydrophobicContact CZ-CD1 3.41Å; F164-I213 VanDerWaalsContact CZ-CD1 3.41Å; F164-I213 HydrophobicContact CZ-CG1 4.39Å
165V89.8Confident86.9Confident48 Ų4861.5 Ų61.529%0.29136%0.363SS..Hα-helixtrans-65.6-39.3174172.70000110.7T161 K162 L167 L168 A169T161-V165 HydrophobicContact CG2-CG2 4.37Å; T161-V165 WeakPolarHBondContact O-CB 3.44Å; T161-V165 VanDerWaalsContact O-CG2 3.28Å; T161-V165 WeakPolarHBondContact O-CG2 3.49Å; T161-V165 PolarHBondContact O-N 3.46Å; K162-V165 PolarHBondContact O-N 3.17Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.41Å; V165-L168 PolarHBondContact O-N 3.37Å; V165-A169 WeakPolarHBondContact O-CB 3.26Å; V165-A169 PolarHBondContact O-N 3.02Å
166D88.5Confident87.4Confident70 Ų7057.2 Ų57.237%0.37434%0.337SS..Hα-helixtrans-60.9-40.8175.6-63.9-27.9000111.8K162 K163 F164 A169 Q170K162-D166 PolarHBondContact O-N 3.02Å; K163-D166 PolarHBondContact O-N 3.02Å; F164-D166 VanDerWaalsContact C-N 3.35Å; D166-A169 PolarHBondContact O-N 2.74Å; D166-Q170 VanDerWaalsContact O-CG 3.25Å; D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 2.79Å; D166-Q170 VanDerWaalsContact O-N 3.08Å; D166-Q170 PolarHBondContact O-NE2 2.78Å; D166-Q170 VanDerWaalsContact O-NE2 3.14Å
167L89.4Confident87.4Confident36 Ų3658.1 Ų58.119%0.18834%0.339CS..Hα-helixtrans-66.9-37.9174.7-70.4174.5000112.4K163 F164 V165 Q170 S171 L176 T184 L185K163-L167 WeakPolarHBondContact O-CG 3.47Å; K163-L167 PolarHBondContact O-N 3.33Å; F164-L167 PolarHBondContact O-N 3.07Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.41Å; L167-Q170 PolarHBondContact O-N 3.32Å; L167-S171 PolarHBondContact O-N 3.15Å; L167-L176 HydrophobicContact CB-CD1 3.96Å; L167-L176 HydrophobicContact CB-CD2 4.49Å; L167-T184 HydrophobicContact CD1-CG2 3.88Å; L167-T184 HydrophobicContact CD2-CG2 3.84Å; L167-T184 HydrophobicContact CG-CG2 4.47Å; L167-L185 HydrophobicContact CD1-CD1 4.38Å; L167-L185 HydrophobicContact CD1-CD2 3.93Å; L167-L185 HydrophobicContact CD1-CG 3.93Å
168L87.9Confident87.4Confident6 Ų655.2 Ų55.23%0.03132%0.324CS..Hα-helixtrans-67.4-39.2176.6-171.458.9000111.3F164 V165 Q170 S171 L176 I205 I213 W215F164-L168 WeakPolarHBondContact O-CB 3.22Å; F164-L168 PolarHBondContact O-N 3.32Å; V165-L168 PolarHBondContact O-N 3.37Å; L168-Q170 VanDerWaalsContact C-N 3.33Å; L168-Q170 PolarHBondContact O-N 3.1Å; L168-S171 PolarHBondContact O-N 3.42Å; L168-S171 PolarHBondContact O-OG 3.47Å; L168-L176 HydrophobicContact CB-CD2 4.25Å; L168-L176 HydrophobicContact CD1-CB 3.5Å; L168-L176 VanDerWaalsContact CD1-CB 3.5Å; L168-L176 HydrophobicContact CD1-CD2 4.46Å; L168-I205 HydrophobicContact CD2-CG2 4.05Å; L168-I213 HydrophobicContact CD1-CD1 4.5Å; L168-I213 HydrophobicContact CD2-CD1 4.41Å; L168-W215 HydrophobicContact CD1-CB 4.13Å; L168-W215 HydrophobicContact CD2-CB 4.01Å; L168-W215 HydrophobicContact CD2-CD2 3.96Å; L168-W215 HydrophobicContact CD2-CE3 3.28Å; L168-W215 HydrophobicContact CD2-CG 4.29Å; L168-W215 HydrophobicContact CD2-CZ3 4.04Å; L168-W215 HydrophobicContact CG-CB 4.02Å; L168-W215 HydrophobicContact CG-CE3 4.25Å; L168-W215 HydrophobicContact CG-CG 4.47Å
169A83.8Confident87.4Confident84 Ų8455.5 Ų55.569%0.69431%0.313SS*.Hα-helixtrans-68-30.1175.800000113.3V165 D166 S171V165-A169 WeakPolarHBondContact O-CB 3.26Å; V165-A169 PolarHBondContact O-N 3.02Å; D166-A169 PolarHBondContact O-N 2.74Å; A169-S171 VanDerWaalsContact C-N 3.32Å
170Q82.8Confident87.3Confident152 Ų15258.6 Ų58.671%0.7133%0.33SS*.Hα-helixtrans-78.9-14175.6-72.3166.349.500113.2D166 L167 L168D166-Q170 VanDerWaalsContact O-CG 3.25Å; D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 2.79Å; D166-Q170 VanDerWaalsContact O-N 3.08Å; D166-Q170 PolarHBondContact O-NE2 2.78Å; D166-Q170 VanDerWaalsContact O-NE2 3.14Å; L167-Q170 PolarHBondContact O-N 3.32Å; L168-Q170 VanDerWaalsContact C-N 3.33Å; L168-Q170 PolarHBondContact O-N 3.1Å
171S83.7Confident87.2Confident29 Ų2958.1 Ų58.120%0.20333%0.327CS..  trans-78.9123.8179.272.20000111.3L167 L168 A169 D173 G174 V175L167-S171 PolarHBondContact O-N 3.15Å; L168-S171 PolarHBondContact O-N 3.42Å; L168-S171 PolarHBondContact O-OG 3.47Å; A169-S171 VanDerWaalsContact C-N 3.32Å; S171-D173 VanDerWaalsContact C-N 3.33Å; S171-D173 PolarHBondContact O-N 2.93Å; S171-G174 PolarHBondContact O-N 3.24Å; S171-V175 WeakPolarHBondContact CB-O 3.47Å; S171-V175 PolarHBondContact OG-N 3.37Å; S171-V175 PolarHBondContact OG-O 3.13Å
172S67.2Low87.1Confident134 Ų13457 Ų5794%0.93732%0.322SS*.THydrogen-bonded Turntrans-71.6-20.9-171.257.80000115.1
173D74.1Confident87.2Confident102 Ų10257.6 Ų57.655%0.54533%0.327SS..THydrogen-bonded Turntrans-99.74.2176.1-169.637.4000111.8S171 V175 K208S171-D173 VanDerWaalsContact C-N 3.33Å; S171-D173 PolarHBondContact O-N 2.93Å; D173-V175 HydrophobicContact CB-CB 4.39Å; D173-V175 HydrophobicContact CB-CG2 4.33Å; D173-V175 PolarHBondContact O-N 3.49Å; D173-V175 VanDerWaalsContact O-N 3.15Å; D173-V175 WeakPolarHBondContact OD2-CG2 3.49Å; D173-K208 IonicContact OD2-NZ 2.57Å; D173-K208 PolarHBondContact OD2-NZ 3.03Å
174G80.6Confident87.1Confident21 Ų2156.3 Ų56.322%0.21633%0.328CS..SBendtrans60.620.7-169.600000112.9S171 Q214 W215S171-G174 PolarHBondContact O-N 3.24Å; G174-Q214 CarbonylContact O-C 3.55Å; G174-Q214 WeakPolarHBondContact O-CA 3.47Å; G174-W215 PolarHBondContact O-N 3.32Å
175V87.4Confident87Confident26 Ų2657.3 Ų57.316%0.15833%0.333CS..EExtended strand (participates in β ladder)trans-115.4124.8-179.1177.60000109.7S171 D173 K208 N212 I213 Q214S171-V175 WeakPolarHBondContact CB-O 3.47Å; S171-V175 PolarHBondContact OG-N 3.37Å; S171-V175 PolarHBondContact OG-O 3.13Å; D173-V175 HydrophobicContact CB-CB 4.39Å; D173-V175 HydrophobicContact CB-CG2 4.33Å; D173-V175 PolarHBondContact O-N 3.49Å; D173-V175 VanDerWaalsContact O-N 3.15Å; D173-V175 WeakPolarHBondContact OD2-CG2 3.49Å; V175-K208 HydrophobicContact CG1-CD 4.17Å; V175-K208 HydrophobicContact CG2-CD 3.62Å; V175-N212 HydrophobicContact CG1-CB 3.76Å; V175-I213 CarbonylContact C-O 3.53Å; V175-I213 VanDerWaalsContact CA-O 3.25Å; V175-I213 WeakPolarHBondContact CA-O 3.34Å; V175-Q214 HydrophobicContact CG2-CB 4.11Å; V175-Q214 HydrophobicContact CG2-CG 3.99Å
176L91Very high87Confident8 Ų862.9 Ų62.94%0.04236%0.356CS..EExtended strand (participates in β ladder)trans-112.8126.2179.2-177.269.6000111F164 L167 L168 A181 N212 I213F164-L176 HydrophobicContact CD1-CD2 4.45Å; F164-L176 HydrophobicContact CD2-CD2 3.84Å; F164-L176 HydrophobicContact CE1-CD2 4.12Å; F164-L176 HydrophobicContact CE2-CD2 3.46Å; F164-L176 VanDerWaalsContact CE2-CD2 3.46Å; F164-L176 HydrophobicContact CG-CD2 4.34Å; F164-L176 HydrophobicContact CZ-CD2 3.65Å; L167-L176 HydrophobicContact CB-CD1 3.96Å; L167-L176 HydrophobicContact CB-CD2 4.49Å; L168-L176 HydrophobicContact CB-CD2 4.25Å; L168-L176 HydrophobicContact CD1-CB 3.5Å; L168-L176 VanDerWaalsContact CD1-CB 3.5Å; L168-L176 HydrophobicContact CD1-CD2 4.46Å; L176-A181 HydrophobicContact CD1-CB 4.42Å; L176-A181 HydrophobicContact CD2-CB 4.15Å; L176-A181 HydrophobicContact CG-CB 4.28Å; L176-N212 WeakPolarHBondContact O-CA 3.39Å; L176-I213 HydrophobicContact CB-CD1 4.35Å; L176-I213 HydrophobicContact CB-CG1 4.03Å; L176-I213 HydrophobicContact CD2-CD1 4.45Å; L176-I213 PolarHBondContact N-O 3.5Å; L176-I213 WeakPolarHBondContact O-CG1 3.5Å; L176-I213 PolarHBondContact O-N 3.27Å
177D91.6Very high87Confident54 Ų5461.1 Ų61.129%0.28935%0.347SS..EExtended strand (participates in β ladder)trans-78.5121.5169.7-173.2-12.7000110.1N179 L180 A181 N211D177-N179 PolarHBondContact O-N 3.3Å; D177-N179 WeakPolarHBondContact OD1-CB 3.39Å; D177-N179 PolarHBondContact OD1-N 3.46Å; D177-N179 PolarHBondContact OD1-ND2 3.11Å; D177-N179 VanDerWaalsContact OD1-ND2 3.09Å; D177-L180 HydrophobicContact CB-CB 4.11Å; D177-L180 PolarHBondContact O-N 3.11Å; D177-A181 WeakPolarHBondContact O-CB 3.49Å; D177-A181 PolarHBondContact O-N 3.24Å; D177-N211 CarbonylContact C-O 3.52Å; D177-N211 WeakPolarHBondContact CA-O 2.82Å
178L91.9Very high87.1Confident12 Ų1266.8 Ų66.86%0.06337%0.373CS..Hα-helixtrans-64.7-24.7178.7-62.9178.6000113F164 A182 L192 Y193 T196 N211 I213F164-L178 HydrophobicContact CE2-CD2 4.17Å; F164-L178 HydrophobicContact CZ-CD2 4.28Å; L178-A182 WeakPolarHBondContact O-CB 3.4Å; L178-A182 PolarHBondContact O-N 3.29Å; L178-A182 VanDerWaalsContact O-N 3.09Å; L178-L192 HydrophobicContact CB-CD1 4.35Å; L178-L192 HydrophobicContact CD2-CD1 4.47Å; L178-L192 WeakPolarHBondContact O-CD1 3.43Å; L178-Y193 HydrophobicContact CD1-CE1 4.42Å; L178-T196 HydrophobicContact CD2-CG2 4.1Å; L178-N211 WeakPolarHBondContact CG-O 3.5Å; L178-N211 PolarHBondContact N-O 3.31Å; L178-I213 HydrophobicContact CD1-CG2 4.33Å; L178-I213 HydrophobicContact CD2-CG1 4.2Å; L178-I213 HydrophobicContact CD2-CG2 4.23Å; L178-I213 HydrophobicContact CG-CG2 4.42Å
179N91.3Very high87.2Confident58 Ų5870.1 Ų70.131%0.3139%0.387SS..Hα-helixtrans-70.6-49.3173.6-60.9-56.8000110.9D177 A181 A182 E183 K189 N211D177-N179 PolarHBondContact O-N 3.3Å; D177-N179 WeakPolarHBondContact OD1-CB 3.39Å; D177-N179 PolarHBondContact OD1-N 3.46Å; D177-N179 PolarHBondContact OD1-ND2 3.11Å; D177-N179 VanDerWaalsContact OD1-ND2 3.09Å; N179-A181 VanDerWaalsContact C-N 3.29Å; N179-A181 PolarHBondContact O-N 2.67Å; N179-A182 WeakPolarHBondContact O-CB 3.43Å; N179-A182 PolarHBondContact O-N 3.41Å; N179-A182 VanDerWaalsContact O-N 3.16Å; N179-E183 PolarHBondContact O-N 3.16Å; N179-E183 VanDerWaalsContact O-N 3.11Å; N179-K189 WeakPolarHBondContact OD1-CE 3.29Å; N179-K189 PolarHBondContact OD1-NZ 2.96Å; N179-N211 VanDerWaalsContact ND2-CG 3.32Å; N179-N211 PolarHBondContact ND2-ND2 2.87Å; N179-N211 VanDerWaalsContact ND2-ND2 3.16Å
180L89.5Confident87.7Confident100 Ų10072.2 Ų72.252%0.52438%0.377SS..Hα-helixtrans-60.8-41.8177.4-178.963.9000111D177 A182 E183 T184D177-L180 HydrophobicContact CB-CB 4.11Å; D177-L180 PolarHBondContact O-N 3.11Å; L180-A182 PolarHBondContact O-N 2.95Å; L180-E183 PolarHBondContact O-N 3.38Å; L180-T184 VanDerWaalsContact O-CB 3.32Å; L180-T184 WeakPolarHBondContact O-CB 2.92Å; L180-T184 PolarHBondContact O-N 3.29Å; L180-T184 PolarHBondContact O-OG1 2.91Å
181A92Very high88.2Confident0 Ų070.1 Ų70.10%036%0.363CS..Hα-helixtrans-64.2-39.4176.200000112.3F164 L176 D177 N179 T184 L185 L192F164-A181 HydrophobicContact CD2-CB 4.34Å; F164-A181 HydrophobicContact CE2-CB 4.27Å; L176-A181 HydrophobicContact CD1-CB 4.42Å; L176-A181 HydrophobicContact CD2-CB 4.15Å; L176-A181 HydrophobicContact CG-CB 4.28Å; D177-A181 WeakPolarHBondContact O-CB 3.49Å; D177-A181 PolarHBondContact O-N 3.24Å; N179-A181 VanDerWaalsContact C-N 3.29Å; N179-A181 PolarHBondContact O-N 2.67Å; A181-T184 PolarHBondContact O-N 2.83Å; A181-L185 VanDerWaalsContact O-CB 3.25Å; A181-L185 WeakPolarHBondContact O-CB 3.43Å; A181-L185 VanDerWaalsContact O-CG 3.28Å; A181-L185 WeakPolarHBondContact O-CG 3.45Å; A181-L185 PolarHBondContact O-N 3.1Å; A181-L192 HydrophobicContact CB-CD1 4.27Å; A181-L192 HydrophobicContact CB-CD2 4.36Å
182A92.9Very high88.7Confident16 Ų1668.8 Ų68.813%0.13235%0.353CS..Hα-helixtrans-64.1-40.6178.300000112L178 N179 L180 Q186 V187 K189 L192L178-A182 WeakPolarHBondContact O-CB 3.4Å; L178-A182 PolarHBondContact O-N 3.29Å; L178-A182 VanDerWaalsContact O-N 3.09Å; N179-A182 WeakPolarHBondContact O-CB 3.43Å; N179-A182 PolarHBondContact O-N 3.41Å; N179-A182 VanDerWaalsContact O-N 3.16Å; L180-A182 PolarHBondContact O-N 2.95Å; A182-Q186 WeakPolarHBondContact O-CA 3.34Å; A182-Q186 PolarHBondContact O-N 2.86Å; A182-Q186 VanDerWaalsContact O-N 3.13Å; A182-V187 PolarHBondContact O-N 3.39Å; A182-V187 VanDerWaalsContact O-N 3.1Å; A182-K189 HydrophobicContact CB-CG 4.36Å; A182-L192 HydrophobicContact CB-CD1 3.82Å
183E92.6Very high90Very high150 Ų15067 Ų6770%0.70133%0.327SS*.Hα-helixtrans-68.5-47.5176.4-173.5171-17000111.5N179 L180 L185 Q186N179-E183 PolarHBondContact O-N 3.16Å; N179-E183 VanDerWaalsContact O-N 3.11Å; L180-E183 PolarHBondContact O-N 3.38Å; E183-L185 PolarHBondContact O-N 2.95Å; E183-Q186 WeakPolarHBondContact O-CG 3.35Å; E183-Q186 PolarHBondContact O-N 3.32Å; E183-Q186 VanDerWaalsContact O-N 3.15Å
184T90.3Very high91Very high77 Ų7763.8 Ų63.847%0.47231%0.309SS..Hα-helixtrans-67-40.5-176.5-54.20000112.6L167 L180 A181 Q186L167-T184 HydrophobicContact CD1-CG2 3.88Å; L167-T184 HydrophobicContact CD2-CG2 3.84Å; L167-T184 HydrophobicContact CG-CG2 4.47Å; L180-T184 VanDerWaalsContact O-CB 3.32Å; L180-T184 WeakPolarHBondContact O-CB 2.92Å; L180-T184 PolarHBondContact O-N 3.29Å; L180-T184 PolarHBondContact O-OG1 2.91Å; A181-T184 PolarHBondContact O-N 2.83Å; T184-Q186 VanDerWaalsContact C-N 3.28Å
