A0A060XVT9_ONCMY Loading...

FEZ family zinc finger 1

AlphaFold DB , UniProt , Accession A0A060XVT9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110521342, Length 438 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.6Very low29.5Very low234 Ų234141.9 Ų141.9100%1.15382%0.821SS**  0162.20-68.6-173.4166.700107
2D26.6Very low29.4Very low157 Ų157147.4 Ų147.484%0.8483%0.828SS**  trans100.884.9-166.7-51.5-13.4000110.1
3S30.3Very low29.1Very low115 Ų115141.5 Ų141.580%0.80482%0.82SS**  48.691.359.4-62.20000111.1
4A30.3Very low29Very low86 Ų86140 Ų14071%0.71182%0.822SS**  8312375.900000113.8
5L30.6Very low29.4Very low144 Ų144139.4 Ų139.475%0.75482%0.824SS**  trans74.8118.5151-58.9166.1000118.7
6Y25.4Very low29.2Very low235 Ų235138.1 Ų138.192%0.92283%0.825SS**  -154.5136.9110.3-119.3-87.6000111.9
7H30.2Very low29Very low161 Ų161136.2 Ų136.275%0.74583%0.827SS**  trans-95.8175.9-177.1-110.5-93.3000111.4
8S31.7Very low28.9Very low104 Ų104134.6 Ų134.673%0.72782%0.823SS**  trans117.5115.3144.9680000114.5
9A30.2Very low28.8Very low105 Ų105137.8 Ų137.887%0.86883%0.828SS**  91.8116.156.300000111.9
10G26.6Very low28.7Very low73 Ų73138.8 Ų138.875%0.75383%0.828SS**  115.5143.8104.700000108.4
11I30.2Very low28.6Very low147 Ų147139.8 Ų139.875%0.75483%0.829SS**  -178.714166.3-71177.3000106.2
12F28.3Very low28.4Very low208 Ų208134.2 Ų134.291%0.91281%0.808SS**  175147.5101.4-93.4-82.8000105.7
13G25Very low28.4Very low70 Ų70131.8 Ų131.872%0.72281%0.81SS**  cis161.61317.400000105.7
14S27.9Very low28.2Very low121 Ų121130.1 Ų130.185%0.84681%0.811SS**  trans-73.4170.8177.8-520000112.1
15P34.6Very low28Very low131 Ų131129.7 Ų129.785%0.85182%0.815SS**  -142160.110536.1-21.5000115.3
16S26.9Very low27.8Very low119 Ų119132.8 Ų132.883%0.83282%0.822SS**  trans-89.5145.4174.748.90000112.6
17A25.3Very low28Very low105 Ų105130.7 Ų130.787%0.86882%0.823SS**  trans-151.8139.7148.300000110.2
18S27.7Very low28Very low108 Ų108130.6 Ų130.676%0.75583%0.827SS**  trans-78.9152.3-175.248.90000114.1
19E26Very low28.1Very low196 Ų196131.1 Ų131.192%0.91683%0.826SS**  -171.6133.4129.9-105.2168.2-166.700111.7
20N27.1Very low28Very low156 Ų156132.4 Ų132.483%0.83483%0.825SS**  trans-80.9148.8169.6-81.3-53.8000109.7
21L27.3Very low28.2Very low160 Ų160135.3 Ų135.384%0.83883%0.828SS**  trans-178.5119.2139.3-96.7156.1000112.5
22T27.3Very low28.4Very low118 Ų118137.6 Ų137.672%0.72483%0.833SS**  trans45.2121.3139.646.30000123.7
23A26.7Very low28.6Very low106 Ų106133.9 Ų133.988%0.87683%0.83SS**  43.5125.6125.500000121.3
24G26.3Very low28.8Very low80 Ų80138.5 Ų138.583%0.82584%0.837SS**  trans159.29915800000113.3
25G26.6Very low28.7Very low77 Ų77136.7 Ų136.779%0.79483%0.829SS**  trans-67150176.600000113.5
26K27.8Very low28.5Very low208 Ų208140.7 Ų140.790%0.90483%0.833SS**  trans-164.5128.5145.4-108.9164.9-173.9178.60110.6
27M29.4Very low28.5Very low192 Ų192139.8 Ų139.895%0.94683%0.827SS**  trans-63131.7175-66.8170.959.700110.7
28I30.2Very low28.8Very low159 Ų159143 Ų14382%0.81583%0.828SS**  trans-130.9129.7162.1-54.7178000108
29T31.9Very low29.2Very low115 Ų115146.8 Ų146.871%0.70683%0.834SS**  trans-48.2151-175.5530000115.8T31T29-T31 PolarHBondContact O-N 2.87Å
30P28.8Very low29.5Very low131 Ų131149 Ų14985%0.85183%0.834SS**  trans-74.3113.6178.629.5-31.3000111.5
31T31.7Very low29.7Very low135 Ų135149.4 Ų149.483%0.82883%0.834SS**PPolyproline II helixtrans-63.2135.7168.141.60000111.8T29T29-T31 PolarHBondContact O-N 2.87Å
32K34.7Very low30.1Very low195 Ų195150.9 Ų150.985%0.84884%0.839SS**PPolyproline II helixtrans-53.8144.9176.9-63.7169.3179.7172.60112.3L34K32-L34 PolarHBondContact O-N 3.3Å
33P31Very low30.1Very low130 Ų130149.7 Ų149.784%0.84484%0.841SS**PPolyproline II helixtrans-73.4124.9173.628.6-30.9000110.9A35P33-A35 PolarHBondContact O-N 2.98Å
34L28.9Very low30.3Very low167 Ų167156 Ų15687%0.87484%0.843SS**PPolyproline II helixtrans-57.8118.7175.9-80.3155.3000111.4K32K32-L34 PolarHBondContact O-N 3.3Å
35A27.6Very low30.3Very low83 Ų83158.4 Ų158.469%0.68684%0.841SS**PPolyproline II helixtrans-69.4124.816200000108.8P33 S37P33-A35 PolarHBondContact O-N 2.98Å; A35-S37 PolarHBondContact O-N 3.34Å
36F28.7Very low30.6Very low214 Ų214160.2 Ų160.294%0.93984%0.839SS**  trans-6894.4168.1-90.2-95.4000109.1
37S27.9Very low31Very low101 Ų101159.1 Ų159.171%0.70684%0.837SS**  trans-103.3128.2165.8-70.20000109.3A35 E39A35-S37 PolarHBondContact O-N 3.34Å; S37-E39 VanDerWaalsContact C-N 3.28Å; S37-E39 PolarHBondContact O-N 3.11Å
38I32.2Very low31.1Very low172 Ų172156 Ų15688%0.88283%0.831SS**SBendtrans-75.177.5178.6-59.1170.5000107.8
39E34.5Very low31Very low187 Ų187157.7 Ų157.787%0.87483%0.832SS**  trans-156.687.5165.5-76.4-158.3161.600110S37S37-E39 VanDerWaalsContact C-N 3.28Å; S37-E39 PolarHBondContact O-N 3.11Å
40R33.3Very low30.8Very low242 Ų242157.9 Ų157.991%0.91384%0.838SS**  trans-158.549.9162.4-149.4176.9-167.8147.33.5115.1
41I31.8Very low30.9Very low166 Ų166159.2 Ų159.285%0.85184%0.837SS**  trans-135.366.4159.1-48.7178.1000108.7
42M34Very low30.8Very low191 Ų191158 Ų15894%0.94183%0.831SS**  trans-152.794.7166.3-82.4-78.1141.300106.1
43A28.1Very low30.5Very low92 Ų92156.9 Ų156.976%0.7683%0.826SS**  trans179.5132.3145.300000112.6
44R30.2Very low30.5Very low240 Ų240156.6 Ų156.691%0.90683%0.825SS**  trans85.4118.1164.5-52.1-175.2-174.3-163.3-0.6113.6
45T27.6Very low30.5Very low130 Ų130155 Ų15580%0.79882%0.817SS**  cis-156.8-167.637.746.50000111.3
46P31.9Very low30.5Very low114 Ų114158.1 Ų158.174%0.7482%0.821SS**PPolyproline II helix-101169.6-97.531.2-10.7000113.5
47E36.5Very low30.5Very low185 Ų185156.5 Ų156.586%0.86481%0.814SS**PPolyproline II helixtrans-57.9140.9175.7-62.4-151.7157.500113.7
48P31.3Very low30.5Very low126 Ų126159.5 Ų159.582%0.81882%0.817SS**PPolyproline II helixtrans-97.5126.6158.130.6-20.3000111.3
49K29.1Very low30.4Very low196 Ų196160.1 Ų160.185%0.85282%0.816SS**PPolyproline II helixtrans-52.1144.1178-61.9167.4179177.20113.1
50S27.6Very low30Very low118 Ų118157 Ų15783%0.82581%0.81SS**PPolyproline II helixtrans-57.7133.5166.352.30000113.1
51I30.5Very low30.4Very low160 Ų160150.9 Ų150.982%0.82180%0.801SS**  trans-140.4141.2160-59.3-177.6000107.7
52P29.4Very low30.3Very low110 Ų110150 Ų15071%0.71480%0.803SS**  trans-95.8157.1-157.636.7-33.6000116.4
53F28.2Very low29.9Very low170 Ų170144.1 Ų144.175%0.74679%0.791SS**  trans14.4148.3147.9-80.9-76.4000121.5
54P31.9Very low29.9Very low125 Ų125149.4 Ų149.481%0.81279%0.792SS**  -138.4143.383.127.1-6.5000117
55N28.2Very low30Very low133 Ų133144 Ų14471%0.71179%0.787SS**  trans-68141.1163.9-79.5-37.4000111.2
56L28.2Very low30.1Very low148 Ų148145.2 Ų145.278%0.77578%0.784SS**  trans-139.4111.9155.9-85.5163.3000110.7
57F28.7Very low29.8Very low181 Ų181144.8 Ų144.879%0.79479%0.79SS**  trans76115.2150.7-70.7-75.7000123.4
58H28.4Very low29.4Very low164 Ų164143.2 Ų143.276%0.75979%0.788SS**  trans-47.7150.4152.3-76.2-88.5000113.8
59H29.1Very low30.1Very low184 Ų184142 Ų14285%0.85278%0.78SS**  -173.2131.3110.6-87-68.6000110.3
60T26.8Very low30.1Very low123 Ų123140.8 Ų140.876%0.75577%0.774SS**  trans-117.1176.3165.645.70000107.5
61P41.9Very low30.2Very low113 Ų113143.7 Ų143.773%0.73478%0.775SS**  cis-131.7-149.6-37.933.1-11.6000109.8
62V28.8Very low30Very low147 Ų147139.8 Ų139.889%0.89177%0.766SS**  trans113.3127.8169.2-176.80000110.6
63G26.6Very low29.9Very low67 Ų67141.8 Ų141.869%0.69177%0.77SS**  cis-173.1160.83.700000108.6
64R26.8Very low29.9Very low204 Ų204140 Ų14077%0.7777%0.768SS**  trans-80.3149.1169.3-159.6-170-122.2-145.20.8108.6E66R64-E66 IonicContact NH1-OE1 3.57Å; R64-E66 PolarHBondContact NH1-OE1 2.82Å
65P32.6Very low29.6Very low125 Ų125141 Ų14181%0.81276%0.764SS**  -141.7162.1109.826.2-6.1000114.5
66E29Very low29.5Very low157 Ų157141.1 Ų141.173%0.73477%0.77SS**  trans-76.7150.1178.6-62.4171.315700112.5R64R64-E66 IonicContact NH1-OE1 3.57Å; R64-E66 PolarHBondContact NH1-OE1 2.82Å
67A26.5Very low29.4Very low104 Ų104138 Ų13886%0.8676%0.761SS**  trans164.9125.9130.200000112.7
68D27.1Very low29.4Very low153 Ų153134.6 Ų134.682%0.81876%0.759SS**  trans-77.2-180157.8-122.9-26.3000109.3
69P46.1Very low29.4Very low100 Ų100132 Ų13265%0.64976%0.759SS**  cis-144.5-178.2-4.930.1-4.6000116.5
70K29.1Very low29.3Very low171 Ų171130.7 Ų130.774%0.74376%0.758SS**  trans115.2117.1146.1-67-174.5179.2178.10120
71Q30.8Very low29.2Very low178 Ų178131.9 Ų131.983%0.83275%0.754SS**  trans67.5146134.1-66.9-179.1800119.4
72A25.5Very low28.3Very low78 Ų78132.2 Ų132.265%0.64576%0.758SS**  cis-175.9175.3-1000000108.3
73L28.1Very low28.1Very low152 Ų152132.5 Ų132.580%0.79675%0.752SS**  trans90131.2167.1-50173.1000115.5
74N27Very low28.1Very low132 Ų132136.2 Ų136.271%0.70675%0.754SS**  cis-163.1128.9-1.4-97-20.8000106.5
75M25.7Very low28.2Very low148 Ų148131.7 Ų131.773%0.72975%0.751SS**  64.4111.390.5-70.7-111.370.500117.5
76T26.5Very low27.8Very low135 Ų135135.8 Ų135.883%0.82876%0.757SS**  -151.896.8122.948.90000107.3
77S27.2Very low27.7Very low83 Ų83134.2 Ų134.258%0.5876%0.758SS**  37.1129.596.370.90000114.9
78S27.3Very low27.7Very low109 Ų109135 Ų13576%0.76275%0.754SS**  cis-158.1116.549.4-44.60000110.8
79S28.2Very low27.6Very low109 Ų109136.2 Ų136.276%0.76276%0.759SS**  78.3111.489.2-62.70000113.3
80L26.9Very low26.5Very low156 Ų156136.1 Ų136.182%0.81777%0.767SS**  46.4135.556.2-73.5165.8000111.5
81H26.6Very low26.2Very low148 Ų148137.4 Ų137.469%0.68577%0.769SS**  cis-170.8154.43.2-142-154.5000104.5
82C21.6Very low25.8Very low120 Ų120136.2 Ų136.281%0.81176%0.763SS**  trans-140.8116.7157.5-158.80000110.1
83M25.7Very low26.2Very low153 Ų153137.6 Ų137.675%0.75477%0.766SS**  trans-99.4130.6171.9-77.1-87.4172.500107.4
84I26.5Very low26Very low145 Ų145133 Ų13374%0.74476%0.755SS**  trans-139136.7159.8-60.7-175.2000108.3
85P28.4Very low26Very low110 Ų110135.7 Ų135.771%0.71476%0.763SS**  trans-86.1160.1-174.436-35.1000112.6
86F24.1Very low25.9Very low211 Ų211137.3 Ų137.393%0.92577%0.766SS**  trans-129.1121.1164.9-112.1-91.2000110.5
87V26.3Very low25.9Very low124 Ų124139.6 Ų139.675%0.75277%0.772SS**PPolyproline II helixtrans-101.5143.8167.41740000107.4
88P27.4Very low25.8Very low119 Ų119141.5 Ų141.577%0.77378%0.776SS**PPolyproline II helixtrans-84.6138.8-174.233-32.4000112.1
89L24.5Very low25.9Very low179 Ų179144.5 Ų144.594%0.93778%0.781SS**PPolyproline II helixtrans-97.3128.1163.3-83.4167.8000109.9
90A23Very low25.9Very low99 Ų99146 Ų14682%0.81878%0.781SS**PPolyproline II helixtrans-78.2149.1167.800000110
91Y22.6Very low25.9Very low197 Ų197141.8 Ų141.877%0.77378%0.775SS**  trans-138147.8165.1-170.9-97.5000110
92E23.2Very low25.9Very low153 Ų153143.4 Ų143.472%0.71579%0.788SS**  trans140.3147.3158.6-76.8-62148.400108.7
93P34.2Very low26.1Very low107 Ų107144 Ų14470%0.69578%0.783SS**  cis-137.4162.3-11.936.7-18.3000115.7
94G22.7Very low26Very low55 Ų55141.6 Ų141.657%0.56778%0.777SS**  trans78118.8137.800000120.9
95H26.7Very low25.9Very low189 Ų189139.2 Ų139.288%0.87577%0.773SS**  -173.4152.8109.1-109.5-103.5000112.3
96K25.1Very low25.9Very low183 Ų183141.5 Ų141.580%0.79677%0.774SS**  trans-59.5144-164.5-59.4164175.6176.60115.1
97L25.9Very low26Very low182 Ų182138.8 Ų138.895%0.95376%0.762SS**  trans-141.4139.1136.2-88.5176.5000111.1
98N24.3Very low25.9Very low124 Ų124141.2 Ų141.266%0.66377%0.765SS**  trans-94.9134-170178.413.7000109.4
99I30.5Very low25.7Very low171 Ų171139.8 Ų139.888%0.87776%0.764SS**  trans-150.4129.8153.88.4175.6000110.1
100N26.9Very low25.7Very low142 Ų142136.4 Ų136.476%0.75976%0.755SS**  trans-76.2149.2-174.3-65.5-45000112.8
101G26.7Very low25.7Very low67 Ų67135.9 Ų135.969%0.69175%0.746SS**  trans74.2111.2137.800000118.3
102L27.1Very low25.8Very low182 Ų182136.8 Ų136.895%0.95375%0.749SS**  -179.9167.5113.7-98.5151.3000110.7
103D25.9Very low25.8Very low132 Ų132136.7 Ų136.771%0.70675%0.753SS**  trans-92.5160.4-135.2-138.4-12.4000116
104T24.3Very low25.3Very low102 Ų102137 Ų13763%0.62676%0.758SS**  trans26.5133.5148.350.70000123.1
105S23.9Very low25.5Very low95 Ų95142 Ų14266%0.66477%0.772SS**  trans61.6116.1133.470.60000117.8
106Q27.7Very low25.5Very low159 Ų159141.3 Ų141.374%0.74377%0.769SS**  169.1148.3119.3-97.8174.428.100112.6
107F26.4Very low25.6Very low154 Ų154138.7 Ų138.768%0.67576%0.763SS**  trans61.3107.8151.8-70.9-65.5000117.9
108E24.9Very low25.7Very low174 Ų174135.8 Ų135.881%0.81375%0.753SS**  102.2154.477.2-104.2-176.5-164.700111.8
109A23.9Very low25.6Very low89 Ų89133.2 Ų133.274%0.73676%0.756SS**  trans-66.4-179.7-17100000114.4
110S24.2Very low25.5Very low109 Ų109132.7 Ų132.776%0.76275%0.753SS**  trans104105165.583.10000112.5
111S22.9Very low25.3Very low88 Ų88129.1 Ų129.162%0.61575%0.75SS**  80.3133.376.775.10000113.5
112Y23.5Very low25.3Very low215 Ų215133.7 Ų133.784%0.84376%0.758SS**  trans74.8117.5172.1-57.3-82.9000114.3
113N23.1Very low25.2Very low151 Ų151131.6 Ų131.681%0.80775%0.747SS**  cis68.19349.2-154.229.9000112.8
114S24.7Very low25.1Very low114 Ų114134.4 Ų134.480%0.79775%0.75SS**  176.6138.2127.347.60000112
115N27.5Very low25.1Very low161 Ų161139.2 Ų139.286%0.86176%0.762SS**  trans-55.2136.8161.8-63-47.6000111.7
116E26.3Very low25.1Very low173 Ų173141.2 Ų141.281%0.80877%0.765SS**  trans-167.4145.8147.1-87.7-155150.300104.4
117L27.4Very low25.1Very low128 Ų128142.9 Ų142.967%0.6777%0.773SS**  cis-177.9164.5-3.3-116.3169.9000103.7
118V27Very low25Very low121 Ų121143.8 Ų143.873%0.73378%0.779SS**  trans73.2117.7155.1-172.80000115
119G23.6Very low25.4Very low71 Ų71140.9 Ų140.973%0.73278%0.775SS**  cis91.967.232.600000110.8
120I27.9Very low25.3Very low159 Ų159143 Ų14382%0.81578%0.775SS**  trans-133.8112.3160.9-57.6-179.6000107.7
121G22.6Very low25.4Very low68 Ų68144.7 Ų144.770%0.70178%0.78SS**  trans-91.8141.8167.400000110.6
122L26.7Very low25.5Very low162 Ų162145.6 Ų145.685%0.84879%0.786SS**  trans-149.8103.5150.7-70.7-179.3000105.1
123N24.7Very low25.9Very low138 Ų138140.8 Ų140.874%0.73878%0.781SS**  72.4101.581.2-145.6-3000113.2
124Y23.4Very low26Very low192 Ų192139.1 Ų139.175%0.75378%0.782SS**  trans30.1130.5149.4-78.8-98.9000120.3
125K25.6Very low26.3Very low203 Ų203140.8 Ų140.888%0.88379%0.786SS**  -169.3144.6100.8-100.1171.2-175.9-176.40113
126N24.2Very low26.2Very low137 Ų137135.1 Ų135.173%0.73377%0.766SS**  trans-58150.9176.4-65.5-39.3000112.6
127E26.1Very low26.3Very low193 Ų193136.1 Ų136.190%0.90277%0.771SS**  -171.2122.6121.1-100162.2-170.400110
128Q25.7Very low26.2Very low174 Ų174140.3 Ų140.381%0.81378%0.779SS**  trans-90.3154.5162.6-79.8-119.4-34.400107.7
129P32.1Very low26.1Very low113 Ų113143.8 Ų143.873%0.73479%0.785SS**  -147.3151.987.932.1-11.5000116.7
130D21.9Very low26.1Very low134 Ų134148.4 Ų148.472%0.71779%0.792SS**  trans40.4116139.4-67.5-40.4000120.9
131V26.6Very low25.8Very low143 Ų143149.8 Ų149.887%0.86779%0.792SS**  -161.6122.2114.3174.10000108.4
132S25.3Very low25.9Very low108 Ų108157.4 Ų157.476%0.75580%0.8SS**  trans-89147.8159.3-58.30000108
133P32.3Very low25.7Very low113 Ų113155.3 Ų155.373%0.73480%0.796SS**  -157.8174.473.539.2-17.3000118.6
134S25.1Very low25.7Very low117 Ų117159.8 Ų159.882%0.81880%0.803SS**  trans101.1110.4146.478.30000118.4
135V29.5Very low25.7Very low148 Ų148156.7 Ų156.790%0.89780%0.803SS**  trans-73.1115.4173.6173.50000109.1
136G26.4Very low25.7Very low43 Ų43153 Ų15344%0.44380%0.797SS.*  trans-115.2122.3164.400000109.8Y138G136-Y138 WeakPolarHBondContact O-CD2 3.4Å; G136-Y138 VanDerWaalsContact O-CE2 3.29Å; G136-Y138 WeakPolarHBondContact O-CE2 3.24Å; G136-Y138 PolarHBondContact O-N 2.73Å
137Q29.2Very low25.8Very low194 Ų194152.8 Ų152.891%0.90780%0.796SS**  trans-64.1115.1-179.7-70.4173.6-14.600111.8
138Y24.1Very low26Very low215 Ų215152.4 Ų152.484%0.84380%0.795SS**  trans-94114.6168.5-53-75.8000110.7G136 L140G136-Y138 WeakPolarHBondContact O-CD2 3.4Å; G136-Y138 VanDerWaalsContact O-CE2 3.29Å; G136-Y138 WeakPolarHBondContact O-CE2 3.24Å; G136-Y138 PolarHBondContact O-N 2.73Å; Y138-L140 PolarHBondContact O-N 3.1Å
139K26.2Very low26.2Very low194 Ų194148.8 Ų148.884%0.84379%0.789SS**  trans-81.5103.9171.2-145.3172.5-170.2172.80108.1F141K139-F141 PolarHBondContact O-N 3.44Å
140L22.1Very low25.9Very low168 Ų168148.7 Ų148.788%0.8879%0.791SS**  trans-63103.9175.1-90.4155000110.9Y138 R142Y138-L140 PolarHBondContact O-N 3.1Å; L140-R142 PolarHBondContact O-N 3.06Å
141F23Very low26.1Very low189 Ų189151.2 Ų151.283%0.82980%0.795SS**  trans-76112.8161.5-101.9-95.6000108.8K139K139-F141 PolarHBondContact O-N 3.44Å
142R23.8Very low26Very low227 Ų227153 Ų15386%0.85779%0.794SS**  trans-61.9132.9169.4-75.2-174.6178.8-177.50.1109.6L140 R144L140-R142 PolarHBondContact O-N 3.06Å; R142-R144 PolarHBondContact O-N 2.83Å; R142-R144 VanDerWaalsContact O-N 3.13Å
143P23.2Very low26Very low119 Ų119152.4 Ų152.477%0.77380%0.796SS**  trans-62.1118.5168.1-17.229.3000109.3V145P143-V145 PolarHBondContact O-N 3.41Å
144R23.2Very low25.7Very low232 Ų232155.9 Ų155.988%0.87580%0.804SS**  trans-72.393.8171.5-167.6177.2-170.9168.61.9107.3R142 V146R142-R144 PolarHBondContact O-N 2.83Å; R142-R144 VanDerWaalsContact O-N 3.13Å; R144-V146 PolarHBondContact O-N 3.32Å
