A0A077ZCX3_TRITR Loading...

LIM bind domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZCX3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 510 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M31.4Very low35.4Very low222 Ų222139 Ų139100%1.09476%0.762SS**  073.50-81.4-62176.600105
2D28.1Very low35.1Very low163 Ų163134 Ų13487%0.87277%0.766SS**  trans-91.5124.4-164.1-60-99.2000106.5
3T40.9Very low35.2Very low125 Ų125141.8 Ų141.877%0.76778%0.775SS**  trans-137.4114.9179-35.50000107.9C5T3-C5 PolarHBondContact O-N 2.89Å; T3-C5 VanDerWaalsContact O-N 3.17Å
4D34.7Very low35.1Very low154 Ų154141.7 Ų141.782%0.82479%0.785SS**  trans-51.4115.7177.8-97.4-63.4000112.1T6D4-T6 VanDerWaalsContact C-N 3.34Å; D4-T6 PolarHBondContact O-N 3.1Å
5C33.1Very low35.2Very low115 Ų115136.3 Ų136.378%0.77778%0.775SS**  trans-95.656.8173.2-83.90000111.3T3 V7T3-C5 PolarHBondContact O-N 2.89Å; T3-C5 VanDerWaalsContact O-N 3.17Å; C5-V7 PolarHBondContact O-N 3.45Å
6T33.5Very low34.9Very low123 Ų123135.6 Ų135.676%0.75578%0.777SS**  trans-76.776.3169.2-60.60000109.9D4 A8D4-T6 VanDerWaalsContact C-N 3.34Å; D4-T6 PolarHBondContact O-N 3.1Å; T6-A8 PolarHBondContact O-N 3.3Å
7V39.2Very low34.6Very low89 Ų89138.4 Ų138.454%0.53978%0.778SS.*  trans-89.193.5174.1-171.90000109.5C5 W9C5-V7 PolarHBondContact O-N 3.45Å; V7-W9 HydrophobicContact CG1-CG 4.48Å; V7-W9 PolarHBondContact O-N 3.06Å; V7-W9 VanDerWaalsContact O-N 3.08Å
8A34.1Very low34.5Very low89 Ų89138.6 Ų138.674%0.73677%0.774SS**  trans-66.7104.9174.100000111.1T6T6-A8 PolarHBondContact O-N 3.3Å
9W38.7Very low34.1Very low94 Ų94141.6 Ų141.636%0.35678%0.781SS.*  trans-96.686172.8-78.297.2000111.2V7 L199 L333V7-W9 HydrophobicContact CG1-CG 4.48Å; V7-W9 PolarHBondContact O-N 3.06Å; V7-W9 VanDerWaalsContact O-N 3.08Å; W9-L199 HydrophobicContact CH2-CD2 3.82Å; W9-L199 HydrophobicContact CZ2-CD2 4.44Å; W9-L333 HydrophobicContact CZ2-CD1 4.36Å
10Q36.4Very low34Very low186 Ų186142.1 Ų142.187%0.86978%0.782SS**  trans-75.5127.1158.6-77.9-176.6-7.100109.3G12Q10-G12 PolarHBondContact O-N 2.78Å
11Q39.1Very low34Very low169 Ų169140.6 Ų140.679%0.7978%0.779SS**  trans-74.9117.8169-75.3174.2-21.700108.3R13Q11-R13 PolarHBondContact O-N 3.49Å
12G32.3Very low34Very low79 Ų79136.8 Ų136.881%0.81477%0.768SS**  trans-65.6115.117900000111.9Q10Q10-G12 PolarHBondContact O-N 2.78Å
13R35.8Very low34.4Very low235 Ų235134.2 Ų134.289%0.88776%0.763SS**  trans-106.3129.7152.8-79.5-172.5171.4-133.60.8107.8Q11 G15Q11-R13 PolarHBondContact O-N 3.49Å; R13-G15 PolarHBondContact O-N 3.13Å
14P33.7Very low34Very low141 Ų141132.5 Ų132.592%0.91676%0.762SS**  trans-74.4110.5170.830.1-31000108.9
15G36.3Very low34.3Very low61 Ų61131.2 Ų131.263%0.62976%0.761SS**  trans-145.9128174.500000108.8R13R13-G15 PolarHBondContact O-N 3.13Å