185L88.8Confident91.6Very high21 Ų2163 Ų6311%0.1130%0.3CS..THydrogen-bonded Turntrans-82.8-7.8177.6-60.4179.2000112.5L160 K163 F164 L167 A181 E183 V187 L192L160-L185 HydrophobicContact CD2-CB 4.48Å; K163-L185 HydrophobicContact CB-CD2 3.3Å; K163-L185 HydrophobicContact CD-CD2 4Å; K163-L185 HydrophobicContact CG-CD2 4.31Å; F164-L185 HydrophobicContact CB-CD1 4.01Å; F164-L185 HydrophobicContact CD2-CD1 4.16Å; L167-L185 HydrophobicContact CD1-CD1 4.38Å; L167-L185 HydrophobicContact CD1-CD2 3.93Å; L167-L185 HydrophobicContact CD1-CG 3.93Å; A181-L185 VanDerWaalsContact O-CB 3.25Å; A181-L185 WeakPolarHBondContact O-CB 3.43Å; A181-L185 VanDerWaalsContact O-CG 3.28Å; A181-L185 WeakPolarHBondContact O-CG 3.45Å; A181-L185 PolarHBondContact O-N 3.1Å; E183-L185 PolarHBondContact O-N 2.95Å; L185-V187 VanDerWaalsContact C-N 3.27Å; L185-V187 HydrophobicContact CB-CG1 4.49Å; L185-V187 HydrophobicContact CB-CG2 3.79Å; L185-V187 WeakPolarHBondContact O-CG1 3.38Å; L185-V187 PolarHBondContact O-N 2.8Å; L185-L192 HydrophobicContact CD1-CD2 4.12Å
186Q88.7Confident91.9Very high165 Ų16562.1 Ų62.177%0.77130%0.295SS*.THydrogen-bonded Turntrans49.445.6-172.5-62.6-168.60.300113A182 E183 T184A182-Q186 WeakPolarHBondContact O-CA 3.34Å; A182-Q186 PolarHBondContact O-N 2.86Å; A182-Q186 VanDerWaalsContact O-N 3.13Å; E183-Q186 WeakPolarHBondContact O-CG 3.35Å; E183-Q186 PolarHBondContact O-N 3.32Å; E183-Q186 VanDerWaalsContact O-N 3.15Å; T184-Q186 VanDerWaalsContact C-N 3.28Å
187V89.6Confident92.1Very high32 Ų3266.3 Ų66.319%0.19432%0.317CS..  trans-127.7155.1-179.2-63.50000112.6L160 A182 L185 L192L160-V187 HydrophobicContact CD1-CG1 3.81Å; L160-V187 HydrophobicContact CD2-CG1 3.43Å; L160-V187 VanDerWaalsContact CD2-CG1 3.43Å; L160-V187 HydrophobicContact CG-CG1 4.27Å; A182-V187 PolarHBondContact O-N 3.39Å; A182-V187 VanDerWaalsContact O-N 3.1Å; L185-V187 VanDerWaalsContact C-N 3.27Å; L185-V187 HydrophobicContact CB-CG1 4.49Å; L185-V187 HydrophobicContact CB-CG2 3.79Å; L185-V187 WeakPolarHBondContact O-CG1 3.38Å; L185-V187 PolarHBondContact O-N 2.8Å; V187-L192 HydrophobicContact CG2-CD2 4.31Å
188Q91.1Very high92.3Very high156 Ų15668.2 Ų68.273%0.72933%0.331SS*.  trans-68.9145.3175.6-60.9176.69.500111R190 R191Q188-R190 PolarHBondContact O-N 2.9Å; Q188-R191 PolarHBondContact O-N 2.79Å
189K89.9Confident92.2Very high76 Ų7668.4 Ų68.433%0.3333%0.332SS..Hα-helixtrans-53-26.6177.6-71.5-168.6173.4-172.90114.3N179 A182 R191 L192 Y193N179-K189 WeakPolarHBondContact OD1-CE 3.29Å; N179-K189 PolarHBondContact OD1-NZ 2.96Å; A182-K189 HydrophobicContact CB-CG 4.36Å; K189-R191 VanDerWaalsContact C-N 3.25Å; K189-R191 PolarHBondContact O-N 3.15Å; K189-L192 WeakPolarHBondContact O-CB 3.23Å; K189-L192 PolarHBondContact O-N 2.88Å; K189-L192 VanDerWaalsContact O-N 3.16Å; K189-Y193 HydrophobicContact CB-CE2 4.17Å; K189-Y193 VanDerWaalsContact O-CD2 3.27Å; K189-Y193 WeakPolarHBondContact O-CD2 3.48Å; K189-Y193 PolarHBondContact O-N 3.13Å; K189-Y193 VanDerWaalsContact O-N 3.13Å
190R94.2Very high92.2Very high127 Ų12769.9 Ų69.948%0.47934%0.337SS..Hα-helixtrans-56.9-38.7175.1-179.664.5-167.984.15.3112.5Q188 Y193 D194Q188-R190 PolarHBondContact O-N 2.9Å; R190-Y193 PolarHBondContact O-N 3.39Å; R190-D194 IonicContact CZ-OD1 2.63Å; R190-D194 IonicContact CZ-OD2 3.93Å; R190-D194 IonicContact NH1-OD1 2.63Å; R190-D194 PolarHBondContact NH1-OD1 2.97Å; R190-D194 IonicContact NH1-OD2 3.09Å; R190-D194 PolarHBondContact NH1-OD2 2.7Å; R190-D194 VanDerWaalsContact NH1-OD2 3.09Å; R190-D194 IonicContact NH2-OD1 3.23Å; R190-D194 PolarHBondContact NH2-OD1 2.85Å; R190-D194 IonicContact NH2-OD2 3.7Å; R190-D194 PolarHBondContact O-N 2.8Å
191R94.3Very high92.2Very high109 Ų10967.7 Ų67.741%0.41134%0.339SS..Hα-helixtrans-72.6-33.8178.6-67-68.587.5136.4-1.2112.1L160 Q188 K189 Y193 D194 I195L160-R191 HydrophobicContact CD1-CB 4.29Å; L160-R191 HydrophobicContact CD1-CG 4.45Å; Q188-R191 PolarHBondContact O-N 2.79Å; K189-R191 VanDerWaalsContact C-N 3.25Å; K189-R191 PolarHBondContact O-N 3.15Å; R191-Y193 VanDerWaalsContact C-N 3.31Å; R191-Y193 PolarHBondContact O-N 2.88Å; R191-D194 IonicContact CZ-OD2 3.12Å; R191-D194 IonicContact NE-OD2 2.83Å; R191-D194 PolarHBondContact NE-OD2 2.73Å; R191-D194 IonicContact NH2-OD2 2.74Å; R191-D194 PolarHBondContact NH2-OD2 3.29Å; R191-D194 WeakPolarHBondContact O-CB 3.37Å; R191-D194 PolarHBondContact O-N 3.33Å; R191-I195 WeakPolarHBondContact O-CG1 3.42Å; R191-I195 PolarHBondContact O-N 3.1Å
192L93.8Very high92Very high1 Ų172.4 Ų72.41%0.00536%0.363CS..Hα-helixtrans-62.2-40.9172.7-61.8179.1000111F164 L178 A181 A182 L185 V187 K189 D194 I195 T196F164-L192 HydrophobicContact CD2-CD2 3.69Å; F164-L192 HydrophobicContact CE2-CD2 3.8Å; L178-L192 HydrophobicContact CB-CD1 4.35Å; L178-L192 HydrophobicContact CD2-CD1 4.47Å; L178-L192 WeakPolarHBondContact O-CD1 3.43Å; A181-L192 HydrophobicContact CB-CD1 4.27Å; A181-L192 HydrophobicContact CB-CD2 4.36Å; A182-L192 HydrophobicContact CB-CD1 3.82Å; L185-L192 HydrophobicContact CD1-CD2 4.12Å; V187-L192 HydrophobicContact CG2-CD2 4.31Å; K189-L192 WeakPolarHBondContact O-CB 3.23Å; K189-L192 PolarHBondContact O-N 2.88Å; K189-L192 VanDerWaalsContact O-N 3.16Å; L192-D194 VanDerWaalsContact C-N 3.32Å; L192-D194 PolarHBondContact O-N 2.57Å; L192-I195 PolarHBondContact O-N 2.98Å; L192-I195 VanDerWaalsContact O-N 3.12Å; L192-T196 WeakPolarHBondContact O-CG2 3.08Å; L192-T196 PolarHBondContact O-N 3.44Å; L192-T196 PolarHBondContact O-OG1 3.39Å
193Y94.3Very high91.6Very high97 Ų9778.9 Ų78.938%0.3839%0.39SS..Hα-helixtrans-64.6-34.4176-55.1-41.7000113.5L178 K189 R190 R191 I195 T196 N197L178-Y193 HydrophobicContact CD1-CE1 4.42Å; K189-Y193 HydrophobicContact CB-CE2 4.17Å; K189-Y193 VanDerWaalsContact O-CD2 3.27Å; K189-Y193 WeakPolarHBondContact O-CD2 3.48Å; K189-Y193 PolarHBondContact O-N 3.13Å; K189-Y193 VanDerWaalsContact O-N 3.13Å; R190-Y193 PolarHBondContact O-N 3.39Å; R191-Y193 VanDerWaalsContact C-N 3.31Å; R191-Y193 PolarHBondContact O-N 2.88Å; Y193-I195 VanDerWaalsContact C-N 3.27Å; Y193-I195 PolarHBondContact O-N 3.3Å; Y193-T196 WeakPolarHBondContact CA-OG1 3.42Å; Y193-T196 PolarHBondContact O-OG1 3.34Å; Y193-N197 WeakPolarHBondContact O-CB 3.41Å; Y193-N197 PolarHBondContact O-N 3.37Å; Y193-N197 PolarHBondContact O-ND2 2.88Å; Y193-N197 PolarHBondContact O-OD1 3.18Å
194D94.8Very high91.4Very high33 Ų3374.6 Ų74.618%0.17637%0.371CS..Hα-helixtrans-60.8-40.2173.3-67.7-48.3000111L157 R190 R191 L192 V198L157-D194 HydrophobicContact CD1-CB 3.94Å; L157-D194 HydrophobicContact CD2-CB 4.17Å; R190-D194 IonicContact CZ-OD1 2.63Å; R190-D194 IonicContact CZ-OD2 3.93Å; R190-D194 IonicContact NH1-OD1 2.63Å; R190-D194 PolarHBondContact NH1-OD1 2.97Å; R190-D194 IonicContact NH1-OD2 3.09Å; R190-D194 PolarHBondContact NH1-OD2 2.7Å; R190-D194 VanDerWaalsContact NH1-OD2 3.09Å; R190-D194 IonicContact NH2-OD1 3.23Å; R190-D194 PolarHBondContact NH2-OD1 2.85Å; R190-D194 IonicContact NH2-OD2 3.7Å; R190-D194 PolarHBondContact O-N 2.8Å; R191-D194 IonicContact CZ-OD2 3.12Å; R191-D194 IonicContact NE-OD2 2.83Å; R191-D194 PolarHBondContact NE-OD2 2.73Å; R191-D194 IonicContact NH2-OD2 2.74Å; R191-D194 PolarHBondContact NH2-OD2 3.29Å; R191-D194 WeakPolarHBondContact O-CB 3.37Å; R191-D194 PolarHBondContact O-N 3.33Å; L192-D194 VanDerWaalsContact C-N 3.32Å; L192-D194 PolarHBondContact O-N 2.57Å; D194-V198 WeakPolarHBondContact O-CG2 3.36Å
195I94.4Very high91.4Very high4 Ų471.2 Ų71.22%0.02135%0.35CS..Hα-helixtrans-72.6-49.4178.7-59.7169.2000110.5L157 L160 T161 F164 R191 L192 Y193 N197 V198 L199L157-I195 HydrophobicContact CD1-CD1 4.16Å; L157-I195 HydrophobicContact CD1-CG1 3.63Å; L157-I195 HydrophobicContact CG-CG1 4.32Å; L160-I195 HydrophobicContact CB-CD1 3.89Å; T161-I195 HydrophobicContact CG2-CG2 4.15Å; F164-I195 HydrophobicContact CB-CD1 4.31Å; F164-I195 HydrophobicContact CD1-CG2 3.74Å; F164-I195 HydrophobicContact CE1-CG2 4.07Å; F164-I195 HydrophobicContact CG-CG2 4.15Å; R191-I195 WeakPolarHBondContact O-CG1 3.42Å; R191-I195 PolarHBondContact O-N 3.1Å; L192-I195 PolarHBondContact O-N 2.98Å; L192-I195 VanDerWaalsContact O-N 3.12Å; Y193-I195 VanDerWaalsContact C-N 3.27Å; Y193-I195 PolarHBondContact O-N 3.3Å; I195-N197 PolarHBondContact O-N 3.36Å; I195-V198 PolarHBondContact O-N 3.28Å; I195-L199 HydrophobicContact CG2-CD1 3.85Å; I195-L199 HydrophobicContact CG2-CG 4.34Å; I195-L199 WeakPolarHBondContact O-CG 3.34Å; I195-L199 PolarHBondContact O-N 3.47Å
196T93.8Very high91.4Very high8 Ų876.2 Ų76.25%0.04937%0.371CS..Hα-helixtrans-65.6-38.9-176.459.90000111.9F164 L178 L192 Y193 V198 L199 E200 I205 I213F164-T196 HydrophobicContact CE1-CG2 4.48Å; F164-T196 HydrophobicContact CZ-CG2 3.86Å; L178-T196 HydrophobicContact CD2-CG2 4.1Å; L192-T196 WeakPolarHBondContact O-CG2 3.08Å; L192-T196 PolarHBondContact O-N 3.44Å; L192-T196 PolarHBondContact O-OG1 3.39Å; Y193-T196 WeakPolarHBondContact CA-OG1 3.42Å; Y193-T196 PolarHBondContact O-OG1 3.34Å; T196-V198 VanDerWaalsContact C-N 3.28Å; T196-V198 PolarHBondContact O-N 3.45Å; T196-L199 PolarHBondContact O-N 2.89Å; T196-E200 WeakPolarHBondContact O-CB 3.31Å; T196-E200 PolarHBondContact O-N 3.47Å; T196-I205 HydrophobicContact CG2-CD1 3.92Å; T196-I213 HydrophobicContact CG2-CD1 4.36Å; T196-I213 HydrophobicContact CG2-CG2 4.3Å
197N94.9Very high91.6Very high97 Ų9774.6 Ų74.652%0.51936%0.362SS..Hα-helixtrans-63.1-36.6179.4-69.1-4000112.1Y193 I195 G201Y193-N197 WeakPolarHBondContact O-CB 3.41Å; Y193-N197 PolarHBondContact O-N 3.37Å; Y193-N197 PolarHBondContact O-ND2 2.88Å; Y193-N197 PolarHBondContact O-OD1 3.18Å; I195-N197 PolarHBondContact O-N 3.36Å; N197-G201 PolarHBondContact O-N 2.87Å
198V94.3Very high91.5Very high93 Ų9378.3 Ų78.356%0.56438%0.375SS*.Hα-helixtrans-70.4-48.9176.4175.10000110D194 I195 T196 E200 G201 I202D194-V198 WeakPolarHBondContact O-CG2 3.36Å; I195-V198 PolarHBondContact O-N 3.28Å; T196-V198 VanDerWaalsContact C-N 3.28Å; T196-V198 PolarHBondContact O-N 3.45Å; V198-E200 VanDerWaalsContact C-N 3.32Å; V198-E200 PolarHBondContact O-N 3.46Å; V198-G201 PolarHBondContact O-N 3.19Å; V198-I202 WeakPolarHBondContact O-CG1 3.38Å; V198-I202 PolarHBondContact O-N 2.87Å; V198-I202 VanDerWaalsContact O-N 3.14Å
199L91.3Very high91.4Very high16 Ų1673.3 Ų73.38%0.08436%0.357CS..Hα-helixtrans-65.3-34.1180-67.1-179000112.9F164 I195 T196 I202 H203 L204 I205F164-L199 HydrophobicContact CD1-CD1 4.29Å; F164-L199 HydrophobicContact CE1-CD1 4.12Å; I195-L199 HydrophobicContact CG2-CD1 3.85Å; I195-L199 HydrophobicContact CG2-CG 4.34Å; I195-L199 WeakPolarHBondContact O-CG 3.34Å; I195-L199 PolarHBondContact O-N 3.47Å; T196-L199 PolarHBondContact O-N 2.89Å; L199-I202 HydrophobicContact CD2-CD1 4.08Å; L199-I202 VanDerWaalsContact O-CG1 3.26Å; L199-I202 WeakPolarHBondContact O-CG1 3.29Å; L199-H203 PolarHBondContact O-N 2.9Å; L199-L204 HydrophobicContact CD2-CD1 4.46Å; L199-L204 PolarHBondContact O-N 3.27Å; L199-I205 HydrophobicContact CB-CD1 3.69Å; L199-I205 HydrophobicContact CB-CG1 3.67Å; L199-I205 HydrophobicContact CB-CG2 4.26Å; L199-I205 HydrophobicContact CD1-CD1 4.44Å; L199-I205 HydrophobicContact CD1-CG2 4.43Å; L199-I205 PolarHBondContact O-N 3.18Å
200E90.8Very high91.3Very high89 Ų8978.2 Ų78.242%0.41638%0.379SS..Hα-helixtrans-72.2-39.4173.6-176.9172.1-161.900110.7T196 V198 I202 H203 I205T196-E200 WeakPolarHBondContact O-CB 3.31Å; T196-E200 PolarHBondContact O-N 3.47Å; V198-E200 VanDerWaalsContact C-N 3.32Å; V198-E200 PolarHBondContact O-N 3.46Å; E200-I202 PolarHBondContact O-N 2.91Å; E200-H203 WeakPolarHBondContact O-CA 3.24Å; E200-H203 PolarHBondContact O-N 3.37Å; E200-I205 HydrophobicContact CB-CG1 4.13Å
201G88.6Confident91Very high55 Ų5574.7 Ų74.757%0.56737%0.369SS*.Hα-helixtrans-62.2-27.7175.700000114N197 V198N197-G201 PolarHBondContact O-N 2.87Å; V198-G201 PolarHBondContact O-N 3.19Å
202I88.4Confident90.8Very high98 Ų9872 Ų7250%0.50336%0.363SS..THydrogen-bonded Turntrans-96.38.3171.363.6176.9000113.2V198 L199 E200 L204V198-I202 WeakPolarHBondContact O-CG1 3.38Å; V198-I202 PolarHBondContact O-N 2.87Å; V198-I202 VanDerWaalsContact O-N 3.14Å; L199-I202 HydrophobicContact CD2-CD1 4.08Å; L199-I202 VanDerWaalsContact O-CG1 3.26Å; L199-I202 WeakPolarHBondContact O-CG1 3.29Å; E200-I202 PolarHBondContact O-N 2.91Å; I202-L204 HydrophobicContact CD1-CB 4.41Å; I202-L204 HydrophobicContact CD1-CD1 3.42Å; I202-L204 VanDerWaalsContact CD1-CD1 3.42Å; I202-L204 HydrophobicContact CD1-CG 3.78Å; I202-L204 HydrophobicContact CG1-CB 4.21Å; I202-L204 HydrophobicContact CG1-CD1 4.06Å; I202-L204 HydrophobicContact CG1-CG 3.83Å; I202-L204 PolarHBondContact O-N 3.42Å
