A0A096LQ22_POEFO Loading...

Zic family member 4

AlphaFold DB , UniProt , Accession A0A096LQ22, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.3Very low36.5Very low242 Ų242141 Ų141100%1.19286%0.862SS**  0137.30-71.5178.4170.200107.9
2S32Very low36Very low125 Ų125141.3 Ų141.387%0.87485%0.854SS**  trans162.4150.5155.8-88.20000107.6
3V36.6Very low36.3Very low141 Ų141140.2 Ų140.286%0.85585%0.852SS**  trans-126.2169.2-173.6-69.60000111.4
4D35.2Very low36.3Very low158 Ų158135.9 Ų135.985%0.84584%0.838SS**  trans-71.8159.7-161.8-47.7-99.2000116.2
5A38.2Very low35.9Very low96 Ų96140.3 Ų140.379%0.79384%0.841SS**  trans-151.791.2152.200000112.3
6L46.3Very low35.6Very low180 Ų180136.9 Ų136.994%0.94283%0.826SS**  trans49.995.1147.8-54178.5000118.8
7G30Very low35.6Very low74 Ų74138 Ų13876%0.76382%0.818SS**  trans-130.3149.7162.800000112.5
8S34.8Very low35.6Very low120 Ų120141.9 Ų141.984%0.83982%0.816SS**  trans-162.7157173.5-75.90000108.6
9P44.5Very low35.5Very low119 Ų119142.9 Ų142.977%0.77382%0.818SS**  cis-130.1-154.2434.3-12.1000113.1
10V31.5Very low35.3Very low126 Ų126143 Ų14376%0.76482%0.821SS**  trans100.3113.7160.4-170.90000118.6
11M34.3Very low35.2Very low170 Ų170141 Ų14184%0.83782%0.823SS**  trans12.1130.7150.9-51.2-57.3-172.900121.6
12D30.8Very low35Very low145 Ų145137.1 Ų137.178%0.77581%0.806SS**  -167.8125.4100.2-156-26.4000111.2A14D12-A14 PolarHBondContact O-N 3.3Å
13P39.5Very low35.3Very low126 Ų126141.5 Ų141.582%0.81880%0.803SS**  trans-89.783.3-177.134.8-36.1000114.4
14A36.3Very low35.1Very low80 Ų80140.4 Ų140.466%0.66179%0.792SS**  trans-123130.3173.800000114.4D12D12-A14 PolarHBondContact O-N 3.3Å
15F30.9Very low35.2Very low202 Ų202139.5 Ų139.589%0.88679%0.791SS**  trans52.296.9161.9-90.6-97.2000119.9
16S30.5Very low34.9Very low86 Ų86140.3 Ų140.360%0.60178%0.782SS**  -175.8128.2117.6-930000117.2
17K35.4Very low34.3Very low156 Ų156139.1 Ų139.168%0.67878%0.776SS**  68.1117.9129.4-65.2165.1-168.71410121.2
18R35.6Very low34.3Very low209 Ų209140.2 Ų140.279%0.78978%0.778SS**  79.3108.8124.8-65.8171.6-170.3164.3-2.3120
19N34.5Very low34.1Very low161 Ų161138 Ų13886%0.86177%0.774SS**  62.577.7108.8-163.336.4000118.6
20T31.8Very low33.6Very low143 Ų143136.8 Ų136.888%0.87777%0.774SS**  trans-137.990.8165.7-49.70000111.2
21A32.9Very low33.6Very low103 Ų103138.7 Ų138.785%0.85177%0.774SS**  trans-158.162.2170.500000111.6
22L33.4Very low33.6Very low159 Ų159138 Ų13883%0.83277%0.769SS**  trans-115.9120.8170.8-118.6179.5000109.3
23R38.8Very low33.6Very low218 Ų218140.7 Ų140.782%0.82378%0.776SS**  trans171120.2146.1-81.9-100.7155.2129.4-1106.6
24L32.9Very low33.3Very low118 Ų118142.6 Ų142.662%0.61877%0.774SS**  53.8123.696.3-77.176.6000110.7
25V35.5Very low33.1Very low138 Ų138146.6 Ų146.684%0.83678%0.779SS**  cis-154.8157.747.2162.10000108.1
26D32.6Very low33.1Very low113 Ų113145.1 Ų145.160%0.60477%0.774SS**  cis167.1164.8-28.6-109.9-61.9000105.4
27L33Very low33.3Very low155 Ų155148.7 Ų148.781%0.81278%0.781SS**  cis-161.8174.6-0.6173.757.3000107.9
28A31.4Very low33Very low98 Ų98149.8 Ų149.881%0.8179%0.788SS**  trans74.7148.8172.600000117.4
29G29.9Very low32.9Very low73 Ų73147.9 Ų147.975%0.75379%0.788SS**  cis-163.1154.4-4.900000111.6
30A33.2Very low32.8Very low94 Ų94146.3 Ų146.378%0.77779%0.785SS**  trans-79.8149.3178.300000111.7
31H33.3Very low33.1Very low165 Ų165145.5 Ų145.576%0.76478%0.781SS**  -172.3142.5122.8-112.2-128.1000114.3
32H32.8Very low33Very low155 Ų155149.7 Ų149.772%0.71878%0.783SS**  trans21.2115.4149.9-70.882.4000120.6H34H32-H34 PolarHBondContact O-N 3.37Å
33H31.2Very low32.9Very low202 Ų202147.5 Ų147.594%0.93578%0.782SS**  trans-60.4118.2150.7-103.2-52.7000110.1
34H32.4Very low32.5Very low167 Ų167144.1 Ų144.177%0.77379%0.785SS**  trans-107.1159.3166.2-152.582.8000110.8H32H32-H34 PolarHBondContact O-N 3.37Å
35H32.7Very low32.6Very low163 Ų163144.5 Ų144.576%0.75579%0.792SS**  trans-69129.7176.1-107.1-103000111.1H37H35-H37 PolarHBondContact O-N 3.28Å
36H31.8Very low32.2Very low172 Ų172141.6 Ų141.680%0.79679%0.791SS**  trans-75121.5162.6-101.5-90.5000109.9
37H33.1Very low32.1Very low160 Ų160146.1 Ų146.174%0.74181%0.805SS**  trans-106.1131.6155.6-106.4-98.2000107.7H35H35-H37 PolarHBondContact O-N 3.28Å
38H31Very low32.5Very low179 Ų179145 Ų14583%0.82981%0.807SS**  trans-78.1129.1170.3-86.3-97.6000109.9
39H32.2Very low32.4Very low170 Ų170143.5 Ų143.579%0.78780%0.801SS**  trans-112.1148.8158-91.6-94.8000109.3
40T32.4Very low32.3Very low128 Ų128150.5 Ų150.579%0.78581%0.811SS**PPolyproline II helixtrans-80.8143.9176.542.40000111
41P38.7Very low32.1Very low125 Ų125149.7 Ų149.781%0.81281%0.812SS**PPolyproline II helixtrans-79.6137.7175.131.8-33000111.4
42Q31.4Very low31.9Very low191 Ų191147.6 Ų147.689%0.89382%0.816SS**PPolyproline II helixtrans-102.9127.4156.4-71.5-177.7-16.900108.1
43S30.3Very low31.7Very low114 Ų114148.6 Ų148.680%0.79782%0.821SS**PPolyproline II helixtrans-93.3120.2178.255.20000110.8
44V31.2Very low32.6Very low146 Ų146143.9 Ų143.989%0.88581%0.808SS**PPolyproline II helixtrans-91128.1171.8-174.50000108.9
45T34.3Very low32.6Very low126 Ų126144 Ų14477%0.77381%0.809SS**PPolyproline II helixtrans-98.3145.3178.344.20000112.1
46G27.9Very low32.4Very low78 Ų78140.4 Ų140.480%0.80480%0.802SS**PPolyproline II helixtrans-91.5146.3177.300000113.6
47F29.8Very low32.4Very low207 Ų207141.1 Ų141.191%0.90881%0.808SS**PPolyproline II helixtrans-62.6156.7168-87.6-79.7000112.1
48P41.7Very low32.3Very low133 Ų133137.2 Ų137.286%0.86480%0.803SS**  -149.1170.863.241.4-22.4000118.1
49G28.2Very low32.2Very low66 Ų66137.3 Ų137.368%0.6880%0.804SS**  trans140.6106.1154.200000117.3
50F29.6Very low32.1Very low219 Ų219133.2 Ų133.296%0.96179%0.794SS**  trans-23.7141.8164.6-59.4-95.4000118.9
51G27.8Very low32.3Very low78 Ų78135.2 Ų135.280%0.80479%0.794SS**  trans176.1122.8164.600000114.6
52S29.2Very low32.9Very low121 Ų121135.4 Ų135.485%0.84680%0.795SS**  trans-77.4141.6-175.450.20000115.2
53H29.5Very low32.8Very low175 Ų175130.1 Ų130.181%0.8179%0.793SS**  trans-67.9176.1153.4-85.759.3000111
54P50Low32.9Very low104 Ų104132.9 Ų132.968%0.67579%0.793SS**  cis-142.2178.98.730.9-6.4000118.4
55H31.9Very low33.1Very low170 Ų170134.1 Ų134.179%0.78779%0.793SS**  trans68121.2138.4-85.8-61.9000125.8
56S29.3Very low33Very low86 Ų86134.1 Ų134.160%0.60179%0.793SS**  94.5128.6121.6-690000123.7
57M31.8Very low33.1Very low187 Ų187135 Ų13592%0.92179%0.793SS**  trans69.4153.8145.6-69.3177.4-177.800117.9
58A29Very low33.4Very low78 Ų78132.6 Ų132.665%0.64578%0.784SS**  cis-158.9179.3-3.200000112.1
59H29.7Very low33.8Very low181 Ų181131.9 Ų131.984%0.83878%0.78SS**  trans-2151.5149.4-59.2-75.1000120.3
60S29.8Very low34.2Very low84 Ų84139.3 Ų139.359%0.58779%0.787SS**  cis-178.4170.5-3.549.30000113.6
61H37.3Very low34.3Very low171 Ų171137.5 Ų137.579%0.79279%0.786SS**  trans69.6175.2159.2-60.1-60.5000118.2
62P51.2Low34.4Very low128 Ų128136.8 Ų136.883%0.83178%0.78SS**  -133.8-177.3-8041.3-24000114
63G29.8Very low35.3Very low81 Ų81137.3 Ų137.384%0.83578%0.78SS**  trans-173.6109.1169.600000114
64E31.3Very low35.8Very low171 Ų171134.5 Ų134.580%0.79978%0.78SS**  trans-112.5136.7176.5-177.4-172152.400109.7
65I35.8Very low36Very low173 Ų173134 Ų13489%0.88778%0.777SS**  trans-141.9145.2162.645.8172.6000110.7
66T32.7Very low36.1Very low125 Ų125135.9 Ų135.977%0.76778%0.783SS**  trans-115.4151-165.8-9.20000111.5
67A30.5Very low36.3Very low98 Ų98135 Ų13581%0.8179%0.788SS**  trans167.1130.313300000113.5
68E34.8Very low37.8Very low155 Ų155132.1 Ų132.172%0.72478%0.783SS**  trans-93.5156.6157.4-107.2-84.7140.300108.1R70E68-R70 PolarHBondContact OE2-N 2.8Å
69P50.2Low38Very low119 Ų119136.2 Ų136.277%0.77379%0.789SS**  -153.412795.535.9-15.8000117.8
70R36.5Very low38.3Very low221 Ų221134.3 Ų134.383%0.83478%0.78SS**  30.7133.5126.6-65.3-174167.8-142.2-4.4120.7E68E68-R70 PolarHBondContact OE2-N 2.8Å
71L32Very low38.6Very low181 Ų181137.3 Ų137.395%0.94879%0.786SS**  -154.6155.7120.5-105.3173000110.8
72G29.6Very low38.3Very low64 Ų64132.7 Ų132.766%0.6679%0.785SS**  trans-113.3-152.6-179.700000112.9
73P48.9Very low37.5Very low132 Ų132134.6 Ų134.686%0.85778%0.783SS**  cis-136.9-174.810.143.3-26.1000115.9
74S40.2Very low37.6Very low115 Ų115136 Ų13680%0.80478%0.779SS**  trans-147137.5162.1172.60000110.4
75P54.1Low37.6Very low95 Ų95132.7 Ų132.762%0.61778%0.782SS**  trans-136.4160.5144.539.3-26.9000111.3
76F34.3Very low37.3Very low208 Ų208129.1 Ų129.191%0.91278%0.778SS**  cis-136.8176.626.6-84.3-95.5000112.9
77G33.3Very low37.5Very low68 Ų68131.4 Ų131.470%0.70179%0.785SS**  trans-109.5-133.5-17300000117.3
78P62.2Low37.6Very low127 Ų127135.9 Ų135.983%0.82579%0.786SS**  -137.6-151.5-105.442.4-25000115.6
79E34.3Very low37.4Very low164 Ų164135.4 Ų135.477%0.76679%0.787SS**  trans81.1141.4174.8-81.1-161.9-108.400117.9
80H35.7Very low36.8Very low141 Ų141135.1 Ų135.165%0.65379%0.788SS**  cis-160.5169.6-14.3-142.6159000113
81M36.7Very low37.1Very low146 Ų146130.3 Ų130.372%0.71979%0.785SS**  trans51123.5150.5-135.166.4110.100121.8
82G30.5Very low37Very low74 Ų74126 Ų12676%0.76378%0.776SS**  trans178.5105.2168.500000114.8
83H34.9Very low37.2Very low169 Ų169131.7 Ų131.778%0.78279%0.785SS**  trans-76.5160.1173.2-42.9-103.7000110.1
84S31.4Very low36.4Very low109 Ų109134 Ų13476%0.76278%0.784SS**  cis-160.5156.322.3-45.60000111.5
85A31.1Very low36.1Very low103 Ų103138.9 Ų138.985%0.85179%0.786SS**  trans53.3149.3149.400000121.5
86A30.2Very low35.4Very low98 Ų98139.2 Ų139.281%0.8179%0.788SS**  cis-162112.5-25.500000109
87L37Very low35.5Very low173 Ų173138.1 Ų138.191%0.90679%0.785SS**  trans-95.1136.3165-80.2170000109.7
88K32.9Very low35.4Very low191 Ų191142.3 Ų142.383%0.8379%0.786SS**  trans-174.5132.3142.5-106.5166.3-179.4178.10114.5
89I30.5Very low34.2Very low145 Ų145144.2 Ų144.274%0.74478%0.784SS**  trans68.5114.7141.4-62.4160000118.8
90S36.2Very low34.1Very low114 Ų114144.3 Ų144.380%0.79778%0.784SS**  trans-83.1155.6156.1-36.60000111.4
91P42.3Very low33.9Very low119 Ų119145.5 Ų145.577%0.77379%0.79SS**  trans-119.6158.5147.69.511.7000112.6
92A31.2Very low33.6Very low92 Ų92146.6 Ų146.676%0.7679%0.793SS**  trans-82.2139.7-178.100000113.1H94A92-H94 PolarHBondContact O-N 3.33Å
93H33.9Very low33.7Very low182 Ų182150 Ų15084%0.84379%0.789SS**  trans-75.7110.7171.6-81.6-82.9000111.8
94H30.8Very low33.5Very low182 Ų182149 Ų14984%0.84379%0.789SS**  trans-69.5133.6162.5-89.451.2000110.7A92A92-H94 PolarHBondContact O-N 3.33Å
95Y35Very low33.5Very low217 Ų217151.4 Ų151.485%0.85179%0.788SS**  trans-100.5115166.2-94.6-86.4000110H97Y95-H97 PolarHBondContact O-N 3.07Å
96P39.3Very low33.7Very low102 Ų102154.4 Ų154.466%0.66278%0.784SS**  trans-77.5120.9174.929.3-32.2000111.4H98P96-H98 PolarHBondContact O-N 3.26Å; P96-H98 VanDerWaalsContact O-N 3.12Å
97H36.4Very low33.7Very low184 Ų184158.2 Ų158.285%0.85279%0.787SS**  trans-80.685.5176.6-124-89.8000110.6Y95 H99Y95-H97 PolarHBondContact O-N 3.07Å; H97-H99 PolarHBondContact O-N 3.31Å
98H31.2Very low33.6Very low156 Ų156154.4 Ų154.472%0.72278%0.78SS**  trans-74.399.1176.1-93.8-68.5000112.6P96P96-H98 PolarHBondContact O-N 3.26Å; P96-H98 VanDerWaalsContact O-N 3.12Å
99H36.5Very low33.4Very low168 Ų168148.8 Ų148.878%0.77878%0.776SS**  trans-63.9140.9147.4-99.5-109.6000109.1H97H97-H99 PolarHBondContact O-N 3.31Å
100H32.5Very low33.5Very low165 Ų165150.9 Ų150.976%0.76478%0.783SS**  trans-128.2110.7172.2-128.174.2000109.4
101H30.7Very low33.3Very low166 Ų166150 Ų15077%0.76978%0.777SS**  trans-79.5127.7172.2-116.3-97000108.8H103H101-H103 PolarHBondContact O-N 3.33Å
102H30.8Very low32.7Very low169 Ų169153.3 Ų153.378%0.78278%0.782SS**  trans-79.2101.6170.4-104.4-79.1000109.7
103H32.1Very low32.7Very low147 Ų147155.1 Ų155.168%0.68178%0.783SS**  trans-91.6120.3154.5-104.4-106.1000108.5H101 H105H101-H103 PolarHBondContact O-N 3.33Å; H103-H105 AromaticContact ND1-NE2 3.84Å
104N31.2Very low32.6Very low147 Ų147152.5 Ų152.579%0.78678%0.779SS**  trans-87.1111162.9-827.5000107.6
105H31.6Very low32.7Very low159 Ų159148.6 Ų148.674%0.73677%0.773SS**  trans-94.3134.7163-96.6-91.3000110.7H103H103-H105 AromaticContact ND1-NE2 3.84Å
106H35.3Very low32.7Very low167 Ų167143.2 Ų143.277%0.77377%0.767SS**  trans-81.9138171.6-141.5-78.2000108.4
107M31.1Very low32.5Very low178 Ų178147 Ų14788%0.87778%0.776SS**  trans-136.5130.6156.9-79.8-61.2176.100108.2
108A34Very low32.5Very low92 Ų92144.6 Ų144.676%0.7677%0.774SS**  trans-107.1144.4165.700000107.6
109G29.3Very low32.3Very low73 Ų73140.9 Ų140.975%0.75378%0.778SS**  trans-152.7140.6179.100000109
110H32.6Very low32.2Very low190 Ų190137.1 Ų137.188%0.8878%0.776SS**  trans-84.8164.6-169.4-98.8-114.7000114
111S32.3Very low32.1Very low96 Ų96140 Ų14067%0.67179%0.787SS**  trans-62.5151.9165.551.30000113.3
112E28.5Very low32Very low188 Ų188135.3 Ų135.388%0.87978%0.783SS**  -163.1-168.7126-110.4169.1-162.900111.8
113V32.3Very low33.1Very low130 Ų130133.1 Ų133.179%0.78878%0.784SS**  trans-137.6165.6-142.6-125.90000115.9
114V31.8Very low33Very low126 Ų126133 Ų13376%0.76479%0.793SS**  trans85.4112144.9157.50000120.8
115S31.5Very low33.1Very low100 Ų100134.5 Ų134.570%0.69980%0.796SS**  trans84.7117.3131.8-760000125.9
116S35Very low33.9Very low104 Ų104131.9 Ų131.973%0.72779%0.792SS**  110148108.9-78.30000122.7
117Q36.5Very low33.6Very low181 Ų181130.4 Ų130.485%0.84680%0.795SS**  trans71.4145.5160.2-76.4-177.612.900119.2
118T35.3Very low33.5Very low135 Ų135127.2 Ų127.283%0.82879%0.791SS**  cis-162.8153.2-34.940000109
119G28.1Very low33.7Very low78 Ų78129 Ų12980%0.80479%0.792SS**  trans175.4131.8168.500000112
120A32.9Very low34.5Very low89 Ų89131 Ų13174%0.73679%0.792SS**  trans-130.7151.8-172.100000112.1
121F32.2Very low34.4Very low226 Ų226132 Ų13299%0.99179%0.789SS**  trans-174.8157.7139.9-88.8-57.1000110.5
122G28.2Very low34.3Very low66 Ų66132.3 Ų132.368%0.6879%0.791SS**  trans179.7-161.7176.400000108.4
123P52.7Low34.9Very low123 Ų123131.5 Ų131.580%0.79979%0.789SS**  cis-130.7174.3-15.641.4-27.2000113.2
124V30.6Very low35.9Very low145 Ų145130.3 Ų130.388%0.87979%0.785SS**  trans-142.6145.8158.8-171.90000109.7
125Q34.2Very low36.2Very low179 Ų179132.3 Ų132.384%0.83679%0.785SS**  trans-136.4170-176.5-88.9-91.4-26.500111.1
126P47.7Very low36.1Very low103 Ų103133.6 Ų133.667%0.66979%0.789SS**  trans-118.4-177.6-144.544.6-39.2000117.2
127T28.1Very low35.9Very low136 Ų136132.8 Ų132.883%0.83479%0.788SS**  trans-145157.3165.450.70000109.3
128S30.8Very low35.6Very low112 Ų112133.3 Ų133.378%0.78379%0.791SS**  cis-166.6152.5-21.747.70000109.7
129V38.2Very low35.2Very low128 Ų128131.9 Ų131.978%0.77679%0.793SS**  trans-92.7163.9-179.2-690000114.3
130P45.8Very low35.2Very low116 Ų116136.2 Ų136.275%0.75380%0.797SS**  -128.9150.7110.86.116.5000112.8
131Y30.9Very low35Very low212 Ų212137.5 Ų137.583%0.83180%0.8SS**  60.9137.171.4-88.3-115.1000115.3
132S30.2Very low34.8Very low102 Ų102132 Ų13271%0.71380%0.796SS**  cis-170.2172.2-13.8-105.80000112.4
133M41.2Very low34.7Very low170 Ų170132.1 Ų132.184%0.83780%0.798SS**  trans-87.4158.8175.5-79.1-79-163.900114.2
134P52Low33.6Very low106 Ų106132.4 Ų132.469%0.68880%0.803SS**  -134.2155.5115.610.512.8000113.4
135H37.5Very low33.6Very low168 Ų168136.3 Ų136.378%0.77880%0.803SS**  63.1141.164.8-59.9-69.8000113.8
136T31.1Very low34.3Very low127 Ų127133.8 Ų133.878%0.77980%0.802SS**  cis-168.6174.37.62.90000112.1
137A29.7Very low33.5Very low86 Ų86131.8 Ų131.871%0.71180%0.8SS**  trans64.4132154.200000118.9
138Q30.5Very low33.6Very low193 Ų193134.5 Ų134.590%0.90280%0.803SS**  70.711155.6-70.6-174.1-13.700115.9
139A27.4Very low33.5Very low105 Ų105139.4 Ų139.487%0.86881%0.806SS**  trans-164.8162.3149.800000110.9
140L26.6Very low33.1Very low169 Ų169136.7 Ų136.789%0.88580%0.804SS**  trans-128.1156.5-178.9-72.2162.4000111.2
141S29Very low32.4Very low116 Ų116140.2 Ų140.281%0.81181%0.81SS**  trans123.2143.7139.9-53.10000117.7
142A27.9Very low32.6Very low109 Ų109137.1 Ų137.190%0.90180%0.803SS**  trans64.5142170.200000118
143G26.9Very low33.3Very low70 Ų70138 Ų13872%0.72281%0.806SS**  cis175.1148.2-1000000114.3
144S28.8Very low32.8Very low129 Ų129136.1 Ų136.190%0.90280%0.799SS**  trans71.7145.9168.7-64.50000120.6
145Y31.2Very low31.8Very low227 Ų227135.6 Ų135.689%0.8980%0.804SS**  trans-94.8173.8179.8-91.2-85.8000110.7
146P49.6Very low31.4Very low126 Ų126131.2 Ų131.282%0.81880%0.804SS**  cis-136.2-178.832.640.2-19.8000117.2
147G30.1Very low31.5Very low60 Ų60133.1 Ų133.162%0.61981%0.81SS**  trans-125.3-176.5175.300000113
148H30.8Very low31.7Very low193 Ų193137.5 Ų137.589%0.89482%0.815SS**  trans-154.5176.5173.2-114.8-86.7000113.4
149Y29.2Very low31.7Very low215 Ų215134.3 Ų134.384%0.84381%0.809SS**  trans-82.3138.8-169.4-81.8-119.3000115.6