145V24Very low25.8Very low127 Ų127154.2 Ų154.277%0.7781%0.805SS**  trans-60.9107.5171.3178.50000108.1P143 N147P143-V145 PolarHBondContact O-N 3.41Å; V145-N147 PolarHBondContact O-N 3.11Å
146V25.9Very low25.5Very low125 Ų125151.1 Ų151.176%0.75880%0.796SS**  trans-70.2112.6176-1770000107.3R144 Q148R144-V146 PolarHBondContact O-N 3.32Å; V146-Q148 PolarHBondContact O-N 2.84Å
147N26Very low25.5Very low132 Ų132154.8 Ų154.871%0.70681%0.809SS**  trans-55.6112.7168.9-80.6-46.1000109V145 S149V145-N147 PolarHBondContact O-N 3.11Å; N147-S149 PolarHBondContact O-N 3.26Å
148Q30.2Very low25.3Very low186 Ų186150.9 Ų150.987%0.86980%0.802SS**SBendtrans-7575.3175.4-143.6162.411.700109.8V146V146-Q148 PolarHBondContact O-N 2.84Å
149S29Very low25.3Very low98 Ų98150.5 Ų150.569%0.68580%0.8SS**  trans-157.851.7166.352.70000110.6N147N147-S149 PolarHBondContact O-N 3.26Å
150S27.2Very low25.4Very low111 Ų111148.6 Ų148.678%0.77680%0.799SS**  trans-159.268.6169.8-62.70000110.3
151F25.5Very low25.7Very low187 Ų187148.3 Ų148.382%0.8280%0.798SS**  trans-101.496.6156.6-94.4-87.5000107.4
152H24.8Very low25.8Very low180 Ų180145.4 Ų145.483%0.83380%0.8SS**  trans-123.8127.5143.1-97.358.8000105.2
153A25.6Very low26Very low96 Ų96138 Ų13879%0.79379%0.794SS**  trans-51.3134.2-176.200000112.7
154M26.1Very low26.4Very low186 Ų186141.5 Ų141.592%0.91680%0.8SS**  trans-116.2108.3137.8-73.8-170.5174.600105.6A156M154-A156 PolarHBondContact O-N 3.16Å
155G25.7Very low26.6Very low81 Ų81136.7 Ų136.784%0.83580%0.802SS**  trans-63111.5160.900000107.5
156A23.7Very low26.8Very low84 Ų84135.5 Ų135.569%0.69481%0.805SS**  trans-100.9107.4156.300000105.5M154 C158M154-A156 PolarHBondContact O-N 3.16Å; A156-C158 PolarHBondContact O-N 3.28Å; A156-C158 VanDerWaalsContact O-N 3.17Å
157V26.8Very low26.8Very low119 Ų119135.5 Ų135.572%0.72181%0.809SS**  trans-66.7106.1159.6179.30000105.1Y159V157-Y159 HydrophobicContact CG1-CD2 3.51Å; V157-Y159 HydrophobicContact CG1-CE2 3.56Å; V157-Y159 HydrophobicContact CG1-CG 4.49Å; V157-Y159 PolarHBondContact O-N 3.06Å; V157-Y159 VanDerWaalsContact O-N 3.12Å
158C24.1Very low27.1Very low113 Ų113135 Ų13576%0.76481%0.814SS**  trans-74.594.5166.2-70.10000107.5A156 L160A156-C158 PolarHBondContact O-N 3.28Å; A156-C158 VanDerWaalsContact O-N 3.17Å; C158-L160 PolarHBondContact O-N 3.05Å
159Y24.7Very low27.4Very low207 Ų207131.8 Ų131.881%0.81281%0.809SS**  trans-76.6104151.9-85.5-84.2000106.6V157V157-Y159 HydrophobicContact CG1-CD2 3.51Å; V157-Y159 HydrophobicContact CG1-CE2 3.56Å; V157-Y159 HydrophobicContact CG1-CG 4.49Å; V157-Y159 PolarHBondContact O-N 3.06Å; V157-Y159 VanDerWaalsContact O-N 3.12Å
160L28.3Very low28.2Very low154 Ų154132.8 Ų132.881%0.80681%0.813SS**  trans-85121.6158.3-76.6169.7000107C158 C162C158-L160 PolarHBondContact O-N 3.05Å; L160-C162 PolarHBondContact O-N 3.42Å
161N27.9Very low28.1Very low162 Ų162131.9 Ų131.987%0.86681%0.812SS**  trans-58.7110.8165.6-78.9-22.4000108.5
162C26.8Very low28.2Very low128 Ų128127.8 Ų127.887%0.86581%0.807SS**  trans-84.3115.2158.2-74.40000107.6L160L160-C162 PolarHBondContact O-N 3.42Å
163G26.9Very low28.1Very low72 Ų72126.1 Ų126.174%0.74280%0.803SS**  trans-72.9152.216400000110.7
164E32.1Very low28Very low192 Ų192128.4 Ų128.490%0.89781%0.806SS**  trans-49.7131.6-172-63.5158.2168.400115.6
165S28.2Very low27.9Very low130 Ų130125.9 Ų125.991%0.90980%0.797SS**  169.9154.7128.543.30000112.4
166A26.4Very low27.8Very low102 Ų102130.1 Ų130.184%0.84380%0.798SS**  trans-79.2160.2-155.800000117.7
167C26.2Very low27.7Very low125 Ų125134.2 Ų134.285%0.84580%0.803SS**  trans-67.4169174.7-52.80000114.2
168P33.1Very low28.3Very low123 Ų123133 Ų13380%0.79980%0.797SS**  -145.8178.680.428.6-4.1000116.7
169P37.1Very low28.2Very low118 Ų118134.9 Ų134.977%0.76680%0.797SS**  trans-113.3-152.3-159.344.8-33000113.6
170P45.6Very low28.2Very low118 Ų118128.6 Ų128.677%0.76679%0.788SS**  cis-126.4176.9-39.829.5-9.3000113.2
171A24.9Very low28Very low92 Ų92125.2 Ų125.276%0.7678%0.776SS**  trans-177.4121.5138.900000115.6
172S26.4Very low27.9Very low101 Ų101127 Ų12771%0.70677%0.772SS**  trans52.7108.8142.759.30000121.7
173I23.9Very low27.7Very low146 Ų146129.6 Ų129.675%0.74977%0.769SS**  88.1119.781-70.8156.1000112.8
174V24.2Very low27.7Very low143 Ų143133.5 Ų133.587%0.86777%0.772SS**  -154.9132.9120.3158.40000109.4
175N23.7Very low27.4Very low134 Ų134131.6 Ų131.672%0.71777%0.768SS**  trans-68.2149.7-176.2-67.9-63.2000115.1
176I22.5Very low27.3Very low169 Ų169131.7 Ų131.787%0.86776%0.764SS**  -148.3117.1126.7-52.4-176.8000110.1
177H21.5Very low27.6Very low171 Ų171132.1 Ų132.179%0.79276%0.758SS**  trans-161.5168.6149.1-126.1-88.2000105.6
178P39Very low27.6Very low92 Ų92133.8 Ų133.860%0.59776%0.757SS**  cis-143168.310.631.2-5.1000115.8
179M23.8Very low27.2Very low154 Ų154136.2 Ų136.276%0.75976%0.758SS**  159.215096-92.5-61.716000106.3
180A23.5Very low26.7Very low75 Ų75138.6 Ų138.662%0.6276%0.759SS**  cis-154.1130.415.100000106.6
181S25.5Very low25.8Very low82 Ų82136.8 Ų136.857%0.57375%0.754SS**  56.6115.466.371.50000114.5
182Y24.7Very low25.9Very low199 Ų199143.7 Ų143.778%0.7876%0.76SS**  trans175.6120.8145.6-81-53000106.4
183F23.1Very low26Very low183 Ų183147.7 Ų147.780%0.80377%0.768SS**  cis-150.9144.25.7-97.1-86.1000107.8
184L25.6Very low26.5Very low154 Ų154152.4 Ų152.481%0.80678%0.776SS**  trans-110.3160.5153.8-84.6169.9000108.3
185N26Very low27.1Very low152 Ų152150.1 Ų150.181%0.81377%0.772SS**  trans126.7119.6158.1-62.1-21.5000110.1
186T26.2Very low27.3Very low133 Ų133153.2 Ų153.282%0.81678%0.779SS**  -164.8163.351.730.50000111.9
187P32.5Very low27.7Very low110 Ų110153 Ų15371%0.71478%0.779SS**  trans-104.4163.4173.938.7-29.5000114.3
188L26Very low27.9Very low160 Ų160150 Ų15084%0.83878%0.784SS**  trans79.9112.2172.8-75.5103.6000118.6
189Q25.8Very low27.5Very low174 Ų174154.7 Ų154.781%0.81380%0.798SS**  176.7136.699.7-91.7-169.6-2.300112.4
190H26.9Very low27.7Very low169 Ų169155.9 Ų155.978%0.78280%0.799SS**  trans58.1107.2151.4-87.4-107.6000122.3
191A26.6Very low28Very low79 Ų79160.6 Ų160.665%0.65381%0.814SS**  57.1130117.200000121.2
192R27.4Very low28.1Very low238 Ų238165.3 Ų165.390%0.89882%0.824SS**  trans91.5122.8173.9-57.3172.8174.1166.8-1.9111.3
193Q28.5Very low28.3Very low185 Ų185162 Ų16286%0.86482%0.824SS**  cis-144.5145.732.2-103.2131.1-33.900111.6
194R34Very low28.5Very low245 Ų245158.6 Ų158.693%0.92582%0.823SS**  trans-63.8151.3158.9-74.1176.4178.1160-0.9109.5
195A36.9Very low28.8Very low94 Ų94158.5 Ų158.578%0.77782%0.818SS**  trans81.584.1172.800000116.2
196F27.4Very low28.9Very low199 Ų199157.6 Ų157.687%0.87382%0.822SS**SBendtrans-167.6134.3131.4-124.6-100.4000109.6
197L30.2Very low29.3Very low164 Ų164155.4 Ų155.486%0.85981%0.809SS**  trans69.589171-69.6133.3000119.3
198A26.3Very low29.1Very low110 Ų110156.9 Ų156.991%0.90981%0.811SS**  trans-135.870.2152.500000110.6
199E30.1Very low29.4Very low189 Ų189160.2 Ų160.288%0.88381%0.812SS**  trans-139.377.1166.9-158.2169.5-163.300110.2
200K29.5Very low29.6Very low179 Ų179160.6 Ų160.678%0.77881%0.807SS**  trans-145.777.6165.2-86.4-172.3179.5167.10109.6
201N28.2Very low29.8Very low175 Ų175157.8 Ų157.894%0.93680%0.804SS**  trans-108.7108.6148.8-92.7-33.6000108.5V203N201-V203 PolarHBondContact O-N 3.06Å
202K28.6Very low30.1Very low181 Ų181160 Ų16079%0.78782%0.815SS**  trans-72.9119.9-158.2-67.6167179.5171.80111S204K202-S204 PolarHBondContact O-N 3.25Å
203V29.6Very low30.6Very low128 Ų128152.2 Ų152.278%0.77681%0.809SS**  trans-49.6117.7150.9175.10000108N201 H205N201-V203 PolarHBondContact O-N 3.06Å; V203-H205 PolarHBondContact O-N 3.43Å; V203-H205 VanDerWaalsContact O-N 3.11Å
204S27.2Very low30.8Very low112 Ų112149.3 Ų149.378%0.78380%0.803SS**  trans-62.7113.4174.657.90000109.5K202 C206K202-S204 PolarHBondContact O-N 3.25Å; S204-C206 PolarHBondContact O-N 3.14Å
205H30Very low30.8Very low153 Ų153141.8 Ų141.871%0.70879%0.794SS**  trans-50.9124.1-179.6-101-90.7000112.6V203 T207V203-H205 PolarHBondContact O-N 3.43Å; V203-H205 VanDerWaalsContact O-N 3.11Å; H205-T207 PolarHBondContact ND1-OG1 3.38Å; H205-T207 PolarHBondContact O-N 2.87Å
206C29.3Very low30.3Very low133 Ų133142.8 Ų142.890%0.89978%0.78SS**  trans-90.465.6157.7-156.20000108.2S204S204-C206 PolarHBondContact O-N 3.14Å
207T34.3Very low30.9Very low87 Ų87142 Ų14253%0.53478%0.777SS.*  trans-141.267.6172.556.10000108.6H205H205-T207 PolarHBondContact ND1-OG1 3.38Å; H205-T207 PolarHBondContact O-N 2.87Å
208D29Very low31.3Very low140 Ų140141.1 Ų141.175%0.74977%0.773SS**SBendtrans-122.7113.7162.8-86.6-32.4000109.6
209R31.7Very low32.1Very low231 Ų231138.5 Ų138.587%0.87274%0.743SS**SBendtrans76.763.6173.2-65.7-176-104-162.5-11.1117.6
210Y29.9Very low32.7Very low181 Ų181131.9 Ų131.971%0.7172%0.718SS**  trans-111121.1143-71.6-85.7000107.2S212Y210-S212 PolarHBondContact O-N 3.11Å
211P31.2Very low33.5Very low110 Ų110131.7 Ų131.771%0.71472%0.72SS**  trans-54.1119.8166-18.930.5000107.3G213P211-G213 PolarHBondContact O-N 3.19Å
212S33.4Very low34.1Very low126 Ų126128.2 Ų128.288%0.88171%0.705SS**SBendtrans-45.6121171.547.80000109.5Y210Y210-S212 PolarHBondContact O-N 3.11Å
213G37.1Very low34.8Very low74 Ų74124.9 Ų124.976%0.76369%0.692SS**  trans147.25.6163.700000119.7P211P211-G213 PolarHBondContact O-N 3.19Å
214V33Very low35.4Very low125 Ų125122.8 Ų122.876%0.75868%0.676SS**  trans-138105.4167-162.60000110.3F216V214-F216 PolarHBondContact O-N 3.14Å
215A33Very low36.2Very low87 Ų87123.8 Ų123.872%0.71967%0.668SS**  trans-64.4122.1177.100000110.2K217A215-K217 PolarHBondContact O-N 3.49Å
216F28.1Very low36.9Very low114 Ų114121.6 Ų121.650%0.566%0.658SS.*  trans-66.592.3154.6-73.9-83.6000106.9V214 D218 I306V214-F216 PolarHBondContact O-N 3.14Å; F216-D218 PolarHBondContact O-N 3.01Å; F216-I306 HydrophobicContact CZ-CG1 4.5Å
217K39.7Very low37.5Very low182 Ų182117.5 Ų117.579%0.79162%0.624SS**THydrogen-bonded Turntrans-62.4132.2155-83.6-178.3174.1-1800106.4A215A215-K217 PolarHBondContact O-N 3.49Å
218D39Very low37.8Very low147 Ų147118.7 Ų118.779%0.78663%0.625SS**THydrogen-bonded Turntrans99.615.9166.3-43.9-26.2000119.2F216F216-D218 PolarHBondContact O-N 3.01Å
219I42.6Very low38.6Very low54 Ų54119.3 Ų119.328%0.27762%0.621SS.*  trans-130.799.7149.2-54.8172.8000107.4Q221 Q223 K305I219-Q221 PolarHBondContact O-N 2.83Å; I219-Q223 HydrophobicContact CG2-CB 3.99Å; I219-K305 HydrophobicContact CD1-CD 3.9Å
220S43.2Very low39Very low51 Ų51112.5 Ų112.536%0.35760%0.599SS.*  trans-57.7142.2175.563.80000109.2T222 Q223 L224S220-T222 VanDerWaalsContact CB-OG1 3.24Å; S220-T222 WeakPolarHBondContact CB-OG1 3.48Å; S220-T222 PolarHBondContact O-N 3.31Å; S220-T222 PolarHBondContact OG-OG1 2.7Å; S220-Q223 WeakPolarHBondContact O-CA 3.29Å; S220-Q223 WeakPolarHBondContact O-CB 3.49Å; S220-Q223 PolarHBondContact O-N 3.18Å; S220-Q223 WeakPolarHBondContact OG-CG 3.47Å; S220-Q223 PolarHBondContact OG-N 2.96Å; S220-L224 PolarHBondContact O-N 2.83Å
221Q45.2Very low39.5Very low174 Ų174105.1 Ų105.181%0.81357%0.574SS**Hα-helixtrans-52.6-26.6175-164.4168.61.100111.6I219 H225I219-Q221 PolarHBondContact O-N 2.83Å; Q221-H225 WeakPolarHBondContact O-CB 3.47Å; Q221-H225 PolarHBondContact O-N 2.8Å
222T42Very low40.1Very low103 Ų103102.6 Ų102.663%0.63256%0.563SS**Hα-helixtrans-68.1-38.7171.350.90000114S220 H225 H226S220-T222 VanDerWaalsContact CB-OG1 3.24Å; S220-T222 WeakPolarHBondContact CB-OG1 3.48Å; S220-T222 PolarHBondContact O-N 3.31Å; S220-T222 PolarHBondContact OG-OG1 2.7Å; T222-H225 PolarHBondContact O-N 3.39Å; T222-H226 VanDerWaalsContact O-CB 3.26Å; T222-H226 WeakPolarHBondContact O-CB 3.44Å; T222-H226 PolarHBondContact O-N 2.9Å
223Q41.6Very low40.4Very low110 Ų110101.5 Ų101.551%0.51454%0.544SS..Hα-helixtrans-69.2-36.4173.9-79.6174.2-1400112.2I219 S220 H225 Y227I219-Q223 HydrophobicContact CG2-CB 3.99Å; S220-Q223 WeakPolarHBondContact O-CA 3.29Å; S220-Q223 WeakPolarHBondContact O-CB 3.49Å; S220-Q223 PolarHBondContact O-N 3.18Å; S220-Q223 WeakPolarHBondContact OG-CG 3.47Å; S220-Q223 PolarHBondContact OG-N 2.96Å; Q223-H225 VanDerWaalsContact C-N 3.33Å; Q223-Y227 WeakPolarHBondContact O-CB 3.18Å; Q223-Y227 PolarHBondContact O-N 3.26Å
224L43.8Very low40.6Very low84 Ų84101.8 Ų101.844%0.4453%0.527SS..Hα-helixtrans-65.5-40.5174.2-163.977.1000110.9S220 Y227 M228S220-L224 PolarHBondContact O-N 2.83Å; L224-Y227 PolarHBondContact O-N 3.38Å; L224-M228 VanDerWaalsContact O-CG 3.31Å; L224-M228 WeakPolarHBondContact O-CG 3.43Å; L224-M228 PolarHBondContact O-N 3.5Å
225H44Very low41.1Very low133 Ų13398.9 Ų98.962%0.61651%0.506SS*.Hα-helixtrans-69.4-43.9177-164.8-173.7000112.2Q221 T222 Q223 Y227 M228 K229Q221-H225 WeakPolarHBondContact O-CB 3.47Å; Q221-H225 PolarHBondContact O-N 2.8Å; T222-H225 PolarHBondContact O-N 3.39Å; Q223-H225 VanDerWaalsContact C-N 3.33Å; H225-Y227 VanDerWaalsContact C-N 3.27Å; H225-Y227 PolarHBondContact O-N 2.8Å; H225-M228 PolarHBondContact O-N 3.34Å; H225-K229 WeakPolarHBondContact O-CB 3.48Å; H225-K229 PolarHBondContact O-N 3.09Å
226H43.4Very low41.7Very low108 Ų10896.9 Ų96.950%0.549%0.487SS..Hα-helixtrans-55.6-44.5173-174.4-90.4000111.1T222 K229 E230T222-H226 VanDerWaalsContact O-CB 3.26Å; T222-H226 WeakPolarHBondContact O-CB 3.44Å; T222-H226 PolarHBondContact O-N 2.9Å; H226-K229 CarbonylContact O-C 3.58Å; H226-K229 WeakPolarHBondContact O-CB 3.41Å; H226-K229 PolarHBondContact O-N 3.46Å; H226-E230 IonicContact CE1-OE1 2.9Å; H226-E230 PolarHBondContact CE1-OE1 2.94Å; H226-E230 IonicContact CE1-OE2 3.23Å; H226-E230 PolarHBondContact CE1-OE2 3.22Å; H226-E230 IonicContact ND1-OE1 3.7Å; H226-E230 IonicContact ND1-OE2 2.7Å; H226-E230 PolarHBondContact ND1-OE2 3.24Å; H226-E230 WeakPolarHBondContact O-CB 3.49Å; H226-E230 WeakPolarHBondContact O-CG 3.4Å; H226-E230 PolarHBondContact O-N 2.83Å
227Y42.9Very low42.3Very low47 Ų4796.7 Ų96.718%0.18449%0.491CS..Hα-helixtrans-69.4-35.6179.7-175.1-114.7000114Q223 L224 H225 K229 S231 F286 A298 L301Q223-Y227 WeakPolarHBondContact O-CB 3.18Å; Q223-Y227 PolarHBondContact O-N 3.26Å; L224-Y227 PolarHBondContact O-N 3.38Å; H225-Y227 VanDerWaalsContact C-N 3.27Å; H225-Y227 PolarHBondContact O-N 2.8Å; Y227-K229 VanDerWaalsContact C-N 3.35Å; Y227-S231 VanDerWaalsContact O-CB 3.28Å; Y227-S231 WeakPolarHBondContact O-CB 3.43Å; Y227-S231 PolarHBondContact O-N 3.22Å; Y227-S231 PolarHBondContact O-OG 3.36Å; Y227-F286 HydrophobicContact CD1-CD1 4.47Å; Y227-F286 HydrophobicContact CD1-CE1 4.12Å; Y227-F286 HydrophobicContact CD2-CD1 4.27Å; Y227-F286 HydrophobicContact CD2-CE1 4.26Å; Y227-F286 AromaticContact CE1-CD1 3.57Å; Y227-F286 HydrophobicContact CE1-CD1 3.57Å; Y227-F286 AromaticContact CE1-CE1 3.56Å; Y227-F286 HydrophobicContact CE1-CE1 3.56Å; Y227-F286 HydrophobicContact CE1-CG 4.25Å; Y227-F286 HydrophobicContact CE1-CZ 4.39Å; Y227-F286 AromaticContact CE2-CD1 3.28Å; Y227-F286 HydrophobicContact CE2-CD1 3.28Å; Y227-F286 AromaticContact CE2-CE1 3.68Å; Y227-F286 HydrophobicContact CE2-CE1 3.68Å; Y227-F286 HydrophobicContact CE2-CG 4.33Å; Y227-F286 HydrophobicContact CG-CE1 4.48Å; Y227-F286 AromaticContact CZ-CD1 2.89Å; Y227-F286 AromaticContact CZ-CE1 3.34Å; Y227-F286 AromaticContact CZ-CG 3.64Å; Y227-F286 WeakPolarHBondContact OH-CA 3.42Å; Y227-F286 WeakPolarHBondContact OH-CB 3.38Å; Y227-F286 WeakPolarHBondContact OH-CD1 3.45Å; Y227-F286 WeakPolarHBondContact OH-CG 3.3Å; Y227-A298 HydrophobicContact CD1-CB 3.72Å; Y227-A298 HydrophobicContact CE1-CB 3.21Å; Y227-L301 WeakPolarHBondContact OH-CD2 3.09Å
228M40.6Very low42.7Very low112 Ų11296.2 Ų96.255%0.55249%0.489SS*.Hα-helixtrans-66.3-38.7170.8-68.5-140.2-73.900111.1L224 H225 S231 A232L224-M228 VanDerWaalsContact O-CG 3.31Å; L224-M228 WeakPolarHBondContact O-CG 3.43Å; L224-M228 PolarHBondContact O-N 3.5Å; H225-M228 PolarHBondContact O-N 3.34Å; M228-S231 WeakPolarHBondContact CA-OG 3.32Å; M228-S231 PolarHBondContact O-N 2.95Å; M228-S231 PolarHBondContact O-OG 3.22Å; M228-A232 PolarHBondContact O-N 3.42Å; M228-A232 VanDerWaalsContact O-N 3.1Å
229K45.7Very low42.9Very low152 Ų15292.9 Ų92.966%0.66147%0.471SS*.Hα-helixtrans-66.9-45.7175.4-167.5177.6-179.9-178.40112.5H225 H226 Y227 S231 A232 Q233H225-K229 WeakPolarHBondContact O-CB 3.48Å; H225-K229 PolarHBondContact O-N 3.09Å; H226-K229 CarbonylContact O-C 3.58Å; H226-K229 WeakPolarHBondContact O-CB 3.41Å; H226-K229 PolarHBondContact O-N 3.46Å; Y227-K229 VanDerWaalsContact C-N 3.35Å; K229-S231 VanDerWaalsContact C-N 3.32Å; K229-S231 PolarHBondContact O-N 3.2Å; K229-A232 WeakPolarHBondContact O-CB 3.32Å; K229-A232 PolarHBondContact O-N 3.46Å; K229-Q233 PolarHBondContact O-N 3.15Å
230E39.4Very low43Very low88 Ų8896.6 Ų96.641%0.41149%0.485SS..Hα-helixtrans-62.9-37.6174.3-76.2-178.913100112H226 A232 Q233 I234H226-E230 IonicContact CE1-OE1 2.9Å; H226-E230 PolarHBondContact CE1-OE1 2.94Å; H226-E230 IonicContact CE1-OE2 3.23Å; H226-E230 PolarHBondContact CE1-OE2 3.22Å; H226-E230 IonicContact ND1-OE1 3.7Å; H226-E230 IonicContact ND1-OE2 2.7Å; H226-E230 PolarHBondContact ND1-OE2 3.24Å; H226-E230 WeakPolarHBondContact O-CB 3.49Å; H226-E230 WeakPolarHBondContact O-CG 3.4Å; H226-E230 PolarHBondContact O-N 2.83Å; E230-A232 VanDerWaalsContact C-N 3.34Å; E230-A232 PolarHBondContact O-N 3.16Å; E230-Q233 PolarHBondContact O-N 3.23Å; E230-I234 WeakPolarHBondContact O-CB 3.29Å; E230-I234 VanDerWaalsContact O-CG1 3.26Å; E230-I234 WeakPolarHBondContact O-CG1 3.34Å; E230-I234 PolarHBondContact O-N 3.29Å