203H85.4Confident90.7Very high153 Ų15372.3 Ų72.371%0.70837%0.365SS*.THydrogen-bonded Turntrans58.624177.8-52.592.1000115.6L199 E200L199-H203 PolarHBondContact O-N 2.9Å; E200-H203 WeakPolarHBondContact O-CA 3.24Å; E200-H203 PolarHBondContact O-N 3.37Å
204L88.1Confident90.5Very high59 Ų5970.7 Ų70.731%0.30936%0.361SS..SBendtrans-82.4-16.2174.2-69.4-174.7000112.9L199 I202 W215 M216 G217L199-L204 HydrophobicContact CD2-CD1 4.46Å; L199-L204 PolarHBondContact O-N 3.27Å; I202-L204 HydrophobicContact CD1-CB 4.41Å; I202-L204 HydrophobicContact CD1-CD1 3.42Å; I202-L204 VanDerWaalsContact CD1-CD1 3.42Å; I202-L204 HydrophobicContact CD1-CG 3.78Å; I202-L204 HydrophobicContact CG1-CB 4.21Å; I202-L204 HydrophobicContact CG1-CD1 4.06Å; I202-L204 HydrophobicContact CG1-CG 3.83Å; I202-L204 PolarHBondContact O-N 3.42Å; L204-W215 HydrophobicContact CB-CH2 4.27Å; L204-W215 HydrophobicContact CB-CZ3 4.09Å; L204-W215 HydrophobicContact CD1-CH2 4.16Å; L204-M216 CarbonylContact O-C 3.58Å; L204-M216 WeakPolarHBondContact O-CA 3.46Å; L204-M216 PolarHBondContact O-N 3.48Å; L204-G217 PolarHBondContact O-N 3.21Å
205I89.7Confident90.3Very high6 Ų673 Ų733%0.03137%0.367CS..EExtended strand (participates in β ladder)trans-136157.8173.564.9171000110.7L168 T196 L199 E200 I213 Q214 W215L168-I205 HydrophobicContact CD2-CG2 4.05Å; T196-I205 HydrophobicContact CG2-CD1 3.92Å; L199-I205 HydrophobicContact CB-CD1 3.69Å; L199-I205 HydrophobicContact CB-CG1 3.67Å; L199-I205 HydrophobicContact CB-CG2 4.26Å; L199-I205 HydrophobicContact CD1-CD1 4.44Å; L199-I205 HydrophobicContact CD1-CG2 4.43Å; L199-I205 PolarHBondContact O-N 3.18Å; E200-I205 HydrophobicContact CB-CG1 4.13Å; I205-I213 HydrophobicContact CD1-CD1 3.9Å; I205-I213 HydrophobicContact CG2-CD1 4.37Å; I205-Q214 CarbonylContact C-O 3.5Å; I205-Q214 WeakPolarHBondContact CA-O 3.48Å; I205-Q214 WeakPolarHBondContact CB-O 3.31Å; I205-W215 HydrophobicContact CG2-CE3 3.64Å; I205-W215 HydrophobicContact CG2-CZ3 4.14Å
206K90Very high89.6Confident126 Ų12677.5 Ų77.555%0.54839%0.389SS..EExtended strand (participates in β ladder)trans-132.5145.4173.2-178.3176.2-179.9-179.80110.4K208 I213 Q214 M216K206-K208 PolarHBondContact O-N 3.5Å; K206-I213 WeakPolarHBondContact O-CA 3.38Å; K206-Q214 PolarHBondContact N-O 3.46Å; K206-Q214 PolarHBondContact O-N 2.87Å; K206-M216 HydrophobicContact CB-CG 3.47Å; K206-M216 VanDerWaalsContact CB-CG 3.47Å; K206-M216 HydrophobicContact CB-SD 3.75Å; K206-M216 HydrophobicContact CD-SD 4.26Å
207K91.4Very high88.2Confident132 Ų13277.5 Ų77.557%0.57439%0.39SS*.EExtended strand (participates in β ladder)trans-71.7112.2171.9-171.8177.4-179.6179.60110.5S209K207-S209 WeakPolarHBondContact CG-O 3.29Å
208K87.3Confident86.4Confident110 Ų11077 Ų7748%0.47839%0.393SS..  trans-83.5-40.4174.2-172173-179172.80110.9D173 V175 K206 N212 Q214D173-K208 IonicContact OD2-NZ 2.57Å; D173-K208 PolarHBondContact OD2-NZ 3.03Å; V175-K208 HydrophobicContact CG1-CD 4.17Å; V175-K208 HydrophobicContact CG2-CD 3.62Å; K206-K208 PolarHBondContact O-N 3.5Å; K208-N212 HydrophobicContact CB-CB 4.46Å; K208-N212 PolarHBondContact N-O 2.88Å; K208-Q214 HydrophobicContact CB-CB 4.23Å; K208-Q214 HydrophobicContact CD-CB 4.49Å
209S90.4Very high84.5Confident50 Ų5075.7 Ų75.735%0.3539%0.388SS..SBendtrans-156.6-177.5173.8670000111.6K207 N211 N212K207-S209 WeakPolarHBondContact CG-O 3.29Å; S209-N211 PolarHBondContact O-N 3.23Å; S209-N211 VanDerWaalsContact O-N 3.11Å; S209-N212 PolarHBondContact N-O 2.86Å; S209-N212 PolarHBondContact O-N 2.57Å; S209-N212 VanDerWaalsContact O-O 3.12Å; S209-N212 VanDerWaalsContact OG-CB 3.28Å; S209-N212 WeakPolarHBondContact OG-CB 3.39Å; S209-N212 PolarHBondContact OG-N 2.76Å; S209-N212 PolarHBondContact OG-ND2 2.63Å
210K86.3Confident82.5Confident179 Ų17982.2 Ų82.278%0.77842%0.423SS*.SBendtrans-53.3-35.4-175.4-174.2176179179.40113.7
211N89.3Confident80.6Confident54 Ų5484.6 Ų84.629%0.28944%0.438SS..SBendtrans-115.8-3.7179.9-64.7-30.7000113.6D177 L178 N179 S209D177-N211 CarbonylContact C-O 3.52Å; D177-N211 WeakPolarHBondContact CA-O 2.82Å; L178-N211 WeakPolarHBondContact CG-O 3.5Å; L178-N211 PolarHBondContact N-O 3.31Å; N179-N211 VanDerWaalsContact ND2-CG 3.32Å; N179-N211 PolarHBondContact ND2-ND2 2.87Å; N179-N211 VanDerWaalsContact ND2-ND2 3.16Å; S209-N211 PolarHBondContact O-N 3.23Å; S209-N211 VanDerWaalsContact O-N 3.11Å
212N89.8Confident78.8Confident51 Ų5188.6 Ų88.627%0.27344%0.441SS..EExtended strand (participates in β ladder)trans-116.5126.4-176.5-61.3-56.6000110.7V175 L176 K208 S209V175-N212 HydrophobicContact CG1-CB 3.76Å; L176-N212 WeakPolarHBondContact O-CA 3.39Å; K208-N212 HydrophobicContact CB-CB 4.46Å; K208-N212 PolarHBondContact N-O 2.88Å; S209-N212 PolarHBondContact N-O 2.86Å; S209-N212 PolarHBondContact O-N 2.57Å; S209-N212 VanDerWaalsContact O-O 3.12Å; S209-N212 VanDerWaalsContact OG-CB 3.28Å; S209-N212 WeakPolarHBondContact OG-CB 3.39Å; S209-N212 PolarHBondContact OG-N 2.76Å; S209-N212 PolarHBondContact OG-ND2 2.63Å
213I91.4Very high77.2Confident9 Ų986.6 Ų86.65%0.04643%0.433CS..EExtended strand (participates in β ladder)trans-106.4149.1168.558.8142.8000109.1F164 L168 V175 L176 L178 T196 I205 K206F164-I213 HydrophobicContact CE1-CD1 3.73Å; F164-I213 HydrophobicContact CZ-CD1 3.41Å; F164-I213 VanDerWaalsContact CZ-CD1 3.41Å; F164-I213 HydrophobicContact CZ-CG1 4.39Å; L168-I213 HydrophobicContact CD1-CD1 4.5Å; L168-I213 HydrophobicContact CD2-CD1 4.41Å; V175-I213 CarbonylContact C-O 3.53Å; V175-I213 VanDerWaalsContact CA-O 3.25Å; V175-I213 WeakPolarHBondContact CA-O 3.34Å; L176-I213 HydrophobicContact CB-CD1 4.35Å; L176-I213 HydrophobicContact CB-CG1 4.03Å; L176-I213 HydrophobicContact CD2-CD1 4.45Å; L176-I213 PolarHBondContact N-O 3.5Å; L176-I213 WeakPolarHBondContact O-CG1 3.5Å; L176-I213 PolarHBondContact O-N 3.27Å; L178-I213 HydrophobicContact CD1-CG2 4.33Å; L178-I213 HydrophobicContact CD2-CG1 4.2Å; L178-I213 HydrophobicContact CD2-CG2 4.23Å; L178-I213 HydrophobicContact CG-CG2 4.42Å; T196-I213 HydrophobicContact CG2-CD1 4.36Å; T196-I213 HydrophobicContact CG2-CG2 4.3Å; I205-I213 HydrophobicContact CD1-CD1 3.9Å; I205-I213 HydrophobicContact CG2-CD1 4.37Å; K206-I213 WeakPolarHBondContact O-CA 3.38Å
214Q90Very high75.7Confident62 Ų6285.5 Ų85.529%0.2943%0.429SS..EExtended strand (participates in β ladder)trans-117.1135.3178-175.31727.600109.1G174 V175 I205 K206 K208 M216G174-Q214 CarbonylContact O-C 3.55Å; G174-Q214 WeakPolarHBondContact O-CA 3.47Å; V175-Q214 HydrophobicContact CG2-CB 4.11Å; V175-Q214 HydrophobicContact CG2-CG 3.99Å; I205-Q214 CarbonylContact C-O 3.5Å; I205-Q214 WeakPolarHBondContact CA-O 3.48Å; I205-Q214 WeakPolarHBondContact CB-O 3.31Å; K206-Q214 PolarHBondContact N-O 3.46Å; K206-Q214 PolarHBondContact O-N 2.87Å; K208-Q214 HydrophobicContact CB-CB 4.23Å; K208-Q214 HydrophobicContact CD-CB 4.49Å; Q214-M216 PolarHBondContact O-N 2.87Å
215W90.1Very high74.5Confident83 Ų8384.7 Ų84.731%0.31444%0.435SS..EExtended strand (participates in β ladder)trans-68.9122.6170.3-173.8-109.6000109.4L168 G174 L204 I205 G217L168-W215 HydrophobicContact CD1-CB 4.13Å; L168-W215 HydrophobicContact CD2-CB 4.01Å; L168-W215 HydrophobicContact CD2-CD2 3.96Å; L168-W215 HydrophobicContact CD2-CE3 3.28Å; L168-W215 HydrophobicContact CD2-CG 4.29Å; L168-W215 HydrophobicContact CD2-CZ3 4.04Å; L168-W215 HydrophobicContact CG-CB 4.02Å; L168-W215 HydrophobicContact CG-CE3 4.25Å; L168-W215 HydrophobicContact CG-CG 4.47Å; G174-W215 PolarHBondContact O-N 3.32Å; L204-W215 HydrophobicContact CB-CH2 4.27Å; L204-W215 HydrophobicContact CB-CZ3 4.09Å; L204-W215 HydrophobicContact CD1-CH2 4.16Å; I205-W215 HydrophobicContact CG2-CE3 3.64Å; I205-W215 HydrophobicContact CG2-CZ3 4.14Å; W215-G217 VanDerWaalsContact NE1-C 3.31Å; W215-G217 PolarHBondContact NE1-O 3.39Å
216M79.9Confident73.4Confident98 Ų9887 Ų8748%0.48345%0.454SS..  trans-108.3-14.5175.3-59.6-60.9-53.100111.5L204 K206 Q214L204-M216 CarbonylContact O-C 3.58Å; L204-M216 WeakPolarHBondContact O-CA 3.46Å; L204-M216 PolarHBondContact O-N 3.48Å; K206-M216 HydrophobicContact CB-CG 3.47Å; K206-M216 VanDerWaalsContact CB-CG 3.47Å; K206-M216 HydrophobicContact CB-SD 3.75Å; K206-M216 HydrophobicContact CD-SD 4.26Å; Q214-M216 PolarHBondContact O-N 2.87Å
217G65.2Low72.6Confident7 Ų784 Ų847%0.07244%0.444CS..SBendtrans-60.6149.1171.600000109.8L204 W215 S219L204-G217 PolarHBondContact O-N 3.21Å; W215-G217 VanDerWaalsContact NE1-C 3.31Å; W215-G217 PolarHBondContact NE1-O 3.39Å; G217-S219 PolarHBondContact O-N 3.44Å; G217-S219 VanDerWaalsContact O-N 3.1Å
218C56.2Low71.9Confident86 Ų8681 Ų8158%0.58144%0.44SS*.  trans-44.2122-171.4-45.20000111L220 V223C218-L220 PolarHBondContact O-N 2.89Å; C218-L220 VanDerWaalsContact O-N 3.11Å; C218-V223 HydrophobicContact CB-CG2 3.17Å
219S54.9Low71.7Confident66 Ų6681.9 Ų81.946%0.46245%0.446SS..  trans-50.2124.7159.5-105.30000105.7G217 L221 E222 V223G217-S219 PolarHBondContact O-N 3.44Å; G217-S219 VanDerWaalsContact O-N 3.1Å; S219-L221 PolarHBondContact O-N 3.21Å; S219-E222 WeakPolarHBondContact O-CA 3.26Å; S219-E222 WeakPolarHBondContact O-CB 3.38Å; S219-E222 PolarHBondContact O-N 3.48Å; S219-V223 PolarHBondContact O-N 3.3Å; S219-V223 VanDerWaalsContact O-N 3.14Å
220L49Very low71.4Confident154 Ų15487 Ų8781%0.80646%0.457SS*.Hα-helixtrans-53-26.6-179.6-152.892.9000111.1C218 E224C218-L220 PolarHBondContact O-N 2.89Å; C218-L220 VanDerWaalsContact O-N 3.11Å; L220-E224 PolarHBondContact O-N 2.96Å
221L50.7Low71.5Confident139 Ų13984.6 Ų84.673%0.72845%0.449SS*.Hα-helixtrans-69.6-35.3171.4-74.7161.7000114.9S219 G225S219-L221 PolarHBondContact O-N 3.21Å; L221-G225 PolarHBondContact O-N 2.75Å; L221-G225 VanDerWaalsContact O-N 3.16Å
222E51.9Low71.6Confident139 Ų13985.6 Ų85.665%0.6546%0.46SS*.Hα-helixtrans-74.2-29.9173.5-88.5-179.1154.600111.8S219 A226S219-E222 WeakPolarHBondContact O-CA 3.26Å; S219-E222 WeakPolarHBondContact O-CB 3.38Å; S219-E222 PolarHBondContact O-N 3.48Å; E222-A226 WeakPolarHBondContact O-CB 3.42Å; E222-A226 PolarHBondContact O-N 2.86Å
223V53.8Low71.8Confident55 Ų5587.3 Ų87.333%0.33347%0.469SS..Hα-helixtrans-66.1-42.6172.6-177.80000110C218 S219 A226 L227C218-V223 HydrophobicContact CB-CG2 3.17Å; S219-V223 PolarHBondContact O-N 3.3Å; S219-V223 VanDerWaalsContact O-N 3.14Å; V223-A226 PolarHBondContact O-N 2.86Å; V223-L227 HydrophobicContact CG1-CD1 3.65Å; V223-L227 HydrophobicContact CG1-CG 3.93Å; V223-L227 WeakPolarHBondContact O-CB 3.33Å; V223-L227 WeakPolarHBondContact O-CG 3.46Å; V223-L227 PolarHBondContact O-N 2.94Å
224E54.9Low71.9Confident130 Ų13091.2 Ų91.261%0.60749%0.493SS*.Hα-helixtrans-64.9-45178.4-152163.1-159.500111.5L220 L227 S228L220-E224 PolarHBondContact O-N 2.96Å; E224-L227 PolarHBondContact O-N 2.99Å; E224-S228 WeakPolarHBondContact O-CB 3.43Å; E224-S228 PolarHBondContact O-N 2.88Å; E224-S228 PolarHBondContact O-OG 3.08Å; E224-S228 VanDerWaalsContact O-OG 3.13Å
225G61.6Low72.1Confident42 Ų4291.1 Ų91.143%0.43350%0.503SS..Hα-helixtrans-63.5-44.4174.100000114L221 S228 Q229L221-G225 PolarHBondContact O-N 2.75Å; L221-G225 VanDerWaalsContact O-N 3.16Å; G225-S228 PolarHBondContact O-N 3.24Å; G225-Q229 WeakPolarHBondContact O-CB 3.49Å; G225-Q229 PolarHBondContact O-N 2.81Å
226A67.5Low72.4Confident54 Ų5492.2 Ų92.245%0.44651%0.512SS..Hα-helixtrans-70.8-32.1178.700000112.5E222 V223 R230E222-A226 WeakPolarHBondContact O-CB 3.42Å; E222-A226 PolarHBondContact O-N 2.86Å; V223-A226 PolarHBondContact O-N 2.86Å; A226-R230 WeakPolarHBondContact O-CB 3.18Å; A226-R230 PolarHBondContact O-N 3.3Å
227L72.6Confident73.3Confident63 Ų6392.4 Ų92.433%0.3352%0.518SS..Hα-helixtrans-68.1-45.1172.6-73177.4000111V223 E224 R230 Q231V223-L227 HydrophobicContact CG1-CD1 3.65Å; V223-L227 HydrophobicContact CG1-CG 3.93Å; V223-L227 WeakPolarHBondContact O-CB 3.33Å; V223-L227 WeakPolarHBondContact O-CG 3.46Å; V223-L227 PolarHBondContact O-N 2.94Å; E224-L227 PolarHBondContact O-N 2.99Å; L227-R230 PolarHBondContact O-N 2.99Å; L227-Q231 WeakPolarHBondContact O-CB 3.5Å; L227-Q231 VanDerWaalsContact O-CG 3.27Å; L227-Q231 WeakPolarHBondContact O-CG 3.35Å; L227-Q231 PolarHBondContact O-N 3.36Å
228S77.3Confident74.8Confident69 Ų6995.2 Ų95.248%0.48354%0.536SS..Hα-helixtrans-63.9-42.7175.6-66.90000112.1E224 G225 Q231 S232E224-S228 WeakPolarHBondContact O-CB 3.43Å; E224-S228 PolarHBondContact O-N 2.88Å; E224-S228 PolarHBondContact O-OG 3.08Å; E224-S228 VanDerWaalsContact O-OG 3.13Å; G225-S228 PolarHBondContact O-N 3.24Å; S228-Q231 PolarHBondContact O-N 3.13Å; S228-S232 PolarHBondContact O-N 3.35Å