150G29.2Very low32.1Very low71 Ų71135.7 Ų135.773%0.73281%0.806SS**  66.6-176.3108.200000123.2
151H31.3Very low32.2Very low190 Ų190135.5 Ų135.588%0.8881%0.805SS**  trans85.1131.8170.3-81.9-82.2000123.3
152H34.5Very low32.2Very low148 Ų148139.3 Ų139.369%0.68581%0.808SS**  trans-37.2163.9157.8-121.3-134.7000115.9D154H152-D154 IonicContact CE1-OD2 3.14Å; H152-D154 IonicContact ND1-OD2 2.65Å
153P46.1Very low32.2Very low119 Ų119140 Ų14077%0.77381%0.806SS**  -147.8142.162.938.5-18.6000119.9
154D29.8Very low32.2Very low132 Ų132140.1 Ų140.171%0.70681%0.807SS**  43.9161.7121.2-117.9-65.5000126.2H152H152-D154 IonicContact CE1-OD2 3.14Å; H152-D154 IonicContact ND1-OD2 2.65Å
155A30.7Very low32.2Very low95 Ų95142.7 Ų142.779%0.78581%0.81SS**  trans69.3132.7167.800000119.6
156G29.9Very low32.1Very low76 Ų76140.2 Ų140.278%0.78481%0.806SS**  trans-17720.8-176.400000122.3
157N32.9Very low31.1Very low167 Ų167142.4 Ų142.489%0.89381%0.805SS**  trans61.9151.6165.2-82-12.2000122.4
158H32.6Very low30.9Very low177 Ų177146.3 Ų146.382%0.81981%0.807SS**  trans-69.8160.1161.6-69.6-138.5000111.3
159T31Very low31.1Very low126 Ų126144.7 Ų144.777%0.77380%0.8SS**  176.7127.4106.8-70.80000111.7
160T35.5Very low31.9Very low134 Ų134139.2 Ų139.282%0.82279%0.791SS**  trans-86.9134.4164.349.60000110.5
161L30.2Very low31.9Very low165 Ų165141.7 Ų141.786%0.86480%0.797SS**  trans-157.8149.3152.5-114.1173000112
162F27.7Very low31.8Very low196 Ų196138.6 Ų138.686%0.8680%0.797SS**  trans-121.9136.5174.6-131.4-88.7000107.1
163S28.2Very low31.4Very low123 Ų123135.3 Ų135.386%0.8680%0.803SS**  trans-96144.9167.7-580000109.2
164G26.7Very low30.6Very low73 Ų73135.4 Ų135.475%0.75381%0.807SS**  cis173.9165-5.100000109.9
165L28.6Very low31.5Very low183 Ų183135.1 Ų135.196%0.95881%0.812SS**  trans-141.3149.6172.9-101.1169.7000109.6
166H30.7Very low31.4Very low175 Ų175134.5 Ų134.581%0.8182%0.815SS**  trans-146.7112.6-155.3-153.4-79.1000113.3
167H27.1Very low31.3Very low173 Ų173134 Ų13480%0.80181%0.81SS**  trans-159.6122.3159.4-110.749.8000108.8
168E26Very low31.4Very low142 Ų142135.3 Ų135.366%0.66481%0.811SS**  71.390.2102.1-64.9-70.778.500113
169Q35.1Very low31.4Very low158 Ų158130.9 Ų130.974%0.73880%0.8SS**  85.7164.272.8-65.8-78.17.300112.2
170P46.2Very low31.7Very low100 Ų100131.9 Ų131.965%0.64980%0.8SS**  -134.3173.9-83.636.2-17.2000115.4
171S28.6Very low31.5Very low123 Ų123133.3 Ų133.386%0.8680%0.802SS**  168.2153.3128.148.70000115.2
172S30Very low31.6Very low125 Ų125128.8 Ų128.887%0.87480%0.795SS**  trans-55.3149.2-176.850.40000119.4
173G25.9Very low31.9Very low80 Ų80127.8 Ų127.883%0.82579%0.793SS**  trans165.4113.415500000116.5
174S29Very low32.2Very low120 Ų120128.3 Ų128.384%0.83979%0.785SS**  trans-97.9-173.3170-40.20000110.5
175P48.5Very low32.5Very low127 Ų127135.2 Ų135.283%0.82579%0.788SS**  cis-132.8-176.2-11.841.2-24.5000113.9
176G28.4Very low32.7Very low82 Ų82133.4 Ų133.485%0.84578%0.779SS**  trans163.3159165.500000114.7
177G28.5Very low32.6Very low66 Ų66128.3 Ų128.368%0.6877%0.774SS**  trans-173.6-174.917700000113.9
178Q35.5Very low32.9Very low194 Ų194128.2 Ų128.291%0.90778%0.778SS**  trans74.5149-172.2-49.2-178.245.200113.5
179S31.8Very low34.2Very low84 Ų84127.5 Ų127.559%0.58779%0.786SS**  cis-151.9137.14.3-127.50000114.3
180L37.1Very low33.9Very low147 Ų147123.7 Ų123.777%0.7779%0.789SS**  44.7129.1127.2-57.7175.6000123
181N32.2Very low33.2Very low164 Ų164127.4 Ų127.488%0.87780%0.798SS**  -177.1127.2108.4-97.6-45.6000115.2
182G31.6Very low33.3Very low70 Ų70128.1 Ų128.172%0.72279%0.789SS**  trans57.8150.5152.300000121.9
183Q33.9Very low33.3Very low174 Ų174131.8 Ų131.881%0.81379%0.785SS**  cis-161.2148-8.9-111.1175.4-91.500109.8
184I35.9Very low33.4Very low135 Ų135134.6 Ų134.669%0.69279%0.786SS**  trans53.6110.1143.4-59.3176.5000117.6
185R33Very low33.3Very low217 Ų217139.4 Ų139.482%0.81979%0.786SS**  54.5146.588.3-78.3-164151.5-154.3-3.5114.8
186L32.1Very low32.5Very low145 Ų145137.5 Ų137.576%0.75978%0.775SS**  cis-165.41710.1-120.2178.4000108.1
187G28.6Very low32.6Very low69 Ų69140.1 Ų140.171%0.71177%0.77SS**  trans126.3117.9145.800000119
188L33.1Very low32.8Very low170 Ų170144.7 Ų144.789%0.8977%0.774SS**  trans-117.1-171.5161.1-68.7168.5000107.3
189P53Low32.4Very low128 Ų128141.7 Ų141.783%0.83176%0.763SS**  -122-164.8-6337.9-22.7000110.9
190G29.5Very low32.2Very low77 Ų77142.2 Ų142.279%0.79477%0.766SS**  trans-164.1153.5170.400000113.5
191E31.4Very low31.9Very low179 Ų179144.2 Ų144.284%0.83677%0.772SS**  trans-122.4161.1-169.6-73.2-160.4139.400115.3
192M29.9Very low31.7Very low137 Ų137143 Ų14368%0.67577%0.77SS**  trans79.2150.6138.5-79.6-99.4-97.700122.8
193Y29.7Very low31.6Very low203 Ų203144.3 Ų144.380%0.79677%0.774SS**  trans61.5124.7165.5-75.2-70.1000121.4
194V28.2Very low31.3Very low138 Ų138141.9 Ų141.984%0.83678%0.776SS**  177.7157.3105.3152.50000109.8
195R27.5Very low31.1Very low221 Ų221141.4 Ų141.483%0.83479%0.785SS**  trans-102171.2175.2-79.5177.761.91600112
196S30.7Very low31.1Very low87 Ų87143.1 Ų143.161%0.60879%0.792SS**  trans103.7110.2142.3-78.90000120.6
197D31.6Very low31Very low138 Ų138140.9 Ų140.974%0.73879%0.794SS**  83113.7116.5-67.3-54000122.7
198H31.8Very low31.2Very low162 Ų162145.2 Ų145.275%0.7580%0.801SS**  96162.7122.6-156.3-96.9000120.4
199L28Very low31.8Very low131 Ų131142.4 Ų142.469%0.68679%0.793SS**  trans69.397.6176.7-128.465000115.3
200S27.8Very low30.6Very low94 Ų94146 Ų14666%0.65780%0.796SS**  63.1118.173.2-55.30000114.8
201Q30.2Very low30.5Very low190 Ų190147.7 Ų147.789%0.88880%0.795SS**  -171.2166.5112-103.6178.822.800115.4
202V28.3Very low30.3Very low137 Ų137143.1 Ų143.183%0.8379%0.788SS**  trans-84.9142.6-168.8-166.40000112.1
203A29.1Very low30.3Very low99 Ų99141.8 Ų141.882%0.81879%0.792SS**  trans-158.8146.8143.700000110.7
204S29Very low30.9Very low122 Ų122137.9 Ų137.985%0.85379%0.792SS**  trans-119.6139170.1-64.70000110.6
205S30.3Very low31Very low126 Ų126138.3 Ų138.388%0.88179%0.789SS**  trans-152.8147.7159.950.80000110.3
206R33.4Very low31.2Very low253 Ų253136.5 Ų136.596%0.95579%0.789SS**  trans-93.7133.8178.5-75.6170.6158.3152.1-9110.1
207A30.2Very low31.1Very low98 Ų98135.2 Ų135.281%0.8179%0.79SS**  trans-164.8108.4149.700000111.6
208D32.8Very low31.1Very low160 Ų160140.4 Ų140.486%0.85680%0.801SS**  trans-73.8150.3138.1-75.1-66.8000106.9
209P45.5Very low30.9Very low110 Ų110136.3 Ų136.371%0.71480%0.803SS**  cis-151.4-175.346.937.4-14.2000118.3
210F28.3Very low31.1Very low205 Ų205133.6 Ų133.690%0.89981%0.807SS**  trans82.7140.6158.9-91.1-84.6000121.6
211S27.1Very low31.4Very low111 Ų111137.2 Ų137.278%0.77682%0.818SS**  trans95.4116.5150.4-148.80000120.8
212A27.1Very low31.4Very low84 Ų84135 Ų13569%0.69481%0.812SS**  trans27.2126.414700000120.1
213S29.7Very low31.8Very low108 Ų108136.1 Ų136.176%0.75581%0.812SS**  -172.3156.468.8-670000113.1
214P42.8Very low31.8Very low121 Ų121137.2 Ų137.279%0.78680%0.804SS**  trans-97.8124.3176.935.2-29.7000113.3
215L29.8Very low32.1Very low147 Ų147140.1 Ų140.177%0.7781%0.807SS**  trans-144.1129.7170.1-78.3-179.4000112.9
216H32.6Very low31.9Very low183 Ų183140.4 Ų140.485%0.84780%0.798SS**  trans54.1141.5163.9-56.6107000119.7
217G27.7Very low32Very low61 Ų61136.3 Ų136.363%0.62980%0.795SS**  cis148.994.6-7.600000113.5
218Y30.8Very low31.9Very low246 Ų246134.5 Ų134.597%0.96579%0.786SS**  trans-130.8135163.3-90.1-81.7000110.7
219G29.4Very low32Very low76 Ų76131.6 Ų131.678%0.78478%0.783SS**  trans-73.5129.1-160.100000115.2
220G30.9Very low31.3Very low75 Ų75134.9 Ų134.977%0.77379%0.789SS**  trans-70.2130.4162.700000111N222G220-N222 PolarHBondContact O-N 3.33Å
221L35.4Very low31.7Very low170 Ų170134.2 Ų134.289%0.8979%0.788SS**  trans-68.892.1178.7-70.8171.7000111.4L223L221-L223 PolarHBondContact O-N 3.49Å; L221-L223 VanDerWaalsContact O-N 3.11Å
222N29.9Very low32Very low142 Ų142138.3 Ų138.376%0.75980%0.795SS**  trans-73.197.9176.2-173.3-6.5000110.9G220 N224G220-N222 PolarHBondContact O-N 3.33Å; N222-N224 PolarHBondContact O-N 2.94Å; N222-N224 PolarHBondContact OD1-N 3.12Å
223L36.3Very low32.5Very low161 Ų161141.7 Ų141.784%0.84380%0.796SS**  trans-79.566.2173.8-74173.1000111.6L221 M225L221-L223 PolarHBondContact O-N 3.49Å; L221-L223 VanDerWaalsContact O-N 3.11Å; L223-M225 PolarHBondContact O-N 2.75Å; L223-M225 VanDerWaalsContact O-N 3.16Å
224N28Very low32.7Very low122 Ų122145.8 Ų145.865%0.65280%0.803SS**  trans-66.5106.5170.5-177.923.4000110.5N222 N226N222-N224 PolarHBondContact O-N 2.94Å; N222-N224 PolarHBondContact OD1-N 3.12Å; N224-N226 PolarHBondContact O-N 3.17Å
225M35.3Very low32.4Very low183 Ų183147.1 Ų147.190%0.90180%0.798SS**  trans-84.186169.4-77.6-166.5165.800110L223 L227L223-M225 PolarHBondContact O-N 2.75Å; L223-M225 VanDerWaalsContact O-N 3.16Å; M225-L227 PolarHBondContact O-N 3.11Å
226N27.8Very low32.8Very low132 Ų132148.1 Ų148.171%0.70680%0.798SS**  trans-66.4116.6174.2-172.14.6000110.7N224 G228N224-N226 PolarHBondContact O-N 3.17Å; N226-G228 PolarHBondContact OD1-N 2.99Å
227L35.3Very low33.7Very low168 Ų168144.5 Ų144.588%0.8879%0.791SS**  trans-112.676.1170.3-171.771.6000108.5M225 A229M225-L227 PolarHBondContact O-N 3.11Å; L227-A229 PolarHBondContact O-N 2.74Å
228G27.9Very low34.1Very low60 Ų60149.7 Ų149.762%0.61980%0.799SS**  trans-70.8110.4-174.800000112.9N226N226-G228 PolarHBondContact OD1-N 2.99Å
229A33.7Very low34.5Very low98 Ų98146.1 Ų146.181%0.8179%0.791SS**  trans-117.9100.6162.200000108.2L227 H231L227-A229 PolarHBondContact O-N 2.74Å; A229-H231 PolarHBondContact O-N 3.13Å
230H31.8Very low35.2Very low180 Ų180148.2 Ų148.283%0.83379%0.79SS**  trans-81.1114.8-179.4-81.5-91.7000111.2
231H35.8Very low35.5Very low191 Ų191152.8 Ų152.888%0.88479%0.791SS**  trans-137.5151.2155-104.435.9000109.3A229A229-H231 PolarHBondContact O-N 3.13Å
232H34.8Very low36Very low196 Ų196152.4 Ų152.491%0.90779%0.785SS**  trans-76.7155.3-163-89.2-105.4000114.6
233H35.9Very low36.4Very low155 Ų155154.2 Ų154.272%0.71879%0.788SS**  trans-59.1146169.5-86.9-69.2000112.7H235H233-H235 AromaticContact ND1-CD2 3.9Å
234H35.8Very low36.8Very low194 Ų194154.8 Ų154.890%0.89879%0.786SS**  -139.8142.6125.4-113.8-88.3000109.5
235H34.8Very low37.5Very low150 Ų150152.7 Ų152.769%0.69479%0.793SS**  trans-102.1135.5-179.9-111.8-94.8000110.3H233H233-H235 AromaticContact ND1-CD2 3.9Å
236H39.4Very low37.5Very low167 Ų167146.4 Ų146.477%0.77378%0.775SS**  trans-151.2132158.2-123.3-88.9000109.7
237P50.9Low38.5Very low108 Ų108145.5 Ų145.570%0.70178%0.777SS**  trans-100.8118.8-173.834.8-30.2000113
238H36Very low38.8Very low170 Ų170139.8 Ų139.879%0.78776%0.758SS**  trans-140.9129.3164.2-82.6-81.3000112.5
239H39.8Very low39.5Very low171 Ų171140.3 Ų140.379%0.79276%0.757SS**  trans23133.5164-95.7-103000122.5
240P43.4Very low40Very low119 Ų119142 Ų14277%0.77375%0.746SS**PPolyproline II helixtrans-79.8123.1172.732.8-32.8000112.3
241H37.7Very low40.7Very low171 Ų171140.9 Ų140.979%0.79274%0.739SS**PPolyproline II helixtrans-102.4133.5161.3-99.3-97.3000110.8H243H241-H243 PolarHBondContact O-N 2.82Å
242H46.3Very low41.2Very low163 Ų163141.9 Ų141.976%0.75574%0.735SS**PPolyproline II helixtrans-65.5117.9174.9-102.6-104.5000110.9H244H242-H244 AromaticContact CE1-NE2 3.9Å; H242-H244 AromaticContact ND1-CD2 3.76Å; H242-H244 AromaticContact ND1-NE2 3.37Å; H242-H244 PolarHBondContact ND1-NE2 2.6Å
243H37.6Very low41.5Very low180 Ų180142.7 Ų142.783%0.83373%0.732SS**  trans-128.8105.9159.4-96.7-80.2000110.9H241 G245H241-H243 PolarHBondContact O-N 2.82Å; H243-G245 PolarHBondContact O-N 3.04Å
244H45.5Very low42Very low173 Ų173142.1 Ų142.180%0.80173%0.731SS**  trans-73.9111.6167-74.5-105.4000109H242H242-H244 AromaticContact CE1-NE2 3.9Å; H242-H244 AromaticContact ND1-CD2 3.76Å; H242-H244 AromaticContact ND1-NE2 3.37Å; H242-H244 PolarHBondContact ND1-NE2 2.6Å
245G42.7Very low42.4Very low77 Ų77142.8 Ų142.879%0.79473%0.726SS**  trans-174.14.2179.200000116.9H243H243-G245 PolarHBondContact O-N 3.04Å
246G34.9Very low42.5Very low52 Ų52144 Ų14454%0.53673%0.732SS.*  trans-80.4148.1-177.400000114G248 A249G246-G248 PolarHBondContact O-N 3.22Å; G246-A249 PolarHBondContact O-N 3.09Å
247P48.1Very low42.7Very low112 Ų112141.1 Ų141.173%0.72773%0.728SS**G310 helixtrans-65.4-4.2-176.425.8-35000115.4A249 F250P247-A249 PolarHBondContact O-N 2.89Å; P247-F250 PolarHBondContact O-N 3.01Å
248G41.4Very low42.7Very low48 Ų48143.3 Ų143.350%0.49573%0.732SS.*G310 helixtrans-61-18.6174.900000114.8G246G246-G248 PolarHBondContact O-N 3.22Å
249A42.7Very low43.4Very low72 Ų72143.7 Ų143.760%0.59573%0.732SS**G310 helixtrans-63.6-39.6176.300000112.9G246 P247 F251 R252G246-A249 PolarHBondContact O-N 3.09Å; P247-A249 PolarHBondContact O-N 2.89Å; A249-F251 VanDerWaalsContact C-N 3.28Å; A249-F251 PolarHBondContact O-N 2.88Å; A249-R252 PolarHBondContact O-N 3.14Å; A249-R252 VanDerWaalsContact O-N 3.12Å
250F44.8Very low44.5Very low134 Ų134141 Ų14159%0.58872%0.719SS**Hα-helixtrans-65.9-31.9-174.7-157.6-93.8000112.6P247 R252 M254P247-F250 PolarHBondContact O-N 3.01Å; F250-R252 VanDerWaalsContact C-N 3.25Å; F250-R252 PolarHBondContact O-N 3.5Å; F250-M254 HydrophobicContact CE1-CG 4.5Å
251F46.3Very low46.2Very low155 Ų155141.7 Ų141.768%0.6871%0.712SS**Hα-helixtrans-72.6-11.5177.5-69.1-78.9000114.3A249 R255A249-F251 VanDerWaalsContact C-N 3.28Å; A249-F251 PolarHBondContact O-N 2.88Å; F251-R255 WeakPolarHBondContact O-CB 3.16Å
252R47.1Very low48.3Very low213 Ų213133.8 Ų133.880%0.80468%0.676SS**Hα-helixtrans-80.9-34.8177.2-71.7-176.9168.9174-3.8112.8A249 F250A249-R252 PolarHBondContact O-N 3.14Å; A249-R252 VanDerWaalsContact O-N 3.12Å; F250-R252 VanDerWaalsContact C-N 3.25Å; F250-R252 PolarHBondContact O-N 3.5Å
253Y41Very low50.1Low212 Ų212130.1 Ų130.183%0.83166%0.661SS**Hα-helixtrans-81.7-29.2-178.3-107.7-86.8000114.2R255Y253-R255 PolarHBondContact O-N 3.38Å
254M45.7Very low52.4Low143 Ų143121.5 Ų121.570%0.70462%0.621SS**THydrogen-bonded Turntrans-85.522175.1-68.3-69.9-72.500113.2F250F250-M254 HydrophobicContact CE1-CG 4.5Å
255R45Very low54.2Low209 Ų209116.9 Ų116.979%0.78960%0.599SS**THydrogen-bonded Turntrans-130.922.7-174.7-146-168.6-150.6-154.28.7114.5F251 Y253 P257F251-R255 WeakPolarHBondContact O-CB 3.16Å; Y253-R255 PolarHBondContact O-N 3.38Å; R255-P257 WeakPolarHBondContact O-CD 3.48Å
256Q37.1Very low56.2Low175 Ų175113.4 Ų113.482%0.81856%0.561SS**  trans-79.5108.2150.8-73.4-172.7-9.400107.5I258Q256-I258 PolarHBondContact O-N 3.27Å; Q256-I258 VanDerWaalsContact O-N 3.11Å
257P43.7Very low58.4Low107 Ų107113 Ų11370%0.69555%0.547SS*.  trans-66.4111.6163.628.8-31.5000107.4R255 K259R255-P257 WeakPolarHBondContact O-CD 3.48Å; P257-K259 PolarHBondContact O-N 3.12Å; P257-K259 VanDerWaalsContact O-N 3.07Å
258I49.4Very low59.6Low153 Ų153110 Ų11079%0.78552%0.523SS*.  trans-52116.9146.1-60.4172.8000104.1Q256 Q260Q256-I258 PolarHBondContact O-N 3.27Å; Q256-I258 VanDerWaalsContact O-N 3.11Å; I258-Q260 PolarHBondContact O-N 3.18Å
259K52Low60.6Low179 Ų179111.9 Ų111.978%0.77853%0.527SS*.  trans-68.882.4-179.9-68.5-175.8-179.9-178.60108.4P257 E261P257-K259 PolarHBondContact O-N 3.12Å; P257-K259 VanDerWaalsContact O-N 3.07Å; K259-E261 VanDerWaalsContact C-N 3.29Å; K259-E261 PolarHBondContact O-N 3.02Å
260Q63Low61.3Low113 Ų113116.4 Ų116.453%0.52854%0.535SS..  trans-68.894.2165.7-74.5-159.9-112.600106.9I258 L262I258-Q260 PolarHBondContact O-N 3.18Å; Q260-L262 HydrophobicContact CB-CD2 4.12Å; Q260-L262 WeakPolarHBondContact O-CD2 3.22Å; Q260-L262 WeakPolarHBondContact O-CG 3.46Å; Q260-L262 PolarHBondContact O-N 2.65Å; Q260-L262 VanDerWaalsContact O-N 3.09Å
261E77.9Confident61.6Low135 Ų135115 Ų11563%0.63153%0.53SS*.  trans-64.6110.1173.9-62.6-175.4166.200108.3K259 I263K259-E261 VanDerWaalsContact C-N 3.29Å; K259-E261 PolarHBondContact O-N 3.02Å; E261-I263 PolarHBondContact O-N 3.28Å; E261-I263 VanDerWaalsContact O-N 3.14Å
262L82.9Confident61.6Low5 Ų5113.3 Ų113.33%0.02654%0.538CS..EExtended strand (participates in β ladder)trans-8594.7-173.7-53.7-177000108.6Q260 Y281 T283 M284 L287 E334Q260-L262 HydrophobicContact CB-CD2 4.12Å; Q260-L262 WeakPolarHBondContact O-CD2 3.22Å; Q260-L262 WeakPolarHBondContact O-CG 3.46Å; Q260-L262 PolarHBondContact O-N 2.65Å; Q260-L262 VanDerWaalsContact O-N 3.09Å; L262-Y281 PolarHBondContact N-O 3.4Å; L262-Y281 PolarHBondContact O-N 3.31Å; L262-T283 VanDerWaalsContact CD1-C 3.44Å; L262-M284 HydrophobicContact CD1-CB 4.31Å; L262-M284 VanDerWaalsContact CD1-N 3.29Å; L262-L287 HydrophobicContact CB-CD2 3.75Å; L262-E334 WeakPolarHBondContact CD1-OE2 3.41Å; L262-E334 HydrophobicContact CD2-CG 3.75Å