231S40.5Very low42.8Very low26 Ų26104.4 Ų104.418%0.18251%0.513CS..Hα-helixtrans-66.1-37.317671.80000112.3Y227 M228 K229 Q233 I235Y227-S231 VanDerWaalsContact O-CB 3.28Å; Y227-S231 WeakPolarHBondContact O-CB 3.43Å; Y227-S231 PolarHBondContact O-N 3.22Å; Y227-S231 PolarHBondContact O-OG 3.36Å; M228-S231 WeakPolarHBondContact CA-OG 3.32Å; M228-S231 PolarHBondContact O-N 2.95Å; M228-S231 PolarHBondContact O-OG 3.22Å; K229-S231 VanDerWaalsContact C-N 3.32Å; K229-S231 PolarHBondContact O-N 3.2Å; S231-Q233 VanDerWaalsContact C-N 3.34Å; S231-I235 VanDerWaalsContact O-CB 3.28Å; S231-I235 WeakPolarHBondContact O-CB 3.36Å; S231-I235 WeakPolarHBondContact O-CD1 3.46Å; S231-I235 WeakPolarHBondContact O-CG1 3.37Å; S231-I235 PolarHBondContact O-N 3.38Å; S231-I235 VanDerWaalsContact O-N 3.12Å
232A44.5Very low42.5Very low58 Ų5899.2 Ų99.248%0.47951%0.506SS..Hα-helixtrans-66.3-35.9173.400000112.1M228 K229 E230 I235 S236M228-A232 PolarHBondContact O-N 3.42Å; M228-A232 VanDerWaalsContact O-N 3.1Å; K229-A232 WeakPolarHBondContact O-CB 3.32Å; K229-A232 PolarHBondContact O-N 3.46Å; E230-A232 VanDerWaalsContact C-N 3.34Å; E230-A232 PolarHBondContact O-N 3.16Å; A232-I235 WeakPolarHBondContact O-CB 3.45Å; A232-I235 PolarHBondContact O-N 3.46Å; A232-S236 PolarHBondContact O-N 2.98Å; A232-S236 VanDerWaalsContact O-N 3.09Å
233Q40Very low42.2Very low103 Ų10398 Ų9848%0.48150%0.502SS..Hα-helixtrans-73.7-40.4177.6-161.565.943.100113K229 E230 S231 I235 S236 D237K229-Q233 PolarHBondContact O-N 3.15Å; E230-Q233 PolarHBondContact O-N 3.23Å; S231-Q233 VanDerWaalsContact C-N 3.34Å; Q233-I235 PolarHBondContact O-N 2.99Å; Q233-S236 WeakPolarHBondContact CA-OG 3.35Å; Q233-S236 PolarHBondContact NE2-OG 3.28Å; Q233-S236 PolarHBondContact O-N 3.32Å; Q233-S236 PolarHBondContact O-OG 3.42Å; Q233-D237 PolarHBondContact NE2-OD1 2.86Å; Q233-D237 PolarHBondContact NE2-OD2 2.9Å; Q233-D237 WeakPolarHBondContact O-CB 3.16Å; Q233-D237 PolarHBondContact O-N 2.84Å
234I40.8Very low42.2Very low79 Ų7998.3 Ų98.341%0.40552%0.516SS..Hα-helixtrans-66.4-31174.8-68165000110.8E230 K238E230-I234 WeakPolarHBondContact O-CB 3.29Å; E230-I234 VanDerWaalsContact O-CG1 3.26Å; E230-I234 WeakPolarHBondContact O-CG1 3.34Å; E230-I234 PolarHBondContact O-N 3.29Å; I234-K238 HydrophobicContact CG2-CD 4.49Å; I234-K238 PolarHBondContact O-N 2.91Å
235I42.8Very low42Very low64 Ų64103.3 Ų103.333%0.32853%0.534SS..Hα-helixtrans-67.4-41.6173.2-80.1165.2000111.4S231 A232 Q233 T274S231-I235 VanDerWaalsContact O-CB 3.28Å; S231-I235 WeakPolarHBondContact O-CB 3.36Å; S231-I235 WeakPolarHBondContact O-CD1 3.46Å; S231-I235 WeakPolarHBondContact O-CG1 3.37Å; S231-I235 PolarHBondContact O-N 3.38Å; S231-I235 VanDerWaalsContact O-N 3.12Å; A232-I235 WeakPolarHBondContact O-CB 3.45Å; A232-I235 PolarHBondContact O-N 3.46Å; Q233-I235 PolarHBondContact O-N 2.99Å; I235-T274 HydrophobicContact CB-CG2 4.04Å; I235-T274 HydrophobicContact CD1-CG2 3.51Å; I235-T274 HydrophobicContact CG1-CG2 3.62Å; I235-T274 HydrophobicContact CG2-CG2 3.25Å
236S45.4Very low41.8Very low46 Ų46104.6 Ų104.632%0.32255%0.545SS..Hα-helixtrans-69.8-38.5176.357.90000111.9A232 Q233 F240A232-S236 PolarHBondContact O-N 2.98Å; A232-S236 VanDerWaalsContact O-N 3.09Å; Q233-S236 WeakPolarHBondContact CA-OG 3.35Å; Q233-S236 PolarHBondContact NE2-OG 3.28Å; Q233-S236 PolarHBondContact O-N 3.32Å; Q233-S236 PolarHBondContact O-OG 3.42Å; S236-F240 WeakPolarHBondContact O-CB 3.36Å
237D41.3Very low41.6Very low110 Ų110106.7 Ų106.759%0.58856%0.56SS**Hα-helixtrans-91.3-16.4-165-60-6.2000113.6Q233Q233-D237 PolarHBondContact NE2-OD1 2.86Å; Q233-D237 PolarHBondContact NE2-OD2 2.9Å; Q233-D237 WeakPolarHBondContact O-CB 3.16Å; Q233-D237 PolarHBondContact O-N 2.84Å
238K47.5Very low41.9Very low172 Ų172109.8 Ų109.875%0.74859%0.589SS**Hα-helixtrans-118.7-5.1-177.9-66.2-173.9179.61790115.7I234I234-K238 HydrophobicContact CG2-CD 4.49Å; I234-K238 PolarHBondContact O-N 2.91Å
239L44.2Very low41.7Very low77 Ų77109.3 Ų109.340%0.40360%0.602SS.*Hα-helixtrans-121.6-9.3178-65.9171.7000114.1K241 M277L239-K241 PolarHBondContact O-N 3.48Å; L239-M277 HydrophobicContact CD1-CB 3.99Å; L239-M277 HydrophobicContact CD1-CG 4.36Å
240F45.3Very low41.6Very low131 Ų131108.5 Ų108.558%0.57561%0.614SS**  trans-97.668.9174.2-103.4-90.9000111.9S236S236-F240 WeakPolarHBondContact O-CB 3.36Å
241K37.6Very low42Very low216 Ų216108.6 Ų108.694%0.93963%0.63SS**SBendtrans-132.274.6153.7-76.4-170.6-179.8-177.30107.9L239L239-K241 PolarHBondContact O-N 3.48Å
242G39Very low42.6Very low65 Ų65112 Ų11267%0.6765%0.654SS**SBendtrans141.273.6174.200000113.8
243S36.8Very low43.1Very low78 Ų78113.7 Ų113.755%0.54568%0.677SS.*  trans-175.762.7148.343.50000110.1K245S243-K245 PolarHBondContact O-N 3.5Å; S243-K245 VanDerWaalsContact O-N 3.13Å
244S40Very low43.8Very low116 Ų116117.1 Ų117.181%0.81169%0.69SS**  trans-71.496.3157.449.90000108.4
245K40.3Very low44.7Very low188 Ų188118.6 Ų118.682%0.81771%0.705SS**  trans175.484.3147.6-95.7164.3-172.4-175.30108.9S243 N247S243-K245 PolarHBondContact O-N 3.5Å; S243-K245 VanDerWaalsContact O-N 3.13Å; K245-N247 PolarHBondContact O-N 3.44Å
246L40.2Very low46.2Very low161 Ų161122.6 Ų122.684%0.84372%0.72SS**  trans-83.398.5158.1-74.4172000106.8S248L246-S248 PolarHBondContact O-N 3.35Å
247N38.5Very low48.2Very low151 Ų151124.3 Ų124.381%0.80773%0.728SS**  trans-68122.1164.1-81.8-6000108.7K245K245-N247 PolarHBondContact O-N 3.44Å
248S48.7Very low50.3Low113 Ų113121.3 Ų121.379%0.7971%0.71SS**  trans-65.9134.5163.750.50000111L246L246-S248 PolarHBondContact O-N 3.35Å
249A37Very low52.2Low101 Ų101116.6 Ų116.684%0.83570%0.696SS**  173132.8129.300000109.6
250C44.9Very low54.3Low135 Ų135113 Ų11391%0.91268%0.677SS**  trans-85.2123.7167.1-175.10000108.1
251A47Very low56.3Low91 Ų91115.5 Ų115.575%0.75269%0.691SS**  trans164.789.315600000110.2
252S52.5Low58.7Low97 Ų97109.7 Ų109.768%0.67867%0.673SS**SBendtrans156.5133.9154.147.30000108.2K254S252-K254 PolarHBondContact O-N 3.1Å
253G55.7Low61.1Low93 Ų93109.2 Ų109.296%0.95966%0.658SS**  trans-66.238-17700000115.7
254K53.6Low63.5Low175 Ų175107.8 Ų107.876%0.76166%0.656SS**  trans-85.8125.1171.9-67.4-177.8-178.7175.90108.8S252 K256S252-K254 PolarHBondContact O-N 3.1Å; K254-K256 PolarHBondContact O-N 3.27Å
255P59.5Low65.8Low110 Ų110107.9 Ų107.971%0.71464%0.642SS**  trans-61.1123.7176.623.7-30.9000109V257P255-V257 PolarHBondContact O-N 2.95Å
256K76.1Confident68.2Low148 Ų148103.1 Ų103.164%0.64363%0.629SS**  trans-62.8107.7174.8-174.1173.4-177.6172.60108.6K254 F258K254-K256 PolarHBondContact O-N 3.27Å; K256-F258 HydrophobicContact CD-CZ 3.98Å; K256-F258 HydrophobicContact CG-CE2 4.15Å; K256-F258 HydrophobicContact CG-CZ 3.98Å
257V86.1Confident70.4Confident82 Ų8297.4 Ų97.450%0.49760%0.597SS.*  trans-101.3150.6178.2-67.90000110.9P255 V266 F267P255-V257 PolarHBondContact O-N 2.95Å; V257-V266 HydrophobicContact CB-CG1 3.53Å; V257-V266 HydrophobicContact CG1-CG1 3.91Å; V257-V266 HydrophobicContact CG2-CG1 4Å; V257-F267 CarbonylContact C-O 3.55Å; V257-F267 WeakPolarHBondContact CA-O 3.45Å
258F86.8Confident72.7Confident47 Ų4796.1 Ų96.121%0.20659%0.59CS.*EExtended strand (participates in β ladder)trans-121.6117.6-177.7-60.8-91.5000108.5K256 V266 F267 H270 L273K256-F258 HydrophobicContact CD-CZ 3.98Å; K256-F258 HydrophobicContact CG-CE2 4.15Å; K256-F258 HydrophobicContact CG-CZ 3.98Å; F258-V266 CarbonylContact O-C 3.28Å; F258-F267 HydrophobicContact CB-CB 4.45Å; F258-F267 PolarHBondContact N-O 3.14Å; F258-F267 PolarHBondContact O-N 2.91Å; F258-H270 HydrophobicContact CD1-CB 3.97Å; F258-H270 AromaticContact CD1-CD2 3.89Å; F258-H270 HydrophobicContact CD2-CB 4.44Å; F258-H270 VanDerWaalsContact CD2-N 3.26Å; F258-H270 HydrophobicContact CE1-CB 3.67Å; F258-H270 AromaticContact CE1-CD2 3.96Å; F258-H270 HydrophobicContact CE2-CB 4.18Å; F258-H270 VanDerWaalsContact CE2-N 3.27Å; F258-H270 HydrophobicContact CG-CB 4.33Å; F258-H270 HydrophobicContact CZ-CB 3.78Å; F258-L273 HydrophobicContact CB-CB 4.19Å; F258-L273 HydrophobicContact CB-CD2 3.91Å
259T86.7Confident74.4Confident73 Ų7391.6 Ų91.645%0.44856%0.56SS.*EExtended strand (participates in β ladder)trans-101.5135.9-176.1-54.30000110.4E261 K265 V266T259-E261 PolarHBondContact O-N 2.83Å; T259-K265 CarbonylContact C-O 3.55Å; T259-K265 WeakPolarHBondContact CA-O 3.48Å; T259-V266 HydrophobicContact CG2-CG2 4.25Å
260C89Confident76.4Confident1 Ų191.1 Ų91.11%0.00754%0.54CS..  trans-75.9119.4170.9178.50000109.8V262 C263 G264 K265 F267 L273 H276 H280C260-V262 PolarHBondContact O-N 3.02Å; C260-C263 VanDerWaalsContact SG-SG 3.67Å; C260-G264 WeakPolarHBondContact O-CA 3.41Å; C260-G264 PolarHBondContact O-N 3.41Å; C260-K265 HydrophobicContact CB-CB 4.4Å; C260-K265 PolarHBondContact N-O 2.8Å; C260-F267 HydrophobicContact CB-CE2 4.07Å; C260-L273 HydrophobicContact CB-CD1 3.6Å; C260-H276 PolarHBondContact SG-NE2 3.38Å; C260-H280 PolarHBondContact SG-NE2 3.16Å; C260-H280 VanDerWaalsContact SG-NE2 3.38Å
261E86.8Confident78Confident185 Ų18591.8 Ų91.886%0.86452%0.524SS*.THydrogen-bonded Turntrans-65.2-26.4-179.6-63.6176.3178.100112.9T259T259-E261 PolarHBondContact O-N 2.83Å
262V88Confident79.7Confident94 Ų9488.3 Ų88.357%0.5749%0.493SS*.THydrogen-bonded Turntrans-82-32.6-176.2-173.20000112.9C260 H280C260-V262 PolarHBondContact O-N 3.02Å; V262-H280 HydrophobicContact CG1-CB 4.16Å; V262-H280 VanDerWaalsContact CG1-ND1 3.33Å; V262-H280 WeakPolarHBondContact CG1-ND1 3.31Å; V262-H280 HydrophobicContact CG2-CB 4.47Å
263C88.9Confident81Confident54 Ų5484.9 Ų84.937%0.36547%0.467SS..THydrogen-bonded Turntrans-132.88.7-177.3680000115.5C260 K265 H276 H280C260-C263 VanDerWaalsContact SG-SG 3.67Å; C263-K265 PolarHBondContact O-N 2.82Å; C263-H276 PolarHBondContact SG-NE2 3.47Å; C263-H280 PolarHBondContact SG-NE2 3.15Å
264G87.9Confident82.2Confident48 Ų4881.2 Ų81.250%0.49543%0.426SS..  trans66.36.4178.500000115C260 V266C260-G264 WeakPolarHBondContact O-CA 3.41Å; C260-G264 PolarHBondContact O-N 3.41Å; G264-V266 PolarHBondContact O-N 3.34Å
265K88.6Confident83.5Confident118 Ų11878.5 Ų78.551%0.51341%0.411SS..  trans-69.4130.2-178.6-76.9-178.6-176.8175.80111.3T259 C260 C263 F267T259-K265 CarbonylContact C-O 3.55Å; T259-K265 WeakPolarHBondContact CA-O 3.48Å; C260-K265 HydrophobicContact CB-CB 4.4Å; C260-K265 PolarHBondContact N-O 2.8Å; C263-K265 PolarHBondContact O-N 2.82Å; K265-F267 HydrophobicContact CB-CE2 3.78Å; K265-F267 HydrophobicContact CB-CZ 3.93Å; K265-F267 WeakPolarHBondContact O-CD2 3.3Å; K265-F267 WeakPolarHBondContact O-CE2 3.13Å
266V89.8Confident84.7Confident89 Ų8974.2 Ų74.254%0.53938%0.381SS..EExtended strand (participates in β ladder)trans-95.2133.4-179.9-172.30000110.4V257 F258 T259 G264V257-V266 HydrophobicContact CB-CG1 3.53Å; V257-V266 HydrophobicContact CG1-CG1 3.91Å; V257-V266 HydrophobicContact CG2-CG1 4Å; F258-V266 CarbonylContact O-C 3.28Å; T259-V266 HydrophobicContact CG2-CG2 4.25Å; G264-V266 PolarHBondContact O-N 3.34Å
267F86.9Confident84.9Confident41 Ų4169.3 Ų69.318%0.1836%0.361CS..EExtended strand (participates in β ladder)trans-121144178.9-60.6-84.1000110V257 F258 C260 K265 A269 N272 L273 H276V257-F267 CarbonylContact C-O 3.55Å; V257-F267 WeakPolarHBondContact CA-O 3.45Å; F258-F267 HydrophobicContact CB-CB 4.45Å; F258-F267 PolarHBondContact N-O 3.14Å; F258-F267 PolarHBondContact O-N 2.91Å; C260-F267 HydrophobicContact CB-CE2 4.07Å; K265-F267 HydrophobicContact CB-CE2 3.78Å; K265-F267 HydrophobicContact CB-CZ 3.93Å; K265-F267 WeakPolarHBondContact O-CD2 3.3Å; K265-F267 WeakPolarHBondContact O-CE2 3.13Å; F267-A269 PolarHBondContact O-N 3.19Å; F267-N272 HydrophobicContact CB-CB 4.08Å; F267-N272 HydrophobicContact CD1-CB 3.82Å; F267-N272 HydrophobicContact CG-CB 4.24Å; F267-L273 HydrophobicContact CB-CB 4.34Å; F267-L273 HydrophobicContact CD2-CB 3.83Å; F267-L273 HydrophobicContact CD2-CD1 3.76Å; F267-L273 HydrophobicContact CD2-CG 4.39Å; F267-L273 HydrophobicContact CE2-CD1 3.81Å; F267-L273 HydrophobicContact CG-CB 4.2Å; F267-H276 HydrophobicContact CE1-CB 3.98Å; F267-H276 HydrophobicContact CE2-CB 4.06Å; F267-H276 AromaticContact CE2-CD2 3.54Å; F267-H276 AromaticContact CE2-CG 3.82Å; F267-H276 HydrophobicContact CZ-CB 3.49Å; F267-H276 VanDerWaalsContact CZ-CB 3.49Å; F267-H276 AromaticContact CZ-CD2 3.47Å; F267-H276 VanDerWaalsContact CZ-CD2 3.47Å; F267-H276 WeakPolarHBondContact CZ-CD2 3.05Å; F267-H276 AromaticContact CZ-CG 3.29Å; F267-H276 AromaticContact CZ-ND1 3.79Å
268N87.1Confident84.9Confident123 Ų12366.2 Ų66.266%0.65834%0.343SS*.SBendtrans-80.9-2.6177.964.2-9.5000113.8N272N268-N272 PolarHBondContact OD1-ND2 3.33Å
269A83.1Confident84.8Confident19 Ų1967 Ų6716%0.15735%0.352CS..SBendtrans-154.9145.6-179.600000111.5F267 Y271 N272 L273F267-A269 PolarHBondContact O-N 3.19Å; A269-Y271 VanDerWaalsContact C-N 3.35Å; A269-Y271 HydrophobicContact CB-CD1 3.45Å; A269-Y271 VanDerWaalsContact CB-CD1 3.45Å; A269-Y271 HydrophobicContact CB-CE1 3.23Å; A269-Y271 PolarHBondContact O-N 3.33Å; A269-N272 WeakPolarHBondContact O-CB 3.43Å; A269-N272 PolarHBondContact O-N 3.3Å; A269-N272 VanDerWaalsContact O-N 3.12Å; A269-L273 PolarHBondContact O-N 3.2Å
270H79.8Confident84.7Confident90 Ų9066.8 Ų66.842%0.41735%0.345SS..Hα-helixtrans-58.4-44.8-179.3-175.4-100.4000112.1F258 N272 L273 T274F258-H270 HydrophobicContact CD1-CB 3.97Å; F258-H270 AromaticContact CD1-CD2 3.89Å; F258-H270 HydrophobicContact CD2-CB 4.44Å; F258-H270 VanDerWaalsContact CD2-N 3.26Å; F258-H270 HydrophobicContact CE1-CB 3.67Å; F258-H270 AromaticContact CE1-CD2 3.96Å; F258-H270 HydrophobicContact CE2-CB 4.18Å; F258-H270 VanDerWaalsContact CE2-N 3.27Å; F258-H270 HydrophobicContact CG-CB 4.33Å; F258-H270 HydrophobicContact CZ-CB 3.78Å; H270-N272 PolarHBondContact O-N 3.37Å; H270-N272 VanDerWaalsContact O-N 3.12Å; H270-L273 WeakPolarHBondContact O-CB 3.26Å; H270-L273 PolarHBondContact O-N 3.02Å; H270-T274 PolarHBondContact CE1-OG1 3.05Å; H270-T274 PolarHBondContact ND1-OG1 3.01Å; H270-T274 PolarHBondContact O-N 3.12Å; H270-T274 PolarHBondContact O-OG1 3.46Å
271Y78.9Confident84.3Confident149 Ų14970.9 Ų70.958%0.58437%0.37SS*.Hα-helixtrans-59.5-29179.779.2-90.9000113.1A269 R275A269-Y271 VanDerWaalsContact C-N 3.35Å; A269-Y271 HydrophobicContact CB-CD1 3.45Å; A269-Y271 VanDerWaalsContact CB-CD1 3.45Å; A269-Y271 HydrophobicContact CB-CE1 3.23Å; A269-Y271 PolarHBondContact O-N 3.33Å; Y271-R275 VanDerWaalsContact O-CB 3.29Å; Y271-R275 WeakPolarHBondContact O-CB 3.4Å; Y271-R275 PolarHBondContact O-N 3.31Å
272N81.2Confident84.1Confident19 Ų1964 Ų6410%0.10235%0.349CS..Hα-helixtrans-71.9-42.1175.9-76.6-40.8000111.5F267 N268 A269 H270 R275 H276F267-N272 HydrophobicContact CB-CB 4.08Å; F267-N272 HydrophobicContact CD1-CB 3.82Å; F267-N272 HydrophobicContact CG-CB 4.24Å; N268-N272 PolarHBondContact OD1-ND2 3.33Å; A269-N272 WeakPolarHBondContact O-CB 3.43Å; A269-N272 PolarHBondContact O-N 3.3Å; A269-N272 VanDerWaalsContact O-N 3.12Å; H270-N272 PolarHBondContact O-N 3.37Å; H270-N272 VanDerWaalsContact O-N 3.12Å; N272-R275 PolarHBondContact O-N 3.48Å; N272-R275 PolarHBondContact OD1-NH2 2.99Å; N272-H276 WeakPolarHBondContact O-CB 3.37Å; N272-H276 PolarHBondContact O-N 3.47Å
273L80.9Confident83.8Confident25 Ų2561.6 Ų61.613%0.13134%0.339CS..Hα-helixtrans-61.3-47.2172.5173.460.8000110.4F258 C260 F267 A269 H270 R275 H276 M277F258-L273 HydrophobicContact CB-CB 4.19Å; F258-L273 HydrophobicContact CB-CD2 3.91Å; C260-L273 HydrophobicContact CB-CD1 3.6Å; F267-L273 HydrophobicContact CB-CB 4.34Å; F267-L273 HydrophobicContact CD2-CB 3.83Å; F267-L273 HydrophobicContact CD2-CD1 3.76Å; F267-L273 HydrophobicContact CD2-CG 4.39Å; F267-L273 HydrophobicContact CE2-CD1 3.81Å; F267-L273 HydrophobicContact CG-CB 4.2Å; A269-L273 PolarHBondContact O-N 3.2Å; H270-L273 WeakPolarHBondContact O-CB 3.26Å; H270-L273 PolarHBondContact O-N 3.02Å; L273-R275 PolarHBondContact O-N 3.27Å; L273-H276 CarbonylContact O-C 3.51Å; L273-H276 WeakPolarHBondContact O-CA 3.3Å; L273-H276 VanDerWaalsContact O-CB 3.25Å; L273-H276 WeakPolarHBondContact O-CB 3.33Å; L273-H276 PolarHBondContact O-N 3.38Å; L273-M277 HydrophobicContact CD1-SD 3.93Å; L273-M277 HydrophobicContact CG-SD 4.44Å; L273-M277 WeakPolarHBondContact O-CG 3.47Å; L273-M277 PolarHBondContact O-N 3.22Å
274T80.1Confident83.5Confident15 Ų1566.1 Ų66.19%0.09235%0.348CS..Hα-helixtrans-57.9-46.1177.5-520000112.5I235 H270 H276 M277 P278I235-T274 HydrophobicContact CB-CG2 4.04Å; I235-T274 HydrophobicContact CD1-CG2 3.51Å; I235-T274 HydrophobicContact CG1-CG2 3.62Å; I235-T274 HydrophobicContact CG2-CG2 3.25Å; H270-T274 PolarHBondContact CE1-OG1 3.05Å; H270-T274 PolarHBondContact ND1-OG1 3.01Å; H270-T274 PolarHBondContact O-N 3.12Å; H270-T274 PolarHBondContact O-OG1 3.46Å; T274-H276 PolarHBondContact O-N 2.76Å; T274-M277 PolarHBondContact O-N 3.37Å; T274-P278 VanDerWaalsContact O-CD 3.28Å; T274-P278 WeakPolarHBondContact O-CD 3.38Å