229Q83.6Confident76.8Confident130 Ų13093.7 Ų93.761%0.60753%0.53SS*.Hα-helixtrans-63-43.9175.3-172.8177.524.400111.4G225 Q231 S232 L233G225-Q229 WeakPolarHBondContact O-CB 3.49Å; G225-Q229 PolarHBondContact O-N 2.81Å; Q229-Q231 VanDerWaalsContact C-N 3.33Å; Q229-Q231 PolarHBondContact O-N 2.92Å; Q229-S232 WeakPolarHBondContact O-CB 3.3Å; Q229-S232 PolarHBondContact O-N 2.76Å; Q229-L233 HydrophobicContact CG-CD1 4.1Å; Q229-L233 WeakPolarHBondContact O-CB 3.26Å; Q229-L233 WeakPolarHBondContact O-CG 3.36Å; Q229-L233 PolarHBondContact O-N 3.37Å
230R83.4Confident78.9Confident157 Ų15795.7 Ų95.759%0.59254%0.535SS*.Hα-helixtrans-63.4-38.7175.7-175.8177.661.11477112.1A226 L227 T234A226-R230 WeakPolarHBondContact O-CB 3.18Å; A226-R230 PolarHBondContact O-N 3.3Å; L227-R230 PolarHBondContact O-N 2.99Å; R230-T234 WeakPolarHBondContact O-CB 3.36Å; R230-T234 PolarHBondContact O-N 2.89Å; R230-T234 PolarHBondContact O-OG1 3.14Å
231Q88.6Confident81.2Confident128 Ų12890 Ų9060%0.59851%0.513SS*.Hα-helixtrans-64.6-43.7173.8-74.7172.726.300111.5L227 S228 Q229 T234 A235L227-Q231 WeakPolarHBondContact O-CB 3.5Å; L227-Q231 VanDerWaalsContact O-CG 3.27Å; L227-Q231 WeakPolarHBondContact O-CG 3.35Å; L227-Q231 PolarHBondContact O-N 3.36Å; S228-Q231 PolarHBondContact O-N 3.13Å; Q229-Q231 VanDerWaalsContact C-N 3.33Å; Q229-Q231 PolarHBondContact O-N 2.92Å; Q231-T234 PolarHBondContact O-N 2.96Å; Q231-A235 PolarHBondContact O-N 3.15Å
232S90.8Very high83.5Confident75 Ų7589.5 Ų89.552%0.52451%0.507SS..Hα-helixtrans-60-48.6175.6-171.20000111.7S228 Q229 T234 A235 E236S228-S232 PolarHBondContact O-N 3.35Å; Q229-S232 WeakPolarHBondContact O-CB 3.3Å; Q229-S232 PolarHBondContact O-N 2.76Å; S232-T234 VanDerWaalsContact C-N 3.3Å; S232-T234 PolarHBondContact O-N 3.37Å; S232-A235 PolarHBondContact O-N 3.42Å; S232-E236 WeakPolarHBondContact O-CB 3.44Å; S232-E236 PolarHBondContact O-N 2.88Å
233L93.5Very high85.7Confident88 Ų8886.6 Ų86.646%0.46149%0.494SS..Hα-helixtrans-62.9-36.9176.9-72.4166.4000111.8Q229 E236 V237Q229-L233 HydrophobicContact CG-CD1 4.1Å; Q229-L233 WeakPolarHBondContact O-CB 3.26Å; Q229-L233 WeakPolarHBondContact O-CG 3.36Å; Q229-L233 PolarHBondContact O-N 3.37Å; L233-E236 PolarHBondContact O-N 3.05Å; L233-V237 WeakPolarHBondContact O-CB 3.42Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.35Å; L233-V237 PolarHBondContact O-N 3.18Å
234T93.9Very high87.9Confident90 Ų9090.8 Ų90.855%0.55251%0.509SS*.Hα-helixtrans-65.8-41.4175.7-54.80000111R230 Q231 S232 S238R230-T234 WeakPolarHBondContact O-CB 3.36Å; R230-T234 PolarHBondContact O-N 2.89Å; R230-T234 PolarHBondContact O-OG1 3.14Å; Q231-T234 PolarHBondContact O-N 2.96Å; S232-T234 VanDerWaalsContact C-N 3.3Å; S232-T234 PolarHBondContact O-N 3.37Å; T234-S238 WeakPolarHBondContact O-CB 3.48Å; T234-S238 PolarHBondContact O-N 3.21Å
235A95.1Very high89.9Confident60 Ų6090 Ų9050%0.49651%0.506SS..Hα-helixtrans-65.3-41175.500000111.6Q231 S232 S238 A239Q231-A235 PolarHBondContact O-N 3.15Å; S232-A235 PolarHBondContact O-N 3.42Å; A235-S238 WeakPolarHBondContact O-CB 3.46Å; A235-S238 PolarHBondContact O-N 2.91Å; A235-A239 WeakPolarHBondContact O-CB 3.25Å; A235-A239 PolarHBondContact O-N 2.88Å
236E96.9Very high91.7Very high107 Ų10793.3 Ų93.350%0.551%0.505SS..Hα-helixtrans-63.8-46.2176.1-174.5177.2-178.900111.8S232 L233 S238 A239 L240S232-E236 WeakPolarHBondContact O-CB 3.44Å; S232-E236 PolarHBondContact O-N 2.88Å; L233-E236 PolarHBondContact O-N 3.05Å; E236-S238 VanDerWaalsContact C-N 3.27Å; E236-S238 PolarHBondContact O-N 3.4Å; E236-A239 PolarHBondContact O-N 2.94Å; E236-L240 HydrophobicContact CG-CD1 4.23Å; E236-L240 WeakPolarHBondContact O-CB 3.45Å; E236-L240 WeakPolarHBondContact O-CG 3.48Å; E236-L240 PolarHBondContact O-N 2.84Å
237V97.8Very high93.2Very high102 Ų10294.4 Ų94.462%0.61850%0.503SS*.Hα-helixtrans-60.4-39.7174.8169.50000111.1L233 G241L233-V237 WeakPolarHBondContact O-CB 3.42Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.35Å; L233-V237 PolarHBondContact O-N 3.18Å; V237-G241 PolarHBondContact O-N 3.37Å
238S97.6Very high94.4Very high65 Ų6595.9 Ų95.946%0.45551%0.508SS..Hα-helixtrans-63.1-46.5174.7-167.20000111.6T234 A235 E236 L240 G241 E242T234-S238 WeakPolarHBondContact O-CB 3.48Å; T234-S238 PolarHBondContact O-N 3.21Å; A235-S238 WeakPolarHBondContact O-CB 3.46Å; A235-S238 PolarHBondContact O-N 2.91Å; E236-S238 VanDerWaalsContact C-N 3.27Å; E236-S238 PolarHBondContact O-N 3.4Å; S238-L240 PolarHBondContact O-N 3.3Å; S238-G241 PolarHBondContact O-N 3.31Å; S238-E242 WeakPolarHBondContact O-CG 3.44Å; S238-E242 PolarHBondContact O-N 2.86Å
239A98.1Very high95.4Very high55 Ų5598.1 Ų98.146%0.45551%0.51SS..Hα-helixtrans-63.3-41.4178.900000112A235 E236 G241 E242 E243A235-A239 WeakPolarHBondContact O-CB 3.25Å; A235-A239 PolarHBondContact O-N 2.88Å; E236-A239 PolarHBondContact O-N 2.94Å; A239-G241 VanDerWaalsContact C-N 3.34Å; A239-E242 PolarHBondContact O-N 2.87Å; A239-E243 WeakPolarHBondContact O-CB 3.08Å; A239-E243 PolarHBondContact O-N 3.33Å
240L98.2Very high96.1Very high108 Ų10896.3 Ų96.357%0.56550%0.504SS*.Hα-helixtrans-63.8-39.4174.1-71.1174000111.8E236 S238 E243 E244E236-L240 HydrophobicContact CG-CD1 4.23Å; E236-L240 WeakPolarHBondContact O-CB 3.45Å; E236-L240 WeakPolarHBondContact O-CG 3.48Å; E236-L240 PolarHBondContact O-N 2.84Å; S238-L240 PolarHBondContact O-N 3.3Å; L240-E243 PolarHBondContact O-N 3.2Å; L240-E244 WeakPolarHBondContact O-CB 3.34Å; L240-E244 PolarHBondContact O-N 3.49Å
241G98.4Very high96.8Very high33 Ų3393.4 Ų93.434%0.3450%0.499SS..Hα-helixtrans-65.1-36.617500000113.2V237 S238 A239 Q245V237-G241 PolarHBondContact O-N 3.37Å; S238-G241 PolarHBondContact O-N 3.31Å; A239-G241 VanDerWaalsContact C-N 3.34Å; G241-Q245 WeakPolarHBondContact O-CB 3.48Å; G241-Q245 PolarHBondContact O-N 2.96Å
242E98.4Very high97.3Very high130 Ų13092.5 Ų92.561%0.60750%0.495SS*.Hα-helixtrans-65.8-41.7173-72.7175.4-162.200111.7S238 A239 Q245 R246S238-E242 WeakPolarHBondContact O-CG 3.44Å; S238-E242 PolarHBondContact O-N 2.86Å; A239-E242 PolarHBondContact O-N 2.87Å; E242-Q245 PolarHBondContact O-N 2.98Å; E242-R246 WeakPolarHBondContact O-CB 3.5Å; E242-R246 PolarHBondContact O-N 3.46Å
243E98.4Very high97.7Very high78 Ų7895.5 Ų95.536%0.36449%0.494SS..Hα-helixtrans-66.6-42.9177.5179.856.6-161.900112.1A239 L240 Q245 R246 L247A239-E243 WeakPolarHBondContact O-CB 3.08Å; A239-E243 PolarHBondContact O-N 3.33Å; L240-E243 PolarHBondContact O-N 3.2Å; E243-Q245 VanDerWaalsContact C-N 3.31Å; E243-Q245 PolarHBondContact O-N 3.05Å; E243-R246 VanDerWaalsContact CD-NE 3.35Å; E243-R246 WeakPolarHBondContact O-CB 3.45Å; E243-R246 PolarHBondContact O-N 2.88Å; E243-R246 VanDerWaalsContact O-N 3.13Å; E243-R246 IonicContact OE1-CZ 2.75Å; E243-R246 VanDerWaalsContact OE1-CZ 3.32Å; E243-R246 IonicContact OE1-NE 3.18Å; E243-R246 PolarHBondContact OE1-NE 3.16Å; E243-R246 IonicContact OE1-NH2 2.79Å; E243-R246 PolarHBondContact OE1-NH2 2.92Å; E243-R246 IonicContact OE2-CZ 2.91Å; E243-R246 IonicContact OE2-NE 3.91Å; E243-R246 PolarHBondContact OE2-NE 2.87Å; E243-R246 IonicContact OE2-NH2 3.81Å; E243-L247 HydrophobicContact CG-CD1 4.41Å; E243-L247 WeakPolarHBondContact O-CG 3.36Å; E243-L247 PolarHBondContact O-N 3.39Å
244E98.5Very high97.9Very high142 Ų14294.5 Ų94.566%0.66449%0.494SS*.Hα-helixtrans-57.2-46.3172.1-176.6-178.8-173.700110.7L240 R246 L247 E248L240-E244 WeakPolarHBondContact O-CB 3.34Å; L240-E244 PolarHBondContact O-N 3.49Å; E244-R246 VanDerWaalsContact C-N 3.28Å; E244-R246 PolarHBondContact O-N 3.42Å; E244-L247 PolarHBondContact O-N 2.97Å; E244-E248 WeakPolarHBondContact O-CB 3.16Å; E244-E248 PolarHBondContact O-N 2.94Å
245Q98.4Very high98.1Very high113 Ų11393.4 Ų93.453%0.52849%0.49SS..Hα-helixtrans-63.7-34.8177.5-160.2-164.643.900112.3G241 E242 E243 K249G241-Q245 WeakPolarHBondContact O-CB 3.48Å; G241-Q245 PolarHBondContact O-N 2.96Å; E242-Q245 PolarHBondContact O-N 2.98Å; E243-Q245 VanDerWaalsContact C-N 3.31Å; E243-Q245 PolarHBondContact O-N 3.05Å; Q245-K249 VanDerWaalsContact O-CG 3.3Å; Q245-K249 WeakPolarHBondContact O-CG 3.38Å; Q245-K249 PolarHBondContact O-N 3.48Å; Q245-K249 VanDerWaalsContact O-N 3.15Å
246R98.6Very high98.2Very high112 Ų11294.2 Ų94.242%0.42349%0.486SS..Hα-helixtrans-66.1-46.3175.6-171-165.970.775.51.8110.8E242 E243 E244 K249 L250E242-R246 WeakPolarHBondContact O-CB 3.5Å; E242-R246 PolarHBondContact O-N 3.46Å; E243-R246 VanDerWaalsContact CD-NE 3.35Å; E243-R246 WeakPolarHBondContact O-CB 3.45Å; E243-R246 PolarHBondContact O-N 2.88Å; E243-R246 VanDerWaalsContact O-N 3.13Å; E243-R246 IonicContact OE1-CZ 2.75Å; E243-R246 VanDerWaalsContact OE1-CZ 3.32Å; E243-R246 IonicContact OE1-NE 3.18Å; E243-R246 PolarHBondContact OE1-NE 3.16Å; E243-R246 IonicContact OE1-NH2 2.79Å; E243-R246 PolarHBondContact OE1-NH2 2.92Å; E243-R246 IonicContact OE2-CZ 2.91Å; E243-R246 IonicContact OE2-NE 3.91Å; E243-R246 PolarHBondContact OE2-NE 2.87Å; E243-R246 IonicContact OE2-NH2 3.81Å; E244-R246 VanDerWaalsContact C-N 3.28Å; E244-R246 PolarHBondContact O-N 3.42Å; R246-K249 PolarHBondContact O-N 3.29Å; R246-L250 PolarHBondContact O-N 2.68Å; R246-L250 VanDerWaalsContact O-N 3.14Å
247L98.7Very high98.2Very high78 Ų7892.1 Ų92.141%0.40848%0.478SS..Hα-helixtrans-62.8-44177.5-70.1172.9000111.5E243 E244 K249 L250 I251E243-L247 HydrophobicContact CG-CD1 4.41Å; E243-L247 WeakPolarHBondContact O-CG 3.36Å; E243-L247 PolarHBondContact O-N 3.39Å; E244-L247 PolarHBondContact O-N 2.97Å; L247-K249 VanDerWaalsContact C-N 3.32Å; L247-K249 PolarHBondContact O-N 3.25Å; L247-L250 WeakPolarHBondContact O-CB 3Å; L247-L250 PolarHBondContact O-N 2.91Å; L247-I251 WeakPolarHBondContact O-CG1 3.27Å; L247-I251 PolarHBondContact O-N 2.77Å
248E98.6Very high98.1Very high93 Ų9391.9 Ų91.944%0.43547%0.472SS..Hα-helixtrans-58.4-44176.9-177.356.6-146.100111.4E244 L250 I251 Q252E244-E248 WeakPolarHBondContact O-CB 3.16Å; E244-E248 PolarHBondContact O-N 2.94Å; E248-L250 VanDerWaalsContact C-N 3.31Å; E248-L250 PolarHBondContact O-N 3.04Å; E248-I251 PolarHBondContact O-N 2.95Å; E248-Q252 WeakPolarHBondContact O-CB 3.49Å; E248-Q252 VanDerWaalsContact O-CG 3.26Å; E248-Q252 WeakPolarHBondContact O-CG 3.46Å; E248-Q252 PolarHBondContact O-N 3.26Å; E248-Q252 PolarHBondContact OE1-NE2 3.41Å
249K98.4Very high97.9Very high117 Ų11793.9 Ų93.951%0.50947%0.473SS..Hα-helixtrans-60.6-39174.8-72.9166.6-173.6160.40112.4Q245 R246 L247 R253Q245-K249 VanDerWaalsContact O-CG 3.3Å; Q245-K249 WeakPolarHBondContact O-CG 3.38Å; Q245-K249 PolarHBondContact O-N 3.48Å; Q245-K249 VanDerWaalsContact O-N 3.15Å; R246-K249 PolarHBondContact O-N 3.29Å; L247-K249 VanDerWaalsContact C-N 3.32Å; L247-K249 PolarHBondContact O-N 3.25Å; K249-R253 WeakPolarHBondContact O-CB 3.46Å; K249-R253 PolarHBondContact O-N 2.88Å
250L98.5Very high97.7Very high92 Ų9295.9 Ų95.948%0.48247%0.472SS..Hα-helixtrans-69.4-42.6177.5-70.9-179000112.2R246 L247 E248 Q252 R253 C254R246-L250 PolarHBondContact O-N 2.68Å; R246-L250 VanDerWaalsContact O-N 3.14Å; L247-L250 WeakPolarHBondContact O-CB 3Å; L247-L250 PolarHBondContact O-N 2.91Å; E248-L250 VanDerWaalsContact C-N 3.31Å; E248-L250 PolarHBondContact O-N 3.04Å; L250-Q252 VanDerWaalsContact C-N 3.33Å; L250-Q252 PolarHBondContact O-N 3.15Å; L250-R253 PolarHBondContact O-N 3.19Å; L250-C254 WeakPolarHBondContact O-CB 3.14Å; L250-C254 PolarHBondContact O-N 3.35Å
251I98.5Very high97.5Very high96 Ų9696.5 Ų96.549%0.49247%0.474SS..Hα-helixtrans-61.1-45.4176-68.6167.2000109.9L247 E248 R253 C254 S255L247-I251 WeakPolarHBondContact O-CG1 3.27Å; L247-I251 PolarHBondContact O-N 2.77Å; E248-I251 PolarHBondContact O-N 2.95Å; I251-R253 PolarHBondContact O-N 3.14Å; I251-C254 PolarHBondContact O-N 3.45Å; I251-S255 VanDerWaalsContact O-CB 3.29Å; I251-S255 WeakPolarHBondContact O-CB 3.41Å; I251-S255 PolarHBondContact O-N 3Å; I251-S255 PolarHBondContact O-OG 2.98Å
252Q98.5Very high97.1Very high109 Ų10998 Ų9851%0.50948%0.479SS..Hα-helixtrans-61.4-43.7176.2-73.1176.711.300111.9E248 L250 S255 L256E248-Q252 WeakPolarHBondContact O-CB 3.49Å; E248-Q252 VanDerWaalsContact O-CG 3.26Å; E248-Q252 WeakPolarHBondContact O-CG 3.46Å; E248-Q252 PolarHBondContact O-N 3.26Å; E248-Q252 PolarHBondContact OE1-NE2 3.41Å; L250-Q252 VanDerWaalsContact C-N 3.33Å; L250-Q252 PolarHBondContact O-N 3.15Å; Q252-S255 PolarHBondContact O-N 3.45Å; Q252-L256 WeakPolarHBondContact O-CB 3.47Å; Q252-L256 PolarHBondContact O-N 2.97Å