263I84.3Confident62.2Low85 Ų85108.5 Ų108.544%0.43653%0.534SS..EExtended strand (participates in β ladder)trans-77.5122-179.1-37.5-173.2000109.1E261 T280 W308E261-I263 PolarHBondContact O-N 3.28Å; E261-I263 VanDerWaalsContact O-N 3.14Å; I263-T280 HydrophobicContact CG1-CG2 4.23Å; I263-T280 HydrophobicContact CG2-CG2 4.28Å; I263-W308 WeakPolarHBondContact O-CH2 3.34Å; I263-W308 WeakPolarHBondContact O-CZ2 3.49Å
264C85.2Confident63.2Low0 Ų0106.1 Ų106.10%053%0.528CS..  trans-64.2141.8163-162.90000109.2C277 S278 K279 Y281 L287 H290C264-C277 CarbonylContact C-O 3.23Å; C264-C277 VanDerWaalsContact C-O 3.23Å; C264-S278 WeakPolarHBondContact O-CA 3.23Å; C264-K279 WeakPolarHBondContact CB-O 3.21Å; C264-K279 PolarHBondContact N-O 3.11Å; C264-Y281 HydrophobicContact CB-CE2 4.42Å; C264-L287 HydrophobicContact CB-CD1 3.71Å; C264-H290 PolarHBondContact SG-NE2 3.18Å; C264-H290 VanDerWaalsContact SG-NE2 3.36Å
265K84.2Confident64.5Low76 Ų76104.5 Ų104.533%0.3352%0.517SS..  trans-138.753.5170.2-67.3177.5148.6-129.90109.8L276 C277 W308 E309K265-L276 HydrophobicContact CB-CD1 4.15Å; K265-C277 WeakPolarHBondContact CA-O 3.33Å; K265-W308 HydrophobicContact CB-CD2 4.38Å; K265-W308 HydrophobicContact CB-CZ2 3.96Å; K265-W308 HydrophobicContact CG-CZ2 4.42Å; K265-W308 WeakPolarHBondContact O-CA 3.32Å; K265-E309 HydrophobicContact CB-CB 4.24Å; K265-E309 WeakPolarHBondContact CD-OE2 3.37Å; K265-E309 WeakPolarHBondContact CE-OE2 3.39Å; K265-E309 IonicContact NZ-OE2 2.71Å; K265-E309 PolarHBondContact NZ-OE2 3.42Å; K265-E309 PolarHBondContact O-N 2.98Å
266W82.9Confident66.2Low3 Ų398 Ų981%0.01150%0.497CS..EExtended strand (participates in β ladder)trans-92.1136.1-178.3-163.6-79.8000110.8L276 C277 V291 H295 V296 I305 C306 F307 W308W266-L276 WeakPolarHBondContact O-CA 3.16Å; W266-C277 HydrophobicContact CB-CB 4.38Å; W266-C277 PolarHBondContact O-N 3.33Å; W266-V291 HydrophobicContact CD2-CG1 4.37Å; W266-V291 HydrophobicContact CE3-CG1 3.61Å; W266-V291 HydrophobicContact CE3-CG2 4.41Å; W266-V291 HydrophobicContact CH2-CG1 3.89Å; W266-V291 HydrophobicContact CZ3-CG1 3.34Å; W266-H295 AromaticContact CD1-CD2 3.92Å; W266-H295 AromaticContact CD1-CG 3.59Å; W266-H295 AromaticContact CD1-ND1 4Å; W266-H295 HydrophobicContact CD2-CB 3.95Å; W266-H295 HydrophobicContact CG-CB 3.89Å; W266-H295 AromaticContact CG-CD2 3.67Å; W266-H295 AromaticContact CG-CG 3.78Å; W266-H295 HydrophobicContact CZ2-CB 4.26Å; W266-V296 HydrophobicContact CH2-CG2 3.54Å; W266-V296 HydrophobicContact CZ2-CG2 3.78Å; W266-V296 HydrophobicContact CZ3-CG2 4.46Å; W266-I305 VanDerWaalsContact CH2-O 3.29Å; W266-I305 WeakPolarHBondContact CH2-O 3.28Å; W266-C306 HydrophobicContact CH2-CB 4.41Å; W266-F307 HydrophobicContact CZ2-CB 4.27Å; W266-F307 AromaticContact CZ2-CD2 3.93Å; W266-F307 HydrophobicContact CZ2-CD2 3.93Å; W266-F307 AromaticContact NE1-CD2 3.93Å; W266-W308 HydrophobicContact CE3-CE3 4.16Å
267L82.7Confident68.4Low45 Ų4590.1 Ų90.124%0.23646%0.462CS..EExtended strand (participates in β ladder)trans-95.3128.5174.3-78.275.5000110.4P269 K274 L276 F307 E309L267-P269 WeakPolarHBondContact O-CD 3.41Å; L267-K274 HydrophobicContact CD2-CD 4.18Å; L267-L276 HydrophobicContact CD1-CD1 3.63Å; L267-L276 HydrophobicContact CG-CD1 4.28Å; L267-F307 PolarHBondContact N-O 2.85Å; L267-E309 VanDerWaalsContact CD1-CA 3.4Å; L267-E309 HydrophobicContact CD1-CB 3.7Å; L267-E309 HydrophobicContact CD1-CG 4.19Å
268E72.5Confident70.3Confident49 Ų4988.9 Ų88.923%0.22946%0.456CS..PPolyproline II helixtrans-80.8118.7167.9-65.8172.3-174.200109K275 H295E268-K275 HydrophobicContact CB-CB 4.25Å; E268-K275 HydrophobicContact CG-CB 4.45Å; E268-K275 PolarHBondContact N-O 2.71Å; E268-K275 WeakPolarHBondContact OE2-CB 3.31Å; E268-K275 WeakPolarHBondContact OE2-CD 3.47Å; E268-H295 IonicContact OE1-CE1 2.67Å; E268-H295 IonicContact OE1-ND1 3.07Å; E268-H295 IonicContact OE1-NE2 3.02Å; E268-H295 PolarHBondContact OE1-NE2 3.45Å
269P62Low72Confident87 Ų8786 Ų8657%0.56544%0.438SS*.SBendtrans-79.7-25.8-174.630.2-34.2000113.9L267 H271L267-P269 WeakPolarHBondContact O-CD 3.41Å; P269-H271 VanDerWaalsContact C-N 3.35Å; P269-H271 PolarHBondContact O-N 3.46Å
270E57.8Low73.5Confident166 Ų16681.5 Ų81.578%0.77643%0.425SS*.SBendtrans-77.2-10.3-168.2-68.8-66.9106.100115.3
271H51.7Low74.6Confident104 Ų10478.3 Ų78.348%0.48141%0.409SS..SBendtrans-128.7132.1-171.6-69.183.8000112.5P269 P273 K274P269-H271 VanDerWaalsContact C-N 3.35Å; P269-H271 PolarHBondContact O-N 3.46Å; H271-P273 CarbonylContact O-C 3.58Å; H271-P273 VanDerWaalsContact O-O 3.11Å; H271-K274 WeakPolarHBondContact O-CA 3.44Å; H271-K274 PolarHBondContact O-N 3.49Å
272S46.2Very low74.7Confident121 Ų12176.4 Ų76.485%0.84641%0.411SS*.SBendtrans-91.7132.8163.4520000110
273P59Low74.7Confident111 Ų11179 Ų7972%0.72143%0.426SS*.SBendcis-69.8151.9-11.232.6-35.9000112.1H271 K275H271-P273 CarbonylContact O-C 3.58Å; H271-P273 VanDerWaalsContact O-O 3.11Å; P273-K275 PolarHBondContact O-N 3.24Å
274K61.9Low74.5Confident162 Ų16275.7 Ų75.770%0.70441%0.409SS*.  trans-50.5107.5178.1-66.7174.1174.5-175.60110.6L267 H271 L276L267-K274 HydrophobicContact CD2-CD 4.18Å; H271-K274 WeakPolarHBondContact O-CA 3.44Å; H271-K274 PolarHBondContact O-N 3.49Å; K274-L276 PolarHBondContact O-N 3.42Å
275K74.1Confident74.3Confident109 Ų10982.1 Ų82.147%0.47444%0.439SS..  trans-75.9117.4177.1-69.6174.6-177.4169.10109E268 P273E268-K275 HydrophobicContact CB-CB 4.25Å; E268-K275 HydrophobicContact CG-CB 4.45Å; E268-K275 PolarHBondContact N-O 2.71Å; E268-K275 WeakPolarHBondContact OE2-CB 3.31Å; E268-K275 WeakPolarHBondContact OE2-CD 3.47Å; P273-K275 PolarHBondContact O-N 3.24Å
276L80.7Confident74.3Confident72 Ų7281.9 Ų81.938%0.37744%0.439SS..EExtended strand (participates in β ladder)trans-87.2114.2168.3-176.769.8000108.1K265 W266 L267 K274 S278 E309K265-L276 HydrophobicContact CB-CD1 4.15Å; W266-L276 WeakPolarHBondContact O-CA 3.16Å; L267-L276 HydrophobicContact CD1-CD1 3.63Å; L267-L276 HydrophobicContact CG-CD1 4.28Å; K274-L276 PolarHBondContact O-N 3.42Å; L276-S278 PolarHBondContact O-N 3.42Å; L276-E309 HydrophobicContact CD1-CB 4.3Å
277C82.6Confident74.4Confident10 Ų1081.7 Ų81.77%0.06844%0.439CS..EExtended strand (participates in β ladder)trans-68.4127.7166.4-177.80000109.3C264 K265 W266 H290 H295C264-C277 CarbonylContact C-O 3.23Å; C264-C277 VanDerWaalsContact C-O 3.23Å; K265-C277 WeakPolarHBondContact CA-O 3.33Å; W266-C277 HydrophobicContact CB-CB 4.38Å; W266-C277 PolarHBondContact O-N 3.33Å; C277-H290 VanDerWaalsContact SG-CE1 3.53Å; C277-H290 PolarHBondContact SG-NE2 2.87Å; C277-H295 WeakPolarHBondContact CB-NE2 3.36Å
278S83.9Confident74.4Confident82 Ų8280.4 Ų80.457%0.57343%0.432SS*.  trans-122.915.1-176.454.30000113.2C264 L276 T280C264-S278 WeakPolarHBondContact O-CA 3.23Å; L276-S278 PolarHBondContact O-N 3.42Å; S278-T280 PolarHBondContact O-N 3.2Å
279K84.7Confident74.9Confident93 Ų9380.8 Ų80.840%0.40444%0.438SS..  trans-59.8135-178.7-63.3-179.9-169.9-176.10110.8C264 Y281 E294C264-K279 WeakPolarHBondContact CB-O 3.21Å; C264-K279 PolarHBondContact N-O 3.11Å; K279-Y281 HydrophobicContact CB-CE2 3.61Å; K279-Y281 VanDerWaalsContact CB-OH 3.31Å; K279-Y281 WeakPolarHBondContact CB-OH 3.41Å; K279-Y281 VanDerWaalsContact CD-OH 3.23Å; K279-Y281 WeakPolarHBondContact CD-OH 3.46Å; K279-Y281 WeakPolarHBondContact O-CE2 3.46Å; K279-E294 IonicContact NZ-OE1 3.54Å; K279-E294 IonicContact NZ-OE2 2.65Å; K279-E294 PolarHBondContact NZ-OE2 3.49Å
280T84.4Confident76.1Confident84 Ų8477.3 Ų77.352%0.51541%0.414SS..EExtended strand (participates in β ladder)trans-99.9146.3179.9550000111.7I263 S278I263-T280 HydrophobicContact CG1-CG2 4.23Å; I263-T280 HydrophobicContact CG2-CG2 4.28Å; S278-T280 PolarHBondContact O-N 3.2Å
281Y84.6Confident77.2Confident45 Ų4569.4 Ų69.418%0.17638%0.377CS..EExtended strand (participates in β ladder)trans-136.2152.5-175.5-65-73.4000112.8L262 C264 K279 E286 L287 H290L262-Y281 PolarHBondContact N-O 3.4Å; L262-Y281 PolarHBondContact O-N 3.31Å; C264-Y281 HydrophobicContact CB-CE2 4.42Å; K279-Y281 HydrophobicContact CB-CE2 3.61Å; K279-Y281 VanDerWaalsContact CB-OH 3.31Å; K279-Y281 WeakPolarHBondContact CB-OH 3.41Å; K279-Y281 VanDerWaalsContact CD-OH 3.23Å; K279-Y281 WeakPolarHBondContact CD-OH 3.46Å; K279-Y281 WeakPolarHBondContact O-CE2 3.46Å; Y281-E286 HydrophobicContact CD1-CB 3.46Å; Y281-E286 VanDerWaalsContact CD1-CB 3.46Å; Y281-E286 HydrophobicContact CD1-CG 4.49Å; Y281-E286 HydrophobicContact CE1-CB 4.26Å; Y281-E286 HydrophobicContact CG-CB 4.04Å; Y281-L287 HydrophobicContact CD2-CB 3.72Å; Y281-L287 HydrophobicContact CD2-CD1 3.7Å; Y281-L287 HydrophobicContact CD2-CG 4.24Å; Y281-L287 HydrophobicContact CE2-CD1 3.99Å; Y281-L287 HydrophobicContact CG-CB 3.92Å; Y281-H290 HydrophobicContact CE1-CB 4.16Å; Y281-H290 HydrophobicContact CE2-CB 4.11Å; Y281-H290 AromaticContact CE2-CD2 3.41Å; Y281-H290 VanDerWaalsContact CE2-CD2 3.41Å; Y281-H290 WeakPolarHBondContact CE2-CD2 3.48Å; Y281-H290 AromaticContact CE2-CG 3.89Å; Y281-H290 AromaticContact CZ-CD2 3.62Å; Y281-H290 AromaticContact CZ-CG 3.6Å; Y281-H290 WeakPolarHBondContact OH-CB 3.48Å; Y281-H290 PolarHBondContact OH-CD2 3.16Å; Y281-H290 VanDerWaalsContact OH-CD2 3.28Å
282S79.7Confident78.5Confident96 Ų9664.8 Ų64.867%0.67136%0.356SS*.SBendtrans-93.7-22.9-178.9770000113.1E286S282-E286 WeakPolarHBondContact CA-OE2 3.35Å; S282-E286 WeakPolarHBondContact CB-OE2 3.42Å; S282-E286 PolarHBondContact N-OE2 3.36Å; S282-E286 VanDerWaalsContact OG-CD 3.31Å; S282-E286 PolarHBondContact OG-OE1 3.22Å; S282-E286 VanDerWaalsContact OG-OE1 3.13Å; S282-E286 PolarHBondContact OG-OE2 2.84Å
283T82.9Confident80.2Confident58 Ų5863.4 Ų63.436%0.35634%0.343SS..SBendtrans-134152.3174.574.90000113L262 H285 E286 L287L262-T283 VanDerWaalsContact CD1-C 3.44Å; T283-H285 PolarHBondContact O-N 3.05Å; T283-H285 VanDerWaalsContact O-N 3.12Å; T283-H285 PolarHBondContact OG1-N 3.32Å; T283-E286 WeakPolarHBondContact CB-OE1 3.32Å; T283-E286 WeakPolarHBondContact CG2-OE1 3.48Å; T283-E286 PolarHBondContact N-OE2 2.54Å; T283-E286 PolarHBondContact O-N 3.12Å; T283-E286 PolarHBondContact OG1-N 3.39Å; T283-E286 PolarHBondContact OG1-OE1 2.95Å; T283-L287 PolarHBondContact O-N 3.31Å
284M80.1Confident81.1Confident16 Ų1663 Ų638%0.07933%0.331CS..Hα-helixtrans-55.7-28.6171.8-173.377-83.900112.1L262 L287 V288 I328 R329 T332 E334L262-M284 HydrophobicContact CD1-CB 4.31Å; L262-M284 VanDerWaalsContact CD1-N 3.29Å; M284-L287 HydrophobicContact CE-CB 4.07Å; M284-L287 HydrophobicContact CE-CD2 3.69Å; M284-L287 HydrophobicContact CE-CG 3.88Å; M284-V288 HydrophobicContact CE-CG2 3.8Å; M284-V288 HydrophobicContact CG-CG2 4.11Å; M284-V288 VanDerWaalsContact O-CB 3.23Å; M284-V288 WeakPolarHBondContact O-CB 3.37Å; M284-V288 WeakPolarHBondContact O-CG2 3.26Å; M284-V288 PolarHBondContact O-N 3.2Å; M284-V288 HydrophobicContact SD-CG2 4.44Å; M284-I328 HydrophobicContact CE-CG2 3.76Å; M284-R329 HydrophobicContact SD-CG 3.54Å; M284-R329 VanDerWaalsContact SD-CG 3.54Å; M284-T332 HydrophobicContact CE-CG2 4.19Å; M284-E334 VanDerWaalsContact CB-OE2 3.26Å; M284-E334 WeakPolarHBondContact CB-OE2 3.25Å
285H81.3Confident81.8Confident136 Ų13657 Ų5763%0.6331%0.306SS*.Hα-helixtrans-69-44.9180-176.558.8000111.2T283 V288 T289T283-H285 PolarHBondContact O-N 3.05Å; T283-H285 VanDerWaalsContact O-N 3.12Å; T283-H285 PolarHBondContact OG1-N 3.32Å; H285-V288 PolarHBondContact O-N 3.21Å; H285-T289 PolarHBondContact CE1-OG1 3.4Å; H285-T289 WeakPolarHBondContact O-CB 3.37Å; H285-T289 PolarHBondContact O-N 2.86Å; H285-T289 PolarHBondContact O-OG1 3.44Å
286E85.1Confident81.8Confident70 Ų7052.3 Ų52.333%0.32729%0.286SS..Hα-helixtrans-59.4-50.3174.9-66.4133.2-132.400111.5Y281 S282 T283 V288 T289 H290Y281-E286 HydrophobicContact CD1-CB 3.46Å; Y281-E286 VanDerWaalsContact CD1-CB 3.46Å; Y281-E286 HydrophobicContact CD1-CG 4.49Å; Y281-E286 HydrophobicContact CE1-CB 4.26Å; Y281-E286 HydrophobicContact CG-CB 4.04Å; S282-E286 WeakPolarHBondContact CA-OE2 3.35Å; S282-E286 WeakPolarHBondContact CB-OE2 3.42Å; S282-E286 PolarHBondContact N-OE2 3.36Å; S282-E286 VanDerWaalsContact OG-CD 3.31Å; S282-E286 PolarHBondContact OG-OE1 3.22Å; S282-E286 VanDerWaalsContact OG-OE1 3.13Å; S282-E286 PolarHBondContact OG-OE2 2.84Å; T283-E286 WeakPolarHBondContact CB-OE1 3.32Å; T283-E286 WeakPolarHBondContact CG2-OE1 3.48Å; T283-E286 PolarHBondContact N-OE2 2.54Å; T283-E286 PolarHBondContact O-N 3.12Å; T283-E286 PolarHBondContact OG1-N 3.39Å; T283-E286 PolarHBondContact OG1-OE1 2.95Å; E286-V288 PolarHBondContact O-N 2.92Å; E286-T289 PolarHBondContact O-N 2.83Å; E286-H290 WeakPolarHBondContact O-CB 3.41Å; E286-H290 PolarHBondContact O-N 3.05Å
287L85.3Confident81.1Confident0 Ų049.9 Ų49.90%028%0.278CS..Hα-helixtrans-62.6-39.9179.5173.357.8000112.2L262 C264 Y281 T283 M284 V291 W308 T332L262-L287 HydrophobicContact CB-CD2 3.75Å; C264-L287 HydrophobicContact CB-CD1 3.71Å; Y281-L287 HydrophobicContact CD2-CB 3.72Å; Y281-L287 HydrophobicContact CD2-CD1 3.7Å; Y281-L287 HydrophobicContact CD2-CG 4.24Å; Y281-L287 HydrophobicContact CE2-CD1 3.99Å; Y281-L287 HydrophobicContact CG-CB 3.92Å; T283-L287 PolarHBondContact O-N 3.31Å; M284-L287 HydrophobicContact CE-CB 4.07Å; M284-L287 HydrophobicContact CE-CD2 3.69Å; M284-L287 HydrophobicContact CE-CG 3.88Å; L287-V291 HydrophobicContact CD1-CG2 3.81Å; L287-V291 WeakPolarHBondContact O-CB 3.15Å; L287-V291 VanDerWaalsContact O-CG2 3.3Å; L287-V291 WeakPolarHBondContact O-CG2 3.32Å; L287-V291 PolarHBondContact O-N 2.96Å; L287-W308 HydrophobicContact CD2-CH2 4.36Å; L287-T332 HydrophobicContact CD2-CG2 3.53Å
288V81.8Confident79.8Confident17 Ų1751.4 Ų51.410%0.10330%0.295CS..Hα-helixtrans-64.1-44.2173.5163.30000111.4M284 H285 E286 T292 V325M284-V288 HydrophobicContact CE-CG2 3.8Å; M284-V288 HydrophobicContact CG-CG2 4.11Å; M284-V288 VanDerWaalsContact O-CB 3.23Å; M284-V288 WeakPolarHBondContact O-CB 3.37Å; M284-V288 WeakPolarHBondContact O-CG2 3.26Å; M284-V288 PolarHBondContact O-N 3.2Å; M284-V288 HydrophobicContact SD-CG2 4.44Å; H285-V288 PolarHBondContact O-N 3.21Å; E286-V288 PolarHBondContact O-N 2.92Å; V288-T292 HydrophobicContact CG1-CG2 4.39Å; V288-T292 VanDerWaalsContact O-CB 3.29Å; V288-T292 WeakPolarHBondContact O-CB 3.45Å; V288-T292 VanDerWaalsContact O-CG2 3.28Å; V288-T292 WeakPolarHBondContact O-CG2 3.38Å; V288-T292 PolarHBondContact O-N 2.68Å; V288-T292 PolarHBondContact O-OG1 2.92Å; V288-V325 HydrophobicContact CG1-CG1 4.28Å; V288-V325 HydrophobicContact CG1-CG2 3.56Å; V288-V325 HydrophobicContact CG2-CB 4.44Å; V288-V325 HydrophobicContact CG2-CG1 3.77Å; V288-V325 HydrophobicContact CG2-CG2 4.15Å
289T83.6Confident78.4Confident58 Ų5853 Ų5336%0.35630%0.304SS..Hα-helixtrans-64.9-48.4-179.3-66.50000110H285 E286 T292 V293H285-T289 PolarHBondContact CE1-OG1 3.4Å; H285-T289 WeakPolarHBondContact O-CB 3.37Å; H285-T289 PolarHBondContact O-N 2.86Å; H285-T289 PolarHBondContact O-OG1 3.44Å; E286-T289 PolarHBondContact O-N 2.83Å; T289-T292 CarbonylContact O-C 3.51Å; T289-T292 PolarHBondContact O-N 2.73Å; T289-V293 HydrophobicContact CG2-CG2 4.31Å; T289-V293 WeakPolarHBondContact O-CB 3.3Å; T289-V293 VanDerWaalsContact O-CG2 3.24Å; T289-V293 WeakPolarHBondContact O-CG2 3.34Å; T289-V293 PolarHBondContact O-N 2.89Å
290H85.8Confident77Confident13 Ų1357.4 Ų57.46%0.0633%0.326CS..Hα-helixtrans-53.9-57.9172.6157.256.1000112.3C264 C277 Y281 E286 T292 V293 E294 H295C264-H290 PolarHBondContact SG-NE2 3.18Å; C264-H290 VanDerWaalsContact SG-NE2 3.36Å; C277-H290 VanDerWaalsContact SG-CE1 3.53Å; C277-H290 PolarHBondContact SG-NE2 2.87Å; Y281-H290 HydrophobicContact CE1-CB 4.16Å; Y281-H290 HydrophobicContact CE2-CB 4.11Å; Y281-H290 AromaticContact CE2-CD2 3.41Å; Y281-H290 VanDerWaalsContact CE2-CD2 3.41Å; Y281-H290 WeakPolarHBondContact CE2-CD2 3.48Å; Y281-H290 AromaticContact CE2-CG 3.89Å; Y281-H290 AromaticContact CZ-CD2 3.62Å; Y281-H290 AromaticContact CZ-CG 3.6Å; Y281-H290 WeakPolarHBondContact OH-CB 3.48Å; Y281-H290 PolarHBondContact OH-CD2 3.16Å; Y281-H290 VanDerWaalsContact OH-CD2 3.28Å; E286-H290 WeakPolarHBondContact O-CB 3.41Å; E286-H290 PolarHBondContact O-N 3.05Å; H290-T292 PolarHBondContact O-N 3.02Å; H290-V293 PolarHBondContact O-N 3.15Å; H290-V293 VanDerWaalsContact O-N 3.15Å; H290-E294 IonicContact CE1-OE2 3.6Å; H290-E294 PolarHBondContact CE1-OE2 2.97Å; H290-E294 IonicContact CG-OE2 2.54Å; H290-E294 IonicContact ND1-OE2 3.9Å; H290-E294 PolarHBondContact ND1-OE2 2.85Å; H290-E294 PolarHBondContact O-N 3.22Å; H290-H295 AromaticContact CE1-CD2 3.55Å; H290-H295 AromaticContact NE2-CD2 3.52Å