275R81.1Confident83.2Confident119 Ų11966.5 Ų66.545%0.44934%0.342SS..Hα-helixtrans-65.8-20.9175.7-176.8173.463.9177.9-2.4112.9Y271 N272 L273 Q297Y271-R275 VanDerWaalsContact O-CB 3.29Å; Y271-R275 WeakPolarHBondContact O-CB 3.4Å; Y271-R275 PolarHBondContact O-N 3.31Å; N272-R275 PolarHBondContact O-N 3.48Å; N272-R275 PolarHBondContact OD1-NH2 2.99Å; L273-R275 PolarHBondContact O-N 3.27Å; R275-Q297 HydrophobicContact CG-CG 3.94Å
276H84Confident82.9Confident19 Ų1961.8 Ų61.89%0.08832%0.322CS..Hα-helixtrans-82.2-32.1176169.470.4000112.7C260 C263 F267 N272 L273 T274 P278 V279 H280C260-H276 PolarHBondContact SG-NE2 3.38Å; C263-H276 PolarHBondContact SG-NE2 3.47Å; F267-H276 HydrophobicContact CE1-CB 3.98Å; F267-H276 HydrophobicContact CE2-CB 4.06Å; F267-H276 AromaticContact CE2-CD2 3.54Å; F267-H276 AromaticContact CE2-CG 3.82Å; F267-H276 HydrophobicContact CZ-CB 3.49Å; F267-H276 VanDerWaalsContact CZ-CB 3.49Å; F267-H276 AromaticContact CZ-CD2 3.47Å; F267-H276 VanDerWaalsContact CZ-CD2 3.47Å; F267-H276 WeakPolarHBondContact CZ-CD2 3.05Å; F267-H276 AromaticContact CZ-CG 3.29Å; F267-H276 AromaticContact CZ-ND1 3.79Å; N272-H276 WeakPolarHBondContact O-CB 3.37Å; N272-H276 PolarHBondContact O-N 3.47Å; L273-H276 CarbonylContact O-C 3.51Å; L273-H276 WeakPolarHBondContact O-CA 3.3Å; L273-H276 VanDerWaalsContact O-CB 3.25Å; L273-H276 WeakPolarHBondContact O-CB 3.33Å; L273-H276 PolarHBondContact O-N 3.38Å; T274-H276 PolarHBondContact O-N 2.76Å; H276-P278 VanDerWaalsContact C-CD 3.4Å; H276-P278 VanDerWaalsContact C-N 3.34Å; H276-P278 VanDerWaalsContact O-N 3.16Å; H276-V279 WeakPolarHBondContact O-CB 3.45Å; H276-V279 WeakPolarHBondContact O-CG2 3.39Å; H276-V279 PolarHBondContact O-N 2.93Å; H276-H280 AromaticContact CE1-NE2 3.62Å; H276-H280 AromaticContact NE2-CD2 3.78Å; H276-H280 AromaticContact NE2-NE2 3.09Å; H276-H280 PolarHBondContact NE2-NE2 2.83Å
277M81.3Confident82.7Confident46 Ų4661.4 Ų61.423%0.22732%0.319CS..THydrogen-bonded Turntrans-51.5-38.2-178-61.7-49.5-69.900115.7L239 L273 T274 V279 H280 T281L239-M277 HydrophobicContact CD1-CB 3.99Å; L239-M277 HydrophobicContact CD1-CG 4.36Å; L273-M277 HydrophobicContact CD1-SD 3.93Å; L273-M277 HydrophobicContact CG-SD 4.44Å; L273-M277 WeakPolarHBondContact O-CG 3.47Å; L273-M277 PolarHBondContact O-N 3.22Å; T274-M277 PolarHBondContact O-N 3.37Å; M277-V279 PolarHBondContact O-N 2.9Å; M277-H280 PolarHBondContact O-N 3.45Å; M277-T281 PolarHBondContact O-N 2.99Å
278P85.6Confident82.7Confident17 Ų1759.5 Ų59.511%0.1131%0.311CS..Hα-helixtrans-58.4-13.2174-26.635.5000115.1T274 H276 G282 A283 R296T274-P278 VanDerWaalsContact O-CD 3.28Å; T274-P278 WeakPolarHBondContact O-CD 3.38Å; H276-P278 VanDerWaalsContact C-CD 3.4Å; H276-P278 VanDerWaalsContact C-N 3.34Å; H276-P278 VanDerWaalsContact O-N 3.16Å; P278-G282 PolarHBondContact O-N 3.11Å; P278-A283 HydrophobicContact CB-CB 4.48Å; P278-R296 HydrophobicContact CB-CB 4.18Å; P278-R296 HydrophobicContact CB-CG 3.96Å; P278-R296 PolarHBondContact O-NE 3.14Å
279V85.9Confident82.7Confident64 Ų6463.7 Ų63.739%0.38832%0.323SS..Hα-helixtrans-66.1-40.1172.9178.90000111.6H276 M277 R296H276-V279 WeakPolarHBondContact O-CB 3.45Å; H276-V279 WeakPolarHBondContact O-CG2 3.39Å; H276-V279 PolarHBondContact O-N 2.93Å; M277-V279 PolarHBondContact O-N 2.9Å; V279-R296 VanDerWaalsContact CA-CZ 3.48Å; V279-R296 PolarHBondContact O-NH2 3.27Å; V279-R296 VanDerWaalsContact O-NH2 3.15Å
280H83.5Confident82.9Confident67 Ų6768 Ų6831%0.3135%0.347SS..Hα-helixtrans-84.7-44.3-176.9-64.7-59.4000112.4C260 V262 C263 H276 M277 G282C260-H280 PolarHBondContact SG-NE2 3.16Å; C260-H280 VanDerWaalsContact SG-NE2 3.38Å; V262-H280 HydrophobicContact CG1-CB 4.16Å; V262-H280 VanDerWaalsContact CG1-ND1 3.33Å; V262-H280 WeakPolarHBondContact CG1-ND1 3.31Å; V262-H280 HydrophobicContact CG2-CB 4.47Å; C263-H280 PolarHBondContact SG-NE2 3.15Å; H276-H280 AromaticContact CE1-NE2 3.62Å; H276-H280 AromaticContact NE2-CD2 3.78Å; H276-H280 AromaticContact NE2-NE2 3.09Å; H276-H280 PolarHBondContact NE2-NE2 2.83Å; M277-H280 PolarHBondContact O-N 3.45Å; H280-G282 PolarHBondContact O-N 2.94Å
281T80.9Confident83.4Confident87 Ų8766.7 Ų66.753%0.53435%0.348SS..Hα-helixtrans-75.4-11.1-178610000113.2M277 A283M277-T281 PolarHBondContact O-N 2.99Å; T281-A283 PolarHBondContact O-N 3.37Å; T281-A283 VanDerWaalsContact O-N 3.08Å; T281-A283 VanDerWaalsContact OG1-CB 3.26Å; T281-A283 WeakPolarHBondContact OG1-CB 3.29Å; T281-A283 PolarHBondContact OG1-N 3.26Å
282G82.9Confident83.8Confident40 Ų4062.3 Ų62.341%0.41235%0.348SS..  trans681.1-17100000113.8P278 H280 R284P278-G282 PolarHBondContact O-N 3.11Å; H280-G282 PolarHBondContact O-N 2.94Å; G282-R284 PolarHBondContact O-N 2.8Å
283A81.9Confident84.2Confident44 Ų4466.8 Ų66.836%0.36437%0.367SS..  trans-57.9136.6-176.700000111.3P278 T281 R296P278-A283 HydrophobicContact CB-CB 4.48Å; T281-A283 PolarHBondContact O-N 3.37Å; T281-A283 VanDerWaalsContact O-N 3.08Å; T281-A283 VanDerWaalsContact OG1-CB 3.26Å; T281-A283 WeakPolarHBondContact OG1-CB 3.29Å; T281-A283 PolarHBondContact OG1-N 3.26Å; A283-R296 WeakPolarHBondContact O-CG 3.35Å
284R83.2Confident84.5Confident150 Ų15066.2 Ų66.257%0.56637%0.366SS*.  trans-129.671.4178.4-73.5173.2177.7-176.95.6109G282 F286 G294 F295 R296G282-R284 PolarHBondContact O-N 2.8Å; R284-F286 PolarHBondContact O-N 3.03Å; R284-G294 WeakPolarHBondContact CD-O 3.4Å; R284-F295 CarbonylContact C-O 3.58Å; R284-F295 WeakPolarHBondContact CA-O 3.13Å; R284-R296 HydrophobicContact CG-CG 4.45Å
285P79.9Confident84.7Confident56 Ų5667 Ų6736%0.36437%0.368SS..  trans-62.9-13.8-172.724.7-33.3000113.3F295P285-F295 WeakPolarHBondContact CD-O 3.16Å
286F83.9Confident84.8Confident19 Ų1965.9 Ų65.98%0.08336%0.364CS..EExtended strand (participates in β ladder)trans-11295.8-169.6-61.8-45.9000111Y227 R284 G294 F295 R296 Q297 A298 L301Y227-F286 HydrophobicContact CD1-CD1 4.47Å; Y227-F286 HydrophobicContact CD1-CE1 4.12Å; Y227-F286 HydrophobicContact CD2-CD1 4.27Å; Y227-F286 HydrophobicContact CD2-CE1 4.26Å; Y227-F286 AromaticContact CE1-CD1 3.57Å; Y227-F286 HydrophobicContact CE1-CD1 3.57Å; Y227-F286 AromaticContact CE1-CE1 3.56Å; Y227-F286 HydrophobicContact CE1-CE1 3.56Å; Y227-F286 HydrophobicContact CE1-CG 4.25Å; Y227-F286 HydrophobicContact CE1-CZ 4.39Å; Y227-F286 AromaticContact CE2-CD1 3.28Å; Y227-F286 HydrophobicContact CE2-CD1 3.28Å; Y227-F286 AromaticContact CE2-CE1 3.68Å; Y227-F286 HydrophobicContact CE2-CE1 3.68Å; Y227-F286 HydrophobicContact CE2-CG 4.33Å; Y227-F286 HydrophobicContact CG-CE1 4.48Å; Y227-F286 AromaticContact CZ-CD1 2.89Å; Y227-F286 AromaticContact CZ-CE1 3.34Å; Y227-F286 AromaticContact CZ-CG 3.64Å; Y227-F286 WeakPolarHBondContact OH-CA 3.42Å; Y227-F286 WeakPolarHBondContact OH-CB 3.38Å; Y227-F286 WeakPolarHBondContact OH-CD1 3.45Å; Y227-F286 WeakPolarHBondContact OH-CG 3.3Å; R284-F286 PolarHBondContact O-N 3.03Å; F286-G294 CarbonylContact O-C 3.56Å; F286-G294 WeakPolarHBondContact O-CA 3.28Å; F286-F295 HydrophobicContact CB-CB 4.06Å; F286-F295 WeakPolarHBondContact CB-O 3.47Å; F286-F295 PolarHBondContact N-O 3.2Å; F286-F295 WeakPolarHBondContact O-CB 3.48Å; F286-F295 WeakPolarHBondContact O-CD2 3.28Å; F286-F295 PolarHBondContact O-N 2.97Å; F286-R296 VanDerWaalsContact CD2-C 3.44Å; F286-R296 WeakPolarHBondContact CD2-O 3.15Å; F286-R296 WeakPolarHBondContact CE2-O 3.41Å; F286-Q297 VanDerWaalsContact CE2-CA 3.46Å; F286-A298 VanDerWaalsContact CD2-N 3.28Å; F286-A298 HydrophobicContact CE1-CB 4.34Å; F286-A298 HydrophobicContact CE2-CB 4.4Å; F286-A298 VanDerWaalsContact CE2-N 3.27Å; F286-A298 HydrophobicContact CZ-CB 4.11Å; F286-L301 HydrophobicContact CB-CB 4.38Å; F286-L301 HydrophobicContact CB-CD2 4.36Å
287V85.4Confident84.7Confident81 Ų8167.8 Ų67.849%0.49137%0.373SS..EExtended strand (participates in β ladder)trans-101.3134.4-172.7-175.40000111.8K289 G292V287-K289 PolarHBondContact O-N 2.98Å; V287-G292 WeakPolarHBondContact CG1-O 3.42Å
288C86.8Confident84.5Confident1 Ų166.8 Ų66.81%0.00737%0.372CS..  trans-74.6120.2170.5-173.80000110V290 G292 K293 F295 L301 H308C288-V290 PolarHBondContact O-N 3.48Å; C288-G292 WeakPolarHBondContact O-CA 3.32Å; C288-G292 PolarHBondContact O-N 3.38Å; C288-K293 WeakPolarHBondContact CB-O 3.29Å; C288-K293 PolarHBondContact N-O 3.49Å; C288-F295 HydrophobicContact CB-CE2 4.22Å; C288-L301 HydrophobicContact CB-CD1 3.58Å; C288-H308 PolarHBondContact SG-NE2 3.11Å; C288-H308 VanDerWaalsContact SG-NE2 3.37Å
289K87.2Confident84.3Confident210 Ų21069.6 Ų69.691%0.91339%0.392SS*.THydrogen-bonded Turntrans-66.3-25.8178.4-64-171.7177.7-175.20113.4V287V287-K289 PolarHBondContact O-N 2.98Å
290V86.8Confident84.2Confident109 Ų10968 Ų6866%0.66138%0.383SS*.THydrogen-bonded Turntrans-78.3-40-176.5-178.30000112.2C288 H308C288-V290 PolarHBondContact O-N 3.48Å; V290-H308 HydrophobicContact CG1-CB 4.42Å
291C89.7Confident84.2Confident63 Ų6365.3 Ų65.343%0.42637%0.371SS..THydrogen-bonded Turntrans-124.47.8-175.966.20000114.6K293 H304 H308C291-K293 PolarHBondContact O-N 3.04Å; C291-K293 VanDerWaalsContact SG-CB 3.51Å; C291-H304 PolarHBondContact SG-NE2 3.22Å; C291-H308 PolarHBondContact SG-NE2 2.92Å; C291-H308 VanDerWaalsContact SG-NE2 3.37Å
292G87.9Confident84.2Confident57 Ų5763.6 Ų63.659%0.58836%0.361SS*.  trans65.93.2-177.900000115V287 C288 G294V287-G292 WeakPolarHBondContact CG1-O 3.42Å; C288-G292 WeakPolarHBondContact O-CA 3.32Å; C288-G292 PolarHBondContact O-N 3.38Å; G292-G294 PolarHBondContact O-N 3.01Å
293K89.3Confident84.1Confident114 Ų11467 Ų6750%0.49636%0.362SS..  trans-73.6122.1-173.8-169.4166.8-176.2167.90111.6C288 C291 F295C288-K293 WeakPolarHBondContact CB-O 3.29Å; C288-K293 PolarHBondContact N-O 3.49Å; C291-K293 PolarHBondContact O-N 3.04Å; C291-K293 VanDerWaalsContact SG-CB 3.51Å; K293-F295 HydrophobicContact CB-CE2 4.04Å; K293-F295 HydrophobicContact CB-CZ 4.28Å; K293-F295 HydrophobicContact CD-CE2 4.5Å; K293-F295 HydrophobicContact CD-CZ 3.91Å; K293-F295 HydrophobicContact CG-CE2 3.98Å; K293-F295 HydrophobicContact CG-CZ 3.85Å; K293-F295 VanDerWaalsContact O-CD2 3.28Å; K293-F295 WeakPolarHBondContact O-CD2 3.5Å; K293-F295 WeakPolarHBondContact O-CE2 3.42Å
294G86.8Confident84.3Confident12 Ų1265.9 Ų65.912%0.12435%0.349CS..EExtended strand (participates in β ladder)trans-82.3145.8175.300000114.2R284 F286 G292R284-G294 WeakPolarHBondContact CD-O 3.4Å; F286-G294 CarbonylContact O-C 3.56Å; F286-G294 WeakPolarHBondContact O-CA 3.28Å; G292-G294 PolarHBondContact O-N 3.01Å
295F84.6Confident84.2Confident31 Ų3162.7 Ų62.714%0.13634%0.339CS..EExtended strand (participates in β ladder)trans-129.6153.8179.1-63.6-87.7000111.2R284 P285 F286 C288 K293 L301 H304R284-F295 CarbonylContact C-O 3.58Å; R284-F295 WeakPolarHBondContact CA-O 3.13Å; P285-F295 WeakPolarHBondContact CD-O 3.16Å; F286-F295 HydrophobicContact CB-CB 4.06Å; F286-F295 WeakPolarHBondContact CB-O 3.47Å; F286-F295 PolarHBondContact N-O 3.2Å; F286-F295 WeakPolarHBondContact O-CB 3.48Å; F286-F295 WeakPolarHBondContact O-CD2 3.28Å; F286-F295 PolarHBondContact O-N 2.97Å; C288-F295 HydrophobicContact CB-CE2 4.22Å; K293-F295 HydrophobicContact CB-CE2 4.04Å; K293-F295 HydrophobicContact CB-CZ 4.28Å; K293-F295 HydrophobicContact CD-CE2 4.5Å; K293-F295 HydrophobicContact CD-CZ 3.91Å; K293-F295 HydrophobicContact CG-CE2 3.98Å; K293-F295 HydrophobicContact CG-CZ 3.85Å; K293-F295 VanDerWaalsContact O-CD2 3.28Å; K293-F295 WeakPolarHBondContact O-CD2 3.5Å; K293-F295 WeakPolarHBondContact O-CE2 3.42Å; F295-L301 HydrophobicContact CB-CB 4.24Å; F295-L301 HydrophobicContact CD2-CB 3.88Å; F295-L301 HydrophobicContact CD2-CD1 3.55Å; F295-L301 HydrophobicContact CD2-CG 4.29Å; F295-L301 HydrophobicContact CE2-CD1 3.68Å; F295-L301 HydrophobicContact CG-CB 4.14Å; F295-H304 HydrophobicContact CE1-CB 3.84Å; F295-H304 HydrophobicContact CE2-CB 3.99Å; F295-H304 AromaticContact CE2-CD2 3.32Å; F295-H304 WeakPolarHBondContact CE2-CD2 3.36Å; F295-H304 AromaticContact CE2-CG 3.67Å; F295-H304 AromaticContact CE2-NE2 3.9Å; F295-H304 HydrophobicContact CZ-CB 3.43Å; F295-H304 VanDerWaalsContact CZ-CB 3.43Å; F295-H304 AromaticContact CZ-CD2 3.29Å; F295-H304 WeakPolarHBondContact CZ-CD2 3.34Å; F295-H304 AromaticContact CZ-CE1 3.99Å; F295-H304 AromaticContact CZ-CG 3.15Å; F295-H304 AromaticContact CZ-ND1 3.63Å; F295-H304 AromaticContact CZ-NE2 3.78Å
296R84.2Confident84.3Confident96 Ų9661 Ų6136%0.36233%0.327SS..SBendtrans-84.1-20.7176.7-70.1177.7175.4162.4-2.7113.3P278 V279 A283 R284 F286P278-R296 HydrophobicContact CB-CB 4.18Å; P278-R296 HydrophobicContact CB-CG 3.96Å; P278-R296 PolarHBondContact O-NE 3.14Å; V279-R296 VanDerWaalsContact CA-CZ 3.48Å; V279-R296 PolarHBondContact O-NH2 3.27Å; V279-R296 VanDerWaalsContact O-NH2 3.15Å; A283-R296 WeakPolarHBondContact O-CG 3.35Å; R284-R296 HydrophobicContact CG-CG 4.45Å; F286-R296 VanDerWaalsContact CD2-C 3.44Å; F286-R296 WeakPolarHBondContact CD2-O 3.15Å; F286-R296 WeakPolarHBondContact CE2-O 3.41Å
297Q80.9Confident84.3Confident60 Ų6063.5 Ų63.528%0.2834%0.341SS..SBendtrans-135.1143.7-178.6-63.4178.47.800112.5R275 F286 S299 T300 L301R275-Q297 HydrophobicContact CG-CG 3.94Å; F286-Q297 VanDerWaalsContact CE2-CA 3.46Å; Q297-S299 PolarHBondContact O-N 3.16Å; Q297-T300 HydrophobicContact CB-CG2 4.04Å; Q297-T300 PolarHBondContact N-OG1 3.05Å; Q297-T300 PolarHBondContact O-N 3.36Å; Q297-T300 VanDerWaalsContact O-N 3.12Å; Q297-T300 PolarHBondContact O-OG1 3.18Å; Q297-L301 PolarHBondContact O-N 2.95Å; Q297-L301 VanDerWaalsContact O-N 3.16Å
298A77.8Confident84.2Confident25 Ų2563 Ų6321%0.20733%0.333CS..Hα-helixtrans-54.1-49.8175.200000113.2Y227 F286 T300 L301 C302Y227-A298 HydrophobicContact CD1-CB 3.72Å; Y227-A298 HydrophobicContact CE1-CB 3.21Å; F286-A298 VanDerWaalsContact CD2-N 3.28Å; F286-A298 HydrophobicContact CE1-CB 4.34Å; F286-A298 HydrophobicContact CE2-CB 4.4Å; F286-A298 VanDerWaalsContact CE2-N 3.27Å; F286-A298 HydrophobicContact CZ-CB 4.11Å; A298-T300 PolarHBondContact O-N 3.46Å; A298-L301 PolarHBondContact O-N 2.7Å; A298-L301 VanDerWaalsContact O-N 3.09Å; A298-C302 PolarHBondContact O-N 3.33Å
299S80Confident83.9Confident76 Ų7666.5 Ų66.553%0.53135%0.354SS..Hα-helixtrans-58.3-34.9178.358.30000112.4Q297 R303Q297-S299 PolarHBondContact O-N 3.16Å; S299-R303 WeakPolarHBondContact O-CB 2.8Å; S299-R303 PolarHBondContact O-N 3.28Å
300T84.4Confident83.5Confident30 Ų3063 Ų6318%0.18434%0.341CS..Hα-helixtrans-73.3-34.817862.30000112.7Q297 A298 H304Q297-T300 HydrophobicContact CB-CG2 4.04Å; Q297-T300 PolarHBondContact N-OG1 3.05Å; Q297-T300 PolarHBondContact O-N 3.36Å; Q297-T300 VanDerWaalsContact O-N 3.12Å; Q297-T300 PolarHBondContact O-OG1 3.18Å; A298-T300 PolarHBondContact O-N 3.46Å; T300-H304 WeakPolarHBondContact O-CB 2.95Å; T300-H304 PolarHBondContact O-N 3.38Å
301L84.9Confident83.2Confident11 Ų1161.9 Ų61.96%0.05833%0.329CS..Hα-helixtrans-66.9-47.2171.3173.463000110.9Y227 F286 C288 F295 Q297 A298 R303 H304 K305Y227-L301 WeakPolarHBondContact OH-CD2 3.09Å; F286-L301 HydrophobicContact CB-CB 4.38Å; F286-L301 HydrophobicContact CB-CD2 4.36Å; C288-L301 HydrophobicContact CB-CD1 3.58Å; F295-L301 HydrophobicContact CB-CB 4.24Å; F295-L301 HydrophobicContact CD2-CB 3.88Å; F295-L301 HydrophobicContact CD2-CD1 3.55Å; F295-L301 HydrophobicContact CD2-CG 4.29Å; F295-L301 HydrophobicContact CE2-CD1 3.68Å; F295-L301 HydrophobicContact CG-CB 4.14Å; Q297-L301 PolarHBondContact O-N 2.95Å; Q297-L301 VanDerWaalsContact O-N 3.16Å; A298-L301 PolarHBondContact O-N 2.7Å; A298-L301 VanDerWaalsContact O-N 3.09Å; L301-R303 VanDerWaalsContact C-N 3.34Å; L301-R303 PolarHBondContact O-N 3.29Å; L301-H304 WeakPolarHBondContact O-CA 3.05Å; L301-H304 WeakPolarHBondContact O-CB 3.43Å; L301-H304 PolarHBondContact O-N 3.08Å; L301-K305 PolarHBondContact O-N 2.99Å
302C80.8Confident82.8Confident50 Ų5064.5 Ų64.534%0.33833%0.333SS..Hα-helixtrans-55.3-50.2178.8-178.30000111.1A298 H304 K305A298-C302 PolarHBondContact O-N 3.33Å; C302-H304 VanDerWaalsContact C-N 3.25Å; C302-H304 PolarHBondContact O-N 3.15Å; C302-K305 WeakPolarHBondContact O-CB 3.44Å; C302-K305 PolarHBondContact O-N 3.47Å; C302-K305 VanDerWaalsContact O-N 3.14Å
303R80.4Confident82.4Confident112 Ų11265.3 Ų65.342%0.42333%0.328SS..Hα-helixtrans-62-31.6174.7-177.3176.364.8-166.4-4.8113.5S299 L301S299-R303 WeakPolarHBondContact O-CB 2.8Å; S299-R303 PolarHBondContact O-N 3.28Å; L301-R303 VanDerWaalsContact C-N 3.34Å; L301-R303 PolarHBondContact O-N 3.29Å