253R98.4Very high96.7Very high137 Ų13797.7 Ų97.752%0.51748%0.478SS..Hα-helixtrans-62.9-49.6178-179.565.8-157-170.46.1111.5K249 L250 I251 S255 L256 D257K249-R253 WeakPolarHBondContact O-CB 3.46Å; K249-R253 PolarHBondContact O-N 2.88Å; L250-R253 PolarHBondContact O-N 3.19Å; I251-R253 PolarHBondContact O-N 3.14Å; R253-S255 VanDerWaalsContact C-N 3.34Å; R253-S255 PolarHBondContact O-N 3.27Å; R253-L256 WeakPolarHBondContact O-CB 3.28Å; R253-L256 PolarHBondContact O-N 2.83Å; R253-D257 IonicContact CZ-OD1 3.68Å; R253-D257 IonicContact CZ-OD2 3.63Å; R253-D257 IonicContact NE-OD1 2.57Å; R253-D257 PolarHBondContact NE-OD1 3.13Å; R253-D257 VanDerWaalsContact NE-OD1 3.08Å; R253-D257 IonicContact NE-OD2 2.76Å; R253-D257 PolarHBondContact NE-OD2 2.84Å; R253-D257 IonicContact NH2-OD1 3.18Å; R253-D257 PolarHBondContact NH2-OD1 3.03Å; R253-D257 IonicContact NH2-OD2 3.04Å; R253-D257 VanDerWaalsContact O-CG 3.26Å; R253-D257 PolarHBondContact O-N 3.27Å
254C98.4Very high96.4Very high68 Ų6898.3 Ų98.346%0.45948%0.483SS..Hα-helixtrans-60.2-44.9178.5-175.30000111.4L250 I251 L256 D257 I258L250-C254 WeakPolarHBondContact O-CB 3.14Å; L250-C254 PolarHBondContact O-N 3.35Å; I251-C254 PolarHBondContact O-N 3.45Å; C254-L256 VanDerWaalsContact C-N 3.3Å; C254-L256 PolarHBondContact O-N 2.82Å; C254-D257 PolarHBondContact O-N 3.11Å; C254-I258 WeakPolarHBondContact O-CG1 3.43Å; C254-I258 PolarHBondContact O-N 3.45Å
255S97.9Very high95.8Very high67 Ų6796.9 Ų96.947%0.46949%0.486SS..Hα-helixtrans-61.1-40.5177-59.10000111.8I251 Q252 R253 K259I251-S255 VanDerWaalsContact O-CB 3.29Å; I251-S255 WeakPolarHBondContact O-CB 3.41Å; I251-S255 PolarHBondContact O-N 3Å; I251-S255 PolarHBondContact O-OG 2.98Å; Q252-S255 PolarHBondContact O-N 3.45Å; R253-S255 VanDerWaalsContact C-N 3.34Å; R253-S255 PolarHBondContact O-N 3.27Å; S255-K259 VanDerWaalsContact O-CB 3.26Å; S255-K259 WeakPolarHBondContact O-CB 3.49Å; S255-K259 PolarHBondContact O-N 2.92Å
256L96.9Very high95.5Very high77 Ų7793.4 Ų93.440%0.40348%0.481SS..Hα-helixtrans-66-43.6175.8-177.664.4000111.5Q252 R253 C254 K259 Q260Q252-L256 WeakPolarHBondContact O-CB 3.47Å; Q252-L256 PolarHBondContact O-N 2.97Å; R253-L256 WeakPolarHBondContact O-CB 3.28Å; R253-L256 PolarHBondContact O-N 2.83Å; C254-L256 VanDerWaalsContact C-N 3.3Å; C254-L256 PolarHBondContact O-N 2.82Å; L256-K259 PolarHBondContact O-N 3.2Å; L256-Q260 HydrophobicContact CD1-CG 4.38Å; L256-Q260 HydrophobicContact CG-CG 4.49Å; L256-Q260 WeakPolarHBondContact O-CB 3.25Å; L256-Q260 VanDerWaalsContact O-CG 3.31Å; L256-Q260 WeakPolarHBondContact O-CG 3.5Å; L256-Q260 PolarHBondContact O-N 3.25Å
257D96.4Very high95.1Very high62 Ų6291 Ų9133%0.33248%0.476SS..Hα-helixtrans-64.1-43.7179.6-69.4-28.5000110.9R253 C254 Q260 M261R253-D257 IonicContact CZ-OD1 3.68Å; R253-D257 IonicContact CZ-OD2 3.63Å; R253-D257 IonicContact NE-OD1 2.57Å; R253-D257 PolarHBondContact NE-OD1 3.13Å; R253-D257 VanDerWaalsContact NE-OD1 3.08Å; R253-D257 IonicContact NE-OD2 2.76Å; R253-D257 PolarHBondContact NE-OD2 2.84Å; R253-D257 IonicContact NH2-OD1 3.18Å; R253-D257 PolarHBondContact NH2-OD1 3.03Å; R253-D257 IonicContact NH2-OD2 3.04Å; R253-D257 VanDerWaalsContact O-CG 3.26Å; R253-D257 PolarHBondContact O-N 3.27Å; C254-D257 PolarHBondContact O-N 3.11Å; D257-Q260 PolarHBondContact O-N 2.79Å; D257-M261 WeakPolarHBondContact O-CB 3.49Å; D257-M261 PolarHBondContact O-N 2.86Å
258I95.9Very high94.6Very high97 Ų9793.4 Ų93.450%0.49749%0.485SS..Hα-helixtrans-60.9-46.5173.4-67.6168.4000110.6C254 Q260 M261 S262C254-I258 WeakPolarHBondContact O-CG1 3.43Å; C254-I258 PolarHBondContact O-N 3.45Å; I258-Q260 PolarHBondContact O-N 3.48Å; I258-M261 PolarHBondContact O-N 3.37Å; I258-S262 WeakPolarHBondContact O-CB 3.42Å; I258-S262 PolarHBondContact O-N 3.1Å; I258-S262 PolarHBondContact O-OG 2.67Å
259K94Very high94.2Very high108 Ų10895.2 Ų95.247%0.4749%0.492SS..Hα-helixtrans-59-50.6179.2-174.6178.5-177.5-178.70111.1S255 L256 M261 S262 E263S255-K259 VanDerWaalsContact O-CB 3.26Å; S255-K259 WeakPolarHBondContact O-CB 3.49Å; S255-K259 PolarHBondContact O-N 2.92Å; L256-K259 PolarHBondContact O-N 3.2Å; K259-M261 VanDerWaalsContact C-N 3.34Å; K259-M261 PolarHBondContact O-N 2.77Å; K259-S262 PolarHBondContact O-N 2.88Å; K259-S262 PolarHBondContact O-OG 3.26Å; K259-E263 WeakPolarHBondContact CE-OE1 3.48Å; K259-E263 WeakPolarHBondContact CE-OE2 3.45Å; K259-E263 VanDerWaalsContact CG-CD 3.42Å; K259-E263 HydrophobicContact CG-CG 4.15Å; K259-E263 WeakPolarHBondContact CG-OE1 3.42Å; K259-E263 WeakPolarHBondContact CG-OE2 3.34Å; K259-E263 IonicContact NZ-OE1 3.08Å; K259-E263 WeakPolarHBondContact O-CB 3.2Å; K259-E263 WeakPolarHBondContact O-CG 3.39Å; K259-E263 PolarHBondContact O-N 3.28Å
260Q93.7Very high93.9Very high96 Ų9697 Ų9745%0.44950%0.496SS..Hα-helixtrans-58.3-46.2176.6-72.9178.5900111.4L256 D257 I258 S262 L264L256-Q260 HydrophobicContact CD1-CG 4.38Å; L256-Q260 HydrophobicContact CG-CG 4.49Å; L256-Q260 WeakPolarHBondContact O-CB 3.25Å; L256-Q260 VanDerWaalsContact O-CG 3.31Å; L256-Q260 WeakPolarHBondContact O-CG 3.5Å; L256-Q260 PolarHBondContact O-N 3.25Å; D257-Q260 PolarHBondContact O-N 2.79Å; I258-Q260 PolarHBondContact O-N 3.48Å; Q260-S262 VanDerWaalsContact C-N 3.29Å; Q260-S262 PolarHBondContact O-N 2.79Å; Q260-L264 WeakPolarHBondContact O-CB 3.48Å; Q260-L264 VanDerWaalsContact O-CD1 3.31Å; Q260-L264 WeakPolarHBondContact O-CD1 3.08Å; Q260-L264 WeakPolarHBondContact O-CG 3.19Å; Q260-L264 PolarHBondContact O-N 3.46Å
261M93.3Very high93.7Very high122 Ų12296.4 Ų96.460%0.60151%0.505SS*.Hα-helixtrans-62.8-36.7179-172.2168.861.900112.3D257 I258 K259 N267D257-M261 WeakPolarHBondContact O-CB 3.49Å; D257-M261 PolarHBondContact O-N 2.86Å; I258-M261 PolarHBondContact O-N 3.37Å; K259-M261 VanDerWaalsContact C-N 3.34Å; K259-M261 PolarHBondContact O-N 2.77Å; M261-N267 VanDerWaalsContact O-CB 3.23Å; M261-N267 WeakPolarHBondContact O-CB 3.26Å; M261-N267 PolarHBondContact O-ND2 2.82Å
262S91.4Very high93.4Very high64 Ų6499.3 Ų99.345%0.44851%0.511SS..Hα-helixtrans-79-37-179.6700000114.4I258 K259 Q260 Q268I258-S262 WeakPolarHBondContact O-CB 3.42Å; I258-S262 PolarHBondContact O-N 3.1Å; I258-S262 PolarHBondContact O-OG 2.67Å; K259-S262 PolarHBondContact O-N 2.88Å; K259-S262 PolarHBondContact O-OG 3.26Å; Q260-S262 VanDerWaalsContact C-N 3.29Å; Q260-S262 PolarHBondContact O-N 2.79Å; S262-Q268 PolarHBondContact O-OE1 3.31Å
263E90.1Very high93.1Very high123 Ų123100.3 Ų100.358%0.57552%0.518SS*.Hα-helixtrans-88-13.9-174.3-68.1179.6170.700113.3K259 P265K259-E263 WeakPolarHBondContact CE-OE1 3.48Å; K259-E263 WeakPolarHBondContact CE-OE2 3.45Å; K259-E263 VanDerWaalsContact CG-CD 3.42Å; K259-E263 HydrophobicContact CG-CG 4.15Å; K259-E263 WeakPolarHBondContact CG-OE1 3.42Å; K259-E263 WeakPolarHBondContact CG-OE2 3.34Å; K259-E263 IonicContact NZ-OE1 3.08Å; K259-E263 WeakPolarHBondContact O-CB 3.2Å; K259-E263 WeakPolarHBondContact O-CG 3.39Å; K259-E263 PolarHBondContact O-N 3.28Å; E263-P265 VanDerWaalsContact O-CD 3.29Å; E263-P265 WeakPolarHBondContact O-CD 3.41Å
264L91.1Very high92.9Very high92 Ų9296.3 Ų96.348%0.48251%0.509SS..  trans-63.7119.3175.7-82.7168.1000110.2Q260 G266 N267 Q268Q260-L264 WeakPolarHBondContact O-CB 3.48Å; Q260-L264 VanDerWaalsContact O-CD1 3.31Å; Q260-L264 WeakPolarHBondContact O-CD1 3.08Å; Q260-L264 WeakPolarHBondContact O-CG 3.19Å; Q260-L264 PolarHBondContact O-N 3.46Å; L264-G266 PolarHBondContact O-N 3.49Å; L264-N267 HydrophobicContact CB-CB 4.36Å; L264-N267 PolarHBondContact O-N 3.11Å; L264-Q268 PolarHBondContact O-N 3.36Å
265P87Confident92.3Very high111 Ų11196.5 Ų96.572%0.72150%0.501SS*.Hα-helixtrans-58.6-28.1-176.4-25.433.7000113.7E263 N267E263-P265 VanDerWaalsContact O-CD 3.29Å; E263-P265 WeakPolarHBondContact O-CD 3.41Å; P265-N267 VanDerWaalsContact C-N 3.29Å; P265-N267 PolarHBondContact O-N 3.16Å
266G90.5Very high91.9Very high40 Ų4098.5 Ų98.541%0.41250%0.503SS..Hα-helixtrans-67.9-26.5176.300000114L264 K269 Y270L264-G266 PolarHBondContact O-N 3.49Å; G266-K269 WeakPolarHBondContact O-CE 3.39Å; G266-K269 WeakPolarHBondContact O-CG 3.42Å; G266-Y270 VanDerWaalsContact O-CD2 3.29Å; G266-Y270 WeakPolarHBondContact O-CD2 3.5Å
267N90.8Very high91.6Very high63 Ų6398.2 Ų98.234%0.33750%0.502SS..Hα-helixtrans-91-31-178.4-66.4-6.7000111.8M261 L264 P265 K269 Y270 A271M261-N267 VanDerWaalsContact O-CB 3.23Å; M261-N267 WeakPolarHBondContact O-CB 3.26Å; M261-N267 PolarHBondContact O-ND2 2.82Å; L264-N267 HydrophobicContact CB-CB 4.36Å; L264-N267 PolarHBondContact O-N 3.11Å; P265-N267 VanDerWaalsContact C-N 3.29Å; P265-N267 PolarHBondContact O-N 3.16Å; N267-K269 PolarHBondContact O-N 2.66Å; N267-K269 VanDerWaalsContact O-N 3.1Å; N267-Y270 PolarHBondContact O-N 2.75Å; N267-A271 PolarHBondContact O-N 3.22Å; N267-A271 VanDerWaalsContact O-N 3.13Å
268Q88.5Confident91.3Very high127 Ų12796.9 Ų96.959%0.59349%0.494SS*.Hα-helixtrans-53-36.5-179.9-16283.547.500112.6S262 L264 Y270 A271S262-Q268 PolarHBondContact O-OE1 3.31Å; L264-Q268 PolarHBondContact O-N 3.36Å; Q268-Y270 VanDerWaalsContact C-N 3.27Å; Q268-Y270 PolarHBondContact O-N 2.93Å; Q268-A271 PolarHBondContact O-N 2.89Å
269K90.7Very high90.8Very high131 Ų13196.8 Ų96.857%0.5749%0.49SS*.THydrogen-bonded Turntrans-72-16.817973.4-174.5-174.5168.90114.4G266 N267 Y272G266-K269 WeakPolarHBondContact O-CE 3.39Å; G266-K269 WeakPolarHBondContact O-CG 3.42Å; N267-K269 PolarHBondContact O-N 2.66Å; N267-K269 VanDerWaalsContact O-N 3.1Å; K269-Y272 WeakPolarHBondContact O-CD1 3.25Å; K269-Y272 WeakPolarHBondContact O-CE1 3.41Å
270Y91.9Very high90.6Very high155 Ų15597.6 Ų97.661%0.60850%0.495SS*.THydrogen-bonded Turntrans-106.6-4.6178.7-58.7-60.5000112.6G266 N267 Q268 Y272G266-Y270 VanDerWaalsContact O-CD2 3.29Å; G266-Y270 WeakPolarHBondContact O-CD2 3.5Å; N267-Y270 PolarHBondContact O-N 2.75Å; Q268-Y270 VanDerWaalsContact C-N 3.27Å; Q268-Y270 PolarHBondContact O-N 2.93Å; Y270-Y272 PolarHBondContact O-N 3.27Å
271A92.8Very high90.4Very high80 Ų8097.3 Ų97.366%0.66150%0.497SS*.  trans-81.463.4176.600000111N267 Q268N267-A271 PolarHBondContact O-N 3.22Å; N267-A271 VanDerWaalsContact O-N 3.13Å; Q268-A271 PolarHBondContact O-N 2.89Å
272Y92.5Very high90.1Very high157 Ų15793.5 Ų93.562%0.61649%0.489SS*.  trans-134.6161.7174.466.7-94.1000110.5K269 Y270 T274K269-Y272 WeakPolarHBondContact O-CD1 3.25Å; K269-Y272 WeakPolarHBondContact O-CE1 3.41Å; Y270-Y272 PolarHBondContact O-N 3.27Å; Y272-T274 HydrophobicContact CD2-CG2 4.23Å; Y272-T274 HydrophobicContact CE2-CG2 3.88Å
273I93.8Very high90Very high129 Ų12994.6 Ų94.666%0.66250%0.496SS*.  trans-123.3138.7174.8-57.8174.5000106.7D277 I278I273-D277 HydrophobicContact CG2-CB 3.7Å; I273-I278 HydrophobicContact CG2-CD1 4.47Å; I273-I278 HydrophobicContact CG2-CG1 3.93Å
274T92.4Very high89.9Confident53 Ų5390.9 Ų90.933%0.32548%0.48SS..  trans-88.4159.4177.9740000111.1Y272 Q276 D277 I278Y272-T274 HydrophobicContact CD2-CG2 4.23Å; Y272-T274 HydrophobicContact CE2-CG2 3.88Å; T274-Q276 PolarHBondContact O-N 2.8Å; T274-Q276 PolarHBondContact OG1-N 2.83Å; T274-D277 WeakPolarHBondContact CB-OD2 3.27Å; T274-D277 PolarHBondContact N-OD2 3.14Å; T274-D277 WeakPolarHBondContact O-CB 3.37Å; T274-D277 PolarHBondContact O-N 2.95Å; T274-D277 VanDerWaalsContact O-N 3.13Å; T274-D277 PolarHBondContact OG1-N 3.44Å; T274-D277 PolarHBondContact OG1-OD1 3.28Å; T274-D277 PolarHBondContact OG1-OD2 3.09Å; T274-I278 PolarHBondContact O-N 3.02Å
275Y86.7Confident89.4Confident73 Ų7394.6 Ų94.629%0.28649%0.487SS..Hα-helixtrans-57.6-37.2172.8170.9-92.8000111.9D277 I278 K279 C325 P326Y275-D277 VanDerWaalsContact C-N 3.28Å; Y275-D277 PolarHBondContact O-N 3.26Å; Y275-I278 PolarHBondContact O-N 3.37Å; Y275-K279 HydrophobicContact CE1-CB 4.47Å; Y275-K279 HydrophobicContact CE1-CD 3.93Å; Y275-K279 PolarHBondContact O-N 3.17Å; Y275-C325 HydrophobicContact CD2-CB 4.04Å; Y275-C325 HydrophobicContact CE2-CB 3.74Å; Y275-P326 HydrophobicContact CE2-CG 4.14Å; Y275-P326 WeakPolarHBondContact CE2-O 3.49Å; Y275-P326 VanDerWaalsContact CZ-O 3.29Å; Y275-P326 PolarHBondContact OH-O 2.91Å
276Q88.6Confident89.3Confident109 Ų10997 Ų9751%0.50949%0.494SS..Hα-helixtrans-65.1-31.7178.7-174.357.131.500112.3T274 Q280T274-Q276 PolarHBondContact O-N 2.8Å; T274-Q276 PolarHBondContact OG1-N 2.83Å; Q276-Q280 VanDerWaalsContact O-CG 3.25Å; Q276-Q280 WeakPolarHBondContact O-CG 3.21Å; Q276-Q280 PolarHBondContact O-N 3.04Å; Q276-Q280 VanDerWaalsContact O-N 3.17Å; Q276-Q280 PolarHBondContact O-NE2 3.32Å
277D91.7Very high89.2Confident71 Ų71100.4 Ų100.438%0.3850%0.5SS..Hα-helixtrans-70.2-39.6176.2-55.7-40.4000111.3I273 T274 Y275 Q280I273-D277 HydrophobicContact CG2-CB 3.7Å; T274-D277 WeakPolarHBondContact CB-OD2 3.27Å; T274-D277 PolarHBondContact N-OD2 3.14Å; T274-D277 WeakPolarHBondContact O-CB 3.37Å; T274-D277 PolarHBondContact O-N 2.95Å; T274-D277 VanDerWaalsContact O-N 3.13Å; T274-D277 PolarHBondContact OG1-N 3.44Å; T274-D277 PolarHBondContact OG1-OD1 3.28Å; T274-D277 PolarHBondContact OG1-OD2 3.09Å; Y275-D277 VanDerWaalsContact C-N 3.28Å; Y275-D277 PolarHBondContact O-N 3.26Å; D277-Q280 PolarHBondContact O-N 3.42Å