16P30.7Very low34.4Very low125 Ų125134.9 Ų134.981%0.81277%0.767SS**  trans-87.4118.5-169.232.1-31.6000110.9
17F30Very low34.3Very low182 Ų182133.8 Ų133.880%0.79877%0.77SS**  trans-165.6144.7146.6-126.1-140.4000118
18M33Very low34.1Very low143 Ų143135.4 Ų135.470%0.70479%0.786SS**  trans44.6100.8156-67.1-161.7-53.400121.3
19Q27.5Very low34.2Very low195 Ų195137.4 Ų137.491%0.91179%0.789SS**  trans-43.2129.6148.2-170.6166.65.900113.1
20L31.1Very low34.2Very low151 Ų151140.6 Ų140.679%0.79181%0.812SS**  trans-121148.3168.4-75174.7000110
21P33.4Very low34.3Very low112 Ų112137.2 Ų137.273%0.72781%0.807SS**  trans-81.1140-164.731.4-35.5000113.5S23P21-S23 PolarHBondContact O-N 2.92Å
22V32.5Very low34.3Very low141 Ų141132.9 Ų132.986%0.85581%0.807SS**  trans-76119.3167.5175.90000109.3
23S36Very low34.6Very low110 Ų110134.5 Ų134.577%0.76981%0.806SS**  trans-114.9113.8167.1-69.50000109.2P21P21-S23 PolarHBondContact O-N 2.92Å
24A32.5Very low34.7Very low89 Ų89126.7 Ų126.774%0.73680%0.798SS**PPolyproline II helixtrans-88.6138.317500000111.2
25P41.7Very low35Very low126 Ų126129.5 Ų129.582%0.81879%0.792SS**PPolyproline II helixtrans-84.1133.7160.8-725.5000110.4
26Q35.1Very low35.2Very low193 Ų193134.1 Ų134.190%0.90280%0.802SS**PPolyproline II helixtrans-69.3152.5175.2-67.6173.6-61.200112.1
27A31Very low35.6Very low99 Ų99131.4 Ų131.482%0.81880%0.797SS**PPolyproline II helixtrans-69.1141166.600000111.4
28S36.2Very low36.4Very low124 Ų124128.8 Ų128.887%0.86780%0.798SS**  trans-119.8122.1158.463.80000109.6
29V36.4Very low37.4Very low131 Ų131127.5 Ų127.579%0.79480%0.801SS**  trans-98.9137173.1175.90000107.8
30N37Very low38.6Very low160 Ų160123.7 Ų123.786%0.85679%0.793SS**  trans-147.9127.6156.9-144.3-1.5000110.2
31P39Very low39.2Very low116 Ų116123.8 Ų123.875%0.75379%0.794SS**  trans-108.1163.6-168.740-34.5000115
32G39.3Very low39.7Very low77 Ų77123.5 Ų123.579%0.79479%0.79SS**  trans166.6152.6166.100000109.9
33S38Very low40.1Very low114 Ų114124.8 Ų124.880%0.79779%0.789SS**  cis-165.1138.6-7.2167.60000106.9
34G38.4Very low40.5Very low70 Ų70125 Ų12572%0.72279%0.786SS**  trans173.275.8-17800000117.5
35Y39.6Very low40.8Very low201 Ų201128.6 Ų128.679%0.78879%0.787SS**  trans10.8141.1142.9-61.8-85.5000119.3
36N40.3Very low40.7Very low157 Ų157127.6 Ų127.684%0.8478%0.783SS**  cis-170.7154.232.1-123.9-27.3000112.3
37G38.9Very low40.9Very low68 Ų68122.1 Ų122.170%0.70177%0.771SS**  trans118.5142.2155.800000117.7
38P47.3Very low41.5Very low127 Ų127123.7 Ų123.783%0.82577%0.77SS**  trans-126.5161.7-147.340-24.4000118.5
39P55Low41.8Very low117 Ų117123.6 Ų123.676%0.7677%0.767SS**  trans-99.6171.5164.342.3-35.4000111.5
40P51.3Low42Very low114 Ų114123.5 Ų123.574%0.7477%0.772SS**  -161.7162.686.841.8-21.4000118.8