304H85.8Confident82.3Confident20 Ų2061.6 Ų61.69%0.09331%0.312CS..Hα-helixtrans-69.1-35177.1165.670.2000112C291 F295 T300 L301 C302 I306 I307 H308C291-H304 PolarHBondContact SG-NE2 3.22Å; F295-H304 HydrophobicContact CE1-CB 3.84Å; F295-H304 HydrophobicContact CE2-CB 3.99Å; F295-H304 AromaticContact CE2-CD2 3.32Å; F295-H304 WeakPolarHBondContact CE2-CD2 3.36Å; F295-H304 AromaticContact CE2-CG 3.67Å; F295-H304 AromaticContact CE2-NE2 3.9Å; F295-H304 HydrophobicContact CZ-CB 3.43Å; F295-H304 VanDerWaalsContact CZ-CB 3.43Å; F295-H304 AromaticContact CZ-CD2 3.29Å; F295-H304 WeakPolarHBondContact CZ-CD2 3.34Å; F295-H304 AromaticContact CZ-CE1 3.99Å; F295-H304 AromaticContact CZ-CG 3.15Å; F295-H304 AromaticContact CZ-ND1 3.63Å; F295-H304 AromaticContact CZ-NE2 3.78Å; T300-H304 WeakPolarHBondContact O-CB 2.95Å; T300-H304 PolarHBondContact O-N 3.38Å; L301-H304 WeakPolarHBondContact O-CA 3.05Å; L301-H304 WeakPolarHBondContact O-CB 3.43Å; L301-H304 PolarHBondContact O-N 3.08Å; C302-H304 VanDerWaalsContact C-N 3.25Å; C302-H304 PolarHBondContact O-N 3.15Å; H304-I306 PolarHBondContact O-N 3.42Å; H304-I306 VanDerWaalsContact O-N 3.16Å; H304-I307 VanDerWaalsContact O-CB 3.28Å; H304-I307 WeakPolarHBondContact O-CB 3.44Å; H304-I307 PolarHBondContact O-N 3.45Å; H304-H308 AromaticContact CE1-NE2 3.69Å; H304-H308 AromaticContact NE2-NE2 3.22Å; H304-H308 PolarHBondContact NE2-NE2 2.94Å
305K81.3Confident82.3Confident83 Ų8368.1 Ų68.136%0.36134%0.337SS..Hα-helixtrans-57-30.8178.9-69.5-177.3175.1-171.30113.3I219 L301 C302 I307 H308 T309I219-K305 HydrophobicContact CD1-CD 3.9Å; L301-K305 PolarHBondContact O-N 2.99Å; C302-K305 WeakPolarHBondContact O-CB 3.44Å; C302-K305 PolarHBondContact O-N 3.47Å; C302-K305 VanDerWaalsContact O-N 3.14Å; K305-I307 PolarHBondContact O-N 3.24Å; K305-I307 VanDerWaalsContact O-N 3.11Å; K305-H308 WeakPolarHBondContact O-CB 3.3Å; K305-H308 PolarHBondContact O-N 3.44Å; K305-T309 PolarHBondContact O-N 3.36Å
306I82.6Confident82.7Confident22 Ų2266.8 Ų66.811%0.11333%0.331CS..Hα-helixtrans-57.3-27.2175-56.7173.3000112.1F216 H304 H308 T309 Q310 E311 N324F216-I306 HydrophobicContact CZ-CG1 4.5Å; H304-I306 PolarHBondContact O-N 3.42Å; H304-I306 VanDerWaalsContact O-N 3.16Å; I306-H308 VanDerWaalsContact C-N 3.27Å; I306-H308 PolarHBondContact O-N 2.89Å; I306-T309 PolarHBondContact O-N 3.4Å; I306-T309 PolarHBondContact O-OG1 3.49Å; I306-Q310 PolarHBondContact O-N 3.15Å; I306-Q310 VanDerWaalsContact O-N 3.15Å; I306-E311 HydrophobicContact CG2-CB 4.47Å; I306-E311 VanDerWaalsContact CG2-O 3.3Å; I306-E311 WeakPolarHBondContact CG2-O 3.45Å; I306-N324 HydrophobicContact CG2-CB 3.97Å
307I84Confident82.9Confident71 Ų7170 Ų7036%0.36436%0.356SS..Hα-helixtrans-69-30.1176.9-60.4171.4000111H304 K305 Q310H304-I307 VanDerWaalsContact O-CB 3.28Å; H304-I307 WeakPolarHBondContact O-CB 3.44Å; H304-I307 PolarHBondContact O-N 3.45Å; K305-I307 PolarHBondContact O-N 3.24Å; K305-I307 VanDerWaalsContact O-N 3.11Å; I307-Q310 PolarHBondContact O-NE2 2.78Å
308H82.5Confident83.3Confident71 Ų7173.6 Ų73.633%0.32937%0.372SS..Hα-helixtrans-77.5-34.9177.7-64.5-57.1000112.1C288 V290 C291 H304 K305 I306 Q310C288-H308 PolarHBondContact SG-NE2 3.11Å; C288-H308 VanDerWaalsContact SG-NE2 3.37Å; V290-H308 HydrophobicContact CG1-CB 4.42Å; C291-H308 PolarHBondContact SG-NE2 2.92Å; C291-H308 VanDerWaalsContact SG-NE2 3.37Å; H304-H308 AromaticContact CE1-NE2 3.69Å; H304-H308 AromaticContact NE2-NE2 3.22Å; H304-H308 PolarHBondContact NE2-NE2 2.94Å; K305-H308 WeakPolarHBondContact O-CB 3.3Å; K305-H308 PolarHBondContact O-N 3.44Å; I306-H308 VanDerWaalsContact C-N 3.27Å; I306-H308 PolarHBondContact O-N 2.89Å; H308-Q310 VanDerWaalsContact C-N 3.27Å; H308-Q310 PolarHBondContact O-N 3.19Å
309T79.6Confident84Confident74 Ų7474.8 Ų74.845%0.45438%0.379SS..Hα-helixtrans-78.3-13177.663.80000112.8K305 I306 E311K305-T309 PolarHBondContact O-N 3.36Å; I306-T309 PolarHBondContact O-N 3.4Å; I306-T309 PolarHBondContact O-OG1 3.49Å; T309-E311 PolarHBondContact O-N 3.15Å; T309-E311 WeakPolarHBondContact OG1-CG 3.39Å; T309-E311 PolarHBondContact OG1-OE2 2.93Å
310Q80Confident84.3Confident137 Ų13773.8 Ų73.864%0.6438%0.381SS*.THydrogen-bonded Turntrans55.513.7-172.6-61.4-64.2-22.200114I306 I307 H308I306-Q310 PolarHBondContact O-N 3.15Å; I306-Q310 VanDerWaalsContact O-N 3.15Å; I307-Q310 PolarHBondContact O-NE2 2.78Å; H308-Q310 VanDerWaalsContact C-N 3.27Å; H308-Q310 PolarHBondContact O-N 3.19Å
311E79.4Confident84.6Confident85 Ų8578.4 Ų78.440%0.39740%0.398SS..  trans-68141.4179.1-70.7171.5154.300110.3I306 T309I306-E311 HydrophobicContact CG2-CB 4.47Å; I306-E311 VanDerWaalsContact CG2-O 3.3Å; I306-E311 WeakPolarHBondContact CG2-O 3.45Å; T309-E311 PolarHBondContact O-N 3.15Å; T309-E311 WeakPolarHBondContact OG1-CG 3.39Å; T309-E311 PolarHBondContact OG1-OE2 2.93Å
312K82.5Confident84.8Confident118 Ų11879.3 Ų79.351%0.51341%0.407SS..  trans-127.277.5177.6-69.4170.3177.31790109H314 A322 F323K312-H314 PolarHBondContact O-N 3.2Å; K312-H314 VanDerWaalsContact O-N 3.14Å; K312-A322 HydrophobicContact CB-CB 3.43Å; K312-A322 VanDerWaalsContact CB-CB 3.43Å; K312-A322 HydrophobicContact CD-CB 4.08Å; K312-A322 WeakPolarHBondContact CD-O 3.46Å; K312-A322 HydrophobicContact CG-CB 4.37Å; K312-F323 CarbonylContact C-O 3.49Å; K312-F323 VanDerWaalsContact C-O 3.28Å; K312-F323 WeakPolarHBondContact CA-O 3.44Å
313P79.8Confident85.1Confident74 Ų7478.7 Ų78.748%0.48140%0.399SS..  trans-65.2-20.8-171.4-21.934.3000113.6
314H85.2Confident85.3Confident36 Ų3676 Ų7617%0.16739%0.393CS..EExtended strand (participates in β ladder)trans-10395-172.2-55.2-74.2000110.9K312 A322 F323 R325 S326 L329K312-H314 PolarHBondContact O-N 3.2Å; K312-H314 VanDerWaalsContact O-N 3.14Å; H314-A322 CarbonylContact O-C 3.5Å; H314-A322 WeakPolarHBondContact O-CA 3.26Å; H314-F323 HydrophobicContact CB-CB 4.37Å; H314-F323 WeakPolarHBondContact CB-O 3.48Å; H314-F323 PolarHBondContact N-O 3.2Å; H314-F323 PolarHBondContact O-N 3.4Å; H314-R325 VanDerWaalsContact CD2-CA 3.46Å; H314-R325 WeakPolarHBondContact CD2-CA 3.2Å; H314-R325 PolarHBondContact CD2-N 3.26Å; H314-S326 PolarHBondContact CD2-N 3.43Å; H314-S326 PolarHBondContact NE2-N 3.5Å; H314-L329 HydrophobicContact CB-CB 4.14Å; H314-L329 HydrophobicContact CB-CD2 3.87Å
315K88.7Confident85.2Confident148 Ų14879.2 Ų79.264%0.64340%0.404SS*.EExtended strand (participates in β ladder)trans-87.2141.7178-63.3-177.5-179.2178.40111.5K321 A322 L329K315-K321 CarbonylContact C-O 3.59Å; K315-A322 HydrophobicContact CG-CB 3.89Å; K315-L329 WeakPolarHBondContact O-CD2 3.43Å
316C91.3Very high85.3Confident3 Ų379 Ų792%0.0241%0.413CS..  trans-84.8122.2170.7-179.10000109.4Q318 G320 K321 F323 L329C316-Q318 PolarHBondContact O-N 3.04Å; C316-G320 WeakPolarHBondContact O-CA 3.43Å; C316-G320 PolarHBondContact O-N 2.67Å; C316-K321 WeakPolarHBondContact CB-O 3.34Å; C316-K321 PolarHBondContact N-O 3.32Å; C316-F323 HydrophobicContact CB-CE2 4.3Å; C316-L329 HydrophobicContact CB-CD1 3.59Å
317N89.1Confident85.4Confident164 Ų16481.2 Ų81.288%0.87743%0.431SS*.THydrogen-bonded Turntrans-68.7-24.8-178.4-62.3-6.5000112.8
318Q89.1Confident85.7Confident135 Ų13580.2 Ų80.263%0.63143%0.428SS*.THydrogen-bonded Turntrans-84.7-30.5-176.2-71.2171.5-12.800113.8C316 H336C316-Q318 PolarHBondContact O-N 3.04Å; Q318-H336 PolarHBondContact OE1-CD2 3.26Å
319C91.9Very high86Confident51 Ų5178.3 Ų78.335%0.34542%0.42SS..THydrogen-bonded Turntrans-132.48.4-17869.80000114.6K321 H332 H336C319-K321 PolarHBondContact O-N 3.06Å; C319-H332 PolarHBondContact SG-NE2 3.22Å; C319-H336 PolarHBondContact SG-NE2 3.36Å; C319-H336 VanDerWaalsContact SG-NE2 3.38Å
320G88.1Confident86.4Confident55 Ų5579.2 Ų79.257%0.56742%0.422SS*.  trans68.3-6.7-179.700000115.3C316 A322C316-G320 WeakPolarHBondContact O-CA 3.43Å; C316-G320 PolarHBondContact O-N 2.67Å; G320-A322 PolarHBondContact O-N 2.96Å
321K90.6Very high86.9Confident126 Ų12674.1 Ų74.155%0.54840%0.4SS..  trans-64.2130-176.9-73.2179.7-178171.50111.4K315 C316 C319 F323K315-K321 CarbonylContact C-O 3.59Å; C316-K321 WeakPolarHBondContact CB-O 3.34Å; C316-K321 PolarHBondContact N-O 3.32Å; C319-K321 PolarHBondContact O-N 3.06Å; K321-F323 HydrophobicContact CB-CE2 4Å; K321-F323 HydrophobicContact CB-CZ 4.08Å; K321-F323 WeakPolarHBondContact O-CE2 3.33Å
322A88.8Confident87.4Confident30 Ų3071.1 Ų71.125%0.24839%0.386CS..EExtended strand (participates in β ladder)trans-101.3143.9-178.600000112.2K312 H314 K315 G320K312-A322 HydrophobicContact CB-CB 3.43Å; K312-A322 VanDerWaalsContact CB-CB 3.43Å; K312-A322 HydrophobicContact CD-CB 4.08Å; K312-A322 WeakPolarHBondContact CD-O 3.46Å; K312-A322 HydrophobicContact CG-CB 4.37Å; H314-A322 CarbonylContact O-C 3.5Å; H314-A322 WeakPolarHBondContact O-CA 3.26Å; K315-A322 HydrophobicContact CG-CB 3.89Å; G320-A322 PolarHBondContact O-N 2.96Å
323F86.3Confident87.7Confident37 Ų3767.8 Ų67.816%0.16238%0.376CS..EExtended strand (participates in β ladder)trans-129.2149.1-178.6-57.5-86.9000111.2K312 H314 C316 K321 R325 T328 L329 H332K312-F323 CarbonylContact C-O 3.49Å; K312-F323 VanDerWaalsContact C-O 3.28Å; K312-F323 WeakPolarHBondContact CA-O 3.44Å; H314-F323 HydrophobicContact CB-CB 4.37Å; H314-F323 WeakPolarHBondContact CB-O 3.48Å; H314-F323 PolarHBondContact N-O 3.2Å; H314-F323 PolarHBondContact O-N 3.4Å; C316-F323 HydrophobicContact CB-CE2 4.3Å; K321-F323 HydrophobicContact CB-CE2 4Å; K321-F323 HydrophobicContact CB-CZ 4.08Å; K321-F323 WeakPolarHBondContact O-CE2 3.33Å; F323-R325 VanDerWaalsContact C-N 3.26Å; F323-R325 PolarHBondContact O-N 2.97Å; F323-T328 HydrophobicContact CD1-CG2 3.59Å; F323-T328 HydrophobicContact CE1-CG2 4.17Å; F323-T328 HydrophobicContact CG-CG2 4.34Å; F323-L329 HydrophobicContact CB-CB 4.36Å; F323-L329 HydrophobicContact CD2-CB 3.86Å; F323-L329 HydrophobicContact CD2-CD1 3.72Å; F323-L329 HydrophobicContact CD2-CG 4.38Å; F323-L329 HydrophobicContact CE2-CD1 3.84Å; F323-L329 HydrophobicContact CG-CB 4.3Å; F323-H332 HydrophobicContact CE1-CB 4.13Å; F323-H332 HydrophobicContact CE2-CB 4Å; F323-H332 AromaticContact CE2-CD2 3.35Å; F323-H332 WeakPolarHBondContact CE2-CD2 3.5Å; F323-H332 AromaticContact CE2-CG 3.69Å; F323-H332 AromaticContact CE2-NE2 3.97Å; F323-H332 HydrophobicContact CZ-CB 3.58Å; F323-H332 AromaticContact CZ-CD2 3.37Å; F323-H332 WeakPolarHBondContact CZ-CD2 3.46Å; F323-H332 AromaticContact CZ-CG 3.25Å; F323-H332 AromaticContact CZ-ND1 3.71Å; F323-H332 AromaticContact CZ-NE2 3.84Å
324N83.8Confident88.3Confident57 Ų5767 Ų6731%0.30536%0.363SS..SBendtrans-80.3-5176.362.212.7000113.7I306I306-N324 HydrophobicContact CG2-CB 3.97Å
325R83.7Confident88.6Confident87 Ų8769.8 Ų69.833%0.32838%0.378SS..  trans-144.4137.7179.7-64.4175.1-170.2179.32.5111.2H314 F323 S327 T328 L329H314-R325 VanDerWaalsContact CD2-CA 3.46Å; H314-R325 WeakPolarHBondContact CD2-CA 3.2Å; H314-R325 PolarHBondContact CD2-N 3.26Å; F323-R325 VanDerWaalsContact C-N 3.26Å; F323-R325 PolarHBondContact O-N 2.97Å; R325-S327 VanDerWaalsContact C-N 3.3Å; R325-S327 PolarHBondContact O-N 2.81Å; R325-T328 PolarHBondContact O-N 3.39Å; R325-T328 VanDerWaalsContact O-N 3.15Å; R325-L329 PolarHBondContact O-N 2.77Å; R325-L329 VanDerWaalsContact O-N 3.13Å
326S83.8Confident88.6Confident77 Ų7766.5 Ų66.554%0.53837%0.365SS..Hα-helixtrans-59-39.3173.457.90000112.5H314 T328 L329 N330H314-S326 PolarHBondContact CD2-N 3.43Å; H314-S326 PolarHBondContact NE2-N 3.5Å; S326-T328 VanDerWaalsContact C-N 3.27Å; S326-T328 PolarHBondContact O-N 2.81Å; S326-L329 WeakPolarHBondContact O-CB 3.24Å; S326-L329 PolarHBondContact O-N 3.27Å; S326-N330 PolarHBondContact O-N 2.98Å
327S85.9Confident88.5Confident70 Ų7070.1 Ų70.149%0.4940%0.395SS..Hα-helixtrans-60-38.3176.762.80000112.3R325 N330 T331R325-S327 VanDerWaalsContact C-N 3.3Å; R325-S327 PolarHBondContact O-N 2.81Å; S327-N330 PolarHBondContact O-N 2.94Å; S327-T331 WeakPolarHBondContact O-CG2 3.48Å; S327-T331 PolarHBondContact O-N 3.36Å; S327-T331 PolarHBondContact O-OG1 3.2Å
328T88.9Confident88.4Confident49 Ų4964.5 Ų64.530%0.30138%0.376SS..Hα-helixtrans-71.2-43.1179.1-50.70000110.3F323 R325 S326 N330 T331 H332F323-T328 HydrophobicContact CD1-CG2 3.59Å; F323-T328 HydrophobicContact CE1-CG2 4.17Å; F323-T328 HydrophobicContact CG-CG2 4.34Å; R325-T328 PolarHBondContact O-N 3.39Å; R325-T328 VanDerWaalsContact O-N 3.15Å; S326-T328 VanDerWaalsContact C-N 3.27Å; S326-T328 PolarHBondContact O-N 2.81Å; T328-N330 VanDerWaalsContact C-N 3.33Å; T328-N330 PolarHBondContact O-N 3.47Å; T328-T331 WeakPolarHBondContact CA-OG1 3.26Å; T328-T331 PolarHBondContact O-N 2.95Å; T328-T331 PolarHBondContact O-OG1 2.96Å; T328-H332 WeakPolarHBondContact O-CB 3.5Å; T328-H332 PolarHBondContact O-N 3.41Å
329L90.3Very high88.5Confident32 Ų3264.6 Ų64.617%0.16837%0.372CS..Hα-helixtrans-56.3-47.3171.7173.161.9000111H314 K315 C316 F323 R325 S326 T331 H332 T333H314-L329 HydrophobicContact CB-CB 4.14Å; H314-L329 HydrophobicContact CB-CD2 3.87Å; K315-L329 WeakPolarHBondContact O-CD2 3.43Å; C316-L329 HydrophobicContact CB-CD1 3.59Å; F323-L329 HydrophobicContact CB-CB 4.36Å; F323-L329 HydrophobicContact CD2-CB 3.86Å; F323-L329 HydrophobicContact CD2-CD1 3.72Å; F323-L329 HydrophobicContact CD2-CG 4.38Å; F323-L329 HydrophobicContact CE2-CD1 3.84Å; F323-L329 HydrophobicContact CG-CB 4.3Å; R325-L329 PolarHBondContact O-N 2.77Å; R325-L329 VanDerWaalsContact O-N 3.13Å; S326-L329 WeakPolarHBondContact O-CB 3.24Å; S326-L329 PolarHBondContact O-N 3.27Å; L329-T331 VanDerWaalsContact C-N 3.32Å; L329-T331 PolarHBondContact O-N 3.49Å; L329-H332 CarbonylContact O-C 3.5Å; L329-H332 WeakPolarHBondContact O-CA 3.15Å; L329-H332 WeakPolarHBondContact O-CB 3.45Å; L329-H332 PolarHBondContact O-N 2.79Å; L329-T333 HydrophobicContact CD1-CG2 4.12Å; L329-T333 HydrophobicContact CG-CG2 4.45Å; L329-T333 WeakPolarHBondContact O-CG2 3.45Å; L329-T333 PolarHBondContact O-N 3.12Å; L329-T333 PolarHBondContact O-OG1 3.26Å
330N87.7Confident88.5Confident92 Ų9267.1 Ų67.149%0.49238%0.377SS..Hα-helixtrans-63.7-34.6178.8-17244.1000113.2S326 S327 T328 H332 T333 R334S326-N330 PolarHBondContact O-N 2.98Å; S327-N330 PolarHBondContact O-N 2.94Å; T328-N330 VanDerWaalsContact C-N 3.33Å; T328-N330 PolarHBondContact O-N 3.47Å; N330-H332 VanDerWaalsContact C-N 3.29Å; N330-T333 PolarHBondContact O-OG1 3.5Å; N330-R334 WeakPolarHBondContact O-CG 3.4Å
331T89.2Confident88.6Confident31 Ų3166.7 Ų66.719%0.1936%0.364CS..Hα-helixtrans-71.4-28.517255.60000112.6S327 T328 L329 Q353S327-T331 WeakPolarHBondContact O-CG2 3.48Å; S327-T331 PolarHBondContact O-N 3.36Å; S327-T331 PolarHBondContact O-OG1 3.2Å; T328-T331 WeakPolarHBondContact CA-OG1 3.26Å; T328-T331 PolarHBondContact O-N 2.95Å; T328-T331 PolarHBondContact O-OG1 2.96Å; L329-T331 VanDerWaalsContact C-N 3.32Å; L329-T331 PolarHBondContact O-N 3.49Å; T331-Q353 HydrophobicContact CG2-CG 4.48Å
332H91.3Very high88.8Confident22 Ų2263.4 Ų63.410%0.10235%0.35CS..Hα-helixtrans-75.1-40.2178.3169.270000112C319 F323 T328 L329 N330 R334 I335 H336C319-H332 PolarHBondContact SG-NE2 3.22Å; F323-H332 HydrophobicContact CE1-CB 4.13Å; F323-H332 HydrophobicContact CE2-CB 4Å; F323-H332 AromaticContact CE2-CD2 3.35Å; F323-H332 WeakPolarHBondContact CE2-CD2 3.5Å; F323-H332 AromaticContact CE2-CG 3.69Å; F323-H332 AromaticContact CE2-NE2 3.97Å; F323-H332 HydrophobicContact CZ-CB 3.58Å; F323-H332 AromaticContact CZ-CD2 3.37Å; F323-H332 WeakPolarHBondContact CZ-CD2 3.46Å; F323-H332 AromaticContact CZ-CG 3.25Å; F323-H332 AromaticContact CZ-ND1 3.71Å; F323-H332 AromaticContact CZ-NE2 3.84Å; T328-H332 WeakPolarHBondContact O-CB 3.5Å; T328-H332 PolarHBondContact O-N 3.41Å; L329-H332 CarbonylContact O-C 3.5Å; L329-H332 WeakPolarHBondContact O-CA 3.15Å; L329-H332 WeakPolarHBondContact O-CB 3.45Å; L329-H332 PolarHBondContact O-N 2.79Å; N330-H332 VanDerWaalsContact C-N 3.29Å; H332-R334 PolarHBondContact O-N 3.2Å; H332-R334 VanDerWaalsContact O-N 3.16Å; H332-I335 WeakPolarHBondContact O-CB 3.49Å; H332-I335 WeakPolarHBondContact O-CG1 3.38Å; H332-I335 PolarHBondContact O-N 3.35Å; H332-H336 AromaticContact CE1-NE2 3.78Å; H332-H336 AromaticContact NE2-NE2 3.35Å; H332-H336 PolarHBondContact NE2-NE2 3Å
333T89.2Confident89Confident47 Ų4766.8 Ų66.829%0.28836%0.363SS..Hα-helixtrans-59.8-27.5177.452.40000112.8L329 N330 I335 H336 A337L329-T333 HydrophobicContact CD1-CG2 4.12Å; L329-T333 HydrophobicContact CG-CG2 4.45Å; L329-T333 WeakPolarHBondContact O-CG2 3.45Å; L329-T333 PolarHBondContact O-N 3.12Å; L329-T333 PolarHBondContact O-OG1 3.26Å; N330-T333 PolarHBondContact O-OG1 3.5Å; T333-I335 PolarHBondContact O-N 3.5Å; T333-H336 PolarHBondContact O-N 2.85Å; T333-H336 VanDerWaalsContact O-N 3.14Å; T333-A337 PolarHBondContact O-N 3.44Å; T333-A337 VanDerWaalsContact O-N 3.17Å
334R91.5Very high89.4Confident59 Ų5965 Ų6522%0.22336%0.355CS..Hα-helixtrans-59.8-25.5172.1-62176.3-167.1176.5-4.2113.8N330 H332 G338 Y339 H352N330-R334 WeakPolarHBondContact O-CG 3.4Å; H332-R334 PolarHBondContact O-N 3.2Å; H332-R334 VanDerWaalsContact O-N 3.16Å; R334-G338 CarbonylContact O-C 3.49Å; R334-G338 PolarHBondContact O-N 3.18Å; R334-Y339 HydrophobicContact CG-CD1 4.25Å; R334-Y339 PolarHBondContact O-N 3.44Å; R334-H352 HydrophobicContact CB-CB 4.42Å; R334-H352 PolarHBondContact NH1-O 3.06Å; R334-H352 PolarHBondContact O-CE1 3.09Å; R334-H352 PolarHBondContact O-ND1 3.24Å