291V82.3Confident75.7Confident0 Ų058.3 Ų58.30%032%0.324CS..Iπ-helixtrans-58.2-39.3-178.61680000111.2W266 L287 H295 V296 I328W266-V291 HydrophobicContact CD2-CG1 4.37Å; W266-V291 HydrophobicContact CE3-CG1 3.61Å; W266-V291 HydrophobicContact CE3-CG2 4.41Å; W266-V291 HydrophobicContact CH2-CG1 3.89Å; W266-V291 HydrophobicContact CZ3-CG1 3.34Å; L287-V291 HydrophobicContact CD1-CG2 3.81Å; L287-V291 WeakPolarHBondContact O-CB 3.15Å; L287-V291 VanDerWaalsContact O-CG2 3.3Å; L287-V291 WeakPolarHBondContact O-CG2 3.32Å; L287-V291 PolarHBondContact O-N 2.96Å; V291-H295 WeakPolarHBondContact O-CB 3.33Å; V291-H295 PolarHBondContact O-N 3.29Å; V291-V296 HydrophobicContact CG1-CG2 4.08Å; V291-V296 WeakPolarHBondContact O-CG2 3.14Å; V291-V296 PolarHBondContact O-N 3.31Å; V291-I328 HydrophobicContact CB-CD1 4.43Å; V291-I328 HydrophobicContact CG1-CD1 3.82Å
292T79.3Confident74.4Confident7 Ų760.4 Ų60.44%0.04335%0.351CS..Iπ-helixtrans-91.910.9-17770.50000115.5V288 T289 H290 G297 K321V288-T292 HydrophobicContact CG1-CG2 4.39Å; V288-T292 VanDerWaalsContact O-CB 3.29Å; V288-T292 WeakPolarHBondContact O-CB 3.45Å; V288-T292 VanDerWaalsContact O-CG2 3.28Å; V288-T292 WeakPolarHBondContact O-CG2 3.38Å; V288-T292 PolarHBondContact O-N 2.68Å; V288-T292 PolarHBondContact O-OG1 2.92Å; T289-T292 CarbonylContact O-C 3.51Å; T289-T292 PolarHBondContact O-N 2.73Å; H290-T292 PolarHBondContact O-N 3.02Å; T292-G297 VanDerWaalsContact O-O 3.06Å; T292-K321 VanDerWaalsContact CB-NZ 3.3Å; T292-K321 WeakPolarHBondContact OG1-CE 3.23Å; T292-K321 PolarHBondContact OG1-NZ 3.44Å
293V80.6Confident73.8Confident92 Ų9260.4 Ų60.456%0.55834%0.343SS*.Iπ-helixtrans-116.1-48168170.10000109.7T289 H290T289-V293 HydrophobicContact CG2-CG2 4.31Å; T289-V293 WeakPolarHBondContact O-CB 3.3Å; T289-V293 VanDerWaalsContact O-CG2 3.24Å; T289-V293 WeakPolarHBondContact O-CG2 3.34Å; T289-V293 PolarHBondContact O-N 2.89Å; H290-V293 PolarHBondContact O-N 3.15Å; H290-V293 VanDerWaalsContact O-N 3.15Å
294E78.9Confident73.5Confident103 Ų10359 Ų5948%0.48133%0.332SS..Iπ-helixtrans-96.8-18.1-169.3-57.9-168.3133.900114.3K279 H290K279-E294 IonicContact NZ-OE1 3.54Å; K279-E294 IonicContact NZ-OE2 2.65Å; K279-E294 PolarHBondContact NZ-OE2 3.49Å; H290-E294 IonicContact CE1-OE2 3.6Å; H290-E294 PolarHBondContact CE1-OE2 2.97Å; H290-E294 IonicContact CG-OE2 2.54Å; H290-E294 IonicContact ND1-OE2 3.9Å; H290-E294 PolarHBondContact ND1-OE2 2.85Å; H290-E294 PolarHBondContact O-N 3.22Å
295H77.2Confident73.4Confident37 Ų3760 Ų6017%0.17134%0.338CS..Iπ-helixtrans-122.9-28.7-174.6-67.1-35.9000115.2W266 E268 C277 H290 V291W266-H295 AromaticContact CD1-CD2 3.92Å; W266-H295 AromaticContact CD1-CG 3.59Å; W266-H295 AromaticContact CD1-ND1 4Å; W266-H295 HydrophobicContact CD2-CB 3.95Å; W266-H295 HydrophobicContact CG-CB 3.89Å; W266-H295 AromaticContact CG-CD2 3.67Å; W266-H295 AromaticContact CG-CG 3.78Å; W266-H295 HydrophobicContact CZ2-CB 4.26Å; E268-H295 IonicContact OE1-CE1 2.67Å; E268-H295 IonicContact OE1-ND1 3.07Å; E268-H295 IonicContact OE1-NE2 3.02Å; E268-H295 PolarHBondContact OE1-NE2 3.45Å; C277-H295 WeakPolarHBondContact CB-NE2 3.36Å; H290-H295 AromaticContact CE1-CD2 3.55Å; H290-H295 AromaticContact NE2-CD2 3.52Å; V291-H295 WeakPolarHBondContact O-CB 3.33Å; V291-H295 PolarHBondContact O-N 3.29Å
296V72.9Confident73.4Confident10 Ų1053.6 Ų53.66%0.06131%0.308CS..SBendtrans-102.5-2.6173.3-171.80000111.2W266 V291 Q301 H304 L324W266-V296 HydrophobicContact CH2-CG2 3.54Å; W266-V296 HydrophobicContact CZ2-CG2 3.78Å; W266-V296 HydrophobicContact CZ3-CG2 4.46Å; V291-V296 HydrophobicContact CG1-CG2 4.08Å; V291-V296 WeakPolarHBondContact O-CG2 3.14Å; V291-V296 PolarHBondContact O-N 3.31Å; V296-Q301 VanDerWaalsContact O-CD 3.23Å; V296-Q301 PolarHBondContact O-OE1 2.98Å; V296-Q301 VanDerWaalsContact O-OE1 3.1Å; V296-H304 HydrophobicContact CG1-CB 4.48Å; V296-L324 HydrophobicContact CG1-CD2 4.22Å; V296-L324 HydrophobicContact CG2-CD2 3.79Å
297G65.3Low73.1Confident20 Ų2053.9 Ų53.921%0.20631%0.309CS..  trans63.8-170.4-17600000114.2T292T292-G297 VanDerWaalsContact O-O 3.06Å
298G56Low72.9Confident42 Ų4254.7 Ų54.743%0.43331%0.312SS..SBendtrans-61.3167.8-175.200000115.1E300 Q301G298-E300 PolarHBondContact O-N 3.16Å; G298-Q301 PolarHBondContact O-N 3.19Å
299P55.3Low72.5Confident115 Ų11558.1 Ų58.175%0.74733%0.327SS*.THydrogen-bonded Turntrans-61.2-14.7-172.525.7-35.2000115.2
300E55.1Low72Confident187 Ų18762.4 Ų62.487%0.87434%0.343SS*.THydrogen-bonded Turntrans-86.2-9.5-176.6-58.4-177.5128.200114G298 A302G298-E300 PolarHBondContact O-N 3.16Å; E300-A302 PolarHBondContact O-N 3.11Å
301Q57.4Low71.7Confident103 Ų10362.2 Ų62.248%0.48134%0.343SS..  trans-69.4106.8178.7-65-156.412.600111.6V296 G298 N303 H304V296-Q301 VanDerWaalsContact O-CD 3.23Å; V296-Q301 PolarHBondContact O-OE1 2.98Å; V296-Q301 VanDerWaalsContact O-OE1 3.1Å; G298-Q301 PolarHBondContact O-N 3.19Å; Q301-N303 PolarHBondContact O-N 2.92Å; Q301-N303 VanDerWaalsContact O-N 3.09Å; Q301-H304 PolarHBondContact O-CE1 3.39Å; Q301-H304 VanDerWaalsContact O-CE1 3.31Å; Q301-H304 PolarHBondContact O-ND1 3.23Å
302A56.6Low71.3Confident88 Ų8868 Ų6873%0.72738%0.38SS*.SBendtrans-60-20.3-177.500000114.7E300E300-A302 PolarHBondContact O-N 3.11Å
303N66.9Low70.7Confident97 Ų9771.7 Ų71.752%0.51939%0.393SS..  trans-109.782.8-176.3-76.2-46.2000111.7Q301 I305 P317Q301-N303 PolarHBondContact O-N 2.92Å; Q301-N303 VanDerWaalsContact O-N 3.09Å; N303-I305 VanDerWaalsContact C-N 3.25Å; N303-I305 HydrophobicContact CB-CD1 4.19Å; N303-I305 HydrophobicContact CB-CG1 4.23Å; N303-I305 PolarHBondContact O-N 3.02Å; N303-P317 HydrophobicContact CB-CB 4.25Å
304H76Confident69.6Low27 Ų2774.8 Ų74.813%0.12540%0.402CS..BIsolated β-bridgetrans-7279.2171.8-46.7-52000110.8V296 Q301 F318 K321 L324V296-H304 HydrophobicContact CG1-CB 4.48Å; Q301-H304 PolarHBondContact O-CE1 3.39Å; Q301-H304 VanDerWaalsContact O-CE1 3.31Å; Q301-H304 PolarHBondContact O-ND1 3.23Å; H304-F318 HydrophobicContact CB-CB 4.31Å; H304-F318 PolarHBondContact CD2-O 3.26Å; H304-F318 WeakPolarHBondContact O-CB 3.23Å; H304-F318 WeakPolarHBondContact O-CD2 3.32Å; H304-F318 PolarHBondContact O-N 3.02Å; H304-K321 PolarHBondContact CD2-N 3.29Å; H304-K321 PolarHBondContact NE2-N 2.86Å; H304-L324 HydrophobicContact CB-CB 4.31Å; H304-L324 HydrophobicContact CB-CD2 3.95Å
305I78.5Confident68.8Low37 Ų3771.5 Ų71.519%0.1940%0.396CS..  trans-81.5164.2177.8-61.3170.7000109.8W266 N303 F307 G315 P317 L324W266-I305 VanDerWaalsContact CH2-O 3.29Å; W266-I305 WeakPolarHBondContact CH2-O 3.28Å; N303-I305 VanDerWaalsContact C-N 3.25Å; N303-I305 HydrophobicContact CB-CD1 4.19Å; N303-I305 HydrophobicContact CB-CG1 4.23Å; N303-I305 PolarHBondContact O-N 3.02Å; I305-F307 HydrophobicContact CB-CE2 3.94Å; I305-F307 HydrophobicContact CB-CZ 4.06Å; I305-F307 HydrophobicContact CD1-CZ 4.23Å; I305-F307 HydrophobicContact CG2-CD1 4.13Å; I305-F307 HydrophobicContact CG2-CD2 4.08Å; I305-F307 HydrophobicContact CG2-CE1 3.67Å; I305-F307 HydrophobicContact CG2-CE2 3.61Å; I305-F307 HydrophobicContact CG2-CG 4.33Å; I305-F307 HydrophobicContact CG2-CZ 3.39Å; I305-G315 WeakPolarHBondContact CG1-O 3.44Å; I305-G315 WeakPolarHBondContact CG2-O 3.42Å; I305-P317 HydrophobicContact CG1-CB 3.83Å; I305-L324 WeakPolarHBondContact O-CD2 3.29Å
306C81.8Confident68.6Low2 Ų276.6 Ų76.61%0.01442%0.417CS..  trans-123.6118.8170.5-167.60000110.3W266 F318 L324W266-C306 HydrophobicContact CH2-CB 4.41Å; C306-F318 HydrophobicContact CB-CE2 4.28Å; C306-L324 HydrophobicContact CB-CD1 3.62Å
307F77.8Confident68.8Low76 Ų7679 Ų7933%0.33343%0.433SS..  trans-110.747.4177-58.3-72.9000111.1W266 L267 I305W266-F307 HydrophobicContact CZ2-CB 4.27Å; W266-F307 AromaticContact CZ2-CD2 3.93Å; W266-F307 HydrophobicContact CZ2-CD2 3.93Å; W266-F307 AromaticContact NE1-CD2 3.93Å; L267-F307 PolarHBondContact N-O 2.85Å; I305-F307 HydrophobicContact CB-CE2 3.94Å; I305-F307 HydrophobicContact CB-CZ 4.06Å; I305-F307 HydrophobicContact CD1-CZ 4.23Å; I305-F307 HydrophobicContact CG2-CD1 4.13Å; I305-F307 HydrophobicContact CG2-CD2 4.08Å; I305-F307 HydrophobicContact CG2-CE1 3.67Å; I305-F307 HydrophobicContact CG2-CE2 3.61Å; I305-F307 HydrophobicContact CG2-CG 4.33Å; I305-F307 HydrophobicContact CG2-CZ 3.39Å
308W81.1Confident69.5Low17 Ų1779 Ų796%0.06443%0.428CS..BIsolated β-bridgetrans-75.7142.5174.9-155.8-79.8000110.4I263 K265 W266 L287 E310 C311 I328 H331I263-W308 WeakPolarHBondContact O-CH2 3.34Å; I263-W308 WeakPolarHBondContact O-CZ2 3.49Å; K265-W308 HydrophobicContact CB-CD2 4.38Å; K265-W308 HydrophobicContact CB-CZ2 3.96Å; K265-W308 HydrophobicContact CG-CZ2 4.42Å; K265-W308 WeakPolarHBondContact O-CA 3.32Å; W266-W308 HydrophobicContact CE3-CE3 4.16Å; L287-W308 HydrophobicContact CD2-CH2 4.36Å; W308-E310 PolarHBondContact O-N 3.3Å; W308-C311 HydrophobicContact CB-CB 4.08Å; W308-C311 WeakPolarHBondContact O-CB 3.24Å; W308-C311 PolarHBondContact O-N 2.92Å; W308-I328 HydrophobicContact CH2-CG2 4.45Å; W308-I328 HydrophobicContact CZ3-CG2 3.96Å; W308-H331 AromaticContact CD1-CE1 3.92Å; W308-H331 AromaticContact CD1-CG 3.51Å; W308-H331 AromaticContact CD1-ND1 3.36Å; W308-H331 HydrophobicContact CD2-CB 3.83Å; W308-H331 AromaticContact CD2-CG 3.81Å; W308-H331 VanDerWaalsContact CE2-CB 3.43Å; W308-H331 AromaticContact CE2-CG 3.85Å; W308-H331 HydrophobicContact CG-CB 4.11Å; W308-H331 AromaticContact CG-CD2 3.8Å; W308-H331 AromaticContact CG-CG 3.6Å; W308-H331 AromaticContact CG-ND1 3.78Å; W308-H331 HydrophobicContact CZ2-CB 3.83Å; W308-H331 AromaticContact NE1-CG 3.63Å; W308-H331 AromaticContact NE1-ND1 3.76Å
309E74.5Confident70.6Confident90 Ų9087.5 Ų87.542%0.42145%0.453SS..THydrogen-bonded Turntrans-47.9-36.1-171.5-171.6176.1-144.500115.8K265 L267 L276K265-E309 HydrophobicContact CB-CB 4.24Å; K265-E309 WeakPolarHBondContact CD-OE2 3.37Å; K265-E309 WeakPolarHBondContact CE-OE2 3.39Å; K265-E309 IonicContact NZ-OE2 2.71Å; K265-E309 PolarHBondContact NZ-OE2 3.42Å; K265-E309 PolarHBondContact O-N 2.98Å; L267-E309 VanDerWaalsContact CD1-CA 3.4Å; L267-E309 HydrophobicContact CD1-CB 3.7Å; L267-E309 HydrophobicContact CD1-CG 4.19Å; L276-E309 HydrophobicContact CD1-CB 4.3Å
310E73.3Confident71.8Confident147 Ų14783.3 Ų83.369%0.68743%0.428SS*.THydrogen-bonded Turntrans-124.241.6-179.4-59.8176.5143.700110.8W308 P312W308-E310 PolarHBondContact O-N 3.3Å; E310-P312 VanDerWaalsContact O-CD 3.25Å; E310-P312 WeakPolarHBondContact O-CD 3.45Å
311C79.8Confident72.8Confident10 Ų1078.2 Ų78.27%0.06840%0.403CS..  trans-77.9115.4-177.6-1670000112.6W308 R313 H327W308-C311 HydrophobicContact CB-CB 4.08Å; W308-C311 WeakPolarHBondContact O-CB 3.24Å; W308-C311 PolarHBondContact O-N 2.92Å; C311-R313 PolarHBondContact O-N 3.12Å; C311-H327 PolarHBondContact SG-NE2 3.11Å; C311-H327 VanDerWaalsContact SG-NE2 3.41Å
312P72.5Confident73.8Confident120 Ų12079.8 Ų79.878%0.77941%0.405SS*.SBendtrans-72.524.7176.9-15.132.5000113.9E310E310-P312 VanDerWaalsContact O-CD 3.25Å; E310-P312 WeakPolarHBondContact O-CD 3.45Å
313R66.8Low75Confident85 Ų8580.4 Ų80.432%0.32139%0.391SS..SBendtrans-141.265.1-172.1-176.3-172-105.9-100.2-2.8108.4C311 G315 K316 P317 F318C311-R313 PolarHBondContact O-N 3.12Å; R313-G315 PolarHBondContact O-N 2.84Å; R313-K316 HydrophobicContact CG-CB 3.89Å; R313-K316 PolarHBondContact NH1-O 3.47Å; R313-P317 PolarHBondContact NH1-O 2.87Å; R313-F318 VanDerWaalsContact CD-CE2 3.42Å; R313-F318 VanDerWaalsContact CZ-CE1 3.44Å; R313-F318 VanDerWaalsContact CZ-CZ 3.4Å
314E58.2Low75.7Confident157 Ų15775.8 Ų75.873%0.73437%0.367SS*.SBendtrans-46103.5174.3-50.4-54.8156.600111.4K316E314-K316 VanDerWaalsContact O-CG 3.26Å; E314-K316 WeakPolarHBondContact O-CG 3.31Å; E314-K316 PolarHBondContact O-N 2.99Å
315G61.9Low75.9Confident35 Ų3575.7 Ų75.736%0.36137%0.368SS..SBendtrans63.2-6.2173.200000118.7I305 R313 P317I305-G315 WeakPolarHBondContact CG1-O 3.44Å; I305-G315 WeakPolarHBondContact CG2-O 3.42Å; R313-G315 PolarHBondContact O-N 2.84Å; G315-P317 VanDerWaalsContact O-CD 3.29Å; G315-P317 WeakPolarHBondContact O-CD 3.39Å
316K72.6Confident76.1Confident143 Ų14376.5 Ų76.562%0.62237%0.373SS*.  trans-76.9114.5-166.2-52.8-168.5179.6176.50112.7R313 E314R313-K316 HydrophobicContact CG-CB 3.89Å; R313-K316 PolarHBondContact NH1-O 3.47Å; E314-K316 VanDerWaalsContact O-CG 3.26Å; E314-K316 WeakPolarHBondContact O-CG 3.31Å; E314-K316 PolarHBondContact O-N 2.99Å
317P78.6Confident76.1Confident60 Ų6077.7 Ų77.739%0.3938%0.378SS..  trans-64153.5-173.824.4-33.9000113.6N303 I305 R313 G315N303-P317 HydrophobicContact CB-CB 4.25Å; I305-P317 HydrophobicContact CG1-CB 3.83Å; R313-P317 PolarHBondContact NH1-O 2.87Å; G315-P317 VanDerWaalsContact O-CD 3.29Å; G315-P317 WeakPolarHBondContact O-CD 3.39Å
318F78.7Confident76.3Confident22 Ų2274 Ų7410%0.09636%0.362CS..BIsolated β-bridgetrans-96.1127.8169-71.5-86.1000110.1H304 C306 R313 A320 K323 L324 H327H304-F318 HydrophobicContact CB-CB 4.31Å; H304-F318 PolarHBondContact CD2-O 3.26Å; H304-F318 WeakPolarHBondContact O-CB 3.23Å; H304-F318 WeakPolarHBondContact O-CD2 3.32Å; H304-F318 PolarHBondContact O-N 3.02Å; C306-F318 HydrophobicContact CB-CE2 4.28Å; R313-F318 VanDerWaalsContact CD-CE2 3.42Å; R313-F318 VanDerWaalsContact CZ-CE1 3.44Å; R313-F318 VanDerWaalsContact CZ-CZ 3.4Å; F318-A320 PolarHBondContact O-N 2.98Å; F318-K323 HydrophobicContact CB-CB 4.11Å; F318-K323 HydrophobicContact CD1-CB 3.66Å; F318-K323 HydrophobicContact CG-CB 4.24Å; F318-L324 HydrophobicContact CB-CB 4.22Å; F318-L324 HydrophobicContact CD2-CB 3.96Å; F318-L324 HydrophobicContact CD2-CD1 3.87Å; F318-L324 HydrophobicContact CD2-CG 4.49Å; F318-L324 HydrophobicContact CE2-CD1 3.96Å; F318-L324 HydrophobicContact CG-CB 4.17Å; F318-H327 HydrophobicContact CE1-CB 3.99Å; F318-H327 HydrophobicContact CE2-CB 4.17Å; F318-H327 AromaticContact CE2-CD2 3.26Å; F318-H327 WeakPolarHBondContact CE2-CD2 3.4Å; F318-H327 AromaticContact CE2-CG 3.93Å; F318-H327 AromaticContact CE2-NE2 3.99Å; F318-H327 HydrophobicContact CZ-CB 3.53Å; F318-H327 AromaticContact CZ-CD2 3.17Å; F318-H327 WeakPolarHBondContact CZ-CD2 3.46Å; F318-H327 AromaticContact CZ-CG 3.39Å; F318-H327 AromaticContact CZ-NE2 3.87Å
319K78.8Confident76.3Confident219 Ų21975.2 Ų75.295%0.95237%0.366SS*.SBendtrans-62.51.4179.2-60.3-163.5175.6-1630116
320A80.4Confident76.7Confident27 Ų2776 Ų7622%0.22338%0.377CS..SBendtrans-167.1141.4176.200000112F318 Y322 K323F318-A320 PolarHBondContact O-N 2.98Å; A320-Y322 HydrophobicContact CB-CD1 3.52Å; A320-Y322 HydrophobicContact CB-CE1 3.47Å; A320-Y322 VanDerWaalsContact CB-CE1 3.47Å; A320-Y322 PolarHBondContact O-N 2.89Å; A320-Y322 VanDerWaalsContact O-N 3.13Å; A320-K323 HydrophobicContact CB-CG 4.44Å; A320-K323 WeakPolarHBondContact O-CB 3.48Å; A320-K323 PolarHBondContact O-N 3.1Å
321K76.9Confident76.9Confident81 Ų8171.1 Ų71.135%0.35235%0.354SS..Hα-helixtrans-49.1-41.9-179-175.3165.2178.11580112.8T292 H304 K323 L324 V325T292-K321 VanDerWaalsContact CB-NZ 3.3Å; T292-K321 WeakPolarHBondContact OG1-CE 3.23Å; T292-K321 PolarHBondContact OG1-NZ 3.44Å; H304-K321 PolarHBondContact CD2-N 3.29Å; H304-K321 PolarHBondContact NE2-N 2.86Å; K321-K323 VanDerWaalsContact C-N 3.26Å; K321-K323 PolarHBondContact O-N 2.86Å; K321-L324 PolarHBondContact O-N 3.47Å; K321-V325 WeakPolarHBondContact O-CG2 3.48Å; K321-V325 PolarHBondContact O-N 2.92Å
322Y78.4Confident76.8Confident135 Ų13571.6 Ų71.653%0.52936%0.357SS..Hα-helixtrans-64.3-25.1179.183.1-91.1000114.1A320 N326A320-Y322 HydrophobicContact CB-CD1 3.52Å; A320-Y322 HydrophobicContact CB-CE1 3.47Å; A320-Y322 VanDerWaalsContact CB-CE1 3.47Å; A320-Y322 PolarHBondContact O-N 2.89Å; A320-Y322 VanDerWaalsContact O-N 3.13Å; Y322-N326 PolarHBondContact O-N 2.98Å; Y322-N326 VanDerWaalsContact O-N 3.11Å; Y322-N326 PolarHBondContact O-ND2 3.19Å
323K82.6Confident76.9Confident101 Ų10167.6 Ų67.644%0.43934%0.338SS..Hα-helixtrans-75-41.3175-62.7-66.1-161.9-155.70111.1F318 A320 K321 N326 H327F318-K323 HydrophobicContact CB-CB 4.11Å; F318-K323 HydrophobicContact CD1-CB 3.66Å; F318-K323 HydrophobicContact CG-CB 4.24Å; A320-K323 HydrophobicContact CB-CG 4.44Å; A320-K323 WeakPolarHBondContact O-CB 3.48Å; A320-K323 PolarHBondContact O-N 3.1Å; K321-K323 VanDerWaalsContact C-N 3.26Å; K321-K323 PolarHBondContact O-N 2.86Å; K323-N326 PolarHBondContact O-N 3.18Å; K323-H327 PolarHBondContact O-N 2.69Å
324L81.8Confident77.2Confident0 Ų065 Ų650%033%0.329CS..Hα-helixtrans-60.7-46.2172.1175.259.5000110.8V296 H304 I305 C306 F318 K321 N326 H327 I328V296-L324 HydrophobicContact CG1-CD2 4.22Å; V296-L324 HydrophobicContact CG2-CD2 3.79Å; H304-L324 HydrophobicContact CB-CB 4.31Å; H304-L324 HydrophobicContact CB-CD2 3.95Å; I305-L324 WeakPolarHBondContact O-CD2 3.29Å; C306-L324 HydrophobicContact CB-CD1 3.62Å; F318-L324 HydrophobicContact CB-CB 4.22Å; F318-L324 HydrophobicContact CD2-CB 3.96Å; F318-L324 HydrophobicContact CD2-CD1 3.87Å; F318-L324 HydrophobicContact CD2-CG 4.49Å; F318-L324 HydrophobicContact CE2-CD1 3.96Å; F318-L324 HydrophobicContact CG-CB 4.17Å; K321-L324 PolarHBondContact O-N 3.47Å; L324-N326 VanDerWaalsContact C-N 3.32Å; L324-N326 PolarHBondContact O-N 3Å; L324-H327 CarbonylContact O-C 3.27Å; L324-H327 WeakPolarHBondContact O-CA 3.4Å; L324-H327 WeakPolarHBondContact O-CB 3.46Å; L324-H327 PolarHBondContact O-N 3.38Å; L324-I328 HydrophobicContact CD1-CD1 4.32Å; L324-I328 HydrophobicContact CD1-CG1 4.25Å; L324-I328 HydrophobicContact CG-CD1 4.12Å; L324-I328 WeakPolarHBondContact O-CG1 3.46Å; L324-I328 PolarHBondContact O-N 3.44Å