278I90.6Very high89.2Confident34 Ų34102.2 Ų102.217%0.17451%0.513CS..Hα-helixtrans-66.4-42.2177-60.4172.1000110.3I273 T274 Y275 Q280 L281 L284 V289 V291I273-I278 HydrophobicContact CG2-CD1 4.47Å; I273-I278 HydrophobicContact CG2-CG1 3.93Å; T274-I278 PolarHBondContact O-N 3.02Å; Y275-I278 PolarHBondContact O-N 3.37Å; I278-Q280 VanDerWaalsContact C-N 3.31Å; I278-Q280 PolarHBondContact O-N 3.42Å; I278-L281 VanDerWaalsContact O-CB 3.26Å; I278-L281 WeakPolarHBondContact O-CB 3.37Å; I278-L281 WeakPolarHBondContact O-CG 3.47Å; I278-L281 PolarHBondContact O-N 3.08Å; I278-L281 VanDerWaalsContact O-N 3.15Å; I278-L284 HydrophobicContact CG2-CD1 3.99Å; I278-V289 HydrophobicContact CG2-CG1 4.09Å; I278-V291 HydrophobicContact CD1-CG2 4.1Å
279K84.8Confident89.3Confident94 Ų9497.5 Ų97.541%0.40949%0.493SS..Hα-helixtrans-68.3-28179.9-171171.9-175.7169.30113.7Y275 L281Y275-K279 HydrophobicContact CE1-CB 4.47Å; Y275-K279 HydrophobicContact CE1-CD 3.93Å; Y275-K279 PolarHBondContact O-N 3.17Å; K279-L281 PolarHBondContact O-N 3.14Å
280Q88.9Confident89.4Confident125 Ų12595.5 Ų95.558%0.58449%0.487SS*.THydrogen-bonded Turntrans-67.7-16.6174.2-79.3170.666.400112.8Q276 D277 I278 G282Q276-Q280 VanDerWaalsContact O-CG 3.25Å; Q276-Q280 WeakPolarHBondContact O-CG 3.21Å; Q276-Q280 PolarHBondContact O-N 3.04Å; Q276-Q280 VanDerWaalsContact O-N 3.17Å; Q276-Q280 PolarHBondContact O-NE2 3.32Å; D277-Q280 PolarHBondContact O-N 3.42Å; I278-Q280 VanDerWaalsContact C-N 3.31Å; I278-Q280 PolarHBondContact O-N 3.42Å; Q280-G282 PolarHBondContact O-N 3.45Å
281L89.8Confident89.5Confident91 Ų9190.5 Ų90.548%0.47647%0.473SS..  trans-69108175.1-61.8172.4000109.3I278 K279 S283 L284I278-L281 VanDerWaalsContact O-CB 3.26Å; I278-L281 WeakPolarHBondContact O-CB 3.37Å; I278-L281 WeakPolarHBondContact O-CG 3.47Å; I278-L281 PolarHBondContact O-N 3.08Å; I278-L281 VanDerWaalsContact O-N 3.15Å; K279-L281 PolarHBondContact O-N 3.14Å; L281-S283 PolarHBondContact O-N 2.83Å; L281-L284 HydrophobicContact CB-CB 4.45Å; L281-L284 HydrophobicContact CB-CD1 4.11Å; L281-L284 HydrophobicContact CB-CG 4.19Å; L281-L284 HydrophobicContact CD1-CD1 3.74Å; L281-L284 PolarHBondContact O-N 3.3Å
282G87Confident89.6Confident42 Ų4290 Ų9043%0.43346%0.461SS..G310 helixtrans-56.6-25.4-175.800000114.3Q280 L284 R285Q280-G282 PolarHBondContact O-N 3.45Å; G282-L284 VanDerWaalsContact C-N 3.35Å; G282-R285 PolarHBondContact O-NE 3.13Å
283S89.9Confident89.7Confident86 Ų8688.5 Ų88.560%0.60146%0.458SS*.G310 helixtrans-74.8-16.4177.653.80000114.7L281 Q287L281-S283 PolarHBondContact O-N 2.83Å; S283-Q287 PolarHBondContact O-NE2 3.16Å
284L87.6Confident89.9Confident46 Ų4684.5 Ų84.524%0.24144%0.444CS..G310 helixtrans-110.71.4-173.5-59.1-178.9000113.9I278 L281 G282 D286 Q287 V289I278-L284 HydrophobicContact CG2-CD1 3.99Å; L281-L284 HydrophobicContact CB-CB 4.45Å; L281-L284 HydrophobicContact CB-CD1 4.11Å; L281-L284 HydrophobicContact CB-CG 4.19Å; L281-L284 HydrophobicContact CD1-CD1 3.74Å; L281-L284 PolarHBondContact O-N 3.3Å; G282-L284 VanDerWaalsContact C-N 3.35Å; L284-D286 VanDerWaalsContact C-N 3.32Å; L284-D286 PolarHBondContact O-N 3.43Å; L284-Q287 PolarHBondContact O-N 3.48Å; L284-V289 HydrophobicContact CB-CG2 4Å; L284-V289 HydrophobicContact CD1-CG2 4.13Å; L284-V289 HydrophobicContact CD2-CG2 4.41Å; L284-V289 HydrophobicContact CG-CG2 4.41Å
285R81.5Confident90Very high169 Ų16983.8 Ų83.864%0.63844%0.44SS*.THydrogen-bonded Turntrans-61-33.8-169.7-74.4-175.9-76.9-172.3-6.1115G282G282-R285 PolarHBondContact O-NE 3.13Å
286D84.9Confident90.4Very high161 Ų16185.2 Ų85.286%0.86146%0.457SS*.THydrogen-bonded Turntrans-114.624.5-177.9-51.2-45.9000111.8L284L284-D286 VanDerWaalsContact C-N 3.32Å; L284-D286 PolarHBondContact O-N 3.43Å
287Q88.4Confident90.7Very high113 Ų11386 Ų8653%0.52847%0.465SS..SBendtrans-121.9139.5-176.8-61-173.720.800111S283 L284 V289S283-Q287 PolarHBondContact O-NE2 3.16Å; L284-Q287 PolarHBondContact O-N 3.48Å; Q287-V289 PolarHBondContact O-N 3.3Å
288T89.3Confident90.9Very high101 Ų10184.2 Ų84.262%0.6246%0.456SS*.  trans-69.1112.2170.5-55.60000109.9L324T288-L324 HydrophobicContact CG2-CD1 3.58Å
289V92.3Very high91.2Very high28 Ų2888.2 Ų88.217%0.1747%0.473CS..  trans-95.7122.9-178.5-177.60000111.2I278 L284 Q287 V291 C325I278-V289 HydrophobicContact CG2-CG1 4.09Å; L284-V289 HydrophobicContact CB-CG2 4Å; L284-V289 HydrophobicContact CD1-CG2 4.13Å; L284-V289 HydrophobicContact CD2-CG2 4.41Å; L284-V289 HydrophobicContact CG-CG2 4.41Å; Q287-V289 PolarHBondContact O-N 3.3Å; V289-V291 HydrophobicContact CG1-CG2 4.32Å; V289-C325 HydrophobicContact CB-CB 3.9Å; V289-C325 HydrophobicContact CG1-CB 4.46Å; V289-C325 WeakPolarHBondContact O-CB 3.39Å; V289-C325 PolarHBondContact O-N 3.21Å
290I92.5Very high91.7Very high88 Ų8889.1 Ų89.145%0.45148%0.481SS..EExtended strand (participates in β ladder)trans-111.1116.7174.6-56.6174.1000108.4V292 V322 L324I290-V292 HydrophobicContact CG2-CG2 4.24Å; I290-V322 HydrophobicContact CG2-CG1 3.41Å; I290-V322 VanDerWaalsContact CG2-CG1 3.41Å; I290-L324 HydrophobicContact CG1-CD1 4.08Å
291V93.8Very high91.9Very high51 Ų5187.1 Ų87.131%0.30947%0.472SS..EExtended strand (participates in β ladder)trans-94121.1176.8-179.50000109.1I278 V289 V322 L323I278-V291 HydrophobicContact CD1-CG2 4.1Å; V289-V291 HydrophobicContact CG1-CG2 4.32Å; V291-V322 WeakPolarHBondContact O-CA 3.4Å; V291-L323 HydrophobicContact CB-CB 4.27Å; V291-L323 PolarHBondContact N-O 3.42Å; V291-L323 PolarHBondContact O-N 3.24Å
292V95.3Very high92.2Very high68 Ų6887.4 Ų87.441%0.41248%0.477SS..EExtended strand (participates in β ladder)trans-110.1121.9179.5-179.30000109.4I290 A294 L313 I320 V322I290-V292 HydrophobicContact CG2-CG2 4.24Å; V292-A294 HydrophobicContact CG1-CB 4.42Å; V292-L313 HydrophobicContact CG1-CD1 3.71Å; V292-L313 HydrophobicContact CG2-CD1 4.26Å; V292-I320 HydrophobicContact CG1-CG2 3.79Å; V292-V322 HydrophobicContact CG2-CG1 4.46Å; V292-V322 HydrophobicContact CG2-CG2 4.45Å
293K94.9Very high92.4Very high127 Ų12787 Ų8755%0.55247%0.467SS*.EExtended strand (participates in β ladder)trans-113109.3171.2173.6176.8161.4-141.80108.7E321K293-E321 HydrophobicContact CB-CB 4.17Å; K293-E321 WeakPolarHBondContact CD-OE2 3.48Å; K293-E321 WeakPolarHBondContact CE-OE2 3.42Å; K293-E321 PolarHBondContact N-O 3.29Å; K293-E321 IonicContact NZ-OE1 2.99Å; K293-E321 IonicContact NZ-OE2 3.32Å; K293-E321 PolarHBondContact NZ-OE2 2.89Å; K293-E321 PolarHBondContact O-N 3.35Å
294A96.1Very high92.5Very high44 Ų4487 Ų8736%0.36446%0.46SS..  trans-122.5151.2-176.100000111.5V292 T298 I320V292-A294 HydrophobicContact CG1-CB 4.42Å; A294-T298 HydrophobicContact CB-CG2 3.8Å; A294-T298 WeakPolarHBondContact CB-OG1 3.28Å; A294-I320 HydrophobicContact CB-CG1 4.18Å; A294-I320 HydrophobicContact CB-CG2 3.99Å
295P96.3Very high92.6Very high38 Ų3889 Ų8925%0.24748%0.476CS..  trans-59.8162.6170.9-22.934.5000112.6T298 K317 P319P295-T298 WeakPolarHBondContact O-CB 3.42Å; P295-T298 PolarHBondContact O-N 3.45Å; P295-T298 PolarHBondContact O-OG1 3.29Å; P295-K317 HydrophobicContact CB-CB 4.08Å; P295-P319 WeakPolarHBondContact CD-O 3.49Å
296T93.9Very high92.9Very high104 Ų10488.2 Ų88.264%0.63848%0.484SS*.THydrogen-bonded Turntrans-59.3147.5173.454.10000111.1T298 K317T296-T298 PolarHBondContact O-N 3.39Å; T296-K317 WeakPolarHBondContact O-CD 3.19Å
297D94.6Very high93Very high125 Ų12588.3 Ų88.367%0.66848%0.479SS*.THydrogen-bonded Turntrans6324.6-175.7-49.9-24.9000114.6K299 K317D297-K299 PolarHBondContact O-N 3.43Å; D297-K317 VanDerWaalsContact OD2-CE 3.24Å; D297-K317 WeakPolarHBondContact OD2-CE 3.34Å; D297-K317 IonicContact OD2-NZ 3.73Å; D297-K317 PolarHBondContact OD2-NZ 2.93Å
298T96.6Very high92.6Very high34 Ų3485.2 Ų85.221%0.20947%0.47CS..  trans-68.3127.8166.3-61.90000109.6A294 P295 T296 I320A294-T298 HydrophobicContact CB-CG2 3.8Å; A294-T298 WeakPolarHBondContact CB-OG1 3.28Å; P295-T298 WeakPolarHBondContact O-CB 3.42Å; P295-T298 PolarHBondContact O-N 3.45Å; P295-T298 PolarHBondContact O-OG1 3.29Å; T296-T298 PolarHBondContact O-N 3.39Å; T298-I320 HydrophobicContact CG2-CD1 3.74Å; T298-I320 HydrophobicContact CG2-CG1 4.48Å
299K96.2Very high92.6Very high118 Ų11888.6 Ų88.651%0.51348%0.484SS..EExtended strand (participates in β ladder)trans-84.1130.8175.6-163.6-174.5-169.3-173.40109.7D297 E301 L313 S314D297-K299 PolarHBondContact O-N 3.43Å; K299-E301 HydrophobicContact CD-CG 4.1Å; K299-E301 WeakPolarHBondContact CD-OE1 3.25Å; K299-E301 WeakPolarHBondContact CE-OE1 3.32Å; K299-E301 HydrophobicContact CG-CG 4.19Å; K299-E301 IonicContact NZ-OE1 3.8Å; K299-E301 PolarHBondContact NZ-OE1 3.11Å; K299-L313 WeakPolarHBondContact O-CA 3.36Å; K299-S314 WeakPolarHBondContact CB-OG 3.48Å; K299-S314 PolarHBondContact N-O 3.41Å; K299-S314 PolarHBondContact O-N 2.92Å
300L95.5Very high92.5Very high113 Ų11388.7 Ų88.759%0.59249%0.486SS*.EExtended strand (participates in β ladder)trans-114120172.2-178.2154.9000108V302 I311 H312 L313L300-V302 HydrophobicContact CD2-CG2 3.67Å; L300-I311 HydrophobicContact CG-CG2 4.36Å; L300-H312 WeakPolarHBondContact CA-O 3.49Å; L300-L313 HydrophobicContact CB-CD2 3.83Å; L300-L313 HydrophobicContact CD1-CD2 3.81Å; L300-L313 HydrophobicContact CG-CD2 3.77Å
301E94.8Very high92.6Very high83 Ų8390.1 Ų90.139%0.38849%0.493SS..EExtended strand (participates in β ladder)trans-118.6133.3175.5-61.6179.616400109.5K299 H312K299-E301 HydrophobicContact CD-CG 4.1Å; K299-E301 WeakPolarHBondContact CD-OE1 3.25Å; K299-E301 WeakPolarHBondContact CE-OE1 3.32Å; K299-E301 HydrophobicContact CG-CG 4.19Å; K299-E301 IonicContact NZ-OE1 3.8Å; K299-E301 PolarHBondContact NZ-OE1 3.11Å; E301-H312 HydrophobicContact CB-CB 4.24Å; E301-H312 PolarHBondContact N-O 3.48Å; E301-H312 PolarHBondContact O-N 3.31Å
302V94.8Very high92.6Very high97 Ų9791.8 Ų91.859%0.58850%0.497SS*.  trans-123.1106.7173.9-175.70000106.3L300 I311L300-V302 HydrophobicContact CD2-CG2 3.67Å; V302-I311 HydrophobicContact CG2-CG1 4.47Å
303P92.2Very high92.6Very high32 Ų3291.2 Ų91.221%0.20849%0.492CS..  trans-61163.2173.2-22.235.1000111.7S310P303-S310 VanDerWaalsContact CD-O 3.26Å; P303-S310 WeakPolarHBondContact CD-O 3.28Å
304D90.6Very high92.6Very high86 Ų8688.3 Ų88.346%0.4649%0.488SS..  trans-59.3136.8173.8-166.4-62.8000109.7D306 E307 S308D304-D306 PolarHBondContact O-N 3.16Å; D304-D306 VanDerWaalsContact O-N 3.1Å; D304-D306 WeakPolarHBondContact OD1-CB 3.12Å; D304-D306 PolarHBondContact OD1-N 3.42Å; D304-E307 HydrophobicContact CB-CG 4.32Å; D304-E307 PolarHBondContact O-N 3.09Å; D304-S308 PolarHBondContact O-N 3.49Å; D304-S308 VanDerWaalsContact O-N 3.11Å
305P89.6Confident92.6Very high88 Ų8887.9 Ų87.957%0.57148%0.482SS*.THydrogen-bonded Turntrans-55.2-26.1178.522.9-36.3000114E307 L309P305-E307 VanDerWaalsContact C-N 3.3Å; P305-L309 HydrophobicContact CB-CD2 4.44Å
306D89Confident92.5Very high154 Ų15492.3 Ų92.382%0.82451%0.508SS*.THydrogen-bonded Turntrans-72.3-24.2176.2-70.3-19.2000112.6D304D304-D306 PolarHBondContact O-N 3.16Å; D304-D306 VanDerWaalsContact O-N 3.1Å; D304-D306 WeakPolarHBondContact OD1-CB 3.12Å; D304-D306 PolarHBondContact OD1-N 3.42Å
307E85.8Confident92.5Very high162 Ų16292.9 Ų92.976%0.75750%0.502SS*.THydrogen-bonded Turntrans-88.6-53.2177.7-64.8-174.4171.900111.6D304 P305D304-E307 HydrophobicContact CB-CG 4.32Å; D304-E307 PolarHBondContact O-N 3.09Å; P305-E307 VanDerWaalsContact C-N 3.3Å
308S81.9Confident92.5Very high48 Ų4888.3 Ų88.334%0.33648%0.484SS..  trans-168.1133.9176.959.90000112.3D304 S310D304-S308 PolarHBondContact O-N 3.49Å; D304-S308 VanDerWaalsContact O-N 3.11Å; S308-S310 PolarHBondContact O-N 3.12Å; S308-S310 PolarHBondContact OG-OG 2.82Å
309L89Confident92.4Very high172 Ų17292 Ų9290%0.90151%0.509SS*.  trans-77.972.4167.7-73.6151.8000110.3P305P305-L309 HydrophobicContact CB-CD2 4.44Å
310S90.4Very high92.5Very high31 Ų3188.8 Ų88.822%0.21750%0.497CS..  trans-130.4155.5176.368.80000111.8P303 S308 H312P303-S310 VanDerWaalsContact CD-O 3.26Å; P303-S310 WeakPolarHBondContact CD-O 3.28Å; S308-S310 PolarHBondContact O-N 3.12Å; S308-S310 PolarHBondContact OG-OG 2.82Å; S310-H312 PolarHBondContact OG-CD2 3.04Å; S310-H312 PolarHBondContact OG-NE2 3.25Å
311I93.4Very high92.5Very high118 Ų11887.9 Ų87.961%0.60549%0.49SS*.  trans-120.8119.7172.4-58.8173.8000106.6L300 V302 L313L300-I311 HydrophobicContact CG-CG2 4.36Å; V302-I311 HydrophobicContact CG2-CG1 4.47Å; I311-L313 HydrophobicContact CG2-CD2 4.43Å; I311-L313 HydrophobicContact CG2-CG 4.4Å