335I90.9Very high89.7Confident94 Ų9470 Ų7048%0.48238%0.376SS..Hα-helixtrans-67.9-45.1177.5-59.8173.1000109.2H332 T333 G338H332-I335 WeakPolarHBondContact O-CB 3.49Å; H332-I335 WeakPolarHBondContact O-CG1 3.38Å; H332-I335 PolarHBondContact O-N 3.35Å; T333-I335 PolarHBondContact O-N 3.5Å; I335-G338 PolarHBondContact O-N 3.48Å; I335-G338 VanDerWaalsContact O-N 3.16Å
336H89.6Confident90Very high79 Ų7972.6 Ų72.637%0.36639%0.39SS..Hα-helixtrans-66.8-38.3178.3-63.5-62000112.5Q318 C319 H332 T333 G338Q318-H336 PolarHBondContact OE1-CD2 3.26Å; C319-H336 PolarHBondContact SG-NE2 3.36Å; C319-H336 VanDerWaalsContact SG-NE2 3.38Å; H332-H336 AromaticContact CE1-NE2 3.78Å; H332-H336 AromaticContact NE2-NE2 3.35Å; H332-H336 PolarHBondContact NE2-NE2 3Å; T333-H336 PolarHBondContact O-N 2.85Å; T333-H336 VanDerWaalsContact O-N 3.14Å; H336-G338 PolarHBondContact O-N 3.14Å
337A88Confident90.4Very high79 Ų7972 Ų7265%0.65339%0.385SS*.THydrogen-bonded Turntrans-74.8-4.1175.100000113.8T333 Y339T333-A337 PolarHBondContact O-N 3.44Å; T333-A337 VanDerWaalsContact O-N 3.17Å; A337-Y339 PolarHBondContact O-N 3.45Å
338G88.2Confident90.7Very high46 Ų4671.3 Ų71.347%0.47439%0.389SS..THydrogen-bonded Turntrans62.83.9-171.500000114.8R334 I335 H336 K340R334-G338 CarbonylContact O-C 3.49Å; R334-G338 PolarHBondContact O-N 3.18Å; I335-G338 PolarHBondContact O-N 3.48Å; I335-G338 VanDerWaalsContact O-N 3.16Å; H336-G338 PolarHBondContact O-N 3.14Å; G338-K340 PolarHBondContact O-N 2.75Å
339Y90.4Very high90.9Very high137 Ų13774.8 Ų74.854%0.53740%0.4SS..  trans-73.6115-169.7-179.7-118.4000112.4R334 A337 P341 H352R334-Y339 HydrophobicContact CG-CD1 4.25Å; R334-Y339 PolarHBondContact O-N 3.44Å; A337-Y339 PolarHBondContact O-N 3.45Å; Y339-P341 HydrophobicContact CD1-CG 4.28Å; Y339-P341 HydrophobicContact CE1-CB 3.78Å; Y339-P341 HydrophobicContact CE1-CG 3.86Å; Y339-P341 VanDerWaalsContact O-CD 3.28Å; Y339-P341 WeakPolarHBondContact O-CD 3.28Å; Y339-H352 PolarHBondContact O-CE1 2.77Å; Y339-H352 PolarHBondContact O-ND1 3.41Å
340K91.9Very high91Very high104 Ų10474.2 Ų74.245%0.45240%0.402SS..  trans-116.982.1-176-70.4167.3-175.3174.80110.9G338 F342 F351 H352G338-K340 PolarHBondContact O-N 2.75Å; K340-F342 PolarHBondContact O-N 3.34Å; K340-F342 VanDerWaalsContact O-N 3.12Å; K340-F351 CarbonylContact C-O 3.48Å; K340-H352 VanDerWaalsContact CG-CE1 3.44Å; K340-H352 WeakPolarHBondContact CG-CE1 3.28Å
341P90.2Very high91.2Very high46 Ų4671.3 Ų71.330%0.29939%0.385SS..  trans-66.9-15-17423.6-32.6000114.6Y339Y339-P341 HydrophobicContact CD1-CG 4.28Å; Y339-P341 HydrophobicContact CE1-CB 3.78Å; Y339-P341 HydrophobicContact CE1-CG 3.86Å; Y339-P341 VanDerWaalsContact O-CD 3.28Å; Y339-P341 WeakPolarHBondContact O-CD 3.28Å
342F94.3Very high91.2Very high56 Ų5671.9 Ų71.925%0.24639%0.385CS..EExtended strand (participates in β ladder)trans-113.2103.3-177.2-52.2-72.9000109.9K340 G350 F351 K354 Y357K340-F342 PolarHBondContact O-N 3.34Å; K340-F342 VanDerWaalsContact O-N 3.12Å; F342-G350 CarbonylContact O-C 3.59Å; F342-G350 WeakPolarHBondContact O-CA 3.44Å; F342-F351 HydrophobicContact CB-CB 4.31Å; F342-F351 PolarHBondContact N-O 3.18Å; F342-F351 PolarHBondContact O-N 3.38Å; F342-K354 HydrophobicContact CD1-CB 4.32Å; F342-K354 HydrophobicContact CD1-CG 4.44Å; F342-K354 HydrophobicContact CD2-CB 4.4Å; F342-K354 HydrophobicContact CE1-CB 3.86Å; F342-K354 HydrophobicContact CE1-CD 4.36Å; F342-K354 HydrophobicContact CE1-CG 4.09Å; F342-K354 HydrophobicContact CE2-CB 3.95Å; F342-K354 HydrophobicContact CZ-CB 3.67Å; F342-K354 HydrophobicContact CZ-CG 4.39Å; F342-Y357 HydrophobicContact CB-CD1 4.31Å; F342-Y357 HydrophobicContact CB-CD2 4.01Å; F342-Y357 HydrophobicContact CB-CG 3.73Å
343I93.8Very high91.2Very high102 Ų10274.7 Ų74.752%0.52340%0.399SS..EExtended strand (participates in β ladder)trans-104.1133-178.3-56.8175.3000109.3E345 Y357I343-E345 PolarHBondContact O-N 3.47Å; I343-Y357 WeakPolarHBondContact O-CE2 3.2Å
344C94Very high91.2Very high0 Ų078.5 Ų78.50%041%0.411CS..  trans-74.5118.1172.4-167.90000110.6F346 C347 G348 K349 F351 Y357 H360 H364C344-F346 VanDerWaalsContact C-N 3.26Å; C344-F346 PolarHBondContact O-N 2.85Å; C344-C347 VanDerWaalsContact SG-SG 3.68Å; C344-G348 WeakPolarHBondContact O-CA 3.45Å; C344-G348 PolarHBondContact O-N 3.25Å; C344-K349 HydrophobicContact CB-CB 4.43Å; C344-K349 WeakPolarHBondContact CB-O 3.4Å; C344-K349 PolarHBondContact N-O 3.15Å; C344-F351 HydrophobicContact CB-CE2 4.45Å; C344-Y357 HydrophobicContact CB-CE2 4.48Å; C344-H360 PolarHBondContact SG-NE2 2.63Å; C344-H360 VanDerWaalsContact SG-NE2 3.37Å; C344-H364 VanDerWaalsContact SG-CD2 3.58Å; C344-H364 PolarHBondContact SG-NE2 3.12Å
345E91.9Very high91.1Very high160 Ų16077.5 Ų77.575%0.74842%0.419SS*.THydrogen-bonded Turntrans-67.2-28.2179.3-66.1165.3168.100112I343I343-E345 PolarHBondContact O-N 3.47Å
346F88.9Confident91Very high143 Ų14377 Ų7763%0.62742%0.418SS*.THydrogen-bonded Turntrans-78.9-29-178.5-60.3-73000114.2C344 H364C344-F346 VanDerWaalsContact C-N 3.26Å; C344-F346 PolarHBondContact O-N 2.85Å; F346-H364 HydrophobicContact CD2-CB 4.36Å
347C92.8Very high91.2Very high63 Ų6375 Ų7543%0.42641%0.407SS..THydrogen-bonded Turntrans-138.89-174.3710000115C344 K349 H360 H364C344-C347 VanDerWaalsContact SG-SG 3.68Å; C347-K349 PolarHBondContact O-N 3.25Å; C347-H360 PolarHBondContact SG-NE2 3.4Å; C347-H364 PolarHBondContact SG-NE2 3.13Å
348G90.9Very high91.2Very high56 Ų5677 Ų7758%0.57740%0.401SS*.  trans68.3-2.2179.900000115.6C344 G350C344-G348 WeakPolarHBondContact O-CA 3.45Å; C344-G348 PolarHBondContact O-N 3.25Å; G348-G350 PolarHBondContact O-N 3.4Å
349K93.4Very high91.1Very high123 Ų12377.5 Ų77.554%0.53539%0.393SS..  trans-70.6123.1-174.1-166.1168.2-175.5168.90112C344 C347 F351C344-K349 HydrophobicContact CB-CB 4.43Å; C344-K349 WeakPolarHBondContact CB-O 3.4Å; C344-K349 PolarHBondContact N-O 3.15Å; C347-K349 PolarHBondContact O-N 3.25Å; K349-F351 HydrophobicContact CB-CE2 4.08Å; K349-F351 HydrophobicContact CB-CZ 4.31Å; K349-F351 HydrophobicContact CD-CZ 3.91Å; K349-F351 HydrophobicContact CG-CE2 3.99Å; K349-F351 HydrophobicContact CG-CZ 3.85Å; K349-F351 WeakPolarHBondContact O-CD2 3.26Å; K349-F351 WeakPolarHBondContact O-CE2 3.47Å
350G92.9Very high91.1Very high20 Ų2072.3 Ų72.321%0.20637%0.373CS..EExtended strand (participates in β ladder)trans-91.4146.2178.500000114.7F342 G348F342-G350 CarbonylContact O-C 3.59Å; F342-G350 WeakPolarHBondContact O-CA 3.44Å; G348-G350 PolarHBondContact O-N 3.4Å
351F92.1Very high90.9Very high30 Ų3070.8 Ų70.813%0.13237%0.367CS..EExtended strand (participates in β ladder)trans-132.4144.4-179.4-58.9-93.5000112.1K340 F342 C344 K349 N356 Y357 H360K340-F351 CarbonylContact C-O 3.48Å; F342-F351 HydrophobicContact CB-CB 4.31Å; F342-F351 PolarHBondContact N-O 3.18Å; F342-F351 PolarHBondContact O-N 3.38Å; C344-F351 HydrophobicContact CB-CE2 4.45Å; K349-F351 HydrophobicContact CB-CE2 4.08Å; K349-F351 HydrophobicContact CB-CZ 4.31Å; K349-F351 HydrophobicContact CD-CZ 3.91Å; K349-F351 HydrophobicContact CG-CE2 3.99Å; K349-F351 HydrophobicContact CG-CZ 3.85Å; K349-F351 WeakPolarHBondContact O-CD2 3.26Å; K349-F351 WeakPolarHBondContact O-CE2 3.47Å; F351-N356 HydrophobicContact CD1-CB 4Å; F351-Y357 HydrophobicContact CD2-CD2 4.06Å; F351-H360 HydrophobicContact CE1-CB 3.88Å; F351-H360 HydrophobicContact CE2-CB 3.92Å; F351-H360 AromaticContact CE2-CD2 3.29Å; F351-H360 WeakPolarHBondContact CE2-CD2 3.16Å; F351-H360 AromaticContact CE2-CG 3.66Å; F351-H360 HydrophobicContact CZ-CB 3.38Å; F351-H360 AromaticContact CZ-CD2 3.32Å; F351-H360 WeakPolarHBondContact CZ-CD2 3.09Å; F351-H360 AromaticContact CZ-CG 3.19Å; F351-H360 AromaticContact CZ-ND1 3.85Å; F351-H360 AromaticContact CZ-NE2 4Å
352H89.6Confident90.7Very high43 Ų4369.9 Ų69.920%0.19936%0.36CS..SBendtrans-78.2-19.6176.9-57.7-67.8000113.7R334 Y339 K340R334-H352 HydrophobicContact CB-CB 4.42Å; R334-H352 PolarHBondContact NH1-O 3.06Å; R334-H352 PolarHBondContact O-CE1 3.09Å; R334-H352 PolarHBondContact O-ND1 3.24Å; Y339-H352 PolarHBondContact O-CE1 2.77Å; Y339-H352 PolarHBondContact O-ND1 3.41Å; K340-H352 VanDerWaalsContact CG-CE1 3.44Å; K340-H352 WeakPolarHBondContact CG-CE1 3.28Å
353Q90.1Very high90.3Very high81 Ų8170.8 Ų70.838%0.37937%0.369SS..SBendtrans-132.2139.9-174.4-63.1-1759.500112.2T331 G355 N356 Y357T331-Q353 HydrophobicContact CG2-CG 4.48Å; Q353-G355 VanDerWaalsContact C-N 3.35Å; Q353-G355 PolarHBondContact O-N 2.76Å; Q353-N356 PolarHBondContact O-N 3.45Å; Q353-Y357 PolarHBondContact O-N 3.24Å; Q353-Y357 VanDerWaalsContact O-N 3.16Å
354K90.3Very high89.9Confident127 Ų12769.7 Ų69.755%0.55236%0.362SS*.Hα-helixtrans-63.2-36.9-178.9-171.2174.1-177.51730113.1F342 Y357 K358F342-K354 HydrophobicContact CD1-CB 4.32Å; F342-K354 HydrophobicContact CD1-CG 4.44Å; F342-K354 HydrophobicContact CD2-CB 4.4Å; F342-K354 HydrophobicContact CE1-CB 3.86Å; F342-K354 HydrophobicContact CE1-CD 4.36Å; F342-K354 HydrophobicContact CE1-CG 4.09Å; F342-K354 HydrophobicContact CE2-CB 3.95Å; F342-K354 HydrophobicContact CZ-CB 3.67Å; F342-K354 HydrophobicContact CZ-CG 4.39Å; K354-Y357 PolarHBondContact O-N 3.02Å; K354-K358 WeakPolarHBondContact O-CG 3.38Å; K354-K358 PolarHBondContact O-N 3.16Å
355G88.2Confident89.3Confident38 Ų3872.7 Ų72.739%0.39238%0.383SS..Hα-helixtrans-62.5-46.6178.600000111.8Q353 Y357 K358 N359Q353-G355 VanDerWaalsContact C-N 3.35Å; Q353-G355 PolarHBondContact O-N 2.76Å; G355-Y357 VanDerWaalsContact C-N 3.33Å; G355-Y357 PolarHBondContact O-N 3.4Å; G355-K358 PolarHBondContact O-N 3.23Å; G355-N359 PolarHBondContact O-N 2.98Å; G355-N359 PolarHBondContact O-OD1 2.99Å
356N89.8Confident88.5Confident84 Ų8467.2 Ų67.245%0.44937%0.369SS..Hα-helixtrans-63.3-41177.3-63.5-2.1000111.6F351 Q353 N359 H360F351-N356 HydrophobicContact CD1-CB 4Å; Q353-N356 PolarHBondContact O-N 3.45Å; N356-N359 PolarHBondContact O-N 3.35Å; N356-H360 WeakPolarHBondContact O-CB 3.41Å; N356-H360 PolarHBondContact O-N 2.95Å
357Y92.6Very high87.9Confident36 Ų3665.4 Ų65.414%0.14136%0.363CS..Hα-helixtrans-59.6-48.3173166.7-103.7000112.4F342 I343 C344 F351 Q353 K354 G355 N359 H360 K361F342-Y357 HydrophobicContact CB-CD1 4.31Å; F342-Y357 HydrophobicContact CB-CD2 4.01Å; F342-Y357 HydrophobicContact CB-CG 3.73Å; I343-Y357 WeakPolarHBondContact O-CE2 3.2Å; C344-Y357 HydrophobicContact CB-CE2 4.48Å; F351-Y357 HydrophobicContact CD2-CD2 4.06Å; Q353-Y357 PolarHBondContact O-N 3.24Å; Q353-Y357 VanDerWaalsContact O-N 3.16Å; K354-Y357 PolarHBondContact O-N 3.02Å; G355-Y357 VanDerWaalsContact C-N 3.33Å; G355-Y357 PolarHBondContact O-N 3.4Å; Y357-N359 PolarHBondContact O-N 3.07Å; Y357-H360 WeakPolarHBondContact O-CB 3.46Å; Y357-H360 PolarHBondContact O-N 2.87Å; Y357-K361 HydrophobicContact CE1-CD 3.78Å; Y357-K361 HydrophobicContact CE1-CG 4.28Å; Y357-K361 HydrophobicContact CE2-CD 4.21Å; Y357-K361 HydrophobicContact CE2-CG 4.11Å; Y357-K361 PolarHBondContact O-N 2.94Å
358K89.3Confident87.3Confident122 Ų12267.5 Ų67.553%0.5337%0.365SS..Hα-helixtrans-58.9-47.6176.8-77.5-171.6173.6-163.70111.9K354 G355 H360 K361 L362K354-K358 WeakPolarHBondContact O-CG 3.38Å; K354-K358 PolarHBondContact O-N 3.16Å; G355-K358 PolarHBondContact O-N 3.23Å; K358-H360 PolarHBondContact O-N 3.38Å; K358-K361 PolarHBondContact O-N 2.91Å; K358-K361 VanDerWaalsContact O-N 3.15Å; K358-L362 PolarHBondContact O-N 2.91Å
359N86.3Confident86.8Confident56 Ų5670.6 Ų70.630%0.29936%0.364SS..Hα-helixtrans-63.9-33.5178.7-68.52.4000111.7G355 N356 Y357 L362 Q381G355-N359 PolarHBondContact O-N 2.98Å; G355-N359 PolarHBondContact O-OD1 2.99Å; N356-N359 PolarHBondContact O-N 3.35Å; Y357-N359 PolarHBondContact O-N 3.07Å; N359-L362 WeakPolarHBondContact O-CB 3.47Å; N359-L362 PolarHBondContact O-N 3.4Å; N359-Q381 PolarHBondContact ND2-OE1 3.01Å
360H89.6Confident86.5Confident28 Ų2867.7 Ų67.713%0.1335%0.352CS..Hα-helixtrans-68.5-40.2173.2171.962000112.5C344 C347 F351 N356 Y357 K358 L362 T363 H364C344-H360 PolarHBondContact SG-NE2 2.63Å; C344-H360 VanDerWaalsContact SG-NE2 3.37Å; C347-H360 PolarHBondContact SG-NE2 3.4Å; F351-H360 HydrophobicContact CE1-CB 3.88Å; F351-H360 HydrophobicContact CE2-CB 3.92Å; F351-H360 AromaticContact CE2-CD2 3.29Å; F351-H360 WeakPolarHBondContact CE2-CD2 3.16Å; F351-H360 AromaticContact CE2-CG 3.66Å; F351-H360 HydrophobicContact CZ-CB 3.38Å; F351-H360 AromaticContact CZ-CD2 3.32Å; F351-H360 WeakPolarHBondContact CZ-CD2 3.09Å; F351-H360 AromaticContact CZ-CG 3.19Å; F351-H360 AromaticContact CZ-ND1 3.85Å; F351-H360 AromaticContact CZ-NE2 4Å; N356-H360 WeakPolarHBondContact O-CB 3.41Å; N356-H360 PolarHBondContact O-N 2.95Å; Y357-H360 WeakPolarHBondContact O-CB 3.46Å; Y357-H360 PolarHBondContact O-N 2.87Å; K358-H360 PolarHBondContact O-N 3.38Å; H360-L362 PolarHBondContact O-N 2.92Å; H360-L362 VanDerWaalsContact O-N 3.15Å; H360-T363 WeakPolarHBondContact O-CB 3.43Å; H360-T363 PolarHBondContact O-N 2.76Å; H360-T363 PolarHBondContact O-OG1 3.37Å; H360-H364 AromaticContact CE1-NE2 3.4Å; H360-H364 PolarHBondContact CE1-NE2 3.29Å; H360-H364 AromaticContact NE2-CD2 3.82Å; H360-H364 AromaticContact NE2-NE2 3.19Å; H360-H364 PolarHBondContact NE2-NE2 3.36Å; H360-H364 VanDerWaalsContact NE2-NE2 3.19Å
361K88.6Confident86.3Confident72 Ų7273.8 Ų73.831%0.31337%0.373SS..Hα-helixtrans-56.4-33.5176.3-69.3-166.183.2162.30112.4Y357 K358 T363 H364 S365Y357-K361 HydrophobicContact CE1-CD 3.78Å; Y357-K361 HydrophobicContact CE1-CG 4.28Å; Y357-K361 HydrophobicContact CE2-CD 4.21Å; Y357-K361 HydrophobicContact CE2-CG 4.11Å; Y357-K361 PolarHBondContact O-N 2.94Å; K358-K361 PolarHBondContact O-N 2.91Å; K358-K361 VanDerWaalsContact O-N 3.15Å; K361-T363 PolarHBondContact O-N 3.45Å; K361-H364 PolarHBondContact O-N 3.16Å; K361-S365 PolarHBondContact O-N 3.19Å
362L86.3Confident86.2Confident28 Ų2872.4 Ų72.415%0.14737%0.366CS..Hα-helixtrans-62.8-21.4176.9-60175.6000113.4K358 N359 H360 H364 S365 G366 E367 H380K358-L362 PolarHBondContact O-N 2.91Å; N359-L362 WeakPolarHBondContact O-CB 3.47Å; N359-L362 PolarHBondContact O-N 3.4Å; H360-L362 PolarHBondContact O-N 2.92Å; H360-L362 VanDerWaalsContact O-N 3.15Å; L362-H364 VanDerWaalsContact C-N 3.28Å; L362-S365 PolarHBondContact O-OG 3.19Å; L362-G366 PolarHBondContact O-N 2.86Å; L362-E367 HydrophobicContact CD2-CB 4.26Å; L362-H380 HydrophobicContact CB-CB 4.45Å; L362-H380 PolarHBondContact O-CE1 3.43Å; L362-H380 PolarHBondContact O-ND1 2.86Å
363T85.1Confident86.2Confident74 Ų7476.7 Ų76.745%0.45439%0.391SS..Hα-helixtrans-73.7-23.7175.569.60000112.3H360 K361H360-T363 WeakPolarHBondContact O-CB 3.43Å; H360-T363 PolarHBondContact O-N 2.76Å; H360-T363 PolarHBondContact O-OG1 3.37Å; K361-T363 PolarHBondContact O-N 3.45Å
364H85.1Confident86.2Confident80 Ų8077.3 Ų77.337%0.3740%0.396SS..Hα-helixtrans-85.3-37.8176.8-66.2-59.2000112.2C344 F346 C347 H360 K361 L362 G366C344-H364 VanDerWaalsContact SG-CD2 3.58Å; C344-H364 PolarHBondContact SG-NE2 3.12Å; F346-H364 HydrophobicContact CD2-CB 4.36Å; C347-H364 PolarHBondContact SG-NE2 3.13Å; H360-H364 AromaticContact CE1-NE2 3.4Å; H360-H364 PolarHBondContact CE1-NE2 3.29Å; H360-H364 AromaticContact NE2-CD2 3.82Å; H360-H364 AromaticContact NE2-NE2 3.19Å; H360-H364 PolarHBondContact NE2-NE2 3.36Å; H360-H364 VanDerWaalsContact NE2-NE2 3.19Å; K361-H364 PolarHBondContact O-N 3.16Å; L362-H364 VanDerWaalsContact C-N 3.28Å; H364-G366 VanDerWaalsContact C-N 3.26Å; H364-G366 PolarHBondContact O-N 3Å
365S80.6Confident86.2Confident62 Ų6273.6 Ų73.643%0.43439%0.385SS..Hα-helixtrans-76.4-13.1177.262.50000113.7K361 L362 E367K361-S365 PolarHBondContact O-N 3.19Å; L362-S365 PolarHBondContact O-OG 3.19Å; S365-E367 PolarHBondContact O-N 3.35Å; S365-E367 VanDerWaalsContact O-N 3.11Å; S365-E367 WeakPolarHBondContact OG-CB 3.5Å; S365-E367 WeakPolarHBondContact OG-CG 3.37Å; S365-E367 PolarHBondContact OG-N 3.05Å
366G75.8Confident86.1Confident45 Ų4577.7 Ų77.746%0.46440%0.398SS..  trans69.21.8-174.500000113.9L362 H364 K368L362-G366 PolarHBondContact O-N 2.86Å; H364-G366 VanDerWaalsContact C-N 3.26Å; H364-G366 PolarHBondContact O-N 3Å; G366-K368 PolarHBondContact O-N 3.24Å
367E76.3Confident86Confident105 Ų10579.9 Ų79.949%0.49140%0.404SS..  trans-64.7106.8-178.4-75175.7-146.100111.1L362 S365 H380L362-E367 HydrophobicContact CD2-CB 4.26Å; S365-E367 PolarHBondContact O-N 3.35Å; S365-E367 VanDerWaalsContact O-N 3.11Å; S365-E367 WeakPolarHBondContact OG-CB 3.5Å; S365-E367 WeakPolarHBondContact OG-CG 3.37Å; S365-E367 PolarHBondContact OG-N 3.05Å; E367-H380 PolarHBondContact O-ND1 3.33Å
368K80.2Confident85.8Confident107 Ų10779.4 Ų79.447%0.46541%0.407SS..  trans-106.793.1177.3-70.8164.8170.9-176.40109.6G366 F370 A378 F379 H380G366-K368 PolarHBondContact O-N 3.24Å; K368-F370 VanDerWaalsContact C-N 3.32Å; K368-F370 PolarHBondContact O-N 3.46Å; K368-A378 HydrophobicContact CB-CB 3.41Å; K368-A378 VanDerWaalsContact CB-CB 3.41Å; K368-A378 HydrophobicContact CD-CB 3.92Å; K368-A378 VanDerWaalsContact CD-O 3.3Å; K368-A378 WeakPolarHBondContact CD-O 3.4Å; K368-A378 HydrophobicContact CG-CB 4.23Å; K368-F379 CarbonylContact C-O 3.53Å; K368-F379 WeakPolarHBondContact CA-O 3.37Å; K368-H380 VanDerWaalsContact CG-CE1 3.45Å; K368-H380 WeakPolarHBondContact CG-CE1 3.36Å