325V80Confident78.1Confident26 Ų2663 Ų6316%0.15832%0.318CS..Hα-helixtrans-58.7-39.8175.8169.60000112.8V288 K321 H327V288-V325 HydrophobicContact CG1-CG1 4.28Å; V288-V325 HydrophobicContact CG1-CG2 3.56Å; V288-V325 HydrophobicContact CG2-CB 4.44Å; V288-V325 HydrophobicContact CG2-CG1 3.77Å; V288-V325 HydrophobicContact CG2-CG2 4.15Å; K321-V325 WeakPolarHBondContact O-CG2 3.48Å; K321-V325 PolarHBondContact O-N 2.92Å; V325-H327 VanDerWaalsContact C-N 3.26Å; V325-H327 PolarHBondContact O-N 3.44Å
326N81.1Confident78.9Confident53 Ų5364.1 Ų64.128%0.28332%0.319SS..Hα-helixtrans-72.2-18.5174.1-83.8-87.3000113.4Y322 K323 L324Y322-N326 PolarHBondContact O-N 2.98Å; Y322-N326 VanDerWaalsContact O-N 3.11Å; Y322-N326 PolarHBondContact O-ND2 3.19Å; K323-N326 PolarHBondContact O-N 3.18Å; L324-N326 VanDerWaalsContact C-N 3.32Å; L324-N326 PolarHBondContact O-N 3Å
327H83.6Confident79.3Confident27 Ų2760.2 Ų60.213%0.12530%0.302CS..Hα-helixtrans-86.5-37.2176.5169.348.6000112.7C311 F318 K323 L324 V325 R329 V330 H331C311-H327 PolarHBondContact SG-NE2 3.11Å; C311-H327 VanDerWaalsContact SG-NE2 3.41Å; F318-H327 HydrophobicContact CE1-CB 3.99Å; F318-H327 HydrophobicContact CE2-CB 4.17Å; F318-H327 AromaticContact CE2-CD2 3.26Å; F318-H327 WeakPolarHBondContact CE2-CD2 3.4Å; F318-H327 AromaticContact CE2-CG 3.93Å; F318-H327 AromaticContact CE2-NE2 3.99Å; F318-H327 HydrophobicContact CZ-CB 3.53Å; F318-H327 AromaticContact CZ-CD2 3.17Å; F318-H327 WeakPolarHBondContact CZ-CD2 3.46Å; F318-H327 AromaticContact CZ-CG 3.39Å; F318-H327 AromaticContact CZ-NE2 3.87Å; K323-H327 PolarHBondContact O-N 2.69Å; L324-H327 CarbonylContact O-C 3.27Å; L324-H327 WeakPolarHBondContact O-CA 3.4Å; L324-H327 WeakPolarHBondContact O-CB 3.46Å; L324-H327 PolarHBondContact O-N 3.38Å; V325-H327 VanDerWaalsContact C-N 3.26Å; V325-H327 PolarHBondContact O-N 3.44Å; H327-R329 PolarHBondContact O-N 2.83Å; H327-R329 VanDerWaalsContact O-N 3.15Å; H327-V330 WeakPolarHBondContact O-CB 3.41Å; H327-V330 WeakPolarHBondContact O-CG2 3.15Å; H327-V330 PolarHBondContact O-N 2.87Å; H327-H331 AromaticContact CE1-NE2 3.52Å; H327-H331 AromaticContact NE2-NE2 3.87Å
328I80.2Confident79.4Confident0 Ų060.6 Ų60.60%030%0.304CS..Hα-helixtrans-55.3-33.7174.8-67.3164.2000111.1M284 V291 W308 L324 V330 H331 T332M284-I328 HydrophobicContact CE-CG2 3.76Å; V291-I328 HydrophobicContact CB-CD1 4.43Å; V291-I328 HydrophobicContact CG1-CD1 3.82Å; W308-I328 HydrophobicContact CH2-CG2 4.45Å; W308-I328 HydrophobicContact CZ3-CG2 3.96Å; L324-I328 HydrophobicContact CD1-CD1 4.32Å; L324-I328 HydrophobicContact CD1-CG1 4.25Å; L324-I328 HydrophobicContact CG-CD1 4.12Å; L324-I328 WeakPolarHBondContact O-CG1 3.46Å; L324-I328 PolarHBondContact O-N 3.44Å; I328-V330 PolarHBondContact O-N 3.17Å; I328-V330 VanDerWaalsContact O-N 3.12Å; I328-H331 WeakPolarHBondContact O-CB 3.43Å; I328-H331 PolarHBondContact O-N 3.23Å; I328-T332 HydrophobicContact CG2-CG2 4.47Å; I328-T332 PolarHBondContact O-N 3.26Å; I328-T332 VanDerWaalsContact O-N 3.16Å
329R82.6Confident79.9Confident41 Ų4160.2 Ų60.216%0.15530%0.304CS..Hα-helixtrans-60.3-16.9172.7-67.1175.7-178.1-155.9-7115.3M284 H327 G333 F337 A349M284-R329 HydrophobicContact SD-CG 3.54Å; M284-R329 VanDerWaalsContact SD-CG 3.54Å; H327-R329 PolarHBondContact O-N 2.83Å; H327-R329 VanDerWaalsContact O-N 3.15Å; R329-G333 PolarHBondContact O-N 3.48Å; R329-F337 VanDerWaalsContact NH1-CE2 3.3Å; R329-A349 PolarHBondContact NH1-O 3.06Å
330V81.2Confident80.2Confident106 Ų10653.3 Ų53.364%0.64228%0.282SS*.Hα-helixtrans-72.9-34.1172-177.50000110.3H327 I328H327-V330 WeakPolarHBondContact O-CB 3.41Å; H327-V330 WeakPolarHBondContact O-CG2 3.15Å; H327-V330 PolarHBondContact O-N 2.87Å; I328-V330 PolarHBondContact O-N 3.17Å; I328-V330 VanDerWaalsContact O-N 3.12Å
331H79.4Confident80.4Confident45 Ų4555.4 Ų55.421%0.20829%0.286CS..Hα-helixtrans-82-40.5179.3-63.4-68.6000112.9W308 H327 I328 G333W308-H331 AromaticContact CD1-CE1 3.92Å; W308-H331 AromaticContact CD1-CG 3.51Å; W308-H331 AromaticContact CD1-ND1 3.36Å; W308-H331 HydrophobicContact CD2-CB 3.83Å; W308-H331 AromaticContact CD2-CG 3.81Å; W308-H331 VanDerWaalsContact CE2-CB 3.43Å; W308-H331 AromaticContact CE2-CG 3.85Å; W308-H331 HydrophobicContact CG-CB 4.11Å; W308-H331 AromaticContact CG-CD2 3.8Å; W308-H331 AromaticContact CG-CG 3.6Å; W308-H331 AromaticContact CG-ND1 3.78Å; W308-H331 HydrophobicContact CZ2-CB 3.83Å; W308-H331 AromaticContact NE1-CG 3.63Å; W308-H331 AromaticContact NE1-ND1 3.76Å; H327-H331 AromaticContact CE1-NE2 3.52Å; H327-H331 AromaticContact NE2-NE2 3.87Å; I328-H331 WeakPolarHBondContact O-CB 3.43Å; I328-H331 PolarHBondContact O-N 3.23Å; H331-G333 PolarHBondContact O-N 3.43Å
332T76.3Confident80.6Confident21 Ų2156.3 Ų56.313%0.12930%0.3CS..SBendtrans-75.2-13.5174.364.90000113.4M284 L287 I328 E334M284-T332 HydrophobicContact CE-CG2 4.19Å; L287-T332 HydrophobicContact CD2-CG2 3.53Å; I328-T332 HydrophobicContact CG2-CG2 4.47Å; I328-T332 PolarHBondContact O-N 3.26Å; I328-T332 VanDerWaalsContact O-N 3.16Å; T332-E334 PolarHBondContact O-N 3.41Å; T332-E334 VanDerWaalsContact O-N 3.11Å; T332-E334 PolarHBondContact OG1-N 3.15Å
333G74.8Confident80.8Confident36 Ų3654.2 Ų54.237%0.37132%0.32SS..  trans68.31-175.800000115R329 H331 K335R329-G333 PolarHBondContact O-N 3.48Å; H331-G333 PolarHBondContact O-N 3.43Å; G333-K335 WeakPolarHBondContact O-CE 3.18Å
334E73.5Confident81Confident30 Ų3050.5 Ų50.514%0.1431%0.306CS..  trans-65.4141-170.9-83.5-165.4112.300114.3L262 M284 T332L262-E334 WeakPolarHBondContact CD1-OE2 3.41Å; L262-E334 HydrophobicContact CD2-CG 3.75Å; M284-E334 VanDerWaalsContact CB-OE2 3.26Å; M284-E334 WeakPolarHBondContact CB-OE2 3.25Å; T332-E334 PolarHBondContact O-N 3.41Å; T332-E334 VanDerWaalsContact O-N 3.11Å; T332-E334 PolarHBondContact OG1-N 3.15Å
335K77.6Confident81Confident115 Ų11553.7 Ų53.750%0.534%0.34SS..  trans-131.664.4-176-68.4160.4-161.11570111G333 F337 V347 F348 A349G333-K335 WeakPolarHBondContact O-CE 3.18Å; K335-F337 PolarHBondContact O-N 2.98Å; K335-V347 HydrophobicContact CB-CB 3.74Å; K335-V347 HydrophobicContact CB-CG2 3.72Å; K335-V347 HydrophobicContact CD-CG2 3.75Å; K335-V347 HydrophobicContact CG-CG2 4.34Å; K335-F348 CarbonylContact C-O 3.15Å; K335-F348 WeakPolarHBondContact CA-O 3.44Å; K335-A349 HydrophobicContact CG-CB 4.46Å
336P76.9Confident81.2Confident59 Ų5958.3 Ų58.338%0.38336%0.357SS..  trans-70.74.7-169.430.8-38.1000115P338P336-P338 VanDerWaalsContact C-CD 3.48Å; P336-P338 WeakPolarHBondContact O-CD 3.34Å
337F81.7Confident81.3Confident60 Ų6059.2 Ų59.226%0.26336%0.364SS..EExtended strand (participates in β ladder)trans-111.982.5175.9-55.9-69.1000110.5R329 K335 F348 A349 S351 L354R329-F337 VanDerWaalsContact NH1-CE2 3.3Å; K335-F337 PolarHBondContact O-N 2.98Å; F337-F348 HydrophobicContact CB-CB 4.31Å; F337-F348 WeakPolarHBondContact CB-O 3.17Å; F337-F348 WeakPolarHBondContact CD2-O 3.26Å; F337-F348 PolarHBondContact N-O 2.91Å; F337-F348 PolarHBondContact O-N 2.74Å; F337-A349 WeakPolarHBondContact CE2-O 3.37Å; F337-S351 VanDerWaalsContact CD2-N 3.25Å; F337-L354 HydrophobicContact CB-CB 4.13Å; F337-L354 HydrophobicContact CB-CD2 3.87Å
338P81.7Confident81.3Confident68 Ų6859.9 Ų59.944%0.44237%0.367SS..EExtended strand (participates in β ladder)trans-67.3149.2173.328.8-35000111.9P336 V347 L354P336-P338 VanDerWaalsContact C-CD 3.48Å; P336-P338 WeakPolarHBondContact O-CD 3.34Å; P338-V347 HydrophobicContact CB-CG1 4.05Å; P338-L354 WeakPolarHBondContact O-CD2 3.29Å
339C88.2Confident81.2Confident14 Ų1461.3 Ų61.310%0.09538%0.379CS..  trans-74.5124.1169.4-165.40000110.4F341 C344 K346 L354 H357C339-F341 PolarHBondContact O-N 2.96Å; C339-C344 HydrophobicContact CB-CB 4.34Å; C339-K346 WeakPolarHBondContact CB-O 3.2Å; C339-K346 PolarHBondContact N-O 3.37Å; C339-L354 HydrophobicContact CB-CD1 4.16Å; C339-H357 PolarHBondContact SG-CD2 3.2Å; C339-H357 PolarHBondContact SG-NE2 3Å
340P85.6Confident81.2Confident75 Ų7563.7 Ų63.749%0.48739%0.388SS..  trans-80.6-1.9-17934.1-37.1000113.6
341F84.1Confident81.2Confident71 Ų7162.1 Ų62.131%0.31138%0.382SS..SBendtrans-74.2125.3176-77.5-87.2000109.8C339 C344 K358 H361 T362C339-F341 PolarHBondContact O-N 2.96Å; F341-C344 HydrophobicContact CB-CB 4.08Å; F341-C344 WeakPolarHBondContact O-CB 3.46Å; F341-C344 PolarHBondContact O-N 3.02Å; F341-K358 HydrophobicContact CE2-CB 4.15Å; F341-K358 HydrophobicContact CE2-CG 4.05Å; F341-H361 HydrophobicContact CD1-CB 3.8Å; F341-H361 AromaticContact CD1-CG 3.96Å; F341-H361 HydrophobicContact CD2-CB 3.91Å; F341-H361 AromaticContact CD2-CD2 3.39Å; F341-H361 WeakPolarHBondContact CD2-CD2 3.5Å; F341-H361 AromaticContact CD2-CG 3.66Å; F341-H361 HydrophobicContact CE1-CB 3.63Å; F341-H361 HydrophobicContact CE2-CB 3.74Å; F341-H361 AromaticContact CE2-CD2 3.86Å; F341-H361 AromaticContact CE2-CG 3.99Å; F341-H361 HydrophobicContact CG-CB 3.94Å; F341-H361 AromaticContact CG-CD2 3.74Å; F341-H361 AromaticContact CG-CG 3.64Å; F341-H361 HydrophobicContact CZ-CB 3.6Å; F341-T362 HydrophobicContact CZ-CG2 4.23Å
342P81.4Confident81.5Confident100 Ų10064.9 Ų64.965%0.64940%0.395SS*.THydrogen-bonded Turntrans-61.1149.9179.326.6-34.5000111C344P342-C344 PolarHBondContact O-N 3.31Å
343G82.6Confident82Confident91 Ų9166.7 Ų66.794%0.93840%0.404SS*.THydrogen-bonded Turntrans68.8-8.3-174.300000115.5
344C87.7Confident82.6Confident22 Ų2266 Ų6615%0.14939%0.392CS..  trans-78.4-41.9-174.7-174.90000114.3C339 F341 P342 K346 H357 H361C339-C344 HydrophobicContact CB-CB 4.34Å; F341-C344 HydrophobicContact CB-CB 4.08Å; F341-C344 WeakPolarHBondContact O-CB 3.46Å; F341-C344 PolarHBondContact O-N 3.02Å; P342-C344 PolarHBondContact O-N 3.31Å; C344-K346 PolarHBondContact O-N 3.15Å; C344-H357 PolarHBondContact SG-NE2 3.41Å; C344-H361 PolarHBondContact SG-CE1 3.12Å; C344-H361 PolarHBondContact SG-NE2 3.46Å
345G81.9Confident83.3Confident68 Ų6871.5 Ų71.570%0.70142%0.415SS*.  trans64-11.4178.500000117.5
346K83.1Confident83.8Confident123 Ų12368.1 Ų68.154%0.53540%0.402SS..  trans-73.3130.7-171.6-69.9167-170172.70112.2C339 C344 F348C339-K346 WeakPolarHBondContact CB-O 3.2Å; C339-K346 PolarHBondContact N-O 3.37Å; C344-K346 PolarHBondContact O-N 3.15Å; K346-F348 HydrophobicContact CB-CE2 3.76Å; K346-F348 HydrophobicContact CB-CZ 3.91Å
347V84Confident84.3Confident71 Ų7166 Ų6643%0.4339%0.387SS..EExtended strand (participates in β ladder)trans-118142.5-179.5-68.50000111.3K335 P338K335-V347 HydrophobicContact CB-CB 3.74Å; K335-V347 HydrophobicContact CB-CG2 3.72Å; K335-V347 HydrophobicContact CD-CG2 3.75Å; K335-V347 HydrophobicContact CG-CG2 4.34Å; P338-V347 HydrophobicContact CB-CG1 4.05Å
348F82.3Confident84.6Confident41 Ų4167.3 Ų67.318%0.1839%0.392CS..EExtended strand (participates in β ladder)trans-127.9143.4-172.7-59.8-91.3000113.1K335 F337 K346 N353 L354 H357K335-F348 CarbonylContact C-O 3.15Å; K335-F348 WeakPolarHBondContact CA-O 3.44Å; F337-F348 HydrophobicContact CB-CB 4.31Å; F337-F348 WeakPolarHBondContact CB-O 3.17Å; F337-F348 WeakPolarHBondContact CD2-O 3.26Å; F337-F348 PolarHBondContact N-O 2.91Å; F337-F348 PolarHBondContact O-N 2.74Å; K346-F348 HydrophobicContact CB-CE2 3.76Å; K346-F348 HydrophobicContact CB-CZ 3.91Å; F348-N353 HydrophobicContact CB-CB 4.23Å; F348-N353 HydrophobicContact CD1-CB 3.76Å; F348-N353 HydrophobicContact CG-CB 4.28Å; F348-L354 HydrophobicContact CB-CB 4.39Å; F348-L354 HydrophobicContact CD2-CB 4.16Å; F348-L354 HydrophobicContact CD2-CD1 4.11Å; F348-L354 HydrophobicContact CE2-CD1 4.36Å; F348-L354 HydrophobicContact CG-CB 4.39Å; F348-H357 HydrophobicContact CE1-CB 4.05Å; F348-H357 HydrophobicContact CE2-CB 3.96Å; F348-H357 AromaticContact CE2-CD2 3.23Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.35Å; F348-H357 AromaticContact CE2-CG 3.73Å; F348-H357 HydrophobicContact CZ-CB 3.54Å; F348-H357 AromaticContact CZ-CD2 3.31Å; F348-H357 WeakPolarHBondContact CZ-CD2 3.37Å; F348-H357 AromaticContact CZ-CG 3.35Å
349A79.4Confident85Confident30 Ų3066.3 Ų66.325%0.24838%0.38CS..SBendtrans-75.3-21175.900000114R329 K335 F337R329-A349 PolarHBondContact NH1-O 3.06Å; K335-A349 HydrophobicContact CG-CB 4.46Å; F337-A349 WeakPolarHBondContact CE2-O 3.37Å
350R81.2Confident85Confident91 Ų9170.1 Ų70.134%0.34340%0.403SS..SBendtrans-129.6137.6-177.1-50.1-166.7-51.6119.63.1111.7E352 N353 L354R350-E352 VanDerWaalsContact C-N 3.33Å; R350-E352 IonicContact CZ-OE2 3.65Å; R350-E352 IonicContact NH1-OE2 3.48Å; R350-E352 PolarHBondContact NH1-OE2 2.91Å; R350-E352 IonicContact NH2-OE2 2.7Å; R350-E352 PolarHBondContact NH2-OE2 2.72Å; R350-E352 PolarHBondContact O-N 3.33Å; R350-N353 HydrophobicContact CB-CB 4.48Å; R350-N353 PolarHBondContact NH2-OD1 3.32Å; R350-N353 WeakPolarHBondContact O-CB 3.41Å; R350-N353 PolarHBondContact O-N 3.3Å; R350-N353 VanDerWaalsContact O-N 3.15Å; R350-L354 PolarHBondContact O-N 3.11Å
351S81.9Confident85Confident73 Ų7370.1 Ų70.151%0.5140%0.396SS..Hα-helixtrans-63.7-35.2179.951.70000113F337 N353 L354 K355F337-S351 VanDerWaalsContact CD2-N 3.25Å; S351-N353 PolarHBondContact O-N 3.25Å; S351-L354 PolarHBondContact O-N 2.99Å; S351-K355 PolarHBondContact O-N 3.13Å
352E85.1Confident85.1Confident104 Ų10470.4 Ų70.449%0.48640%0.403SS..Hα-helixtrans-58.1-44.8172-178-174.4-139.500111.8R350 L354 K355 I356R350-E352 VanDerWaalsContact C-N 3.33Å; R350-E352 IonicContact CZ-OE2 3.65Å; R350-E352 IonicContact NH1-OE2 3.48Å; R350-E352 PolarHBondContact NH1-OE2 2.91Å; R350-E352 IonicContact NH2-OE2 2.7Å; R350-E352 PolarHBondContact NH2-OE2 2.72Å; R350-E352 PolarHBondContact O-N 3.33Å; E352-L354 VanDerWaalsContact C-N 3.32Å; E352-L354 PolarHBondContact O-N 3.2Å; E352-K355 PolarHBondContact O-N 3.1Å; E352-I356 HydrophobicContact CG-CD1 3.99Å; E352-I356 WeakPolarHBondContact O-CG1 3.47Å; E352-I356 PolarHBondContact O-N 3.14Å
353N86.7Confident85.3Confident59 Ų5968 Ų6832%0.31640%0.397SS..Hα-helixtrans-62.9-40.2177.3-71.55.3000110.9F348 R350 S351 I356 H357F348-N353 HydrophobicContact CB-CB 4.23Å; F348-N353 HydrophobicContact CD1-CB 3.76Å; F348-N353 HydrophobicContact CG-CB 4.28Å; R350-N353 HydrophobicContact CB-CB 4.48Å; R350-N353 PolarHBondContact NH2-OD1 3.32Å; R350-N353 WeakPolarHBondContact O-CB 3.41Å; R350-N353 PolarHBondContact O-N 3.3Å; R350-N353 VanDerWaalsContact O-N 3.15Å; S351-N353 PolarHBondContact O-N 3.25Å; N353-I356 PolarHBondContact O-N 2.68Å; N353-H357 VanDerWaalsContact O-CB 3.32Å; N353-H357 WeakPolarHBondContact O-CB 3.39Å; N353-H357 PolarHBondContact O-N 2.78Å
354L87.8Confident85.5Confident22 Ų2267.9 Ų67.912%0.11537%0.372CS..Hα-helixtrans-63.7-43.8173.1173.160.4000111.5F337 P338 C339 F348 R350 S351 E352 I356 H357 K358F337-L354 HydrophobicContact CB-CB 4.13Å; F337-L354 HydrophobicContact CB-CD2 3.87Å; P338-L354 WeakPolarHBondContact O-CD2 3.29Å; C339-L354 HydrophobicContact CB-CD1 4.16Å; F348-L354 HydrophobicContact CB-CB 4.39Å; F348-L354 HydrophobicContact CD2-CB 4.16Å; F348-L354 HydrophobicContact CD2-CD1 4.11Å; F348-L354 HydrophobicContact CE2-CD1 4.36Å; F348-L354 HydrophobicContact CG-CB 4.39Å; R350-L354 PolarHBondContact O-N 3.11Å; S351-L354 PolarHBondContact O-N 2.99Å; E352-L354 VanDerWaalsContact C-N 3.32Å; E352-L354 PolarHBondContact O-N 3.2Å; L354-I356 VanDerWaalsContact C-N 3.33Å; L354-I356 PolarHBondContact O-N 3.24Å; L354-H357 CarbonylContact O-C 3.48Å; L354-H357 PolarHBondContact O-N 2.87Å; L354-H357 VanDerWaalsContact O-N 3.11Å; L354-K358 HydrophobicContact CD1-CG 4.21Å; L354-K358 WeakPolarHBondContact O-CG 3.38Å; L354-K358 PolarHBondContact O-N 3.05Å
355K87.9Confident85.5Confident145 Ų14572.6 Ų72.663%0.6339%0.39SS*.Hα-helixtrans-61.7-41177.8-170.7173.7-177.4174.20111.8S351 E352S351-K355 PolarHBondContact O-N 3.13Å; E352-K355 PolarHBondContact O-N 3.1Å
356I88.2Confident85.8Confident43 Ų4372.2 Ų72.222%0.22138%0.375CS..Hα-helixtrans-65.8-39.1173-67.3166000110.9E352 N353 L354 R359 N380E352-I356 HydrophobicContact CG-CD1 3.99Å; E352-I356 WeakPolarHBondContact O-CG1 3.47Å; E352-I356 PolarHBondContact O-N 3.14Å; N353-I356 PolarHBondContact O-N 2.68Å; L354-I356 VanDerWaalsContact C-N 3.33Å; L354-I356 PolarHBondContact O-N 3.24Å; I356-R359 WeakPolarHBondContact O-CB 3.41Å; I356-R359 PolarHBondContact O-N 3.31Å; I356-N380 HydrophobicContact CD1-CB 3.82Å; I356-N380 HydrophobicContact CG1-CB 4.02Å; I356-N380 HydrophobicContact CG2-CB 3.86Å