312H93.4Very high92.5Very high85 Ų8587 Ų8739%0.39449%0.489SS..EExtended strand (participates in β ladder)trans-104.5122.7-178.8-66.7-174.1000109.6L300 E301 S310L300-H312 WeakPolarHBondContact CA-O 3.49Å; E301-H312 HydrophobicContact CB-CB 4.24Å; E301-H312 PolarHBondContact N-O 3.48Å; E301-H312 PolarHBondContact O-N 3.31Å; S310-H312 PolarHBondContact OG-CD2 3.04Å; S310-H312 PolarHBondContact OG-NE2 3.25Å
313L95.9Very high92.4Very high56 Ų5685.2 Ų85.229%0.29348%0.476SS..EExtended strand (participates in β ladder)trans-116.4123.1178.4-62.5173.1000109.7V292 K299 L300 I311 I320V292-L313 HydrophobicContact CG1-CD1 3.71Å; V292-L313 HydrophobicContact CG2-CD1 4.26Å; K299-L313 WeakPolarHBondContact O-CA 3.36Å; L300-L313 HydrophobicContact CB-CD2 3.83Å; L300-L313 HydrophobicContact CD1-CD2 3.81Å; L300-L313 HydrophobicContact CG-CD2 3.77Å; I311-L313 HydrophobicContact CG2-CD2 4.43Å; I311-L313 HydrophobicContact CG2-CG 4.4Å; L313-I320 HydrophobicContact CB-CD1 3.73Å; L313-I320 HydrophobicContact CD1-CG2 4.36Å
314S94.4Very high92.4Very high67 Ų6788.5 Ų88.547%0.46949%0.492SS..EExtended strand (participates in β ladder)trans-128.3123.5177.272.20000111.4K299K299-S314 WeakPolarHBondContact CB-OG 3.48Å; K299-S314 PolarHBondContact N-O 3.41Å; K299-S314 PolarHBondContact O-N 2.92Å
315S96.3Very high92.2Very high34 Ų3485 Ų8524%0.23847%0.474CS..  trans-121.5137178.4167.80000110.4K317 G318S315-K317 PolarHBondContact OG-N 2.74Å; S315-G318 WeakPolarHBondContact CB-O 3.45Å; S315-G318 PolarHBondContact OG-N 2.93Å; S315-G318 PolarHBondContact OG-O 2.79Å
316T94.6Very high91.7Very high132 Ų13283.4 Ų83.481%0.8146%0.464SS*.SBendtrans-102.6-12.7173.8560000112.8
317K93.4Very high91Very high115 Ų11579.6 Ų79.650%0.544%0.443SS..SBendtrans-104.1-0.8-171.9-60.9-166.5-170.3174.40114.5P295 T296 D297 S315P295-K317 HydrophobicContact CB-CB 4.08Å; T296-K317 WeakPolarHBondContact O-CD 3.19Å; D297-K317 VanDerWaalsContact OD2-CE 3.24Å; D297-K317 WeakPolarHBondContact OD2-CE 3.34Å; D297-K317 IonicContact OD2-NZ 3.73Å; D297-K317 PolarHBondContact OD2-NZ 2.93Å; S315-K317 PolarHBondContact OG-N 2.74Å
318G93.9Very high89.8Confident29 Ų2978 Ų7830%0.29944%0.436SS..SBendtrans157177178.400000113.9S315S315-G318 WeakPolarHBondContact CB-O 3.45Å; S315-G318 PolarHBondContact OG-N 2.93Å; S315-G318 PolarHBondContact OG-O 2.79Å
319P95.9Very high88.6Confident113 Ų11384.6 Ų84.673%0.73446%0.461SS*.PPolyproline II helixtrans-68.5152.6178.630.4-35.3000111.6P295P295-P319 WeakPolarHBondContact CD-O 3.49Å
320I96.8Very high86.7Confident49 Ų4982.8 Ų82.825%0.25145%0.453SS..PPolyproline II helixtrans-101.4128.1174.8-56.3176000107.8V292 A294 T298 L313 V322V292-I320 HydrophobicContact CG1-CG2 3.79Å; A294-I320 HydrophobicContact CB-CG1 4.18Å; A294-I320 HydrophobicContact CB-CG2 3.99Å; T298-I320 HydrophobicContact CG2-CD1 3.74Å; T298-I320 HydrophobicContact CG2-CG1 4.48Å; L313-I320 HydrophobicContact CB-CD1 3.73Å; L313-I320 HydrophobicContact CD1-CG2 4.36Å; I320-V322 HydrophobicContact CG2-CG2 4.16Å
321E95.8Very high84.8Confident95 Ų9586.8 Ų86.844%0.44447%0.472SS..EExtended strand (participates in β ladder)trans-95.4127175.1-69.3173.8-176.100108.9K293K293-E321 HydrophobicContact CB-CB 4.17Å; K293-E321 WeakPolarHBondContact CD-OE2 3.48Å; K293-E321 WeakPolarHBondContact CE-OE2 3.42Å; K293-E321 PolarHBondContact N-O 3.29Å; K293-E321 IonicContact NZ-OE1 2.99Å; K293-E321 IonicContact NZ-OE2 3.32Å; K293-E321 PolarHBondContact NZ-OE2 2.89Å; K293-E321 PolarHBondContact O-N 3.35Å
322V95.1Very high82.5Confident63 Ų6390.2 Ų90.238%0.38249%0.487SS..EExtended strand (participates in β ladder)trans-123.2127.3178-175.60000108.2I290 V291 V292 I320I290-V322 HydrophobicContact CG2-CG1 3.41Å; I290-V322 VanDerWaalsContact CG2-CG1 3.41Å; V291-V322 WeakPolarHBondContact O-CA 3.4Å; V292-V322 HydrophobicContact CG2-CG1 4.46Å; V292-V322 HydrophobicContact CG2-CG2 4.45Å; I320-V322 HydrophobicContact CG2-CG2 4.16Å
323L92.4Very high80.2Confident60 Ų6097.2 Ų97.231%0.31451%0.51SS..EExtended strand (participates in β ladder)trans-123.1132.4-177.3-56.5167.2000108.7V291 F349V291-L323 HydrophobicContact CB-CB 4.27Å; V291-L323 PolarHBondContact N-O 3.42Å; V291-L323 PolarHBondContact O-N 3.24Å; L323-F349 HydrophobicContact CB-CD1 4.2Å; L323-F349 HydrophobicContact CB-CE1 4.1Å; L323-F349 HydrophobicContact CD1-CE1 4.42Å; L323-F349 HydrophobicContact CD2-CB 4.43Å; L323-F349 HydrophobicContact CD2-CD1 3.65Å; L323-F349 HydrophobicContact CD2-CE1 4.07Å; L323-F349 HydrophobicContact CD2-CG 4.1Å; L323-F349 HydrophobicContact CG-CD1 4.41Å; L323-F349 HydrophobicContact CG-CE1 4.43Å
324L92.1Very high77.4Confident101 Ų10198.7 Ų98.753%0.52953%0.526SS..EExtended strand (participates in β ladder)trans-96.4126.9172.8-178.664.2000108.9T288 I290 P326T288-L324 HydrophobicContact CG2-CD1 3.58Å; I290-L324 HydrophobicContact CG1-CD1 4.08Å; L324-P326 WeakPolarHBondContact O-CD 3.48Å
325C87.8Confident75.1Confident12 Ų12101.6 Ų101.68%0.08154%0.543CS..PPolyproline II helixtrans-74.6118.3170.5-73.30000108.3Y275 V289Y275-C325 HydrophobicContact CD2-CB 4.04Å; Y275-C325 HydrophobicContact CE2-CB 3.74Å; V289-C325 HydrophobicContact CB-CB 3.9Å; V289-C325 HydrophobicContact CG1-CB 4.46Å; V289-C325 WeakPolarHBondContact O-CB 3.39Å; V289-C325 PolarHBondContact O-N 3.21Å
326P79.2Confident72.4Confident56 Ų56105.7 Ų105.736%0.36457%0.566SS.*PPolyproline II helixtrans-68.3145.7-179.627.5-33.8000110.7Y275 L324Y275-P326 HydrophobicContact CE2-CG 4.14Å; Y275-P326 WeakPolarHBondContact CE2-O 3.49Å; Y275-P326 VanDerWaalsContact CZ-O 3.29Å; Y275-P326 PolarHBondContact OH-O 2.91Å; L324-P326 WeakPolarHBondContact O-CD 3.48Å
327D72.6Confident69.7Low74 Ų74108.5 Ų108.540%0.39657%0.567SS.*  trans-96.9103.9169-66.8-32.5000108.1E329 N330D327-E329 PolarHBondContact O-N 2.91Å; D327-N330 PolarHBondContact O-N 2.98Å; D327-N330 VanDerWaalsContact O-N 3.13Å
328E61.3Low67.1Low128 Ų128111.5 Ų111.560%0.59859%0.588SS**THydrogen-bonded Turntrans-59.7-7.9-178.8-65.3-82.6119.900113.5
329E57.3Low64.3Low186 Ų186113 Ų11387%0.86960%0.604SS**THydrogen-bonded Turntrans-78.4-13.2175.2-84.4-164.6132.200114.4D327D327-E329 PolarHBondContact O-N 2.91Å
330N49.2Very low61.4Low135 Ų135114.6 Ų114.672%0.72261%0.606SS**SBendtrans-105.4-2.7-173.8-142.47.7000115.3D327 M332D327-N330 PolarHBondContact O-N 2.98Å; D327-N330 VanDerWaalsContact O-N 3.13Å; N330-M332 VanDerWaalsContact C-N 3.34Å; N330-M332 PolarHBondContact O-N 2.94Å
331D50.6Low58.5Low115 Ų115118.9 Ų118.962%0.61564%0.635SS**THydrogen-bonded Turntrans-89.418.1-175-80.7-43.6000115.4
332M44.8Very low55.6Low190 Ų190121.1 Ų121.194%0.93665%0.65SS**THydrogen-bonded Turntrans-88.43.1167.2-79.5-141.6-172.400114.6N330N330-M332 VanDerWaalsContact C-N 3.34Å; N330-M332 PolarHBondContact O-N 2.94Å
333R45.1Very low53.2Low231 Ų231126.5 Ų126.587%0.87268%0.675SS**SBendtrans-140.846.2-179-67.5-166.5-169.2-130.64.6116.2
334S37.7Very low50.6Low88 Ų88130.4 Ų130.462%0.61570%0.696SS**  trans-128.2102.7163.5-169.80000111.6V336S334-V336 VanDerWaalsContact C-N 3.32Å; S334-V336 PolarHBondContact O-N 3.31Å; S334-V336 VanDerWaalsContact O-N 3.15Å
335P46Very low48.1Very low127 Ų127129.5 Ų129.583%0.82571%0.711SS**  trans-89.668.8178.836-30.7000109.5
336V39.5Very low45.7Very low120 Ų120136.5 Ų136.573%0.72775%0.747SS**  trans-144.8119.3162.7-149.30000111.3S334S334-V336 VanDerWaalsContact C-N 3.32Å; S334-V336 PolarHBondContact O-N 3.31Å; S334-V336 VanDerWaalsContact O-N 3.15Å
337K37.7Very low44.3Very low191 Ų191138.5 Ų138.583%0.8376%0.763SS**  trans94.878.9152.5-144.1169-175.7-179.90116.7G339K337-G339 PolarHBondContact O-N 3.09Å
338N39.1Very low43Very low178 Ų178140.8 Ų140.895%0.95278%0.781SS**  trans-56.1122142-969.4000108.9
339G34.9Very low42Very low60 Ų60141.1 Ų141.162%0.61978%0.781SS**  trans-170.582.517400000110.9K337K337-G339 PolarHBondContact O-N 3.09Å
340N34.6Very low41.4Very low147 Ų147139.9 Ų139.979%0.78678%0.78SS**  trans67.197.6162.4-57.65.2000117.2D342N340-D342 PolarHBondContact O-N 2.74Å
341T35.4Very low40.9Very low140 Ų140142.4 Ų142.486%0.85978%0.784SS**  trans-69.3103.6158.2-150000108.6
342D34.3Very low40.5Very low141 Ų141143.6 Ų143.675%0.75480%0.796SS**  trans-76.9134162.3-64.7-30.3000108.1N340 N344N340-D342 PolarHBondContact O-N 2.74Å; D342-N344 PolarHBondContact O-N 2.83Å
343I45.6Very low40.2Very low176 Ų176140.2 Ų140.290%0.90379%0.785SS**SBendtrans-74.442.1-168.6-43.7172.9000111.8
344N38.3Very low39.4Very low143 Ų143135.7 Ų135.777%0.76577%0.774SS**SBendtrans-151.654.2-178-150.139.5000113.8D342 N346D342-N344 PolarHBondContact O-N 2.83Å; N344-N346 PolarHBondContact O-N 2.63Å
345G39.5Very low39.1Very low81 Ų81139.1 Ų139.184%0.83579%0.785SS**  trans56.26148.500000120.5
346N36.2Very low38.3Very low159 Ų159138.8 Ų138.885%0.8579%0.786SS**  trans-104.5104.7177.4-89-5.1000110N344N344-N346 PolarHBondContact O-N 2.63Å
347S50.6Low37.8Very low98 Ų98141.4 Ų141.469%0.68580%0.796SS**  trans-61.7152.6166.3-27.60000110.7F349S347-F349 PolarHBondContact O-N 3.41Å
348P45.2Very low37.1Very low122 Ų122137.6 Ų137.679%0.79279%0.792SS**  trans-82.9113-173.432.5-29.6000110.3L350P348-L350 PolarHBondContact O-N 3.25Å
349F40.8Very low36.5Very low136 Ų136135.6 Ų135.660%0.59679%0.787SS**  trans-64.3128.6162.4-77.6-84.1000109.5L323 S347 K351L323-F349 HydrophobicContact CB-CD1 4.2Å; L323-F349 HydrophobicContact CB-CE1 4.1Å; L323-F349 HydrophobicContact CD1-CE1 4.42Å; L323-F349 HydrophobicContact CD2-CB 4.43Å; L323-F349 HydrophobicContact CD2-CD1 3.65Å; L323-F349 HydrophobicContact CD2-CE1 4.07Å; L323-F349 HydrophobicContact CD2-CG 4.1Å; L323-F349 HydrophobicContact CG-CD1 4.41Å; L323-F349 HydrophobicContact CG-CE1 4.43Å; S347-F349 PolarHBondContact O-N 3.41Å; F349-K351 PolarHBondContact O-N 3.49Å; F349-K351 VanDerWaalsContact O-N 3.1Å
350L44.7Very low36Very low159 Ų159138 Ų13883%0.83279%0.789SS**  trans-72.9100.1170.8-70.5174.2000109.4P348 V352P348-L350 PolarHBondContact O-N 3.25Å; L350-V352 PolarHBondContact O-N 3.15Å
351K38.4Very low35.6Very low188 Ų188138 Ų13882%0.81780%0.795SS**  trans-73.2111.4164.7-97.9-172.9175.4176.70109F349 V353F349-K351 PolarHBondContact O-N 3.49Å; F349-K351 VanDerWaalsContact O-N 3.1Å; K351-V353 HydrophobicContact CB-CG2 4.5Å; K351-V353 PolarHBondContact O-N 3.38Å
352V42Very low35.3Very low141 Ų141136.8 Ų136.886%0.85579%0.792SS**  trans-75.9107.7167.8177.10000108.1L350L350-V352 PolarHBondContact O-N 3.15Å
353V37.5Very low35.5Very low118 Ų118135.7 Ų135.772%0.71579%0.792SS**  trans-109.8133.9172.5176.90000108.5K351K351-V353 HydrophobicContact CB-CG2 4.5Å; K351-V353 PolarHBondContact O-N 3.38Å
354Q30.1Very low34.7Very low137 Ų137132.2 Ų132.264%0.6478%0.784SS**  trans-75.9134.8-176-171.5174.810.700112.5
355D29.8Very low34.1Very low159 Ų159130.2 Ų130.285%0.8578%0.777SS**  trans-68.2141.1179.6-70.6-50.6000113.8
356S30Very low33.5Very low121 Ų121135 Ų13585%0.84678%0.775SS**  trans-107.7116.7173.6-640000110.6
357N28.7Very low33.1Very low175 Ų175135.1 Ų135.194%0.93678%0.775SS**  trans-97.9138.8171-96.80.7000112.2
358C24.1Very low32.2Very low110 Ų110135.7 Ų135.774%0.74378%0.779SS**  trans-87.4146-170.8-178.30000113.2
359T25.8Very low31.9Very low137 Ų137135.6 Ų135.684%0.8478%0.778SS**  trans-153.9113.5141.1-11.40000112.7
360T24.9Very low31.8Very low110 Ų110135.2 Ų135.268%0.67579%0.789SS**  trans-4.3129.515657.20000121
361T25.5Very low31Very low147 Ų147131.9 Ų131.990%0.90279%0.785SS**  -168.8128114.6290000110.2
362S29.3Very low30.7Very low114 Ų114128 Ų12880%0.79778%0.781SS**  trans-105.2171.5173.359.30000109.1
363P39Very low30Very low118 Ų118126.4 Ų126.477%0.76678%0.777SS**  cis-133170.242.533.6-10.2000113.5
364S28.4Very low29.6Very low103 Ų103126.7 Ų126.772%0.7278%0.784SS**  -178.5135.858.159.60000114.6
365T25.9Very low29.3Very low102 Ų102124.8 Ų124.863%0.62679%0.792SS**  trans83.6131.5137.2-3.30000125.7
366F27.1Very low29.4Very low180 Ų180123.4 Ų123.479%0.78979%0.789SS**  trans83.8125.4156.6-60.2-62.7000116.7
367L28.3Very low29.3Very low162 Ų162123.2 Ų123.285%0.84879%0.787SS**  cis-156.4157.615.5-87.4142.2000110.6
368S30.4Very low29.3Very low110 Ų110121.3 Ų121.377%0.76978%0.782SS**  trans-71.3-172-174.1-19.40000116.7
369P39.3Very low29.4Very low120 Ų120122.8 Ų122.878%0.77979%0.788SS**  cis-133.7-177.9-22.136.2-15.5000115.1
370P38.1Very low29.4Very low128 Ų128121.8 Ų121.883%0.83178%0.781SS**  trans-116.2175.3-169.641-29.2000116.3
371A28.7Very low29.5Very low90 Ų90123.8 Ų123.874%0.74479%0.787SS**  trans-141120.1163.400000113.9
372S31.3Very low29.5Very low105 Ų105121.5 Ų121.573%0.73478%0.777SS**  trans47.9108.8142.250.60000121.2
373S27.1Very low30.2Very low108 Ų108121.5 Ų121.576%0.75578%0.775SS**  74.5103.488760000115
374S29.5Very low29.6Very low124 Ų124123.6 Ų123.687%0.86778%0.778SS**  66.6118.892.3-161.30000115.3