41N44.1Very low42.1Very low154 Ų154119.2 Ų119.282%0.82477%0.766SS**  trans170149.1136.7-103.1-10.5000109.1
42V44.3Very low42.2Very low106 Ų106121.8 Ų121.864%0.64277%0.767SS**  cis167156.6-21.8136.90000104.7
43M41.7Very low42.3Very low167 Ų167124.9 Ų124.982%0.82377%0.765SS**  trans80.2114.6172.5-82.3164.4-17200117.1
44V43.7Very low42.5Very low116 Ų116126.6 Ų126.670%0.70376%0.764SS**  101.5135.963.2145.20000108.9
45Q39.4Very low42.6Very low163 Ų163127.9 Ų127.976%0.76277%0.767SS**  cis-158.9159.218.8-136.6157.53300111.8
46S38.4Very low42.3Very low105 Ų105121.5 Ų121.573%0.73476%0.762SS**  trans31.2150.8141.367.70000123.1
47A40.1Very low42.7Very low78 Ų78120.5 Ų120.565%0.64577%0.765SS**  cis-162.2145.123.500000115.9
48T42.2Very low42.7Very low132 Ų132120 Ų12081%0.8176%0.76SS**  trans53133.6137.355.30000125.3
49P43.4Very low42.5Very low123 Ų123122.6 Ų122.680%0.79976%0.76SS**  trans-113.1-179.6169.843.1-34.1000115.1
50S40.6Very low42Very low128 Ų128122.7 Ų122.790%0.89576%0.759SS**  trans-164.4131.3158.5-76.30000108.8
51G39.2Very low41.7Very low70 Ų70123.2 Ų123.272%0.72276%0.762SS**  95.5134.982.700000109.6
52H42.1Very low42Very low171 Ų171121.7 Ų121.779%0.79276%0.761SS**  cis-152.1149.112.9-93.5-61.1000109.5
53L39.8Very low41.9Very low141 Ų141124.6 Ų124.674%0.73877%0.767SS**  51.2139.9105.3-49.4179.8000116
54I43Very low41.9Very low151 Ų151124.5 Ų124.577%0.77477%0.769SS**  cis-164148.734.1-129.1146000113.3
55A40.3Very low41.8Very low96 Ų96122.6 Ų122.679%0.79377%0.774SS**  trans39.4142.2149.700000126.5
56G34.2Very low41.8Very low67 Ų67123.8 Ų123.869%0.69178%0.779SS**  trans-95.7-137.6149.300000110.9
57P47.3Very low42.2Very low136 Ų136124.8 Ų124.888%0.88378%0.783SS**  cis-140.2-173.9-10.943.4-25.7000115.1
58G38.6Very low42.2Very low58 Ų58124.5 Ų124.560%0.59879%0.788SS**  trans114.1143.3135.200000122.2
59H43.7Very low42.8Very low182 Ų182123.8 Ų123.884%0.84379%0.785SS**  trans70.6150.5154-57.7-81000120.5
60T45Very low42.5Very low119 Ų119123.5 Ų123.573%0.7379%0.786SS**  cis-170.1153.3-30.124.40000107.9
61P44.9Very low42.8Very low125 Ų125122.7 Ų122.781%0.81278%0.778SS**  trans-107.6151.8-17838.8-33000116.7
62P50.4Low42.7Very low122 Ų122124.7 Ų124.779%0.79278%0.78SS**  trans-142.5178.4150.433.1-14.5000113.6
63Q42.3Very low42.6Very low166 Ų166122.9 Ų122.978%0.77678%0.78SS**  cis-170.6136.7-40.6-170.6-164.295.500109.5
64L40.4Very low42.8Very low165 Ų165122.2 Ų122.286%0.86478%0.784SS**  trans53.1138.6159.7-85.9162.3000122.6
65G43.4Very low42.6Very low77 Ų77120 Ų12079%0.79479%0.789SS**  trans173.396.6165.100000116.3
66Q39Very low42.5Very low188 Ų188118.9 Ų118.988%0.87979%0.786SS**  trans-106.7-178.6157-72.5-167.31.500108.3