357H88.2Confident86Confident16 Ų1669.1 Ų69.17%0.07436%0.362CS..Hα-helixtrans-69.5-35.7177.7175.345.2000113.5C339 C344 F348 N353 L354 R359 T360 H361C339-H357 PolarHBondContact SG-CD2 3.2Å; C339-H357 PolarHBondContact SG-NE2 3Å; C344-H357 PolarHBondContact SG-NE2 3.41Å; F348-H357 HydrophobicContact CE1-CB 4.05Å; F348-H357 HydrophobicContact CE2-CB 3.96Å; F348-H357 AromaticContact CE2-CD2 3.23Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.35Å; F348-H357 AromaticContact CE2-CG 3.73Å; F348-H357 HydrophobicContact CZ-CB 3.54Å; F348-H357 AromaticContact CZ-CD2 3.31Å; F348-H357 WeakPolarHBondContact CZ-CD2 3.37Å; F348-H357 AromaticContact CZ-CG 3.35Å; N353-H357 VanDerWaalsContact O-CB 3.32Å; N353-H357 WeakPolarHBondContact O-CB 3.39Å; N353-H357 PolarHBondContact O-N 2.78Å; L354-H357 CarbonylContact O-C 3.48Å; L354-H357 PolarHBondContact O-N 2.87Å; L354-H357 VanDerWaalsContact O-N 3.11Å; H357-R359 PolarHBondContact O-N 3.09Å; H357-R359 VanDerWaalsContact O-N 3.1Å; H357-T360 PolarHBondContact CE1-OG1 3.43Å; H357-T360 VanDerWaalsContact CE1-OG1 3.26Å; H357-T360 PolarHBondContact ND1-OG1 3.02Å; H357-T360 PolarHBondContact O-N 3.31Å; H357-T360 PolarHBondContact O-OG1 2.97Å; H357-H361 AromaticContact CE1-CD2 3.81Å; H357-H361 AromaticContact CE1-CE1 3.99Å; H357-H361 AromaticContact CE1-NE2 3.12Å; H357-H361 PolarHBondContact CE1-NE2 2.77Å; H357-H361 AromaticContact NE2-CD2 3.84Å; H357-H361 AromaticContact NE2-NE2 3.05Å; H357-H361 PolarHBondContact NE2-NE2 2.91Å
358K87.8Confident86.3Confident86 Ų8670 Ų7037%0.37436%0.36SS..Hα-helixtrans-53.8-34174.9-73.3-168.8-179.9-168.70111.8F341 L354 T360 H361 T362F341-K358 HydrophobicContact CE2-CB 4.15Å; F341-K358 HydrophobicContact CE2-CG 4.05Å; L354-K358 HydrophobicContact CD1-CG 4.21Å; L354-K358 WeakPolarHBondContact O-CG 3.38Å; L354-K358 PolarHBondContact O-N 3.05Å; K358-T360 VanDerWaalsContact C-N 3.25Å; K358-T360 PolarHBondContact O-N 3.23Å; K358-H361 WeakPolarHBondContact O-CB 3.2Å; K358-H361 PolarHBondContact O-N 3.14Å; K358-T362 PolarHBondContact O-N 3.44Å
359R90.3Very high86.7Confident48 Ų4868.4 Ų68.418%0.18135%0.354CS..Hα-helixtrans-65-19.8174.6-61.3-171.7169.5136.91.1115.4I356 H357 H361 T362 G363 E364 A379I356-R359 WeakPolarHBondContact O-CB 3.41Å; I356-R359 PolarHBondContact O-N 3.31Å; H357-R359 PolarHBondContact O-N 3.09Å; H357-R359 VanDerWaalsContact O-N 3.1Å; R359-H361 PolarHBondContact O-N 3.07Å; R359-T362 WeakPolarHBondContact CA-OG1 3.46Å; R359-G363 CarbonylContact O-C 3.55Å; R359-G363 WeakPolarHBondContact O-CA 3.36Å; R359-G363 PolarHBondContact O-N 3.19Å; R359-E364 HydrophobicContact CB-CB 3.84Å; R359-E364 HydrophobicContact CG-CB 3.73Å; R359-E364 IonicContact NE-OE2 2.71Å; R359-E364 PolarHBondContact NE-OE2 2.83Å; R359-E364 VanDerWaalsContact NE-OE2 3.14Å; R359-E364 PolarHBondContact O-N 3.25Å; R359-A379 HydrophobicContact CB-CB 4.01Å; R359-A379 WeakPolarHBondContact CD-O 3.42Å; R359-A379 PolarHBondContact NH1-O 3.23Å
360T87.1Confident87.1Confident94 Ų9474.3 Ų74.358%0.57738%0.376SS*.Hα-helixtrans-76.6-12.4172.472.20000112.5H357 K358H357-T360 PolarHBondContact CE1-OG1 3.43Å; H357-T360 VanDerWaalsContact CE1-OG1 3.26Å; H357-T360 PolarHBondContact ND1-OG1 3.02Å; H357-T360 PolarHBondContact O-N 3.31Å; H357-T360 PolarHBondContact O-OG1 2.97Å; K358-T360 VanDerWaalsContact C-N 3.25Å; K358-T360 PolarHBondContact O-N 3.23Å
361H86.3Confident87.3Confident74 Ų7475.3 Ų75.334%0.34338%0.383SS..Hα-helixtrans-97.1-39.5172.9-60.4-76000111.8F341 C344 H357 K358 R359 G363F341-H361 HydrophobicContact CD1-CB 3.8Å; F341-H361 AromaticContact CD1-CG 3.96Å; F341-H361 HydrophobicContact CD2-CB 3.91Å; F341-H361 AromaticContact CD2-CD2 3.39Å; F341-H361 WeakPolarHBondContact CD2-CD2 3.5Å; F341-H361 AromaticContact CD2-CG 3.66Å; F341-H361 HydrophobicContact CE1-CB 3.63Å; F341-H361 HydrophobicContact CE2-CB 3.74Å; F341-H361 AromaticContact CE2-CD2 3.86Å; F341-H361 AromaticContact CE2-CG 3.99Å; F341-H361 HydrophobicContact CG-CB 3.94Å; F341-H361 AromaticContact CG-CD2 3.74Å; F341-H361 AromaticContact CG-CG 3.64Å; F341-H361 HydrophobicContact CZ-CB 3.6Å; C344-H361 PolarHBondContact SG-CE1 3.12Å; C344-H361 PolarHBondContact SG-NE2 3.46Å; H357-H361 AromaticContact CE1-CD2 3.81Å; H357-H361 AromaticContact CE1-CE1 3.99Å; H357-H361 AromaticContact CE1-NE2 3.12Å; H357-H361 PolarHBondContact CE1-NE2 2.77Å; H357-H361 AromaticContact NE2-CD2 3.84Å; H357-H361 AromaticContact NE2-NE2 3.05Å; H357-H361 PolarHBondContact NE2-NE2 2.91Å; K358-H361 WeakPolarHBondContact O-CB 3.2Å; K358-H361 PolarHBondContact O-N 3.14Å; R359-H361 PolarHBondContact O-N 3.07Å; H361-G363 VanDerWaalsContact C-N 3.31Å
362T86.3Confident87.4Confident77 Ų7779 Ų7947%0.47240%0.397SS..Hα-helixtrans-81.4-7175.860.90000113.9F341 K358 R359 E364F341-T362 HydrophobicContact CZ-CG2 4.23Å; K358-T362 PolarHBondContact O-N 3.44Å; R359-T362 WeakPolarHBondContact CA-OG1 3.46Å; T362-E364 PolarHBondContact O-N 2.74Å; T362-E364 WeakPolarHBondContact OG1-CG 3.38Å; T362-E364 PolarHBondContact OG1-OE1 2.84Å
363G85.4Confident87.3Confident49 Ų4977.4 Ų77.451%0.50541%0.409SS..  trans73.4-4.2-176.700000115.1R359 H361 K365R359-G363 CarbonylContact O-C 3.55Å; R359-G363 WeakPolarHBondContact O-CA 3.36Å; R359-G363 PolarHBondContact O-N 3.19Å; H361-G363 VanDerWaalsContact C-N 3.31Å; G363-K365 PolarHBondContact O-N 2.84Å
364E87.9Confident87.3Confident89 Ų8975.2 Ų75.242%0.41640%0.397SS..  trans-51.1119.8-177.6-84.6169.9-112.700113.4R359 T362R359-E364 HydrophobicContact CB-CB 3.84Å; R359-E364 HydrophobicContact CG-CB 3.73Å; R359-E364 IonicContact NE-OE2 2.71Å; R359-E364 PolarHBondContact NE-OE2 2.83Å; R359-E364 VanDerWaalsContact NE-OE2 3.14Å; R359-E364 PolarHBondContact O-N 3.25Å; T362-E364 PolarHBondContact O-N 2.74Å; T362-E364 WeakPolarHBondContact OG1-CG 3.38Å; T362-E364 PolarHBondContact OG1-OE1 2.84Å
365K87.6Confident87.3Confident121 Ų12179.8 Ų79.853%0.52642%0.422SS..  trans-126.675.2172.8-68.9163.1-178.4174.40110.5G363 F367 R377 F378G363-K365 PolarHBondContact O-N 2.84Å; K365-F367 VanDerWaalsContact C-N 3.27Å; K365-F367 PolarHBondContact O-N 2.93Å; K365-R377 HydrophobicContact CB-CB 3.56Å; K365-R377 HydrophobicContact CD-CB 4.42Å; K365-R377 WeakPolarHBondContact CD-O 3.43Å; K365-R377 PolarHBondContact O-NE 3.34Å; K365-R377 PolarHBondContact O-NH2 3.3Å; K365-F378 CarbonylContact C-O 3.14Å; K365-F378 VanDerWaalsContact C-O 3.27Å; K365-F378 VanDerWaalsContact CA-O 3.28Å; K365-F378 WeakPolarHBondContact CA-O 3.38Å
366P87.4Confident87.3Confident60 Ų6080.3 Ų80.339%0.3942%0.42SS..  trans-62.1-34.3-174.3-23.334.9000113.1K368P366-K368 PolarHBondContact O-N 3.16Å
367F88.3Confident87.4Confident59 Ų5985.2 Ų85.226%0.25944%0.436SS..EExtended strand (participates in β ladder)trans-90.690.9-169.9-53.9-84.1000110.9K365 R377 F378 N380 R384K365-F367 VanDerWaalsContact C-N 3.27Å; K365-F367 PolarHBondContact O-N 2.93Å; F367-R377 CarbonylContact O-C 3.57Å; F367-R377 WeakPolarHBondContact O-CA 3.46Å; F367-F378 HydrophobicContact CB-CB 4.38Å; F367-F378 WeakPolarHBondContact CD2-O 3.25Å; F367-F378 PolarHBondContact N-O 3.09Å; F367-F378 VanDerWaalsContact N-O 3.16Å; F367-F378 PolarHBondContact O-N 2.06Å; F367-N380 VanDerWaalsContact CD2-CA 3.5Å; F367-R384 HydrophobicContact CB-CB 4.33Å
368K89.8Confident87.4Confident89 Ų8986.5 Ų86.539%0.38744%0.441SS..EExtended strand (participates in β ladder)trans-65.4148.4164.3-169.6-176.2153.9161.20109.4P366 C374 D375 R377 R384P366-K368 PolarHBondContact O-N 3.16Å; K368-C374 WeakPolarHBondContact CE-O 3.28Å; K368-D375 WeakPolarHBondContact CE-OD1 3.45Å; K368-D375 IonicContact NZ-OD1 2.71Å; K368-D375 PolarHBondContact NZ-OD1 2.82Å; K368-R377 HydrophobicContact CB-CG 4.06Å; K368-R377 HydrophobicContact CG-CG 4.16Å; K368-R384 WeakPolarHBondContact O-CD 3.45Å; K368-R384 PolarHBondContact O-NH1 2.91Å
369C91Very high87.4Confident8 Ų883.4 Ų83.45%0.05443%0.432CS..  trans-57.6149.8165.4-151.70000110.8C374 R376C369-C374 HydrophobicContact CB-CB 4.19Å; C369-R376 PolarHBondContact N-O 3.26Å
370E87.3Confident87.4Confident153 Ų15382 Ų8272%0.71543%0.428SS*.SBendtrans-100-0.4-179.1-72.2155.3164.400111.9R384E370-R384 IonicContact OE1-CZ 3.91Å; E370-R384 IonicContact OE1-NH1 2.68Å; E370-R384 PolarHBondContact OE1-NH1 3.37Å; E370-R384 IonicContact OE1-NH2 2.72Å; E370-R384 PolarHBondContact OE1-NH2 3.43Å; E370-R384 IonicContact OE2-CZ 2.68Å; E370-R384 IonicContact OE2-NE 3.14Å; E370-R384 IonicContact OE2-NH1 3.64Å; E370-R384 PolarHBondContact OE2-NH1 2.88Å; E370-R384 IonicContact OE2-NH2 3.71Å; E370-R384 PolarHBondContact OE2-NH2 3.34Å
371F85.9Confident87.4Confident113 Ų11380.3 Ų80.350%0.49642%0.42SS..SBendtrans-83.1132.3172.3-172.7-95.5000109.9C374 H391F371-C374 HydrophobicContact CB-CB 4.35Å; F371-C374 HydrophobicContact CD1-CB 4.2Å; F371-C374 WeakPolarHBondContact O-CB 3.29Å; F371-C374 PolarHBondContact O-N 2.84Å; F371-H391 HydrophobicContact CB-CB 4.32Å; F371-H391 VanDerWaalsContact CB-CD2 3.46Å; F371-H391 WeakPolarHBondContact CB-CD2 3.45Å; F371-H391 HydrophobicContact CD1-CB 4.1Å; F371-H391 AromaticContact CD1-CE1 3.62Å; F371-H391 AromaticContact CD1-CG 3.55Å; F371-H391 AromaticContact CD1-ND1 3.27Å; F371-H391 VanDerWaalsContact CD1-ND1 3.27Å; F371-H391 WeakPolarHBondContact CD1-ND1 3.47Å; F371-H391 HydrophobicContact CD2-CB 3.58Å; F371-H391 AromaticContact CD2-CG 3.85Å; F371-H391 HydrophobicContact CE1-CB 4.32Å; F371-H391 AromaticContact CE1-ND1 3.65Å; F371-H391 HydrophobicContact CE2-CB 3.82Å; F371-H391 HydrophobicContact CG-CB 3.72Å; F371-H391 AromaticContact CG-CD2 3.7Å; F371-H391 AromaticContact CG-CG 3.42Å; F371-H391 VanDerWaalsContact CG-CG 3.42Å; F371-H391 AromaticContact CG-ND1 3.68Å; F371-H391 HydrophobicContact CZ-CB 4.19Å
372D82.3Confident87.4Confident151 Ų15180.2 Ų80.281%0.80743%0.428SS*.THydrogen-bonded Turntrans-67.3149.3-178.2-166.928.1000112.2C374D372-C374 PolarHBondContact O-N 3.09Å
373G83.1Confident87.4Confident70 Ų7079.5 Ų79.572%0.72242%0.421SS*.THydrogen-bonded Turntrans66.46.9-169.100000115.3
374C87.8Confident87.7Confident12 Ų1279.7 Ų79.78%0.08141%0.406CS..  trans-113.397.9177-170.30000114K368 C369 F371 D372 R376 H387 H391K368-C374 WeakPolarHBondContact CE-O 3.28Å; C369-C374 HydrophobicContact CB-CB 4.19Å; F371-C374 HydrophobicContact CB-CB 4.35Å; F371-C374 HydrophobicContact CD1-CB 4.2Å; F371-C374 WeakPolarHBondContact O-CB 3.29Å; F371-C374 PolarHBondContact O-N 2.84Å; D372-C374 PolarHBondContact O-N 3.09Å; C374-R376 PolarHBondContact O-N 3.33Å; C374-H387 PolarHBondContact SG-NE2 3.03Å; C374-H391 PolarHBondContact SG-CE1 3.06Å; C374-H391 PolarHBondContact SG-NE2 3.07Å
375D88.3Confident87.6Confident118 Ų11882.2 Ų82.263%0.63142%0.416SS*.  trans-8113176.7-74.4-61.7000115.6K368 R377K368-D375 WeakPolarHBondContact CE-OD1 3.45Å; K368-D375 IonicContact NZ-OD1 2.71Å; K368-D375 PolarHBondContact NZ-OD1 2.82Å; D375-R377 PolarHBondContact O-N 3.18Å
376R87.1Confident87.3Confident157 Ų15781.3 Ų81.359%0.59241%0.412SS*.  trans-66.8122.3176.9-77.9178.7160.9139.5-3.3111.2C369 C374 F378 H387C369-R376 PolarHBondContact N-O 3.26Å; C374-R376 PolarHBondContact O-N 3.33Å; R376-F378 HydrophobicContact CB-CE2 3.78Å; R376-F378 HydrophobicContact CB-CZ 3.94Å; R376-F378 WeakPolarHBondContact O-CE2 3.13Å; R376-H387 VanDerWaalsContact CD-NE2 3.28Å; R376-H387 WeakPolarHBondContact CD-NE2 3.49Å
377R91.1Very high87.3Confident145 Ų14579.2 Ų79.255%0.54740%0.397SS..EExtended strand (participates in β ladder)trans-112.5143.9177.5-54.2-178.867.9157.27.9112K365 F367 K368 D375K365-R377 HydrophobicContact CB-CB 3.56Å; K365-R377 HydrophobicContact CD-CB 4.42Å; K365-R377 WeakPolarHBondContact CD-O 3.43Å; K365-R377 PolarHBondContact O-NE 3.34Å; K365-R377 PolarHBondContact O-NH2 3.3Å; F367-R377 CarbonylContact O-C 3.57Å; F367-R377 WeakPolarHBondContact O-CA 3.46Å; K368-R377 HydrophobicContact CB-CG 4.06Å; K368-R377 HydrophobicContact CG-CG 4.16Å; D375-R377 PolarHBondContact O-N 3.18Å
378F88.4Confident87Confident43 Ų4378.6 Ų78.619%0.18940%0.4CS..EExtended strand (participates in β ladder)trans-125.3150.1-173.5-59.5-91.9000112.3K365 F367 R376 N380 D383 R384 H387K365-F378 CarbonylContact C-O 3.14Å; K365-F378 VanDerWaalsContact C-O 3.27Å; K365-F378 VanDerWaalsContact CA-O 3.28Å; K365-F378 WeakPolarHBondContact CA-O 3.38Å; F367-F378 HydrophobicContact CB-CB 4.38Å; F367-F378 WeakPolarHBondContact CD2-O 3.25Å; F367-F378 PolarHBondContact N-O 3.09Å; F367-F378 VanDerWaalsContact N-O 3.16Å; F367-F378 PolarHBondContact O-N 2.06Å; R376-F378 HydrophobicContact CB-CE2 3.78Å; R376-F378 HydrophobicContact CB-CZ 3.94Å; R376-F378 WeakPolarHBondContact O-CE2 3.13Å; F378-N380 VanDerWaalsContact C-N 3.31Å; F378-N380 WeakPolarHBondContact CB-O 3.39Å; F378-D383 HydrophobicContact CD1-CB 4.03Å; F378-R384 HydrophobicContact CB-CB 4.24Å; F378-R384 HydrophobicContact CD2-CB 3.76Å; F378-R384 HydrophobicContact CD2-CG 4Å; F378-R384 HydrophobicContact CE2-CB 4.49Å; F378-R384 HydrophobicContact CE2-CG 4.45Å; F378-R384 HydrophobicContact CG-CB 4.07Å; F378-H387 HydrophobicContact CE1-CB 3.99Å; F378-H387 HydrophobicContact CE2-CB 4.03Å; F378-H387 AromaticContact CE2-CD2 3.42Å; F378-H387 VanDerWaalsContact CE2-CD2 3.42Å; F378-H387 WeakPolarHBondContact CE2-CD2 3.15Å; F378-H387 AromaticContact CE2-CG 3.96Å; F378-H387 HydrophobicContact CZ-CB 3.46Å; F378-H387 VanDerWaalsContact CZ-CB 3.46Å; F378-H387 AromaticContact CZ-CD2 3.28Å; F378-H387 WeakPolarHBondContact CZ-CD2 3.38Å; F378-H387 AromaticContact CZ-CG 3.42Å; F378-H387 VanDerWaalsContact CZ-CG 3.42Å
379A87.9Confident86.5Confident21 Ų2177.6 Ų77.617%0.17440%0.396CS..SBendtrans-77-15.7176.200000113.6R359R359-A379 HydrophobicContact CB-CB 4.01Å; R359-A379 WeakPolarHBondContact CD-O 3.42Å; R359-A379 PolarHBondContact NH1-O 3.23Å
380N89.1Confident86.1Confident20 Ų2081.5 Ų81.511%0.10742%0.42CS..SBendtrans-143.8154.8174.869.882.5000111.8I356 F367 F378 S382 D383 R384I356-N380 HydrophobicContact CD1-CB 3.82Å; I356-N380 HydrophobicContact CG1-CB 4.02Å; I356-N380 HydrophobicContact CG2-CB 3.86Å; F367-N380 VanDerWaalsContact CD2-CA 3.5Å; F378-N380 VanDerWaalsContact C-N 3.31Å; F378-N380 WeakPolarHBondContact CB-O 3.39Å; N380-S382 WeakPolarHBondContact OD1-CB 3.34Å; N380-S382 PolarHBondContact OD1-N 3.06Å; N380-D383 PolarHBondContact ND2-OD2 3.25Å; N380-D383 PolarHBondContact OD1-N 3.11Å; N380-D383 PolarHBondContact OD1-OD2 2.82Å; N380-R384 PolarHBondContact O-N 2.65Å
381S87.1Confident85.7Confident58 Ų5876.6 Ų76.641%0.40640%0.397SS..Hα-helixtrans-69.8-30.4-178.950.70000113.7R384 K385S381-R384 PolarHBondContact O-N 2.9Å; S381-K385 PolarHBondContact O-N 2.96Å
382S87.1Confident85.1Confident72 Ų7274.2 Ų74.250%0.50339%0.391SS..Hα-helixtrans-65.9-38179.7-55.60000112.5N380 K385 K386N380-S382 WeakPolarHBondContact OD1-CB 3.34Å; N380-S382 PolarHBondContact OD1-N 3.06Å; S382-K385 PolarHBondContact O-N 3.17Å; S382-K386 WeakPolarHBondContact O-CG 3.48Å; S382-K386 PolarHBondContact O-N 3.27Å
383D86.8Confident84.3Confident62 Ų6272 Ų7233%0.33239%0.388SS..Hα-helixtrans-76.1-32.7176.2-68-24.9000112F378 N380 K386 H387F378-D383 HydrophobicContact CD1-CB 4.03Å; N380-D383 PolarHBondContact ND2-OD2 3.25Å; N380-D383 PolarHBondContact OD1-N 3.11Å; N380-D383 PolarHBondContact OD1-OD2 2.82Å; D383-K386 PolarHBondContact O-N 2.96Å; D383-K386 WeakPolarHBondContact OD1-CE 3.33Å; D383-K386 IonicContact OD1-NZ 3.21Å; D383-K386 PolarHBondContact OD1-NZ 3.43Å; D383-H387 WeakPolarHBondContact O-CB 3.47Å; D383-H387 PolarHBondContact O-N 2.83Å
384R89.7Confident83.8Confident52 Ų5274.1 Ų74.120%0.19638%0.383CS..Hα-helixtrans-58.1-47.5165.7-174.1-169.268.5171.214.2111.2F367 K368 E370 F378 N380 S381 K386 H387 S388F367-R384 HydrophobicContact CB-CB 4.33Å; K368-R384 WeakPolarHBondContact O-CD 3.45Å; K368-R384 PolarHBondContact O-NH1 2.91Å; E370-R384 IonicContact OE1-CZ 3.91Å; E370-R384 IonicContact OE1-NH1 2.68Å; E370-R384 PolarHBondContact OE1-NH1 3.37Å; E370-R384 IonicContact OE1-NH2 2.72Å; E370-R384 PolarHBondContact OE1-NH2 3.43Å; E370-R384 IonicContact OE2-CZ 2.68Å; E370-R384 IonicContact OE2-NE 3.14Å; E370-R384 IonicContact OE2-NH1 3.64Å; E370-R384 PolarHBondContact OE2-NH1 2.88Å; E370-R384 IonicContact OE2-NH2 3.71Å; E370-R384 PolarHBondContact OE2-NH2 3.34Å; F378-R384 HydrophobicContact CB-CB 4.24Å; F378-R384 HydrophobicContact CD2-CB 3.76Å; F378-R384 HydrophobicContact CD2-CG 4Å; F378-R384 HydrophobicContact CE2-CB 4.49Å; F378-R384 HydrophobicContact CE2-CG 4.45Å; F378-R384 HydrophobicContact CG-CB 4.07Å; N380-R384 PolarHBondContact O-N 2.65Å; S381-R384 PolarHBondContact O-N 2.9Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.01Å; R384-H387 CarbonylContact O-C 3.24Å; R384-H387 WeakPolarHBondContact O-CA 3.26Å; R384-H387 WeakPolarHBondContact O-CB 3.28Å; R384-H387 PolarHBondContact O-N 3.24Å; R384-S388 PolarHBondContact O-N 3.29Å