369Q81.4Confident85.6Confident121 Ų12175.7 Ų75.757%0.56539%0.391SS*.  trans-75.5-19.3-174-63.3179.7-1200113.4F379Q369-F379 PolarHBondContact N-O 2.75Å
370F86.4Confident85.4Confident62 Ų6274.9 Ų74.927%0.27239%0.386SS..EExtended strand (participates in β ladder)trans-112.9103.8-172.2-55.9-70.8000110.8K368 A378 F379 V382 L385K368-F370 VanDerWaalsContact C-N 3.32Å; K368-F370 PolarHBondContact O-N 3.46Å; F370-A378 CarbonylContact O-C 3.48Å; F370-A378 WeakPolarHBondContact O-CA 3.35Å; F370-F379 HydrophobicContact CB-CB 4.48Å; F370-F379 PolarHBondContact N-O 3.26Å; F370-F379 PolarHBondContact O-N 3.3Å; F370-V382 HydrophobicContact CD1-CG2 3.57Å; F370-V382 HydrophobicContact CD2-CG2 4.22Å; F370-V382 HydrophobicContact CE1-CG2 3.22Å; F370-V382 HydrophobicContact CE2-CG2 3.91Å; F370-V382 HydrophobicContact CG-CG2 4.06Å; F370-V382 HydrophobicContact CZ-CG2 3.41Å; F370-V382 VanDerWaalsContact CZ-CG2 3.41Å; F370-L385 HydrophobicContact CB-CB 4.17Å; F370-L385 HydrophobicContact CB-CD2 3.89Å
371K88.3Confident85.1Confident149 Ų14975.5 Ų75.565%0.64839%0.389SS*.EExtended strand (participates in β ladder)trans-96.2140.5-179.7-62.1-176.4-178.71800111.5A378K371-A378 HydrophobicContact CG-CB 3.92Å
372C91.4Very high85Confident0 Ų075.8 Ų75.80%040%0.396CS..  trans-70.7127.9166.9174.60000109.8I374 C375 N376 K377 L385 H388 M389 H392C372-I374 VanDerWaalsContact C-N 3.31Å; C372-I374 PolarHBondContact SG-N 2.92Å; C372-I374 VanDerWaalsContact SG-N 3.36Å; C372-C375 PolarHBondContact SG-N 3.23Å; C372-N376 WeakPolarHBondContact O-CA 3.33Å; C372-N376 PolarHBondContact O-N 3.01Å; C372-K377 HydrophobicContact CB-CB 4.41Å; C372-K377 VanDerWaalsContact CB-O 3.29Å; C372-K377 WeakPolarHBondContact CB-O 3.28Å; C372-K377 PolarHBondContact N-O 3.1Å; C372-L385 HydrophobicContact CB-CD1 3.99Å; C372-H388 PolarHBondContact SG-NE2 3.22Å; C372-M389 HydrophobicContact CB-CE 3.71Å; C372-M389 WeakPolarHBondContact SG-CE 3.4Å; C372-H392 PolarHBondContact SG-NE2 3.44Å
373N89.1Confident85Confident134 Ų13479.9 Ų79.972%0.71741%0.411SS*.THydrogen-bonded Turntrans-75.8-17.3177.160.8-21000113.7
374I88.7Confident85.1Confident94 Ų9479.1 Ų79.148%0.48240%0.404SS..THydrogen-bonded Turntrans-91.5-48.4-178.1-61.6168.5000111.2C372 H392C372-I374 VanDerWaalsContact C-N 3.31Å; C372-I374 PolarHBondContact SG-N 2.92Å; C372-I374 VanDerWaalsContact SG-N 3.36Å; I374-H392 HydrophobicContact CD1-CB 3.48Å; I374-H392 VanDerWaalsContact CD1-CB 3.48Å
375C90.9Very high85.3Confident48 Ų4876.7 Ų76.732%0.32439%0.393SS..THydrogen-bonded Turntrans-122.313.2-17479.20000114C372 K377 H388 H392C372-C375 PolarHBondContact SG-N 3.23Å; C375-K377 PolarHBondContact O-N 3.02Å; C375-K377 VanDerWaalsContact SG-CG 3.58Å; C375-H388 VanDerWaalsContact SG-CE1 3.56Å; C375-H388 PolarHBondContact SG-NE2 3.48Å; C375-H392 PolarHBondContact SG-NE2 3.29Å
376N86.6Confident85.6Confident125 Ų12576.9 Ų76.967%0.66839%0.392SS*.  trans56.47.9176.8-70.8-45.1000116.9C372 A378C372-N376 WeakPolarHBondContact O-CA 3.33Å; C372-N376 PolarHBondContact O-N 3.01Å; N376-A378 PolarHBondContact O-N 3.09Å
377K87.3Confident86.1Confident129 Ų12978.1 Ų78.156%0.56139%0.385SS*.  trans-64.3131.4174.5-74.2-176.7-176.9-172.30110.3C372 C375 F379C372-K377 HydrophobicContact CB-CB 4.41Å; C372-K377 VanDerWaalsContact CB-O 3.29Å; C372-K377 WeakPolarHBondContact CB-O 3.28Å; C372-K377 PolarHBondContact N-O 3.1Å; C375-K377 PolarHBondContact O-N 3.02Å; C375-K377 VanDerWaalsContact SG-CG 3.58Å; K377-F379 HydrophobicContact CB-CE2 4Å; K377-F379 HydrophobicContact CB-CZ 4.13Å; K377-F379 WeakPolarHBondContact O-CE2 3.48Å
378A87.9Confident86.6Confident27 Ų2774.2 Ų74.222%0.22337%0.366CS..EExtended strand (participates in β ladder)trans-106.7143.5-175.700000111.8K368 F370 K371 N376K368-A378 HydrophobicContact CB-CB 3.41Å; K368-A378 VanDerWaalsContact CB-CB 3.41Å; K368-A378 HydrophobicContact CD-CB 3.92Å; K368-A378 VanDerWaalsContact CD-O 3.3Å; K368-A378 WeakPolarHBondContact CD-O 3.4Å; K368-A378 HydrophobicContact CG-CB 4.23Å; F370-A378 CarbonylContact O-C 3.48Å; F370-A378 WeakPolarHBondContact O-CA 3.35Å; K371-A378 HydrophobicContact CG-CB 3.92Å; N376-A378 PolarHBondContact O-N 3.09Å
379F85.6Confident86.9Confident44 Ų4470.7 Ų70.719%0.19335%0.352CS..EExtended strand (participates in β ladder)trans-130.5152.3-175.6-57.7-89.3000111K368 Q369 F370 K377 N384 L385 H388K368-F379 CarbonylContact C-O 3.53Å; K368-F379 WeakPolarHBondContact CA-O 3.37Å; Q369-F379 PolarHBondContact N-O 2.75Å; F370-F379 HydrophobicContact CB-CB 4.48Å; F370-F379 PolarHBondContact N-O 3.26Å; F370-F379 PolarHBondContact O-N 3.3Å; K377-F379 HydrophobicContact CB-CE2 4Å; K377-F379 HydrophobicContact CB-CZ 4.13Å; K377-F379 WeakPolarHBondContact O-CE2 3.48Å; F379-N384 HydrophobicContact CB-CB 4.1Å; F379-N384 HydrophobicContact CD1-CB 3.81Å; F379-N384 HydrophobicContact CG-CB 4.18Å; F379-L385 HydrophobicContact CB-CB 4.48Å; F379-L385 HydrophobicContact CD2-CB 3.96Å; F379-L385 HydrophobicContact CD2-CD1 3.9Å; F379-L385 HydrophobicContact CE2-CD1 4.03Å; F379-L385 HydrophobicContact CG-CB 4.4Å; F379-H388 HydrophobicContact CE1-CB 4.02Å; F379-H388 HydrophobicContact CE2-CB 3.82Å; F379-H388 AromaticContact CE2-CD2 3.3Å; F379-H388 WeakPolarHBondContact CE2-CD2 3.21Å; F379-H388 AromaticContact CE2-CG 3.64Å; F379-H388 HydrophobicContact CZ-CB 3.39Å; F379-H388 AromaticContact CZ-CD2 3.41Å; F379-H388 VanDerWaalsContact CZ-CD2 3.41Å; F379-H388 WeakPolarHBondContact CZ-CD2 3.29Å; F379-H388 AromaticContact CZ-CG 3.27Å; F379-H388 AromaticContact CZ-ND1 3.94Å
380H82.7Confident87.1Confident38 Ų3866.6 Ų66.618%0.17633%0.333CS..SBendtrans-79-17.5176.2-57.1-72.5000113.5L362 E367 K368L362-H380 HydrophobicContact CB-CB 4.45Å; L362-H380 PolarHBondContact O-CE1 3.43Å; L362-H380 PolarHBondContact O-ND1 2.86Å; E367-H380 PolarHBondContact O-ND1 3.33Å; K368-H380 VanDerWaalsContact CG-CE1 3.45Å; K368-H380 WeakPolarHBondContact CG-CE1 3.36Å
381Q83.8Confident87Confident42 Ų4267.3 Ų67.320%0.19634%0.342CS..SBendtrans-139.9141.5-173.9-54.3-169.45600111.6N359 Y383 N384 L385N359-Q381 PolarHBondContact ND2-OE1 3.01Å; Q381-Y383 VanDerWaalsContact C-N 3.32Å; Q381-Y383 HydrophobicContact CB-CD1 3.9Å; Q381-Y383 HydrophobicContact CB-CE1 3.7Å; Q381-Y383 VanDerWaalsContact CD-CE1 3.48Å; Q381-Y383 HydrophobicContact CG-CE1 4.18Å; Q381-Y383 PolarHBondContact NE2-OH 2.94Å; Q381-Y383 PolarHBondContact O-N 3.25Å; Q381-N384 WeakPolarHBondContact O-CB 3.42Å; Q381-N384 PolarHBondContact O-N 3.37Å; Q381-N384 VanDerWaalsContact O-N 3.12Å; Q381-L385 PolarHBondContact O-N 3.45Å
382V86.1Confident86.8Confident78 Ų7863.1 Ų63.147%0.47333%0.325SS..Hα-helixtrans-58-40-178.6179.60000112.6F370 N384 L385 T386F370-V382 HydrophobicContact CD1-CG2 3.57Å; F370-V382 HydrophobicContact CD2-CG2 4.22Å; F370-V382 HydrophobicContact CE1-CG2 3.22Å; F370-V382 HydrophobicContact CE2-CG2 3.91Å; F370-V382 HydrophobicContact CG-CG2 4.06Å; F370-V382 HydrophobicContact CZ-CG2 3.41Å; F370-V382 VanDerWaalsContact CZ-CG2 3.41Å; V382-N384 VanDerWaalsContact C-N 3.28Å; V382-N384 PolarHBondContact O-N 3.05Å; V382-L385 WeakPolarHBondContact O-CB 3.19Å; V382-L385 PolarHBondContact O-N 2.99Å; V382-T386 PolarHBondContact O-N 3.03Å; V382-T386 PolarHBondContact O-OG1 3.49Å
383Y84.9Confident86.4Confident114 Ų11467.4 Ų67.445%0.44735%0.348SS..Hα-helixtrans-66.2-33.1-179.372.3-103.3000111.8Q381 T386 F387Q381-Y383 VanDerWaalsContact C-N 3.32Å; Q381-Y383 HydrophobicContact CB-CD1 3.9Å; Q381-Y383 HydrophobicContact CB-CE1 3.7Å; Q381-Y383 VanDerWaalsContact CD-CE1 3.48Å; Q381-Y383 HydrophobicContact CG-CE1 4.18Å; Q381-Y383 PolarHBondContact NE2-OH 2.94Å; Q381-Y383 PolarHBondContact O-N 3.25Å; Y383-T386 PolarHBondContact O-N 2.89Å; Y383-F387 AromaticContact CD2-CD2 3.94Å; Y383-F387 HydrophobicContact CD2-CD2 3.94Å; Y383-F387 AromaticContact CD2-CE2 3.81Å; Y383-F387 HydrophobicContact CD2-CE2 3.81Å; Y383-F387 WeakPolarHBondContact O-CD2 3.33Å; Y383-F387 WeakPolarHBondContact O-CG 3.21Å; Y383-F387 PolarHBondContact O-N 2.87Å
384N87.3Confident85.8Confident57 Ų5766.8 Ų66.831%0.30535%0.345SS..Hα-helixtrans-66-42175.1-73.8-34.5000110.5F379 Q381 V382 T386 F387 H388F379-N384 HydrophobicContact CB-CB 4.1Å; F379-N384 HydrophobicContact CD1-CB 3.81Å; F379-N384 HydrophobicContact CG-CB 4.18Å; Q381-N384 WeakPolarHBondContact O-CB 3.42Å; Q381-N384 PolarHBondContact O-N 3.37Å; Q381-N384 VanDerWaalsContact O-N 3.12Å; V382-N384 VanDerWaalsContact C-N 3.28Å; V382-N384 PolarHBondContact O-N 3.05Å; N384-T386 VanDerWaalsContact C-N 3.34Å; N384-F387 PolarHBondContact O-N 3.17Å; N384-H388 VanDerWaalsContact O-CB 3.31Å; N384-H388 WeakPolarHBondContact O-CB 3.45Å; N384-H388 PolarHBondContact O-N 3.2Å
385L89.4Confident85.4Confident30 Ų3068.7 Ų68.716%0.15735%0.349CS..Hα-helixtrans-60.8-44.4171.9173.962.1000111F370 C372 F379 Q381 V382 F387 H388 M389F370-L385 HydrophobicContact CB-CB 4.17Å; F370-L385 HydrophobicContact CB-CD2 3.89Å; C372-L385 HydrophobicContact CB-CD1 3.99Å; F379-L385 HydrophobicContact CB-CB 4.48Å; F379-L385 HydrophobicContact CD2-CB 3.96Å; F379-L385 HydrophobicContact CD2-CD1 3.9Å; F379-L385 HydrophobicContact CE2-CD1 4.03Å; F379-L385 HydrophobicContact CG-CB 4.4Å; Q381-L385 PolarHBondContact O-N 3.45Å; V382-L385 WeakPolarHBondContact O-CB 3.19Å; V382-L385 PolarHBondContact O-N 2.99Å; L385-F387 PolarHBondContact O-N 3.14Å; L385-H388 CarbonylContact O-C 3.52Å; L385-H388 WeakPolarHBondContact O-CA 3.33Å; L385-H388 WeakPolarHBondContact O-CB 3.46Å; L385-H388 PolarHBondContact O-N 3.24Å; L385-H388 VanDerWaalsContact O-N 3.14Å; L385-M389 HydrophobicContact CD1-CE 3.59Å; L385-M389 HydrophobicContact CD1-CG 4.42Å; L385-M389 HydrophobicContact CD1-SD 4.39Å; L385-M389 WeakPolarHBondContact O-CG 3.39Å; L385-M389 PolarHBondContact O-N 3.09Å
386T88.2Confident85.1Confident66 Ų6671.7 Ų71.741%0.40536%0.357SS..Hα-helixtrans-60.8-47.1179.5-51.30000111.4V382 Y383 N384 H388 M389 H390V382-T386 PolarHBondContact O-N 3.03Å; V382-T386 PolarHBondContact O-OG1 3.49Å; Y383-T386 PolarHBondContact O-N 2.89Å; N384-T386 VanDerWaalsContact C-N 3.34Å; T386-H388 VanDerWaalsContact C-N 3.29Å; T386-H388 PolarHBondContact O-N 3.36Å; T386-M389 WeakPolarHBondContact O-CB 3.15Å; T386-M389 PolarHBondContact O-N 3.46Å; T386-M389 VanDerWaalsContact O-N 3.1Å; T386-H390 PolarHBondContact O-N 2.91Å
387F85Confident85Confident70 Ų7069.2 Ų69.231%0.30735%0.348SS..Hα-helixtrans-66.1-33.1175-68.9-53.2000112.7Y383 N384 L385 M389 H390 C408 R409Y383-F387 AromaticContact CD2-CD2 3.94Å; Y383-F387 HydrophobicContact CD2-CD2 3.94Å; Y383-F387 AromaticContact CD2-CE2 3.81Å; Y383-F387 HydrophobicContact CD2-CE2 3.81Å; Y383-F387 WeakPolarHBondContact O-CD2 3.33Å; Y383-F387 WeakPolarHBondContact O-CG 3.21Å; Y383-F387 PolarHBondContact O-N 2.87Å; N384-F387 PolarHBondContact O-N 3.17Å; L385-F387 PolarHBondContact O-N 3.14Å; F387-M389 VanDerWaalsContact C-N 3.32Å; F387-H390 AromaticContact CD1-ND1 3.96Å; F387-H390 WeakPolarHBondContact O-CB 3.4Å; F387-H390 PolarHBondContact O-N 2.98Å; F387-C408 WeakPolarHBondContact CD1-O 3.36Å; F387-R409 HydrophobicContact CB-CG 4.17Å; F387-R409 HydrophobicContact CD1-CG 3.99Å; F387-R409 HydrophobicContact CG-CG 4Å
388H87.2Confident85.1Confident24 Ų2465.9 Ų65.911%0.11133%0.333CS..Hα-helixtrans-66.5-35.1171.1172.757.5000111.7C372 C375 F379 N384 L385 T386 H390 T391 H392C372-H388 PolarHBondContact SG-NE2 3.22Å; C375-H388 VanDerWaalsContact SG-CE1 3.56Å; C375-H388 PolarHBondContact SG-NE2 3.48Å; F379-H388 HydrophobicContact CE1-CB 4.02Å; F379-H388 HydrophobicContact CE2-CB 3.82Å; F379-H388 AromaticContact CE2-CD2 3.3Å; F379-H388 WeakPolarHBondContact CE2-CD2 3.21Å; F379-H388 AromaticContact CE2-CG 3.64Å; F379-H388 HydrophobicContact CZ-CB 3.39Å; F379-H388 AromaticContact CZ-CD2 3.41Å; F379-H388 VanDerWaalsContact CZ-CD2 3.41Å; F379-H388 WeakPolarHBondContact CZ-CD2 3.29Å; F379-H388 AromaticContact CZ-CG 3.27Å; F379-H388 AromaticContact CZ-ND1 3.94Å; N384-H388 VanDerWaalsContact O-CB 3.31Å; N384-H388 WeakPolarHBondContact O-CB 3.45Å; N384-H388 PolarHBondContact O-N 3.2Å; L385-H388 CarbonylContact O-C 3.52Å; L385-H388 WeakPolarHBondContact O-CA 3.33Å; L385-H388 WeakPolarHBondContact O-CB 3.46Å; L385-H388 PolarHBondContact O-N 3.24Å; L385-H388 VanDerWaalsContact O-N 3.14Å; T386-H388 VanDerWaalsContact C-N 3.29Å; T386-H388 PolarHBondContact O-N 3.36Å; H388-H390 PolarHBondContact O-N 3.16Å; H388-T391 PolarHBondContact ND1-OG1 3.42Å; H388-T391 WeakPolarHBondContact O-CB 3.32Å; H388-T391 PolarHBondContact O-N 3.3Å; H388-T391 PolarHBondContact O-OG1 3Å; H388-H392 AromaticContact CE1-CD2 3.98Å; H388-H392 AromaticContact CE1-NE2 3.2Å; H388-H392 PolarHBondContact CE1-NE2 3.07Å; H388-H392 AromaticContact NE2-CD2 3.83Å; H388-H392 AromaticContact NE2-NE2 3.09Å; H388-H392 PolarHBondContact NE2-NE2 2.74Å
389M86.7Confident85.2Confident32 Ų3268.7 Ų68.716%0.15835%0.348CS..Hα-helixtrans-62.6-28.7176.6-69.7-55.289.200112.3C372 L385 T386 F387 T391 H392 N393C372-M389 HydrophobicContact CB-CE 3.71Å; C372-M389 WeakPolarHBondContact SG-CE 3.4Å; L385-M389 HydrophobicContact CD1-CE 3.59Å; L385-M389 HydrophobicContact CD1-CG 4.42Å; L385-M389 HydrophobicContact CD1-SD 4.39Å; L385-M389 WeakPolarHBondContact O-CG 3.39Å; L385-M389 PolarHBondContact O-N 3.09Å; T386-M389 WeakPolarHBondContact O-CB 3.15Å; T386-M389 PolarHBondContact O-N 3.46Å; T386-M389 VanDerWaalsContact O-N 3.1Å; F387-M389 VanDerWaalsContact C-N 3.32Å; M389-T391 PolarHBondContact O-N 3.44Å; M389-H392 PolarHBondContact O-N 2.78Å; M389-H392 VanDerWaalsContact O-N 3.16Å; M389-N393 PolarHBondContact O-N 3.25Å; M389-N393 PolarHBondContact O-ND2 3.3Å
390H86.8Confident85.5Confident35 Ų3566.7 Ų66.716%0.16234%0.339CS..THydrogen-bonded Turntrans-62.3-22.7172.9-65.3163.2000113.3T386 F387 H388 H392 D394 K395 C408T386-H390 PolarHBondContact O-N 2.91Å; F387-H390 AromaticContact CD1-ND1 3.96Å; F387-H390 WeakPolarHBondContact O-CB 3.4Å; F387-H390 PolarHBondContact O-N 2.98Å; H388-H390 PolarHBondContact O-N 3.16Å; H390-H392 VanDerWaalsContact C-N 3.33Å; H390-D394 PolarHBondContact O-N 3.5Å; H390-K395 VanDerWaalsContact CB-O 3.32Å; H390-K395 WeakPolarHBondContact CB-O 3.49Å; H390-K395 PolarHBondContact O-N 3.12Å; H390-C408 HydrophobicContact CB-CB 3.88Å; H390-C408 PolarHBondContact ND1-O 3.17Å
391T83.7Confident85.8Confident77 Ų7770.4 Ų70.447%0.47237%0.367SS..THydrogen-bonded Turntrans-77.6-18.4176.673.70000113.4H388 M389H388-T391 PolarHBondContact ND1-OG1 3.42Å; H388-T391 WeakPolarHBondContact O-CB 3.32Å; H388-T391 PolarHBondContact O-N 3.3Å; H388-T391 PolarHBondContact O-OG1 3Å; M389-T391 PolarHBondContact O-N 3.44Å
392H84.2Confident86.1Confident61 Ų6173.1 Ų73.128%0.28239%0.386SS..THydrogen-bonded Turntrans-95.5-26.9177.2-64.4-67.9000112.9C372 I374 C375 H388 M389 H390C372-H392 PolarHBondContact SG-NE2 3.44Å; I374-H392 HydrophobicContact CD1-CB 3.48Å; I374-H392 VanDerWaalsContact CD1-CB 3.48Å; C375-H392 PolarHBondContact SG-NE2 3.29Å; H388-H392 AromaticContact CE1-CD2 3.98Å; H388-H392 AromaticContact CE1-NE2 3.2Å; H388-H392 PolarHBondContact CE1-NE2 3.07Å; H388-H392 AromaticContact NE2-CD2 3.83Å; H388-H392 AromaticContact NE2-NE2 3.09Å; H388-H392 PolarHBondContact NE2-NE2 2.74Å; M389-H392 PolarHBondContact O-N 2.78Å; M389-H392 VanDerWaalsContact O-N 3.16Å; H390-H392 VanDerWaalsContact C-N 3.33Å
393N82.7Confident86.3Confident90 Ų9072 Ų7248%0.48138%0.381SS..SBendtrans-100.15-176.8-63.7-81000112.6M389 K395M389-N393 PolarHBondContact O-N 3.25Å; M389-N393 PolarHBondContact O-ND2 3.3Å; N393-K395 HydrophobicContact CB-CD 4.2Å; N393-K395 HydrophobicContact CB-CG 3.97Å; N393-K395 PolarHBondContact O-N 3.32Å
394D76.8Confident86.5Confident122 Ų12269.1 Ų69.165%0.65239%0.386SS*.  trans47.718.6-171-69.7-56.6000115.5H390 K396H390-D394 PolarHBondContact O-N 3.5Å; D394-K396 PolarHBondContact O-N 3.47Å; D394-K396 VanDerWaalsContact O-N 3.11Å
395K80.3Confident86.5Confident133 Ų13372.4 Ų72.458%0.57840%0.398SS*.  trans-70.1113177.7-72.1-175.8-179.91800107.7H390 N393 P397H390-K395 VanDerWaalsContact CB-O 3.32Å; H390-K395 WeakPolarHBondContact CB-O 3.49Å; H390-K395 PolarHBondContact O-N 3.12Å; N393-K395 HydrophobicContact CB-CD 4.2Å; N393-K395 HydrophobicContact CB-CG 3.97Å; N393-K395 PolarHBondContact O-N 3.32Å; K395-P397 WeakPolarHBondContact O-CD 3.31Å
396K84.6Confident86.5Confident112 Ų11272.2 Ų72.249%0.48740%0.403SS..  trans-113.282.3174.8-74.2165.6178.4175.80108.7D394 F398 G406 F407D394-K396 PolarHBondContact O-N 3.47Å; D394-K396 VanDerWaalsContact O-N 3.11Å; K396-F398 PolarHBondContact O-N 2.8Å; K396-F398 VanDerWaalsContact O-N 3.11Å; K396-G406 WeakPolarHBondContact CD-O 3.48Å; K396-F407 CarbonylContact C-O 3.58Å; K396-F407 WeakPolarHBondContact CA-O 3.45Å
397P84.8Confident86.4Confident73 Ų7370.9 Ų70.947%0.47439%0.392SS..  trans-68.6-14.1-171.7-14.830.3000113K395 F407K395-P397 WeakPolarHBondContact O-CD 3.31Å; P397-F407 WeakPolarHBondContact CD-O 3.37Å