67P46.8Very low42.9Very low125 Ų125124.6 Ų124.681%0.81280%0.798SS**  cis-135.7-170.80.542.2-23.9000114.9
68G40.5Very low42.6Very low73 Ų73125.9 Ų125.975%0.75379%0.791SS**  trans145.3135.7155.100000117
69P53.4Low42.4Very low116 Ų116129.5 Ų129.575%0.75380%0.796SS**  trans-125.2151.6-165.140.7-26.9000118.6
70S38.6Very low42.4Very low117 Ų117126.4 Ų126.482%0.81879%0.792SS**  trans62.8173.6149.9-540000118.4
71P46.3Very low42.3Very low111 Ų111125.9 Ų125.972%0.72179%0.791SS**  cis-136.1-176.7-3.644.5-27.8000116.8
72C37.7Very low42Very low112 Ų112127.3 Ų127.376%0.75779%0.787SS**  trans74.5112.3148.4-69.60000124.7
73V38.5Very low41.5Very low133 Ų133129.3 Ų129.381%0.80679%0.785SS**  5.1163.7125.6-93.90000121.5
74P45.6Very low41.1Very low127 Ų127125.4 Ų125.483%0.82579%0.79SS**  cis-138.6-169.213.433.6-9.1000117.4
75A37.9Very low41Very low106 Ų106121.7 Ų121.788%0.87679%0.791SS**  trans-79.2161.8-176.800000116.6
76G39Very low40.5Very low71 Ų71123.4 Ų123.473%0.73279%0.791SS**  trans178.692.6169.400000117.9
77M41.1Very low40.4Very low188 Ų188122.7 Ų122.793%0.92679%0.792SS**  trans56.1139.9143.5-55.7-161.2176.800124.8
78H40.7Very low39.8Very low162 Ų162120.5 Ų120.575%0.7579%0.785SS**  trans97114.6137.4-128.775.7000122.5
79L35.4Very low39.6Very low135 Ų135126.1 Ų126.171%0.70779%0.789SS**  trans-2.7158.9134.2-60.7167.5000118.6
80P42.8Very low38.6Very low117 Ų117128 Ų12876%0.7679%0.792SS**  cis-145-175.634.736.9-13.2000116.9
81P44Very low38.4Very low108 Ų108127.2 Ų127.270%0.70179%0.786SS**  trans-99.617117738.9-34.1000113.8
82E39.1Very low37.8Very low155 Ų155130.5 Ų130.572%0.72479%0.792SS**  trans171.2147.3132.2-91.7-77.45700115
83H40Very low37.5Very low164 Ų164133.4 Ų133.476%0.75979%0.792SS**  trans55.8117.7148.3-80.237.2000124.5
84G32.8Very low37.4Very low84 Ų84131.9 Ų131.987%0.86679%0.793SS**  90.6119110.300000120.7
85G38.1Very low36.7Very low87 Ų87133.5 Ų133.590%0.89779%0.79SS**  trans171.3122.5164.700000114.7
86S33.3Very low36.5Very low113 Ų113140.5 Ų140.579%0.7979%0.793SS**  trans-121.2132.3174.5173.60000109.3
87L37.4Very low36.1Very low172 Ų172143.1 Ų143.190%0.90180%0.795SS**  trans-178.1148136-101159.4000114.7
88A33.6Very low35.7Very low80 Ų80144.7 Ų144.766%0.66180%0.797SS**  trans-68.3170.2-174.100000118.1
89K35.6Very low35.2Very low191 Ų191142.1 Ų142.183%0.8380%0.797SS**  trans102.7124.8141.2-80.4177175.4178.30121.6
90L33.2Very low35.1Very low156 Ų156141.1 Ų141.182%0.81780%0.802SS**  105146.8129.5-112.687.9000122.2
91S34.3Very low34.7Very low100 Ų100140.9 Ų140.970%0.69980%0.803SS**  trans69.2105.8165-149.40000117.3
92Q34.2Very low34.3Very low180 Ų180141.5 Ų141.584%0.84181%0.805SS**  74134.262.6-74.6-161.60.700116.9
93F31.9Very low33.9Very low172 Ų172142 Ų14275%0.75481%0.813SS**  trans93.798.2147.1-137.8-88.3000120.4