385K85.9Confident83.2Confident143 Ų14378.9 Ų78.962%0.62240%0.402SS*.Hα-helixtrans-66.4-32.1179.6-171.8168.6-177.1170.90112.7S381 S382 H387 S388 H389S381-K385 PolarHBondContact O-N 2.96Å; S382-K385 PolarHBondContact O-N 3.17Å; K385-H387 VanDerWaalsContact C-N 3.31Å; K385-S388 PolarHBondContact O-OG 3.28Å; K385-H389 PolarHBondContact O-CD2 3.35Å
386K82.9Confident82.7Confident101 Ų10177.2 Ų77.244%0.43940%0.398SS..Hα-helixtrans-65.3-37168.6-68.5164.8-154162.90111.5S382 D383 R384S382-K386 WeakPolarHBondContact O-CG 3.48Å; S382-K386 PolarHBondContact O-N 3.27Å; D383-K386 PolarHBondContact O-N 2.96Å; D383-K386 WeakPolarHBondContact OD1-CE 3.33Å; D383-K386 IonicContact OD1-NZ 3.21Å; D383-K386 PolarHBondContact OD1-NZ 3.43Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.01Å
387H85.8Confident82.5Confident17 Ų1773.8 Ų73.88%0.07939%0.385CS..Hα-helixtrans-73-31.5179176.242.3000113.9C374 R376 F378 D383 R384 K385 H389 V390 H391C374-H387 PolarHBondContact SG-NE2 3.03Å; R376-H387 VanDerWaalsContact CD-NE2 3.28Å; R376-H387 WeakPolarHBondContact CD-NE2 3.49Å; F378-H387 HydrophobicContact CE1-CB 3.99Å; F378-H387 HydrophobicContact CE2-CB 4.03Å; F378-H387 AromaticContact CE2-CD2 3.42Å; F378-H387 VanDerWaalsContact CE2-CD2 3.42Å; F378-H387 WeakPolarHBondContact CE2-CD2 3.15Å; F378-H387 AromaticContact CE2-CG 3.96Å; F378-H387 HydrophobicContact CZ-CB 3.46Å; F378-H387 VanDerWaalsContact CZ-CB 3.46Å; F378-H387 AromaticContact CZ-CD2 3.28Å; F378-H387 WeakPolarHBondContact CZ-CD2 3.38Å; F378-H387 AromaticContact CZ-CG 3.42Å; F378-H387 VanDerWaalsContact CZ-CG 3.42Å; D383-H387 WeakPolarHBondContact O-CB 3.47Å; D383-H387 PolarHBondContact O-N 2.83Å; R384-H387 CarbonylContact O-C 3.24Å; R384-H387 WeakPolarHBondContact O-CA 3.26Å; R384-H387 WeakPolarHBondContact O-CB 3.28Å; R384-H387 PolarHBondContact O-N 3.24Å; K385-H387 VanDerWaalsContact C-N 3.31Å; H387-H389 PolarHBondContact O-N 2.88Å; H387-H389 VanDerWaalsContact O-N 3.15Å; H387-V390 VanDerWaalsContact O-CB 3.23Å; H387-V390 WeakPolarHBondContact O-CB 3.42Å; H387-V390 WeakPolarHBondContact O-CG2 3.44Å; H387-V390 PolarHBondContact O-N 3.13Å; H387-H391 AromaticContact CE1-NE2 3.57Å; H387-H391 AromaticContact NE2-NE2 3.34Å; H387-H391 PolarHBondContact NE2-NE2 2.83Å
388S82.3Confident82.2Confident45 Ų4571.5 Ų71.532%0.31538%0.384SS..Hα-helixtrans-58.6-29.9177.348.30000112.9R384 K385 V390 H391 T392R384-S388 PolarHBondContact O-N 3.29Å; K385-S388 PolarHBondContact O-OG 3.28Å; S388-V390 PolarHBondContact O-N 3.23Å; S388-H391 PolarHBondContact O-N 3.42Å; S388-T392 PolarHBondContact O-N 2.96Å
389H80.7Confident82.2Confident69 Ų6970.2 Ų70.232%0.31938%0.38SS..THydrogen-bonded Turntrans-69.713.1169.6-56.6-72000114.9K385 H387 T409K385-H389 PolarHBondContact O-CD2 3.35Å; H387-H389 PolarHBondContact O-N 2.88Å; H387-H389 VanDerWaalsContact O-N 3.15Å; H389-T409 WeakPolarHBondContact O-CB 3.42Å; H389-T409 WeakPolarHBondContact O-CG2 3.34Å; H389-T409 PolarHBondContact O-OG1 3.34Å
390V80.8Confident82Confident89 Ų8977.3 Ų77.354%0.53941%0.407SS..THydrogen-bonded Turntrans-98.7-23.5166.4-1790000110.8H387 S388H387-V390 VanDerWaalsContact O-CB 3.23Å; H387-V390 WeakPolarHBondContact O-CB 3.42Å; H387-V390 WeakPolarHBondContact O-CG2 3.44Å; H387-V390 PolarHBondContact O-N 3.13Å; S388-V390 PolarHBondContact O-N 3.23Å
391H79.8Confident81.8Confident50 Ų5078.7 Ų78.723%0.23142%0.416CS..THydrogen-bonded Turntrans-87.5-26.8174.9-55.8-64.7000111.9F371 C374 H387 S388 S393F371-H391 HydrophobicContact CB-CB 4.32Å; F371-H391 VanDerWaalsContact CB-CD2 3.46Å; F371-H391 WeakPolarHBondContact CB-CD2 3.45Å; F371-H391 HydrophobicContact CD1-CB 4.1Å; F371-H391 AromaticContact CD1-CE1 3.62Å; F371-H391 AromaticContact CD1-CG 3.55Å; F371-H391 AromaticContact CD1-ND1 3.27Å; F371-H391 VanDerWaalsContact CD1-ND1 3.27Å; F371-H391 WeakPolarHBondContact CD1-ND1 3.47Å; F371-H391 HydrophobicContact CD2-CB 3.58Å; F371-H391 AromaticContact CD2-CG 3.85Å; F371-H391 HydrophobicContact CE1-CB 4.32Å; F371-H391 AromaticContact CE1-ND1 3.65Å; F371-H391 HydrophobicContact CE2-CB 3.82Å; F371-H391 HydrophobicContact CG-CB 3.72Å; F371-H391 AromaticContact CG-CD2 3.7Å; F371-H391 AromaticContact CG-CG 3.42Å; F371-H391 VanDerWaalsContact CG-CG 3.42Å; F371-H391 AromaticContact CG-ND1 3.68Å; F371-H391 HydrophobicContact CZ-CB 4.19Å; C374-H391 PolarHBondContact SG-CE1 3.06Å; C374-H391 PolarHBondContact SG-NE2 3.07Å; H387-H391 AromaticContact CE1-NE2 3.57Å; H387-H391 AromaticContact NE2-NE2 3.34Å; H387-H391 PolarHBondContact NE2-NE2 2.83Å; S388-H391 PolarHBondContact O-N 3.42Å; H391-S393 PolarHBondContact O-N 3.01Å
392T72.7Confident81.4Confident63 Ų6387.5 Ų87.539%0.38744%0.441SS..SBendtrans-76.2111.4164.4-36.40000108.8S388 D394S388-T392 PolarHBondContact O-N 2.96Å; T392-D394 HydrophobicContact CG2-CB 4.01Å; T392-D394 VanDerWaalsContact CG2-OD2 3.27Å; T392-D394 WeakPolarHBondContact CG2-OD2 3.37Å; T392-D394 PolarHBondContact O-N 2.84Å
393S66Low81Confident105 Ų10587.9 Ų87.973%0.73446%0.455SS*.  trans-66-15.4178.3-64.40000113.8H391 K395H391-S393 PolarHBondContact O-N 3.01Å; S393-K395 PolarHBondContact O-N 3.47Å
394D72.7Confident80.9Confident114 Ų11485.2 Ų85.261%0.6144%0.442SS*.  trans-62.6126.3-178.9-59.1-44.5000112.5T392 P396 T409T392-D394 HydrophobicContact CG2-CB 4.01Å; T392-D394 VanDerWaalsContact CG2-OD2 3.27Å; T392-D394 WeakPolarHBondContact CG2-OD2 3.37Å; T392-D394 PolarHBondContact O-N 2.84Å; D394-P396 WeakPolarHBondContact O-CD 3.37Å; D394-T409 WeakPolarHBondContact O-CG2 3.34Å
395K74.9Confident80.6Confident113 Ų11390.2 Ų90.249%0.49147%0.472SS..  trans-113.764.6177.1-65.8169.4-170.1168.30110.7S393 Y397 N398 S407 Y408 T409S393-K395 PolarHBondContact O-N 3.47Å; K395-Y397 PolarHBondContact O-N 3.44Å; K395-N398 PolarHBondContact O-OD1 2.9Å; K395-S407 VanDerWaalsContact CD-OG 3.25Å; K395-S407 WeakPolarHBondContact CD-OG 3.41Å; K395-Y408 CarbonylContact C-O 3.58Å; K395-Y408 VanDerWaalsContact C-O 3.24Å; K395-Y408 WeakPolarHBondContact CA-O 3.35Å; K395-T409 HydrophobicContact CG-CG2 3.72Å
396P77.8Confident80.5Confident83 Ų8389.1 Ų89.154%0.53947%0.467SS..  trans-66.9-9.7-171.728.6-36.6000114.2D394 N398D394-P396 WeakPolarHBondContact O-CD 3.37Å; P396-N398 PolarHBondContact O-N 3.46Å
397Y82.9Confident80.5Confident84 Ų8486.3 Ų86.333%0.32946%0.461SS..EExtended strand (participates in β ladder)trans-10078.3-179-51.6-67.1000111.1K395 Y408 P411K395-Y397 PolarHBondContact O-N 3.44Å; Y397-Y408 WeakPolarHBondContact CB-O 3.28Å; Y397-Y408 WeakPolarHBondContact CD2-O 3.38Å; Y397-Y408 PolarHBondContact N-O 3.33Å; Y397-Y408 VanDerWaalsContact N-O 3.1Å; Y397-Y408 PolarHBondContact O-N 3.44Å; Y397-P411 HydrophobicContact CD1-CB 4.5Å; Y397-P411 HydrophobicContact CD1-CG 4.03Å; Y397-P411 HydrophobicContact CD2-CG 4.18Å; Y397-P411 HydrophobicContact CE1-CG 3.68Å; Y397-P411 VanDerWaalsContact CE2-CD 3.47Å; Y397-P411 HydrophobicContact CE2-CG 3.82Å; Y397-P411 HydrophobicContact CG-CG 4.26Å
398N84.9Confident80.4Confident97 Ų9788.1 Ų88.152%0.51947%0.467SS..EExtended strand (participates in β ladder)trans-72.5144.5175.1-62.9-39.7000112K395 P396 S407 L414K395-N398 PolarHBondContact O-OD1 2.9Å; P396-N398 PolarHBondContact O-N 3.46Å; N398-S407 WeakPolarHBondContact OD1-CB 3.42Å; N398-L414 WeakPolarHBondContact O-CD2 2.99Å
399C88.6Confident80.3Confident16 Ų1688 Ų8811%0.10846%0.464CS..  trans-66.9141.4163.3-169.10000110.2C404 K406 L414C399-C404 WeakPolarHBondContact CB-O 3.42Å; C399-K406 WeakPolarHBondContact CB-O 3.43Å; C399-K406 PolarHBondContact N-O 3.25Å; C399-L414 HydrophobicContact CB-CD1 4.11Å
400K84.1Confident80.2Confident170 Ų17087.2 Ų87.274%0.73946%0.461SS*.  trans-100.93.2177.6-66.6-170.8177.4-174.70113.4S481K400-S481 PolarHBondContact NZ-OG 3.46Å
401V85.4Confident80.2Confident50 Ų5085.1 Ų85.130%0.30345%0.449SS..SBendtrans-80.1129.8179.4-179.30000109.4G403 C404 M418 H421V401-G403 PolarHBondContact O-N 3.3Å; V401-C404 HydrophobicContact CB-CB 4.38Å; V401-C404 PolarHBondContact O-N 3.05Å; V401-M418 HydrophobicContact CG2-CE 3.74Å; V401-M418 HydrophobicContact CG2-SD 4.23Å; V401-H421 HydrophobicContact CG2-CB 4.16Å
402R78.7Confident80.4Confident243 Ų24384.8 Ų84.892%0.91745%0.452SS*.THydrogen-bonded Turntrans-58.8135.2178.4-63.1-65-177.3108.6-2.3110.1
403G78.4Confident81Confident79 Ų7983.9 Ų83.981%0.81445%0.449SS*.THydrogen-bonded Turntrans74.624.4-175.400000114.8V401V401-G403 PolarHBondContact O-N 3.3Å
404C84.9Confident82Confident7 Ų780.4 Ų80.45%0.04742%0.422CS..  trans-143.383.5178.2-166.60000113.4C399 V401 K406 H417 H421C399-C404 WeakPolarHBondContact CB-O 3.42Å; V401-C404 HydrophobicContact CB-CB 4.38Å; V401-C404 PolarHBondContact O-N 3.05Å; C404-K406 PolarHBondContact O-N 3.45Å; C404-H417 PolarHBondContact SG-CE1 3.41Å; C404-H417 PolarHBondContact SG-NE2 3.21Å; C404-H421 WeakPolarHBondContact CB-NE2 3.32Å; C404-H421 PolarHBondContact SG-NE2 2.79Å
405D82.7Confident82.7Confident156 Ų15680.5 Ų80.583%0.83441%0.414SS*.  trans-78.931.1-174.5-45.1-75.3000113.7S407D405-S407 PolarHBondContact O-N 3.38Å
406K83.2Confident83.2Confident120 Ų12082.7 Ų82.752%0.52242%0.423SS..  trans-84.4111.6-174.2-69.1179.2-176.8167.20110.9C399 C404 Y408C399-K406 WeakPolarHBondContact CB-O 3.43Å; C399-K406 PolarHBondContact N-O 3.25Å; C404-K406 PolarHBondContact O-N 3.45Å; K406-Y408 HydrophobicContact CB-CE2 3.91Å; K406-Y408 WeakPolarHBondContact O-CE2 3.46Å
407S83.9Confident83.6Confident42 Ų4279.4 Ų79.429%0.29440%0.401SS..EExtended strand (participates in β ladder)trans-103.7146.318062.20000112.6K395 N398 D405K395-S407 VanDerWaalsContact CD-OG 3.25Å; K395-S407 WeakPolarHBondContact CD-OG 3.41Å; N398-S407 WeakPolarHBondContact OD1-CB 3.42Å; D405-S407 PolarHBondContact O-N 3.38Å
408Y82.1Confident83.7Confident56 Ų5678.1 Ų78.122%0.2240%0.398CS..EExtended strand (participates in β ladder)trans-132.2146.9-173.9-62.4-84000112.6K395 Y397 K406 H410 L414 H417K395-Y408 CarbonylContact C-O 3.58Å; K395-Y408 VanDerWaalsContact C-O 3.24Å; K395-Y408 WeakPolarHBondContact CA-O 3.35Å; Y397-Y408 WeakPolarHBondContact CB-O 3.28Å; Y397-Y408 WeakPolarHBondContact CD2-O 3.38Å; Y397-Y408 PolarHBondContact N-O 3.33Å; Y397-Y408 VanDerWaalsContact N-O 3.1Å; Y397-Y408 PolarHBondContact O-N 3.44Å; K406-Y408 HydrophobicContact CB-CE2 3.91Å; K406-Y408 WeakPolarHBondContact O-CE2 3.46Å; Y408-H410 VanDerWaalsContact C-N 3.32Å; Y408-L414 HydrophobicContact CD2-CB 3.92Å; Y408-L414 HydrophobicContact CD2-CD1 4.1Å; Y408-L414 HydrophobicContact CE2-CD1 4.31Å; Y408-L414 HydrophobicContact CG-CB 4.33Å; Y408-H417 HydrophobicContact CE1-CB 4.42Å; Y408-H417 HydrophobicContact CE2-CB 3.85Å; Y408-H417 AromaticContact CE2-CD2 3.42Å; Y408-H417 VanDerWaalsContact CE2-CD2 3.42Å; Y408-H417 WeakPolarHBondContact CE2-CD2 3.38Å; Y408-H417 AromaticContact CE2-CG 3.8Å; Y408-H417 AromaticContact CZ-CD2 3.8Å; Y408-H417 AromaticContact CZ-CG 3.72Å; Y408-H417 WeakPolarHBondContact OH-CB 3.4Å; Y408-H417 PolarHBondContact OH-CD2 3.32Å
409T80.7Confident83.7Confident41 Ų4180.5 Ų80.525%0.25240%0.404SS..SBendtrans-80.8-7.8175.364.80000113.8H389 D394 K395H389-T409 WeakPolarHBondContact O-CB 3.42Å; H389-T409 WeakPolarHBondContact O-CG2 3.34Å; H389-T409 PolarHBondContact O-OG1 3.34Å; D394-T409 WeakPolarHBondContact O-CG2 3.34Å; K395-T409 HydrophobicContact CG-CG2 3.72Å
410H79.8Confident83.6Confident54 Ų5483.6 Ų83.625%0.2542%0.422CS..SBendtrans-148.5140.7-178.4-170.2-99.4000113.6Y408 S412 S413 L414Y408-H410 VanDerWaalsContact C-N 3.32Å; H410-S412 VanDerWaalsContact C-N 3.31Å; H410-S412 PolarHBondContact CE1-OG 3Å; H410-S412 VanDerWaalsContact CE1-OG 3.25Å; H410-S412 PolarHBondContact ND1-N 2.88Å; H410-S412 PolarHBondContact ND1-OG 2.94Å; H410-S412 PolarHBondContact O-N 3.15Å; H410-S413 WeakPolarHBondContact O-CB 2.94Å; H410-S413 PolarHBondContact O-N 3.43Å; H410-L414 PolarHBondContact O-N 3.33Å
411P80.9Confident83.4Confident44 Ų4478.3 Ų78.329%0.28640%0.4SS..Hα-helixtrans-63.5-30.5-172.8-21.831.9000114.5Y397 S413 L414 R415Y397-P411 HydrophobicContact CD1-CB 4.5Å; Y397-P411 HydrophobicContact CD1-CG 4.03Å; Y397-P411 HydrophobicContact CD2-CG 4.18Å; Y397-P411 HydrophobicContact CE1-CG 3.68Å; Y397-P411 VanDerWaalsContact CE2-CD 3.47Å; Y397-P411 HydrophobicContact CE2-CG 3.82Å; Y397-P411 HydrophobicContact CG-CG 4.26Å; P411-S413 VanDerWaalsContact C-N 3.25Å; P411-S413 PolarHBondContact O-N 3.09Å; P411-L414 PolarHBondContact O-N 2.67Å; P411-R415 WeakPolarHBondContact O-CB 3.42Å; P411-R415 PolarHBondContact O-N 3.41Å
412S83.2Confident82.7Confident44 Ų4479.4 Ų79.431%0.30841%0.409SS..Hα-helixtrans-71.2-21.8178.570.60000113.1H410 K416H410-S412 VanDerWaalsContact C-N 3.31Å; H410-S412 PolarHBondContact CE1-OG 3Å; H410-S412 VanDerWaalsContact CE1-OG 3.25Å; H410-S412 PolarHBondContact ND1-N 2.88Å; H410-S412 PolarHBondContact ND1-OG 2.94Å; H410-S412 PolarHBondContact O-N 3.15Å; S412-K416 WeakPolarHBondContact O-CG 3.44Å; S412-K416 PolarHBondContact O-N 2.7Å; S412-K416 VanDerWaalsContact O-N 3.11Å
413S85.4Confident82Confident44 Ų4476.4 Ų76.431%0.30840%0.403SS..Hα-helixtrans-75.3-46173.8-57.30000110.3H410 P411 R415 K416 H417H410-S413 WeakPolarHBondContact O-CB 2.94Å; H410-S413 PolarHBondContact O-N 3.43Å; P411-S413 VanDerWaalsContact C-N 3.25Å; P411-S413 PolarHBondContact O-N 3.09Å; S413-R415 PolarHBondContact O-N 2.9Å; S413-K416 WeakPolarHBondContact O-CB 3.34Å; S413-K416 PolarHBondContact O-N 3.48Å; S413-H417 PolarHBondContact O-N 3.49Å
414L87.3Confident80.3Confident32 Ų3275.7 Ų75.717%0.16839%0.385CS..Hα-helixtrans-56.7-47.8169.9174.658.2000111.2N398 C399 Y408 H410 P411 K416 H417 M418N398-L414 WeakPolarHBondContact O-CD2 2.99Å; C399-L414 HydrophobicContact CB-CD1 4.11Å; Y408-L414 HydrophobicContact CD2-CB 3.92Å; Y408-L414 HydrophobicContact CD2-CD1 4.1Å; Y408-L414 HydrophobicContact CE2-CD1 4.31Å; Y408-L414 HydrophobicContact CG-CB 4.33Å; H410-L414 PolarHBondContact O-N 3.33Å; P411-L414 PolarHBondContact O-N 2.67Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 2.71Å; L414-H417 CarbonylContact O-C 3.55Å; L414-H417 WeakPolarHBondContact O-CA 3.09Å; L414-H417 WeakPolarHBondContact O-CB 3.49Å; L414-H417 PolarHBondContact O-N 3.04Å; L414-M418 HydrophobicContact CD1-CG 4.14Å; L414-M418 HydrophobicContact CD1-SD 4.19Å; L414-M418 HydrophobicContact CG-CG 4.44Å; L414-M418 WeakPolarHBondContact O-CG 3.18Å; L414-M418 PolarHBondContact O-N 2.98Å
415R86.6Confident78.1Confident116 Ų11680.5 Ų80.544%0.43842%0.416SS..Hα-helixtrans-59.6-34.3177-172.5-174.1-67139.8-1.1113.4P411 S413 Y484P411-R415 WeakPolarHBondContact O-CB 3.42Å; P411-R415 PolarHBondContact O-N 3.41Å; S413-R415 PolarHBondContact O-N 2.9Å; R415-Y484 VanDerWaalsContact CZ-OH 3.25Å; R415-Y484 PolarHBondContact NE-OH 3.42Å; R415-Y484 PolarHBondContact NH2-OH 3.22Å
416K85.3Confident76.2Confident158 Ų15878.5 Ų78.569%0.68741%0.412SS*.Hα-helixtrans-68-43.9171.9-77.2174178.4-174.10111S412 S413 L414 K419S412-K416 WeakPolarHBondContact O-CG 3.44Å; S412-K416 PolarHBondContact O-N 2.7Å; S412-K416 VanDerWaalsContact O-N 3.11Å; S413-K416 WeakPolarHBondContact O-CB 3.34Å; S413-K416 PolarHBondContact O-N 3.48Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 2.71Å; K416-K419 WeakPolarHBondContact O-CB 3.41Å; K416-K419 PolarHBondContact O-N 2.71Å
417H86.6Confident74.2Confident15 Ų1578.7 Ų78.77%0.06943%0.425CS..Hα-helixtrans-64.1-38.7178.5168.445.9000113.2C404 Y408 S413 L414 K419 V420 H421C404-H417 PolarHBondContact SG-CE1 3.41Å; C404-H417 PolarHBondContact SG-NE2 3.21Å; Y408-H417 HydrophobicContact CE1-CB 4.42Å; Y408-H417 HydrophobicContact CE2-CB 3.85Å; Y408-H417 AromaticContact CE2-CD2 3.42Å; Y408-H417 VanDerWaalsContact CE2-CD2 3.42Å; Y408-H417 WeakPolarHBondContact CE2-CD2 3.38Å; Y408-H417 AromaticContact CE2-CG 3.8Å; Y408-H417 AromaticContact CZ-CD2 3.8Å; Y408-H417 AromaticContact CZ-CG 3.72Å; Y408-H417 WeakPolarHBondContact OH-CB 3.4Å; Y408-H417 PolarHBondContact OH-CD2 3.32Å; S413-H417 PolarHBondContact O-N 3.49Å; L414-H417 CarbonylContact O-C 3.55Å; L414-H417 WeakPolarHBondContact O-CA 3.09Å; L414-H417 WeakPolarHBondContact O-CB 3.49Å; L414-H417 PolarHBondContact O-N 3.04Å; H417-K419 PolarHBondContact O-N 3.26Å; H417-V420 VanDerWaalsContact O-CB 3.25Å; H417-V420 WeakPolarHBondContact O-CB 3.4Å; H417-V420 WeakPolarHBondContact O-CG2 3.41Å; H417-V420 PolarHBondContact O-N 3.46Å; H417-H421 AromaticContact CE1-CD2 3.76Å; H417-H421 AromaticContact NE2-CD2 3.8Å
418M85.3Confident72.1Confident57 Ų5782 Ų8228%0.28145%0.448SS..Hα-helixtrans-56.8-25.1175-69.8-55.6-57.900113.2V401 L414 V420 H421 C422V401-M418 HydrophobicContact CG2-CE 3.74Å; V401-M418 HydrophobicContact CG2-SD 4.23Å; L414-M418 HydrophobicContact CD1-CG 4.14Å; L414-M418 HydrophobicContact CD1-SD 4.19Å; L414-M418 HydrophobicContact CG-CG 4.44Å; L414-M418 WeakPolarHBondContact O-CG 3.18Å; L414-M418 PolarHBondContact O-N 2.98Å; M418-V420 PolarHBondContact O-N 2.97Å; M418-H421 PolarHBondContact O-N 2.95Å; M418-H421 VanDerWaalsContact O-N 3.13Å; M418-C422 PolarHBondContact O-N 3.43Å