375A25Very low29.5Very low98 Ų98123.8 Ų123.881%0.8178%0.779SS**  trans-177.6133.9134.900000112.8
376V31.6Very low29.6Very low129 Ų129124.2 Ų124.278%0.78279%0.786SS**  trans-88.4150.4170.4173.60000109.2
377S27.1Very low30.4Very low117 Ų117121 Ų12182%0.81878%0.784SS**  trans-153.9128.7155.4-69.70000111.6
378V29.9Very low30.4Very low136 Ų136123.9 Ų123.982%0.82479%0.785SS**  trans-103.8135.4172.2-85.70000109
379T25.7Very low30.5Very low141 Ų141124.3 Ų124.387%0.86578%0.782SS**  trans-140.3150.7170.8-47.50000110.9
380T26Very low29.9Very low115 Ų115123.6 Ų123.671%0.70678%0.781SS**  trans-109.2147.1-150.947.50000114.9
381L26.3Very low30Very low153 Ų153125.6 Ų125.680%0.80178%0.783SS**  trans79.2111.8142-64.5168.3000123.4
382S24.9Very low30.4Very low99 Ų99129.1 Ų129.169%0.69279%0.789SS**  70.9169.3124.9-33.70000122
383P45.8Very low30.7Very low114 Ų114132.2 Ų132.274%0.7479%0.792SS**  -137137.4-73.338-20.6000113.7
384I26.3Very low31Very low162 Ų162135.7 Ų135.783%0.83180%0.796SS**  trans-147.6116.6170.2-57.4-177.8000113.4
385S24.9Very low31.4Very low107 Ų107136.3 Ų136.375%0.74880%0.795SS**  trans42.4121.6137.1-35.70000123.4
386S28.2Very low31.9Very low110 Ų110140.7 Ų140.777%0.76980%0.798SS**  trans-48.4168.6145.744.20000113.5
387P44.2Very low32.1Very low114 Ų114141 Ų14174%0.7480%0.796SS**  cis-154.1172.636.642.1-18.8000119.9
388Y28.4Very low32.6Very low222 Ų222144.6 Ų144.687%0.87180%0.8SS**  trans29.1152.6143.4-94.1-99.9000124.9
389T31.5Very low33.1Very low118 Ų118144.3 Ų144.372%0.72480%0.798SS**  trans79.7118.9146.1-179.20000120.3
390S28.2Very low33.9Very low106 Ų106143.8 Ų143.874%0.74180%0.797SS**  -178.3128.699.7-72.40000113.9
391L40.3Very low34.4Very low169 Ų169143.5 Ų143.589%0.88580%0.799SS**  trans-57.7146149.4-89.9106.6000110.2
392L35.6Very low34.6Very low165 Ų165141.6 Ų141.686%0.86480%0.799SS**  trans-166.1113143.3-107.9159.5000114.1
393Q39.2Very low35.1Very low169 Ų169145.8 Ų145.879%0.7981%0.808SS**  trans-20.1139.2146-162.3151.633.100119.3
394Q33.3Very low34.6Very low182 Ų182143.3 Ų143.385%0.8580%0.803SS**  trans-151.5107.2155.7-66.9-170.1-27.900108.4
395T37Very low35.4Very low137 Ų137141.6 Ų141.684%0.8480%0.802SS**  70.4129.883.148.60000117.3
396E35.4Very low36.1Very low189 Ų189146.2 Ų146.288%0.88381%0.809SS**  trans-77.4167.5-171.3-164.1176.5136.700113.5
397D36.9Very low36.8Very low137 Ų137148.3 Ų148.373%0.73381%0.811SS**  trans105.288.8163.3-131.3-48.5000117.7
398Q37.2Very low36.8Very low191 Ų191150.1 Ų150.189%0.89382%0.815SS**  trans-166.9115130.1-107.4177.494.200110.1
399V40.4Very low37.3Very low131 Ų131147.2 Ų147.279%0.79481%0.813SS**  trans-125.7146.1163-146.20000108
400P40.9Very low38.1Very low129 Ų129146.6 Ų146.684%0.83881%0.809SS**  -128.6136.3129.58.712.3000112.8
401S37.8Very low39Very low109 Ų109146.4 Ų146.476%0.76281%0.805SS**  trans-70.4147.9-176.335.70000116.3
402S30.5Very low39.3Very low113 Ų113144.1 Ų144.179%0.7980%0.8SS**  trans-166.5118133.149.10000114.2
403Q34.5Very low39.7Very low188 Ų188143.5 Ų143.588%0.87980%0.797SS**  trans47.8121.2139.5-98.567.8-3.700123.8
404G36.4Very low40.1Very low62 Ų62141.6 Ų141.664%0.63979%0.791SS**  trans145.6141.3141.700000116.1
405P43.7Very low40.7Very low126 Ų126141.8 Ų141.882%0.81879%0.792SS**  trans-93.6120.3-146.635.5-30000113.5
406F38.3Very low41.1Very low203 Ų203142 Ų14289%0.8979%0.788SS**  trans-108.9116155.1-69.1-76.2000108N408F406-N408 PolarHBondContact O-N 3.1Å
407L43.2Very low41.6Very low154 Ų154139.2 Ų139.281%0.80678%0.779SS**  trans-63111.4164.2-73.7161.8000106.8L409L407-L409 PolarHBondContact O-N 3.13Å
408N43.3Very low42.1Very low153 Ų153142.8 Ų142.882%0.81878%0.784SS**  trans-67.1104.2164.4-108.2-52.1000107F406 V410F406-N408 PolarHBondContact O-N 3.1Å; N408-V410 PolarHBondContact O-N 3.4Å
409L40.3Very low42.8Very low160 Ų160141.8 Ų141.884%0.83878%0.784SS**  trans-80.514.5-179.8-72.5166.3000112.9L407L407-L409 PolarHBondContact O-N 3.13Å
410V47.8Very low43.4Very low106 Ų106143.9 Ų143.964%0.64279%0.789SS**SBendtrans-117.9120.1-177.3-177.90000108.7N408N408-V410 PolarHBondContact O-N 3.4Å
411P46.5Very low43.9Very low102 Ų102140.7 Ų140.766%0.66278%0.78SS**  trans-61.2152.1171.6-16.529.4000110.6I413P411-I413 PolarHBondContact O-N 3.48Å
412P46.9Very low44.9Very low120 Ų120140.2 Ų140.278%0.77977%0.769SS**  trans-57.3130.8173.6-1426.6000109.3L414P412-L414 PolarHBondContact O-N 2.94Å
413I44.7Very low46.1Very low153 Ų153141.2 Ų141.279%0.78576%0.761SS**  trans-64.6100.2176-60.2167.6000107.2P411P411-I413 PolarHBondContact O-N 3.48Å
414L46.7Very low47.3Very low129 Ų129141 Ų14168%0.67577%0.766SS**  trans-80.1131.2157.3-78.6164.3000106.6P412 D416P412-L414 PolarHBondContact O-N 2.94Å; L414-D416 PolarHBondContact O-N 3.35Å
415E46.6Very low48.3Very low186 Ų186144.2 Ų144.287%0.86977%0.768SS**THydrogen-bonded Turntrans-67.50-164.3-139.7167.8-178.500114.3
416D44.5Very low49.1Very low142 Ų142142.3 Ų142.376%0.75975%0.748SS**THydrogen-bonded Turntrans-119.4-4.6-168.7-66.4-44.9000115.6L414L414-D416 PolarHBondContact O-N 3.35Å
417D46.8Very low50.4Low129 Ų129134.1 Ų134.169%0.6972%0.722SS**THydrogen-bonded Turntrans-95.14.2-171.8-78.1-21000115.5
418Y47.9Very low51.4Low213 Ų213133.3 Ų133.384%0.83572%0.716SS**THydrogen-bonded Turntrans-126.921.8178.5-73.4-83.2000114.5L420Y418-L420 VanDerWaalsContact C-N 3.3Å; Y418-L420 PolarHBondContact O-N 3.22Å
419L51.8Low52Low169 Ų169130.1 Ų130.189%0.88571%0.707SS**  trans-90.963.3172.1-137.975.8000111.1G421L419-G421 PolarHBondContact O-N 2.79Å; L419-G421 VanDerWaalsContact O-N 3.09Å
420L51.5Low53Low175 Ų175126 Ų12692%0.91669%0.685SS**  trans-8176.7163.2-78.1161.7000108.2Y418Y418-L420 VanDerWaalsContact C-N 3.3Å; Y418-L420 PolarHBondContact O-N 3.22Å
421G53.3Low53.6Low63 Ų63126.6 Ų126.665%0.64968%0.684SS**PPolyproline II helixtrans-78.4132.4164.700000109.2L419 E423L419-G421 PolarHBondContact O-N 2.79Å; L419-G421 VanDerWaalsContact O-N 3.09Å; G421-E423 PolarHBondContact O-N 3.14Å
422L56.7Low54.1Low98 Ų98129 Ų12951%0.51368%0.684SS.*PPolyproline II helixtrans-63132.7163.7-66.1169.7000107.7Q426L422-Q426 HydrophobicContact CB-CB 4.21Å; L422-Q426 HydrophobicContact CD2-CB 4.12Å
423E57.6Low54.4Low134 Ų134129.3 Ų129.363%0.62668%0.68SS**PPolyproline II helixtrans-67.3156.5175.1-145.2165.6-161.900109G421 D425 Q426G421-E423 PolarHBondContact O-N 3.14Å; E423-D425 PolarHBondContact O-N 3.01Å; E423-Q426 PolarHBondContact O-N 3.47Å
424D57.9Low54.7Low185 Ų185126.3 Ų126.399%0.98968%0.678SS**THydrogen-bonded Turntrans-60.6-8.4-168.9-68.8-34.5000114.5
425D59.1Low54.8Low128 Ų128123.8 Ų123.868%0.68467%0.67SS**THydrogen-bonded Turntrans-106-2.8176.265.5-21.1000114.7E423E423-D425 PolarHBondContact O-N 3.01Å
426Q60.7Low54.7Low86 Ų86119.7 Ų119.740%0.40265%0.654SS.*  trans-103.1123-179.2-70.7177.951.200112L422 E423L422-Q426 HydrophobicContact CB-CB 4.21Å; L422-Q426 HydrophobicContact CD2-CB 4.12Å; E423-Q426 PolarHBondContact O-N 3.47Å
427G65.4Low54.9Low32 Ų32120.4 Ų120.433%0.3365%0.651SS.*  trans-100.6165.7178.100000112.6S429 D430G427-S429 PolarHBondContact O-N 3.39Å; G427-D430 PolarHBondContact N-OD2 3.11Å; G427-D430 PolarHBondContact O-N 3.42Å
428I62.5Low55Low136 Ų136121.9 Ų121.970%0.69766%0.659SS**THydrogen-bonded Turntrans-53.8-18.1169.714.6169.1000113.6L431 F432I428-L431 WeakPolarHBondContact O-CB 3.26Å; I428-F432 WeakPolarHBondContact O-CD2 3.35Å
429S57.5Low55.1Low87 Ų87120 Ų12061%0.60865%0.654SS**THydrogen-bonded Turntrans-65.8-36.8173.8-36.70000113G427 L431 F432G427-S429 PolarHBondContact O-N 3.39Å; S429-L431 PolarHBondContact O-N 3.28Å; S429-F432 PolarHBondContact O-N 3.34Å
430D60.4Low54.7Low73 Ų73118.6 Ų118.639%0.3965%0.645SS.*Hα-helixtrans-70.9-20.7-178.8-71.8-44000112.5G427 F432 D433G427-D430 PolarHBondContact N-OD2 3.11Å; G427-D430 PolarHBondContact O-N 3.42Å; D430-F432 PolarHBondContact O-N 2.78Å; D430-D433 PolarHBondContact O-N 3.04Å
431L60.8Low54.4Low118 Ų118115.2 Ų115.262%0.61863%0.634SS**Hα-helixtrans-64-22.1175.8-151.978.8000112.2I428 S429I428-L431 WeakPolarHBondContact O-CB 3.26Å; S429-L431 PolarHBondContact O-N 3.28Å
432F56.6Low54.1Low153 Ų153118.1 Ų118.167%0.67164%0.644SS**Hα-helixtrans-103.9-17.4-179.7-63.2-80.3000113.6I428 S429 D430 A434 C435I428-F432 WeakPolarHBondContact O-CD2 3.35Å; S429-F432 PolarHBondContact O-N 3.34Å; D430-F432 PolarHBondContact O-N 2.78Å; F432-A434 VanDerWaalsContact C-N 3.34Å; F432-C435 PolarHBondContact O-N 2.92Å
433D53.5Low53.5Low127 Ų127120.9 Ų120.968%0.67966%0.659SS**Hα-helixtrans-77.6-19.1177.1-78.4-18.1000112.9D430 C435D430-D433 PolarHBondContact O-N 3.04Å; D433-C435 VanDerWaalsContact C-N 3.28Å; D433-C435 PolarHBondContact O-N 3.23Å
434A50.8Low52.8Low90 Ų90117.2 Ų117.274%0.74466%0.657SS**THydrogen-bonded Turntrans-76.6-12.6174.600000113.9F432 D436F432-A434 VanDerWaalsContact C-N 3.34Å; A434-D436 PolarHBondContact O-N 3.11Å
435C49.4Very low52.1Low76 Ų76116.2 Ų116.251%0.51465%0.65SS.*  trans-95.673.4176.6-74.40000110.3F432 D433 F437F432-C435 PolarHBondContact O-N 2.92Å; D433-C435 VanDerWaalsContact C-N 3.28Å; D433-C435 PolarHBondContact O-N 3.23Å; C435-F437 VanDerWaalsContact C-N 3.31Å; C435-F437 HydrophobicContact CB-CD2 4.22Å; C435-F437 HydrophobicContact CB-CE2 3.8Å; C435-F437 HydrophobicContact CB-CZ 4.34Å; C435-F437 WeakPolarHBondContact O-CD2 3.39Å; C435-F437 PolarHBondContact O-N 2.92Å
436D43.9Very low51.4Low99 Ų99117.2 Ų117.253%0.52966%0.656SS.*  trans-68.489.6165.7-169.76.2000109.1A434 D438 K439A434-D436 PolarHBondContact O-N 3.11Å; D436-D438 PolarHBondContact O-N 2.96Å; D436-D438 VanDerWaalsContact O-N 3.11Å; D436-D438 PolarHBondContact OD1-N 2.7Å; D436-K439 PolarHBondContact O-N 3.35Å; D436-K439 VanDerWaalsContact O-N 3.16Å
437F49.4Very low50.7Low158 Ų158120.9 Ų120.969%0.69368%0.678SS**G310 helixtrans-62.5-13.3-179.9-78.3-84.4000113.1C435 K439 M440C435-F437 VanDerWaalsContact C-N 3.31Å; C435-F437 HydrophobicContact CB-CD2 4.22Å; C435-F437 HydrophobicContact CB-CE2 3.8Å; C435-F437 HydrophobicContact CB-CZ 4.34Å; C435-F437 WeakPolarHBondContact O-CD2 3.39Å; C435-F437 PolarHBondContact O-N 2.92Å; F437-K439 VanDerWaalsContact C-N 3.3Å; F437-M440 HydrophobicContact CD1-CE 4.08Å
438D49.3Very low49.7Very low160 Ų160127 Ų12786%0.85670%0.703SS**G310 helixtrans-83.9-0.9177.2-80.4-44.7000113.6D436D436-D438 PolarHBondContact O-N 2.96Å; D436-D438 VanDerWaalsContact O-N 3.11Å; D436-D438 PolarHBondContact OD1-N 2.7Å
439K48.8Very low48.9Very low172 Ų172128.8 Ų128.875%0.74871%0.713SS**G310 helixtrans-122.319.4-176.8-137.8175.6-174-178.50115.9D436 F437D436-K439 PolarHBondContact O-N 3.35Å; D436-K439 VanDerWaalsContact O-N 3.16Å; F437-K439 VanDerWaalsContact C-N 3.3Å
440M43.7Very low48.3Very low140 Ų140130.5 Ų130.569%0.6972%0.723SS**  trans-70.5127.4168.6-79-164.1-76.100110.8F437 S442F437-M440 HydrophobicContact CD1-CE 4.08Å; M440-S442 PolarHBondContact O-N 2.94Å
441P44.5Very low47.5Very low105 Ų105136.6 Ų136.668%0.68277%0.772SS**  trans-64.6131.9169.226.7-30.1000108.6L443P441-L443 VanDerWaalsContact C-N 3.32Å; P441-L443 PolarHBondContact O-N 3.2Å
442S47.7Very low46.8Very low124 Ų124137.6 Ų137.687%0.86778%0.779SS**  trans-59.792.3172.859.60000109.6M440 G444M440-S442 PolarHBondContact O-N 2.94Å; S442-G444 PolarHBondContact O-N 3.18Å; S442-G444 VanDerWaalsContact O-N 3.15Å
443L43.5Very low46.3Very low156 Ų156136.7 Ų136.782%0.81779%0.785SS**  trans-71.8108.3169.6-71.9175.3000107.3P441 L445P441-L443 VanDerWaalsContact C-N 3.32Å; P441-L443 PolarHBondContact O-N 3.2Å; L443-L445 PolarHBondContact O-N 3.38Å
444G43.8Very low45.9Very low57 Ų57137.3 Ų137.359%0.58879%0.791SS**  trans-54.1121.8-17800000111.5S442 D446S442-G444 PolarHBondContact O-N 3.18Å; S442-G444 VanDerWaalsContact O-N 3.15Å; G444-D446 PolarHBondContact O-N 3.25Å
445L43.3Very low45.6Very low163 Ų163140.1 Ų140.185%0.85379%0.794SS**THydrogen-bonded Turntrans-85.222.6174.3-100.9162.8000112L443L443-L445 PolarHBondContact O-N 3.38Å
446D44.4Very low45.4Very low149 Ų149144.1 Ų144.180%0.79781%0.811SS**THydrogen-bonded Turntrans-94.6-6.9-172-54.3-55.9000114G444G444-D446 PolarHBondContact O-N 3.25Å
447D45.5Very low45.5Very low163 Ų163147.1 Ų147.187%0.87283%0.83SS**SBendtrans-110.619.4-167.3-128.48.9000115.7
448L43.7Very low45.2Very low162 Ų162146.3 Ų146.385%0.84884%0.84SS**SBendtrans-118.419.4178.4-102.5153000114.4
449L47.1Very low44.9Very low173 Ų173145.2 Ų145.291%0.90684%0.839SS**SBendtrans-121.229.4174.1-89173.8000114.4
450C44.9Very low44.6Very low122 Ų122143 Ų14382%0.82485%0.846SS**  trans-151.991165.8-140.30000112.8
451S42.6Very low44.6Very low202 Ų202143.3 Ų143.3100%1.41386%0.861SS**  trans-167.40142.1-80.40000110.4

Retrieved 451 of 451 residues in 316.2 ms (Link to these results)