94A35.4Very low33.5Very low101 Ų101139.9 Ų139.984%0.83582%0.816SS**  trans-159.597.5142.900000110.4
95Q31.6Very low33.4Very low162 Ų162141.3 Ų141.376%0.75781%0.813SS**  trans-86.2134.7167.9-70.7175.1-24.200109.8
96R32.8Very low33.4Very low253 Ų253143.7 Ų143.796%0.95581%0.81SS**  trans-135.9133.6149.9-79.4-164.8174.3179.4-1110.5
97T30.7Very low33.6Very low125 Ų125147.3 Ų147.377%0.76782%0.816SS**  trans-86.6140.3-171.845.40000112.1
98F32.1Very low33.4Very low222 Ų222150.4 Ų150.497%0.97482%0.816SS**  trans-137.3137146.7-110.2-85.4000109.3
99S30.2Very low33.4Very low107 Ų107155.1 Ų155.175%0.74882%0.824SS**  trans-131.4118.8-167.353.40000111.3
100S34.4Very low33.4Very low115 Ų115154.7 Ų154.780%0.80483%0.83SS**  trans-166.4101.3156.455.30000112.3
101S33.8Very low33.3Very low111 Ų111152.4 Ų152.478%0.77683%0.827SS**  trans42.6144136.6-60.60000124.3
102T35.4Very low33Very low122 Ų122151.7 Ų151.775%0.74882%0.821SS**  trans66.480.2147.849.80000119.7
103N31.8Very low32.8Very low165 Ų165153.6 Ų153.688%0.88282%0.822SS**  177.311098.5-96.9-50000111.7
104S30.4Very low32.8Very low119 Ų119151 Ų15183%0.83282%0.821SS**  trans-102.3107.1175.755.60000111.1
105S32.1Very low32.6Very low114 Ų114154.3 Ų154.380%0.79782%0.817SS**  trans175.752.7144.1-1720000113.7
106V37Very low32.7Very low138 Ų138151.9 Ų151.984%0.83681%0.813SS**SBendtrans-14337.1172.9-135.50000114.3
107M37.5Very low32.8Very low188 Ų188150.9 Ų150.993%0.92681%0.809SS**SBendtrans-155.953.1178.9-147.6177.9-74.800114.9
108R34.4Very low33.1Very low238 Ų238154 Ų15490%0.89881%0.812SS**SBendtrans-134.93.4176.7-96-168.8-179.8-168.30.8117.6
109E32.6Very low33.1Very low178 Ų178147.2 Ų147.283%0.83280%0.804SS**SBendtrans-108.66.8-174-143.2169.6-174.100115.2
110L35Very low33.4Very low182 Ų182151.4 Ų151.495%0.95381%0.809SS**SBendtrans-107.113.9-179.4-75.5166.6000114.7
111S32.2Very low33.8Very low108 Ų108151.6 Ų151.676%0.75581%0.808SS**SBendtrans-108.26.3-177.966.90000116
112C26.9Very low33.8Very low85 Ų85157.8 Ų157.857%0.57481%0.814SS**  trans-132.551.7-174.366.90000115.7
113Y30Very low33.9Very low220 Ų220160 Ų16086%0.86382%0.822SS**  trans-115.742.6160.5-93.7-81.3000113.3F115Y113-F115 VanDerWaalsContact C-N 3.31Å; Y113-F115 PolarHBondContact O-N 3.36Å
114T31.8Very low34.4Very low117 Ų117156.6 Ų156.672%0.71882%0.817SS**  trans-67.193.5151.239.50000108.6V116T114-V116 VanDerWaalsContact C-N 3.27Å; T114-V116 PolarHBondContact O-N 3.18Å
115F31.3Very low34.9Very low172 Ų172158.7 Ų158.775%0.75482%0.817SS**  trans-67.187174.4-172.1-96.7000110.3Y113 R117Y113-F115 VanDerWaalsContact C-N 3.31Å; Y113-F115 PolarHBondContact O-N 3.36Å; F115-R117 PolarHBondContact O-N 3.03Å