419K85.2Confident70.3Confident146 Ų14685.3 Ų85.364%0.63548%0.48SS*.Hα-helixtrans-71.7-10.2172.8-58.2-166.3174.9-159.50114.4K416 H417 K423K416-K419 WeakPolarHBondContact O-CB 3.41Å; K416-K419 PolarHBondContact O-N 2.71Å; H417-K419 PolarHBondContact O-N 3.26Å; K419-K423 WeakPolarHBondContact O-CB 3.22Å; K419-K423 WeakPolarHBondContact O-CD 3.46Å; K419-K423 WeakPolarHBondContact O-CG 3.27Å
420V85.5Confident68.1Low82 Ų8286.1 Ų86.150%0.49750%0.496SS..Hα-helixtrans-76.2-41.1167.3-175.70000109.1H417 M418 K423 S424H417-V420 VanDerWaalsContact O-CB 3.25Å; H417-V420 WeakPolarHBondContact O-CB 3.4Å; H417-V420 WeakPolarHBondContact O-CG2 3.41Å; H417-V420 PolarHBondContact O-N 3.46Å; M418-V420 PolarHBondContact O-N 2.97Å; V420-K423 WeakPolarHBondContact O-CB 3.23Å; V420-K423 PolarHBondContact O-N 2.88Å; V420-K423 VanDerWaalsContact O-N 3.07Å; V420-S424 PolarHBondContact O-N 3.2Å
421H80.4Confident66Low59 Ų5992.8 Ų92.827%0.27352%0.521SS..Hα-helixtrans-70.7-36.9-179.7-64.4-56.8000113.6V401 C404 H417 M418 K423V401-H421 HydrophobicContact CG2-CB 4.16Å; C404-H421 WeakPolarHBondContact CB-NE2 3.32Å; C404-H421 PolarHBondContact SG-NE2 2.79Å; H417-H421 AromaticContact CE1-CD2 3.76Å; H417-H421 AromaticContact NE2-CD2 3.8Å; M418-H421 PolarHBondContact O-N 2.95Å; M418-H421 VanDerWaalsContact O-N 3.13Å; H421-K423 PolarHBondContact O-N 3.01Å
422C70.8Confident64.2Low73 Ų7399.4 Ų99.449%0.49355%0.548SS..THydrogen-bonded Turntrans-83.425.9166.9-60.40000113.2M418 C486M418-C422 PolarHBondContact O-N 3.43Å; C422-C486 HydrophobicContact CB-CB 4.14Å; C422-C486 WeakPolarHBondContact CB-SG 3Å; C422-C486 WeakPolarHBondContact SG-CB 3.43Å; C422-C486 CovalentContact SG-SG 2.06Å; C422-C486 PolarHBondContact SG-SG 3.05Å
423K62.8Low61.7Low180 Ų180100.9 Ų100.978%0.78356%0.558SS**THydrogen-bonded Turntrans-126.4-29.6171.5-88-172.9173.8-155.60112.9K419 V420 H421K419-K423 WeakPolarHBondContact O-CB 3.22Å; K419-K423 WeakPolarHBondContact O-CD 3.46Å; K419-K423 WeakPolarHBondContact O-CG 3.27Å; V420-K423 WeakPolarHBondContact O-CB 3.23Å; V420-K423 PolarHBondContact O-N 2.88Å; V420-K423 VanDerWaalsContact O-N 3.07Å; H421-K423 PolarHBondContact O-N 3.01Å
424S43.5Very low59.4Low63 Ų63104 Ų10444%0.44158%0.58SS.*SBendtrans-66.9145.3155.9-57.40000109.4V420V420-S424 PolarHBondContact O-N 3.2Å
425P38Very low56.8Low109 Ų109108.4 Ų108.471%0.70861%0.608SS**PPolyproline II helixtrans-60.4151.4156.329.4-33.8000108.9
426P42.8Very low54.7Low113 Ų113108.6 Ų108.673%0.73462%0.624SS**PPolyproline II helixtrans-60.6143.1170.727.8-34000109.5S428P426-S428 PolarHBondContact O-N 3.1Å
427P42.8Very low52.1Low125 Ų125106.8 Ų106.881%0.81263%0.632SS**PPolyproline II helixtrans-59.4128.8167.927.2-33.2000108.3S429P427-S429 PolarHBondContact O-N 3.03Å
428S38.8Very low49.6Very low110 Ų110114.4 Ų114.477%0.76967%0.672SS**  trans-66106.8-174.1510000111P426 G430P426-S428 PolarHBondContact O-N 3.1Å; S428-G430 PolarHBondContact O-N 2.92Å
429S43.9Very low47Very low127 Ų127118.5 Ų118.589%0.88870%0.7SS**  trans-73.7119.1163.154.70000109P427P427-S429 PolarHBondContact O-N 3.03Å
430G35.3Very low44.5Very low58 Ų58116.8 Ų116.860%0.59871%0.707SS**  trans124.4129.7-169.300000108.8S428S428-G430 PolarHBondContact O-N 2.92Å
431Y34.8Very low42.6Very low194 Ų194118.1 Ų118.176%0.76172%0.717SS**  cis-144.2152.71959.6-73.6000110.6S433Y431-S433 VanDerWaalsContact CE2-CB 3.45Å; Y431-S433 PolarHBondContact O-N 3.03Å
432E43.5Very low40.2Very low182 Ų182120.5 Ų120.585%0.8574%0.74SS**  trans-73.1125.5163.6-65.9-164.4129.300108.6
433S30.8Very low38.5Very low76 Ų76122.1 Ų122.153%0.53175%0.752SS.*  trans-10770.5-176.9-168.50000110.5Y431 T435Y431-S433 VanDerWaalsContact CE2-CB 3.45Å; Y431-S433 PolarHBondContact O-N 3.03Å; S433-T435 PolarHBondContact O-N 2.84Å
434S37Very low37Very low110 Ų110120 Ų12077%0.76975%0.75SS**  trans-60.7106.2180-57.90000112P436S434-P436 WeakPolarHBondContact O-CD 3.25Å
435T32.4Very low36.6Very low123 Ų123124.5 Ų124.576%0.75577%0.768SS**  trans-101.9105.5170.953.30000110.1S433S433-T435 PolarHBondContact O-N 2.84Å
436P43.2Very low36.2Very low120 Ų120122.9 Ų122.978%0.77977%0.771SS**  trans-79.2137.8176.631.9-33.4000111.3S434S434-P436 WeakPolarHBondContact O-CD 3.25Å
437S30.4Very low35.6Very low121 Ų121129.3 Ų129.385%0.84678%0.781SS**  trans-151135.9163-78.40000109.1
438L34.1Very low35.1Very low175 Ų175131.4 Ų131.492%0.91678%0.779SS**  trans-112.5123.4-167.9-64.3166.1000110.7
439V31.9Very low35.7Very low143 Ų143131.7 Ų131.787%0.86778%0.779SS**  trans-172.7140.4149.4540000111
440S32.3Very low35.1Very low110 Ų110130.2 Ų130.277%0.76977%0.774SS**  trans-134.1-175.6176-49.70000107.7
441P46.3Very low34.8Very low110 Ų110131.3 Ų131.371%0.71479%0.786SS**  cis-138.7-166.41.143.9-25.2000115.3
442S29.8Very low34.3Very low109 Ų109125.7 Ų125.776%0.76279%0.787SS**  trans69.1156.4161-82.50000117.9
443S34.8Very low34.6Very low107 Ų107122.7 Ų122.775%0.74878%0.783SS**  cis-173.5166.7-9.8-97.90000107.7
444D31.6Very low34.5Very low136 Ų136124.4 Ų124.473%0.72780%0.795SS**  cis-172.2179.9-17.2-178.128.5000108.4
445L34Very low34.2Very low156 Ų156126 Ų12682%0.81780%0.8SS**  trans74139.5173.6-46.2174.9000116.7
446G30Very low34.1Very low75 Ų75126.2 Ų126.277%0.77380%0.8SS**  cis120.699.6-11.900000115.4
447R30Very low33.5Very low249 Ų249126.2 Ų126.294%0.9480%0.803SS**  trans-160.5107.5164-157.8161.7-171.8159.91.8116.8
448E32.9Very low33.5Very low168 Ų168129.2 Ų129.279%0.78580%0.804SS**  trans-101.1-167.7152.5-84.6-73.113100108
449P51.3Low34.9Very low116 Ų116125.9 Ų125.975%0.75379%0.793SS**  cis-120.1-148.7-10.130.4-5000110.1
450A31.3Very low35.9Very low97 Ų97124.4 Ų124.480%0.80279%0.786SS**  cis-165.91728.900000112.3
451G27.7Very low35.9Very low81 Ų81125.7 Ų125.784%0.83579%0.789SS**  trans136.5113.6146.600000118.4
452G26.2Very low35.1Very low76 Ų76123.8 Ų123.878%0.78479%0.789SS**  trans-112.8-151158.500000110.6
453P48.3Very low35.1Very low118 Ų118123.1 Ų123.177%0.76679%0.791SS**  cis-141.1-176.20.543.8-26.2000116.3
454S29.8Very low34.9Very low112 Ų112123.6 Ų123.678%0.78379%0.794SS**  trans69.5161.2159.3-580000117.3
455V30.9Very low35.3Very low144 Ų144125.9 Ų125.987%0.87380%0.801SS**  cis-141.1171.233.6172.90000112.7
456V30Very low35.5Very low127 Ų127126.5 Ų126.577%0.7780%0.799SS**  trans-99.7149.2-168.3175.80000114.4
457S29.9Very low35.9Very low120 Ų120130 Ų13084%0.83980%0.795SS**  trans-176.7152.6140.8-80.10000113.2
458E31Very low36.6Very low184 Ų184127.7 Ų127.786%0.8680%0.795SS**  trans-117.8-145.1179.9-64-167.392.300114
459P62Low37.2Very low105 Ų105126.9 Ų126.968%0.68279%0.791SS**  -123.8-148-117.745.1-22.9000111.6
460P53.6Low37Very low113 Ų113130.3 Ų130.373%0.73480%0.798SS**  cis-117.1-158.936.5216000111.4
461V32.4Very low37.6Very low136 Ų136133.8 Ų133.882%0.82480%0.797SS**  cis-149165.213.2-153.30000110.1
462G29.6Very low38.4Very low70 Ų70138 Ų13872%0.72280%0.795SS**  trans-85.3-177.3163.200000113.4
463A29.6Very low39Very low96 Ų96142.1 Ų142.179%0.79379%0.794SS**  cis-149.2-160.94.400000108.5
464S31.6Very low38.6Very low117 Ų117144.3 Ų144.382%0.81879%0.794SS**  cis-155.3-176.724-67.10000111.9
465Q38.3Very low38.9Very low184 Ų184147.4 Ų147.486%0.8680%0.796SS**  trans-91144.2178.4-57.5162.8-5.200112.7
466Q38.9Very low39.1Very low168 Ų168149 Ų14979%0.78579%0.794SS**  -177.9123.8114.2-104.8-173.8-52.300115.1
467Q38.7Very low39.3Very low149 Ų149148.5 Ų148.570%0.69679%0.793SS**  39103.2126.6-169.1174.41.800119.3
468Q44.2Very low39.4Very low201 Ų201146.5 Ų146.594%0.93978%0.784SS**  trans-115.3121.8159.3-16617271.800110.1
469Q46.8Very low39.5Very low150 Ų150141.8 Ų141.870%0.70177%0.765SS**  trans-128.2104.7-174.7-176.3-17850.600110.3
470Q46.9Very low38.3Very low189 Ų189141.1 Ų141.188%0.88376%0.755SS**  trans-136.6111.4164-78.5-168.10.200109.9
471Q43.7Very low37.5Very low170 Ų170139 Ų13979%0.79474%0.743SS**  trans-81115.3171.7-69.6179.1-10.500109.3Q473Q471-Q473 PolarHBondContact O-N 3.19Å
472Q43.7Very low37.6Very low169 Ų169139.7 Ų139.779%0.7974%0.737SS**  trans-74.1109.6160.5-77.5-167.22.700109.2Q474Q472-Q474 VanDerWaalsContact C-N 3.26Å; Q472-Q474 PolarHBondContact O-N 3.03Å
473Q38.6Very low37.6Very low162 Ų162142.2 Ų142.276%0.75773%0.725SS**  trans-76.974.3-178.6-166.4174.887.800110.9Q471 Q475Q471-Q473 PolarHBondContact O-N 3.19Å; Q473-Q475 PolarHBondContact O-N 3.22Å
474Q39.7Very low38.2Very low165 Ų165143.6 Ų143.677%0.77171%0.71SS**  trans-63.7108173.8-69.5-170.7800110Q472 Q476Q472-Q474 VanDerWaalsContact C-N 3.26Å; Q472-Q474 PolarHBondContact O-N 3.03Å; Q474-Q476 PolarHBondContact O-N 3.5Å
475Q37.8Very low38.6Very low176 Ų176143.1 Ų143.182%0.82270%0.703SS**  trans-6899.2177.8-64.9178.69.800109.6Q473Q473-Q475 PolarHBondContact O-N 3.22Å
476Q33.6Very low38.5Very low178 Ų178138 Ų13883%0.83269%0.686SS**  trans-58.9131.2173.2-63.9-172.311.800109.6Q474 A478Q474-Q476 PolarHBondContact O-N 3.5Å; Q476-A478 PolarHBondContact O-N 3.2Å
477P34.1Very low38.2Very low116 Ų116137.9 Ų137.975%0.75369%0.685SS**  trans-62.9114.9168.526.4-32000108.1
478A32.4Very low37.8Very low78 Ų78136.5 Ų136.565%0.64569%0.692SS**  trans-45.5144.9-168.800000113.6Q476 L480Q476-A478 PolarHBondContact O-N 3.2Å; A478-L480 WeakPolarHBondContact O-CD2 3.13Å; A478-L480 WeakPolarHBondContact O-CG 3.02Å; A478-L480 PolarHBondContact O-N 3.47Å
479N33.8Very low37.1Very low85 Ų85133.1 Ų133.146%0.45569%0.691SS.*  trans-47.1102.1-168-171.13.6000113.9S481 W483N479-S481 VanDerWaalsContact C-N 3.32Å; N479-S481 WeakPolarHBondContact OD1-CB 3.27Å; N479-S481 PolarHBondContact OD1-N 3.39Å; N479-S481 PolarHBondContact OD1-OG 3.43Å; N479-W483 PolarHBondContact O-NE1 3.42Å
480L36.2Very low36.2Very low92 Ų92129.5 Ų129.548%0.48269%0.694SS.*  trans-92.714.3176.1-45.5-174.1000112.9A478 W483A478-L480 WeakPolarHBondContact O-CD2 3.13Å; A478-L480 WeakPolarHBondContact O-CG 3.02Å; A478-L480 PolarHBondContact O-N 3.47Å; L480-W483 VanDerWaalsContact CA-CZ2 3.47Å; L480-W483 HydrophobicContact CB-CH2 3.68Å; L480-W483 HydrophobicContact CB-CZ2 3.74Å; L480-W483 HydrophobicContact CB-CZ3 4.36Å; L480-W483 HydrophobicContact CD1-CH2 4.46Å; L480-W483 HydrophobicContact CD2-CH2 3.6Å; L480-W483 HydrophobicContact CD2-CZ2 3.44Å; L480-W483 VanDerWaalsContact CD2-CZ2 3.44Å; L480-W483 HydrophobicContact CG-CH2 4.08Å; L480-W483 HydrophobicContact CG-CZ2 4.14Å
481S37.4Very low35.3Very low69 Ų69125 Ų12548%0.48369%0.688SS.*  trans-90.9-27.9-167.9-41.60000113.8K400 N479 W483K400-S481 PolarHBondContact NZ-OG 3.46Å; N479-S481 VanDerWaalsContact C-N 3.32Å; N479-S481 WeakPolarHBondContact OD1-CB 3.27Å; N479-S481 PolarHBondContact OD1-N 3.39Å; N479-S481 PolarHBondContact OD1-OG 3.43Å; S481-W483 VanDerWaalsContact C-N 3.31Å; S481-W483 PolarHBondContact O-N 3.42Å
482E35Very low34.8Very low149 Ų149123.1 Ų123.170%0.69669%0.694SS**THydrogen-bonded Turntrans-80.5-4.7-164.8-65.9172.6146.100114.9
483W28.7Very low33.9Very low124 Ų124118.5 Ų118.547%0.4769%0.692SS.*THydrogen-bonded Turntrans-126.727-166.527.8-91.5000115N479 L480 S481N479-W483 PolarHBondContact O-NE1 3.42Å; L480-W483 VanDerWaalsContact CA-CZ2 3.47Å; L480-W483 HydrophobicContact CB-CH2 3.68Å; L480-W483 HydrophobicContact CB-CZ2 3.74Å; L480-W483 HydrophobicContact CB-CZ3 4.36Å; L480-W483 HydrophobicContact CD1-CH2 4.46Å; L480-W483 HydrophobicContact CD2-CH2 3.6Å; L480-W483 HydrophobicContact CD2-CZ2 3.44Å; L480-W483 VanDerWaalsContact CD2-CZ2 3.44Å; L480-W483 HydrophobicContact CG-CH2 4.08Å; L480-W483 HydrophobicContact CG-CZ2 4.14Å; S481-W483 VanDerWaalsContact C-N 3.31Å; S481-W483 PolarHBondContact O-N 3.42Å
484Y41.9Very low33.7Very low124 Ų124114.7 Ų114.749%0.48670%0.696SS.*  trans-134.152.1165.6-67.3-54.8000113.8R415R415-Y484 VanDerWaalsContact CZ-OH 3.25Å; R415-Y484 PolarHBondContact NE-OH 3.42Å; R415-Y484 PolarHBondContact NH2-OH 3.22Å
485V41Very low33.2Very low108 Ų108116.1 Ų116.166%0.65570%0.702SS**  trans-75.5125.2155.5-179.20000108H487V485-H487 PolarHBondContact O-N 3.04Å; V485-H487 VanDerWaalsContact O-N 3.09Å
486C34.9Very low32.8Very low75 Ų75114 Ų11451%0.50770%0.701SS.*  trans-77.391.2171.3-79.30000108.7C422 S488C422-C486 HydrophobicContact CB-CB 4.14Å; C422-C486 WeakPolarHBondContact CB-SG 3Å; C422-C486 WeakPolarHBondContact SG-CB 3.43Å; C422-C486 CovalentContact SG-SG 2.06Å; C422-C486 PolarHBondContact SG-SG 3.05Å; C486-S488 PolarHBondContact O-N 2.98Å; C486-S488 VanDerWaalsContact O-N 3.14Å
487H33.3Very low32.9Very low167 Ų167110.9 Ų110.977%0.77370%0.697SS**  trans-65.1108.7175.4-79.6-108.1000110.7V485 S489V485-H487 PolarHBondContact O-N 3.04Å; V485-H487 VanDerWaalsContact O-N 3.09Å; H487-S489 PolarHBondContact O-N 3.05Å
488S29.6Very low32.9Very low119 Ų119111.6 Ų111.683%0.83270%0.701SS**  trans-82.2105.1174.1-60.30000110.5C486 G490C486-S488 PolarHBondContact O-N 2.98Å; C486-S488 VanDerWaalsContact O-N 3.14Å; S488-G490 PolarHBondContact O-N 2.88Å
489S31Very low32.7Very low131 Ų131113.4 Ų113.492%0.91671%0.71SS**  trans-73.292.9172.6-58.50000111H487H487-S489 PolarHBondContact O-N 3.05Å
490G26.9Very low32.5Very low74 Ų74113.2 Ų113.276%0.76373%0.727SS**  trans-113.9145.4164.900000109.9S488S488-G490 PolarHBondContact O-N 2.88Å
491A28.1Very low32.3Very low94 Ų94117.2 Ų117.278%0.77774%0.743SS**  trans-109.9158.7-167.200000114.2
492S32.4Very low31.9Very low131 Ų131119.7 Ų119.792%0.91676%0.761SS**  trans71.4153.9170.176.40000117.8
493G26.2Very low31.8Very low72 Ų72118.8 Ų118.874%0.74277%0.766SS**  trans122.763.6-178.200000113.3
494G33.2Very low32.4Very low81 Ų81118.6 Ų118.684%0.83578%0.78SS**  trans-75.6138.6177.300000112.1
495Q29.4Very low31.8Very low195 Ų195119.9 Ų119.991%0.91180%0.795SS**  trans-135.2134.9171-70.2-171.465.700110.3
496T29.5Very low32.3Very low131 Ų131119.2 Ų119.280%0.80479%0.793SS**PPolyproline II helixtrans-82.9143.5176.544.90000111.3
497P35Very low32Very low113 Ų113120.9 Ų120.973%0.73481%0.806SS**PPolyproline II helixtrans-68.7147.916631.4-34.2000110.5
498P34.2Very low31.9Very low131 Ų131122.1 Ų122.185%0.85181%0.812SS**PPolyproline II helixtrans-76.4143.8-179.631.1-34.9000112.3
499S29.5Very low32Very low117 Ų117124.6 Ų124.682%0.81881%0.81SS**PPolyproline II helixtrans-86.6137.7173.3-50.20000111.5
500G29.1Very low32.5Very low80 Ų80123.4 Ų123.483%0.82580%0.8SS**  trans-132.4114.616800000110
501H32.2Very low32.6Very low176 Ų176123.2 Ų123.282%0.81579%0.791SS**  trans-84.7140.6178.7-89.5-116.5000111.9
502S28Very low32.6Very low122 Ų122129.4 Ų129.485%0.85380%0.796SS**  trans-167.6132.6132.9-79.50000111.3
503T34Very low32.5Very low130 Ų130134.3 Ų134.380%0.79879%0.794SS**  trans-123.9152.1169360000106.5
504P41.1Very low32.8Very low119 Ų119136.9 Ų136.977%0.77379%0.791SS**  -151.4142.667.538.3-17.4000119
505D29.1Very low33Very low151 Ų151138.7 Ų138.781%0.80779%0.788SS**  56.4179.5126.9-132.529.6000119.7
506P51.8Low33.3Very low94 Ų94137.1 Ų137.161%0.6178%0.781SS**  -125172.5-10540-24.1000114.7
507S28.8Very low34Very low111 Ų111135.8 Ų135.878%0.77677%0.774SS**  trans169.1166.5131.3-74.60000113.2
508E30.3Very low33.9Very low192 Ų192142 Ų14290%0.89778%0.783SS**  trans72.8112.7160.7-48.1-154.4107.900120.5
509E31.8Very low34.2Very low171 Ų171143.3 Ų143.380%0.79978%0.783SS**  trans-73.6174.8150.1-119.3-140.5110.700109.8
510P42.4Very low34.5Very low107 Ų107141.8 Ų141.870%0.69578%0.778SS**  cis-147.1-175.627.243.5-22.9000118.6
511A29.1Very low35Very low69 Ų69151.3 Ų151.357%0.5780%0.797SS**  trans83.5122.213800000123.3
512Y27.5Very low35.1Very low224 Ų224150.1 Ų150.188%0.87880%0.796SS**  trans44.5113.4138.7-77-95000121.2
513R29.7Very low35.5Very low235 Ų235151.5 Ų151.589%0.88779%0.793SS**  -171.2146.389.6-123.8176.6177.5159.9-0.4114.5
514N32.5Very low35.6Very low125 Ų125152.7 Ų152.767%0.66879%0.792SS**  trans-87.4145.7159.3-174.15.1000108.7Q516N514-Q516 PolarHBondContact OD1-N 3.25Å
515P37.8Very low35.3Very low119 Ų119154.7 Ų154.777%0.77379%0.793SS**  -140.3148116.136.8-24.3000115.8
516Q35.9Very low35.6Very low163 Ų163154.9 Ų154.976%0.76279%0.793SS**  trans-77.5173.3168.7-93.8-81.3-64.700111.6N514N514-Q516 PolarHBondContact OD1-N 3.25Å
517P43.7Very low34.6Very low103 Ų103159 Ų15967%0.66981%0.805SS**  trans-84.5-178.4-148.935.6-39.8000115.5
518R34.3Very low35Very low243 Ų243162.4 Ų162.492%0.91781%0.807SS**  trans-131.6137.1165.5-82.9-172.6160.1-155-6.7111.6
519D39.3Very low35.3Very low158 Ų158160.2 Ų160.285%0.84580%0.8SS**  trans-79.3-176.6166.3-57.6-83.6000112.6
520A36.3Very low35.6Very low86 Ų86159.3 Ų159.371%0.71180%0.8SS**  trans76.4137.9-17900000114.8
521F39.2Very low35Very low279 Ų279164 Ų164100%1.22481%0.809SS**  cis-125.5012.3-104.2-86.8000113.1

Retrieved 521 of 521 residues in 238.4 ms (Link to these results)