398F88.2Confident86.4Confident58 Ų5868.9 Ų68.925%0.25439%0.386SS..EExtended strand (participates in β ladder)trans-114.6103.9-175-55.5-73.3000109.3K396 G406 F407 N410 L413K396-F398 PolarHBondContact O-N 2.8Å; K396-F398 VanDerWaalsContact O-N 3.11Å; F398-G406 CarbonylContact O-C 3.6Å; F398-G406 WeakPolarHBondContact O-CA 3.25Å; F398-F407 HydrophobicContact CB-CB 4.38Å; F398-F407 PolarHBondContact N-O 3.12Å; F398-F407 PolarHBondContact O-N 3.39Å; F398-N410 HydrophobicContact CD1-CB 3.94Å; F398-N410 HydrophobicContact CD2-CB 4.42Å; F398-N410 HydrophobicContact CE1-CB 3.81Å; F398-N410 HydrophobicContact CE2-CB 4.3Å; F398-N410 HydrophobicContact CG-CB 4.23Å; F398-N410 HydrophobicContact CZ-CB 4Å; F398-L413 HydrophobicContact CB-CB 4.25Å; F398-L413 HydrophobicContact CB-CD2 3.84Å
399T90.2Very high86.2Confident86 Ų8673.4 Ų73.453%0.52840%0.402SS..EExtended strand (participates in β ladder)trans-98.2143.5176.249.50000110.5P401 K405T399-P401 WeakPolarHBondContact O-CD 3.41Å; T399-K405 CarbonylContact C-O 3.22Å
400C92.9Very high86.3Confident2 Ų274.8 Ų74.81%0.01441%0.41CS..  trans-73.1122.9170.9-178.60000109.4T402 C403 G404 K405 F407 L413 H421C400-T402 PolarHBondContact O-N 3.34Å; C400-C403 VanDerWaalsContact CB-SG 3.6Å; C400-G404 VanDerWaalsContact O-CA 3.24Å; C400-G404 WeakPolarHBondContact O-CA 3.44Å; C400-G404 PolarHBondContact O-N 3.5Å; C400-K405 PolarHBondContact N-O 3.02Å; C400-F407 HydrophobicContact CB-CE2 4.29Å; C400-L413 HydrophobicContact CB-CD1 3.71Å; C400-H421 VanDerWaalsContact SG-CD2 3.55Å; C400-H421 PolarHBondContact SG-NE2 3.39Å; C400-H421 VanDerWaalsContact SG-NE2 3.44Å
401P88.4Confident86.3Confident117 Ų11779.4 Ų79.476%0.7643%0.43SS*.THydrogen-bonded Turntrans-62.7-32.3177.3-2233.6000112.6T399T399-P401 WeakPolarHBondContact O-CD 3.41Å
402T89.1Confident86.6Confident98 Ų9877.7 Ų77.760%0.60142%0.418SS*.THydrogen-bonded Turntrans-81.3-38.1-173.9-41.30000113.2C400 H421C400-T402 PolarHBondContact O-N 3.34Å; T402-H421 WeakPolarHBondContact CG2-ND1 3.45Å
403C92.1Very high86.9Confident54 Ų5475.5 Ų75.537%0.36541%0.408SS..THydrogen-bonded Turntrans-126.75.1-173.774.70000114.7C400 K405 H416C400-C403 VanDerWaalsContact CB-SG 3.6Å; C403-K405 PolarHBondContact O-N 3.38Å; C403-H416 PolarHBondContact SG-NE2 3.06Å
404G87.1Confident87.3Confident54 Ų5477.1 Ų77.156%0.55741%0.411SS*.  trans69.9-7.2178.600000115.9C400 G406C400-G404 VanDerWaalsContact O-CA 3.24Å; C400-G404 WeakPolarHBondContact O-CA 3.44Å; C400-G404 PolarHBondContact O-N 3.5Å; G404-G406 PolarHBondContact O-N 3.13Å
405K88.6Confident88Confident127 Ų12775.9 Ų75.955%0.55240%0.4SS*.  trans-61.6127.3-178-72-177.9-179.4178.90111.5T399 C400 C403 F407T399-K405 CarbonylContact C-O 3.22Å; C400-K405 PolarHBondContact N-O 3.02Å; C403-K405 PolarHBondContact O-N 3.38Å; K405-F407 HydrophobicContact CB-CE2 3.9Å; K405-F407 HydrophobicContact CB-CZ 4.09Å; K405-F407 VanDerWaalsContact O-CD2 3.29Å; K405-F407 WeakPolarHBondContact O-CD2 3.29Å; K405-F407 WeakPolarHBondContact O-CE2 3.4Å
406G88.4Confident88.5Confident25 Ų2570.6 Ų70.626%0.25838%0.377SS..EExtended strand (participates in β ladder)trans-89.1142.3178.300000113.6K396 F398 G404K396-G406 WeakPolarHBondContact CD-O 3.48Å; F398-G406 CarbonylContact O-C 3.6Å; F398-G406 WeakPolarHBondContact O-CA 3.25Å; G404-G406 PolarHBondContact O-N 3.13Å
407F86.6Confident88.8Confident39 Ų3967.3 Ų67.317%0.17136%0.364CS..EExtended strand (participates in β ladder)trans-131.1145.6-179.3-60.3-89.4000111.3K396 P397 F398 C400 K405 D412 L413 H416K396-F407 CarbonylContact C-O 3.58Å; K396-F407 WeakPolarHBondContact CA-O 3.45Å; P397-F407 WeakPolarHBondContact CD-O 3.37Å; F398-F407 HydrophobicContact CB-CB 4.38Å; F398-F407 PolarHBondContact N-O 3.12Å; F398-F407 PolarHBondContact O-N 3.39Å; C400-F407 HydrophobicContact CB-CE2 4.29Å; K405-F407 HydrophobicContact CB-CE2 3.9Å; K405-F407 HydrophobicContact CB-CZ 4.09Å; K405-F407 VanDerWaalsContact O-CD2 3.29Å; K405-F407 WeakPolarHBondContact O-CD2 3.29Å; K405-F407 WeakPolarHBondContact O-CE2 3.4Å; F407-D412 HydrophobicContact CB-CB 4.44Å; F407-D412 HydrophobicContact CD1-CB 3.89Å; F407-D412 HydrophobicContact CG-CB 4.47Å; F407-L413 HydrophobicContact CB-CB 4.21Å; F407-L413 HydrophobicContact CD2-CB 3.85Å; F407-L413 HydrophobicContact CD2-CD1 3.71Å; F407-L413 HydrophobicContact CD2-CG 4.38Å; F407-L413 HydrophobicContact CE2-CD1 3.84Å; F407-L413 HydrophobicContact CG-CB 4.11Å; F407-H416 HydrophobicContact CE1-CB 3.94Å; F407-H416 HydrophobicContact CE2-CB 4.07Å; F407-H416 AromaticContact CE2-CD2 3.9Å; F407-H416 AromaticContact CE2-CG 3.85Å; F407-H416 HydrophobicContact CZ-CB 3.47Å; F407-H416 VanDerWaalsContact CZ-CB 3.47Å; F407-H416 AromaticContact CZ-CD2 3.81Å; F407-H416 AromaticContact CZ-CG 3.31Å; F407-H416 AromaticContact CZ-ND1 3.57Å
408C84.7Confident89.1Confident27 Ų2770.8 Ų70.818%0.18237%0.368CS..SBendtrans-79.8-18.8177.8-56.30000113F387 H390F387-C408 WeakPolarHBondContact CD1-O 3.36Å; H390-C408 HydrophobicContact CB-CB 3.88Å; H390-C408 PolarHBondContact ND1-O 3.17Å
409R84.1Confident89.2Confident119 Ų11975.3 Ų75.345%0.44939%0.387SS..SBendtrans-132.5139.5179.8-56.7180-65.3-171.91.4110.9F387 F411 D412 L413F387-R409 HydrophobicContact CB-CG 4.17Å; F387-R409 HydrophobicContact CD1-CG 3.99Å; F387-R409 HydrophobicContact CG-CG 4Å; R409-F411 VanDerWaalsContact C-N 3.27Å; R409-F411 PolarHBondContact O-N 2.73Å; R409-D412 WeakPolarHBondContact CB-OD2 3.46Å; R409-D412 IonicContact CZ-OD1 3.36Å; R409-D412 IonicContact CZ-OD2 2.95Å; R409-D412 VanDerWaalsContact CZ-OD2 3.23Å; R409-D412 IonicContact NE-OD1 2.96Å; R409-D412 IonicContact NE-OD2 2.98Å; R409-D412 PolarHBondContact NE-OD2 2.79Å; R409-D412 VanDerWaalsContact NH2-CG 3.32Å; R409-D412 IonicContact NH2-OD1 3.06Å; R409-D412 PolarHBondContact NH2-OD1 3.43Å; R409-D412 IonicContact NH2-OD2 3.76Å; R409-D412 PolarHBondContact NH2-OD2 3.27Å; R409-D412 PolarHBondContact O-N 3.36Å; R409-L413 PolarHBondContact O-N 3.12Å
410N87.8Confident89.1Confident62 Ų6276.4 Ų76.433%0.33239%0.389SS..Hα-helixtrans-62-33.5176.5-170.5-78.2000112.8F398 D412 L413 K414F398-N410 HydrophobicContact CD1-CB 3.94Å; F398-N410 HydrophobicContact CD2-CB 4.42Å; F398-N410 HydrophobicContact CE1-CB 3.81Å; F398-N410 HydrophobicContact CE2-CB 4.3Å; F398-N410 HydrophobicContact CG-CB 4.23Å; F398-N410 HydrophobicContact CZ-CB 4Å; N410-D412 VanDerWaalsContact C-N 3.31Å; N410-D412 PolarHBondContact O-N 2.73Å; N410-L413 WeakPolarHBondContact O-CB 3.49Å; N410-L413 PolarHBondContact O-N 3.03Å; N410-K414 PolarHBondContact O-N 3.48Å; N410-K414 WeakPolarHBondContact OD1-CD 3.46Å; N410-K414 WeakPolarHBondContact OD1-CE 3.2Å
411F87.9Confident88.6Confident132 Ų13278.5 Ų78.558%0.57940%0.399SS*.Hα-helixtrans-59.7-41.8175.9177-95.6000112.2R409 K414 K415R409-F411 VanDerWaalsContact C-N 3.27Å; R409-F411 PolarHBondContact O-N 2.73Å; F411-K414 PolarHBondContact O-N 3.41Å; F411-K415 HydrophobicContact CE1-CD 4.46Å; F411-K415 WeakPolarHBondContact O-CB 3.28Å; F411-K415 PolarHBondContact O-N 3.41Å
412D89.3Confident87.8Confident40 Ų4077.6 Ų77.621%0.21439%0.388CS..Hα-helixtrans-68.1-40.8178.8-60.5-36.8000110.5F407 R409 N410 K415 H416F407-D412 HydrophobicContact CB-CB 4.44Å; F407-D412 HydrophobicContact CD1-CB 3.89Å; F407-D412 HydrophobicContact CG-CB 4.47Å; R409-D412 WeakPolarHBondContact CB-OD2 3.46Å; R409-D412 IonicContact CZ-OD1 3.36Å; R409-D412 IonicContact CZ-OD2 2.95Å; R409-D412 VanDerWaalsContact CZ-OD2 3.23Å; R409-D412 IonicContact NE-OD1 2.96Å; R409-D412 IonicContact NE-OD2 2.98Å; R409-D412 PolarHBondContact NE-OD2 2.79Å; R409-D412 VanDerWaalsContact NH2-CG 3.32Å; R409-D412 IonicContact NH2-OD1 3.06Å; R409-D412 PolarHBondContact NH2-OD1 3.43Å; R409-D412 IonicContact NH2-OD2 3.76Å; R409-D412 PolarHBondContact NH2-OD2 3.27Å; R409-D412 PolarHBondContact O-N 3.36Å; N410-D412 VanDerWaalsContact C-N 3.31Å; N410-D412 PolarHBondContact O-N 2.73Å; D412-K415 PolarHBondContact O-N 2.77Å; D412-H416 WeakPolarHBondContact O-CB 3.22Å; D412-H416 PolarHBondContact O-N 2.96Å
413L90.9Very high86.4Confident16 Ų1681 Ų818%0.08440%0.401CS..Hα-helixtrans-58.5-49.4172.1171.661.4000111.7F398 C400 F407 R409 N410 K415 H416 I417F398-L413 HydrophobicContact CB-CB 4.25Å; F398-L413 HydrophobicContact CB-CD2 3.84Å; C400-L413 HydrophobicContact CB-CD1 3.71Å; F407-L413 HydrophobicContact CB-CB 4.21Å; F407-L413 HydrophobicContact CD2-CB 3.85Å; F407-L413 HydrophobicContact CD2-CD1 3.71Å; F407-L413 HydrophobicContact CD2-CG 4.38Å; F407-L413 HydrophobicContact CE2-CD1 3.84Å; F407-L413 HydrophobicContact CG-CB 4.11Å; R409-L413 PolarHBondContact O-N 3.12Å; N410-L413 WeakPolarHBondContact O-CB 3.49Å; N410-L413 PolarHBondContact O-N 3.03Å; L413-K415 VanDerWaalsContact C-N 3.3Å; L413-K415 PolarHBondContact O-N 3.11Å; L413-H416 WeakPolarHBondContact O-CB 3.47Å; L413-H416 PolarHBondContact O-N 3.48Å; L413-H416 VanDerWaalsContact O-N 3.14Å; L413-I417 HydrophobicContact CD1-CD1 3.75Å; L413-I417 HydrophobicContact CD1-CG1 3.99Å; L413-I417 HydrophobicContact CG-CD1 3.92Å; L413-I417 WeakPolarHBondContact O-CG1 3.41Å; L413-I417 PolarHBondContact O-N 2.83Å
414K90.8Very high84.7Confident124 Ų12483.8 Ų83.854%0.53942%0.421SS..Hα-helixtrans-63.1-35.8178.1-76.1-177.1173.7-1790112.6N410 F411 R418N410-K414 PolarHBondContact O-N 3.48Å; N410-K414 WeakPolarHBondContact OD1-CD 3.46Å; N410-K414 WeakPolarHBondContact OD1-CE 3.2Å; F411-K414 PolarHBondContact O-N 3.41Å; K414-R418 WeakPolarHBondContact O-CB 3.41Å; K414-R418 VanDerWaalsContact O-CG 3.3Å; K414-R418 WeakPolarHBondContact O-CG 3.35Å; K414-R418 PolarHBondContact O-N 3.35Å; K414-R418 PolarHBondContact O-NE 3.17Å
415K91.4Very high83Confident96 Ų9684.5 Ų84.542%0.41743%0.429SS..Hα-helixtrans-68.1-38.9174.2-175-178.9177.6-176.20111F411 D412 L413 K419F411-K415 HydrophobicContact CE1-CD 4.46Å; F411-K415 WeakPolarHBondContact O-CB 3.28Å; F411-K415 PolarHBondContact O-N 3.41Å; D412-K415 PolarHBondContact O-N 2.77Å; L413-K415 VanDerWaalsContact C-N 3.3Å; L413-K415 PolarHBondContact O-N 3.11Å; K415-K419 HydrophobicContact CG-CD 4.28Å; K415-K419 WeakPolarHBondContact O-CB 3.44Å; K415-K419 VanDerWaalsContact O-CG 3.29Å; K415-K419 WeakPolarHBondContact O-CG 3.41Å; K415-K419 PolarHBondContact O-N 2.97Å; K415-K419 VanDerWaalsContact O-N 3.14Å
416H90.9Very high80.9Confident21 Ų2183.6 Ų83.610%0.09744%0.438CS..Hα-helixtrans-62.5-51.7174.6170.184.1000111.4C403 F407 D412 L413 R418 K419 L420 H421C403-H416 PolarHBondContact SG-NE2 3.06Å; F407-H416 HydrophobicContact CE1-CB 3.94Å; F407-H416 HydrophobicContact CE2-CB 4.07Å; F407-H416 AromaticContact CE2-CD2 3.9Å; F407-H416 AromaticContact CE2-CG 3.85Å; F407-H416 HydrophobicContact CZ-CB 3.47Å; F407-H416 VanDerWaalsContact CZ-CB 3.47Å; F407-H416 AromaticContact CZ-CD2 3.81Å; F407-H416 AromaticContact CZ-CG 3.31Å; F407-H416 AromaticContact CZ-ND1 3.57Å; D412-H416 WeakPolarHBondContact O-CB 3.22Å; D412-H416 PolarHBondContact O-N 2.96Å; L413-H416 WeakPolarHBondContact O-CB 3.47Å; L413-H416 PolarHBondContact O-N 3.48Å; L413-H416 VanDerWaalsContact O-N 3.14Å; H416-R418 PolarHBondContact O-N 3.01Å; H416-K419 PolarHBondContact O-N 3.01Å; H416-L420 VanDerWaalsContact CE1-CD1 3.44Å; H416-L420 WeakPolarHBondContact CE1-CD1 3.2Å; H416-L420 WeakPolarHBondContact ND1-CD1 3.42Å; H416-L420 WeakPolarHBondContact O-CB 3.41Å; H416-L420 PolarHBondContact O-N 2.8Å; H416-H421 AromaticContact CD2-CD2 3.86Å; H416-H421 AromaticContact CD2-NE2 3.79Å; H416-H421 AromaticContact CE1-NE2 3.94Å; H416-H421 AromaticContact NE2-CD2 3.61Å; H416-H421 AromaticContact NE2-NE2 3.06Å; H416-H421 PolarHBondContact NE2-NE2 3.18Å
417I91Very high78.5Confident44 Ų4492.3 Ų92.323%0.22647%0.469CS..Hα-helixtrans-57.7-51.7177.5-65.7169.7000110.5L413 K419 L420 H421 D422L413-I417 HydrophobicContact CD1-CD1 3.75Å; L413-I417 HydrophobicContact CD1-CG1 3.99Å; L413-I417 HydrophobicContact CG-CD1 3.92Å; L413-I417 WeakPolarHBondContact O-CG1 3.41Å; L413-I417 PolarHBondContact O-N 2.83Å; I417-K419 PolarHBondContact O-N 3.13Å; I417-K419 VanDerWaalsContact O-N 3.11Å; I417-L420 PolarHBondContact O-N 3.05Å; I417-H421 HydrophobicContact CG2-CB 4.23Å; I417-H421 CarbonylContact O-C 3.6Å; I417-H421 WeakPolarHBondContact O-CA 3.4Å; I417-H421 PolarHBondContact O-N 3.26Å; I417-D422 PolarHBondContact O-N 2.72Å
418R90.9Very high75.9Confident146 Ų14695.6 Ų95.655%0.55150%0.497SS*.Hα-helixtrans-57.7-30.2178.9-78-170.7-64.5154.8-1.3114.7K414 H416 D422K414-R418 WeakPolarHBondContact O-CB 3.41Å; K414-R418 VanDerWaalsContact O-CG 3.3Å; K414-R418 WeakPolarHBondContact O-CG 3.35Å; K414-R418 PolarHBondContact O-N 3.35Å; K414-R418 PolarHBondContact O-NE 3.17Å; H416-R418 PolarHBondContact O-N 3.01Å; R418-D422 WeakPolarHBondContact CA-OD2 3.35Å; R418-D422 VanDerWaalsContact CG-OD2 3.26Å; R418-D422 WeakPolarHBondContact CG-OD2 3.29Å
419K89.9Confident73.7Confident152 Ų152100.2 Ų100.266%0.66153%0.527SS*.Hα-helixtrans-90.3-31.1-176.5-77.6-171.9169.9-147.20113.6K415 H416 I417K415-K419 HydrophobicContact CG-CD 4.28Å; K415-K419 WeakPolarHBondContact O-CB 3.44Å; K415-K419 VanDerWaalsContact O-CG 3.29Å; K415-K419 WeakPolarHBondContact O-CG 3.41Å; K415-K419 PolarHBondContact O-N 2.97Å; K415-K419 VanDerWaalsContact O-N 3.14Å; H416-K419 PolarHBondContact O-N 3.01Å; I417-K419 PolarHBondContact O-N 3.13Å; I417-K419 VanDerWaalsContact O-N 3.11Å
420L87.3Confident71.2Confident109 Ų10998.8 Ų98.857%0.57154%0.54SS*.Hα-helixtrans-120.4-15.7-167-64.6173.8000113.5H416 I417H416-L420 VanDerWaalsContact CE1-CD1 3.44Å; H416-L420 WeakPolarHBondContact CE1-CD1 3.2Å; H416-L420 WeakPolarHBondContact ND1-CD1 3.42Å; H416-L420 WeakPolarHBondContact O-CB 3.41Å; H416-L420 PolarHBondContact O-N 2.8Å; I417-L420 PolarHBondContact O-N 3.05Å
421H84.3Confident68.8Low47 Ų47102.3 Ų102.322%0.21856%0.564CS.*THydrogen-bonded Turntrans-127.9-16.1-175.4-57.4-55000114.2C400 T402 H416 I417 L423C400-H421 VanDerWaalsContact SG-CD2 3.55Å; C400-H421 PolarHBondContact SG-NE2 3.39Å; C400-H421 VanDerWaalsContact SG-NE2 3.44Å; T402-H421 WeakPolarHBondContact CG2-ND1 3.45Å; H416-H421 AromaticContact CD2-CD2 3.86Å; H416-H421 AromaticContact CD2-NE2 3.79Å; H416-H421 AromaticContact CE1-NE2 3.94Å; H416-H421 AromaticContact NE2-CD2 3.61Å; H416-H421 AromaticContact NE2-NE2 3.06Å; H416-H421 PolarHBondContact NE2-NE2 3.18Å; I417-H421 HydrophobicContact CG2-CB 4.23Å; I417-H421 CarbonylContact O-C 3.6Å; I417-H421 WeakPolarHBondContact O-CA 3.4Å; I417-H421 PolarHBondContact O-N 3.26Å; H421-L423 PolarHBondContact O-N 3.05Å
422D71.3Confident66.3Low97 Ų97103.6 Ų103.652%0.51958%0.577SS.*THydrogen-bonded Turntrans-78.525.9179.7-89.76.9000114.7I417 R418 S424I417-D422 PolarHBondContact O-N 2.72Å; R418-D422 WeakPolarHBondContact CA-OD2 3.35Å; R418-D422 VanDerWaalsContact CG-OD2 3.26Å; R418-D422 WeakPolarHBondContact CG-OD2 3.29Å; D422-S424 PolarHBondContact O-N 3.43Å
423L60.2Low63.9Low170 Ų170107.7 Ų107.789%0.8960%0.602SS**THydrogen-bonded Turntrans-77.2-3.2168.8-71.5171.7000113H421 G425H421-L423 PolarHBondContact O-N 3.05Å; L423-G425 PolarHBondContact O-N 3.38Å
424S55.8Low61.3Low112 Ų112113.2 Ų113.278%0.78364%0.637SS**  trans-99.655.4-179.667.10000112.6D422D422-S424 PolarHBondContact O-N 3.43Å
425G50.2Low58.8Low69 Ų69112.3 Ų112.371%0.71165%0.647SS**  trans-13825.7-172.200000115.9L423L423-G425 PolarHBondContact O-N 3.38Å
426S46.3Very low56.4Low108 Ų108116.5 Ų116.576%0.75567%0.668SS**  trans-152.5100.1163.656.30000110.8
427K36.8Very low53.8Low208 Ų208121.4 Ų121.490%0.90470%0.699SS**  trans-173.291.4145.9-100.7165.9-170.6-170.70106.6
428S32.8Very low51.3Low109 Ų109131.7 Ų131.776%0.76275%0.746SS**  trans-53.4141.8146-72.60000107.3A430S428-A430 PolarHBondContact O-N 3.28Å
429P37.5Very low49.3Very low124 Ų124131 Ų13181%0.80576%0.756SS**  trans-66.4105.5166.18.93.7000106.4T431P429-T431 PolarHBondContact O-N 3.17Å; P429-T431 VanDerWaalsContact O-N 3.16Å
430A32.8Very low47.2Very low88 Ų88129.9 Ų129.973%0.72776%0.761SS**  trans-58.5116.3158.200000105.9S428 L432S428-A430 PolarHBondContact O-N 3.28Å; A430-L432 PolarHBondContact O-N 3.4Å
431T36Very low44.9Very low137 Ų137131.1 Ų131.184%0.8477%0.771SS**  trans-48111.7167.711.70000108.2P429 V433P429-T431 PolarHBondContact O-N 3.17Å; P429-T431 VanDerWaalsContact O-N 3.16Å; T431-V433 PolarHBondContact O-N 3.12Å
432L36.6Very low42.6Very low159 Ų159136 Ų13683%0.83280%0.804SS**  trans-60.8117.8168.6-87.9154.3000108A430 T434A430-L432 PolarHBondContact O-N 3.4Å; L432-T434 PolarHBondContact O-N 3.18Å
433V38.6Very low40.8Very low125 Ų125138.4 Ų138.476%0.75882%0.821SS**  trans-52.7118155.8174.20000107.2T431T431-V433 PolarHBondContact O-N 3.12Å
434T35.9Very low39.5Very low133 Ų133136.3 Ų136.382%0.81682%0.817SS**  trans-104100.6156.838.70000106.3L432L432-T434 PolarHBondContact O-N 3.18Å
435S37.5Very low38.4Very low105 Ų105138.1 Ų138.173%0.73482%0.819SS**  trans-84.1106.115650.10000106.6
436E41.3Very low37.5Very low184 Ų184143.4 Ų143.486%0.8683%0.828SS**  trans-129.4129.6155.9-78.3-171.1165.700109.2
437T37.7Very low36.7Very low124 Ų124146.3 Ų146.376%0.76183%0.834SS**  trans-49.1134.4175.344.80000114.7
438H37.3Very low36.7Very low260 Ų260140.7 Ų140.7100%1.20483%0.827SS**  -162.10117.9-111.7-62.4000112.2

Retrieved 438 of 438 residues in 604.5 ms (Link to these results)