116V34.9Very low35Very low111 Ų111162.1 Ų162.167%0.67382%0.817SS**  trans-64.3108.2172.9175.70000108T114 K118T114-V116 VanDerWaalsContact C-N 3.27Å; T114-V116 PolarHBondContact O-N 3.18Å; V116-K118 PolarHBondContact O-N 3.43Å
117R34Very low35Very low231 Ų231165 Ų16587%0.87282%0.818SS**  trans-56.199.7172.3-73.7179.6170.6173.9-1.3110.4F115F115-R117 PolarHBondContact O-N 3.03Å
118K36.7Very low34.9Very low191 Ų191161.1 Ų161.183%0.8381%0.805SS**  trans-83.6138.3155.3-82.9-174.5173.8178.40109.2V116V116-K118 PolarHBondContact O-N 3.43Å
119G33Very low35.2Very low79 Ų79157.6 Ų157.681%0.81480%0.797SS**  trans-67.9133.7-162.400000114.1
120F37.3Very low35.5Very low196 Ų196153.9 Ų153.986%0.8679%0.791SS**  trans-107.5144153.8-105.8-102.4000108.8R122F120-R122 PolarHBondContact O-N 3.18Å
121P42.1Very low36Very low119 Ų119152.6 Ų152.677%0.77377%0.773SS**  trans-62.4137.2-175.524.1-33.5000111.9N123P121-N123 PolarHBondContact O-N 2.91Å; P121-N123 VanDerWaalsContact O-N 3.13Å
122R34.6Very low36.7Very low240 Ų240149.5 Ų149.591%0.90675%0.75SS**SBendtrans-65.3110.5172.4-63.1174.5-177.71730.5108.6F120F120-R122 PolarHBondContact O-N 3.18Å
123N36.7Very low37.4Very low169 Ų169157.9 Ų157.990%0.90477%0.77SS**  trans178.772145.8-89.3-16.2000110.4P121P121-N123 PolarHBondContact O-N 2.91Å; P121-N123 VanDerWaalsContact O-N 3.13Å
124A42.1Very low38.5Very low94 Ų94150.8 Ų150.878%0.77776%0.764SS**  trans-119.2123.8164.800000108.5K126A124-K126 PolarHBondContact O-N 3.41Å
125I39.9Very low39.5Very low163 Ų163146.8 Ų146.884%0.83674%0.738SS**  trans-60.5117.3-174.5-68.3164.2000109.5K127I125-K127 PolarHBondContact O-N 2.87Å
126K35.9Very low40.4Very low186 Ų186140.7 Ų140.781%0.80972%0.715SS**  trans-66.691.6172.9-68.8-178.9178.5179.20109.8A124 T128A124-K126 PolarHBondContact O-N 3.41Å; K126-T128 HydrophobicContact CB-CG2 4.2Å; K126-T128 PolarHBondContact O-N 3.34Å
127K36Very low41Very low197 Ų197141.1 Ų141.186%0.85772%0.72SS**  trans-70.986.2152.1-78.4-173176.3-179.20107.3I125 F129I125-K127 PolarHBondContact O-N 2.87Å; K127-F129 PolarHBondContact O-N 3.45Å
128T34.8Very low41.9Very low107 Ų107135 Ų13566%0.65671%0.713SS**  trans-64.8101.5171.547.30000108.6K126 S130K126-T128 HydrophobicContact CB-CG2 4.2Å; K126-T128 PolarHBondContact O-N 3.34Å; T128-S130 PolarHBondContact O-N 2.79Å; T128-S130 VanDerWaalsContact O-N 3.08Å
129F40.9Very low43.1Very low164 Ų164128.8 Ų128.872%0.71969%0.686SS**  trans-66.3105.4163.1-172.6-96.3000107.2K127 R131K127-F129 PolarHBondContact O-N 3.45Å; F129-R131 PolarHBondContact O-N 2.91Å
130S39.4Very low45.2Very low100 Ų100129.3 Ų129.370%0.69967%0.67SS**  trans-63107.2-178.7-55.30000109.5T128T128-S130 PolarHBondContact O-N 2.79Å; T128-S130 VanDerWaalsContact O-N 3.08Å
131R45.8Very low47.5Very low156 Ų156120.2 Ų120.259%0.58963%0.63SS**  trans-55.3132.3173.4-76.6-173.5169.2-143.1-6.3109.4F129 R133F129-R131 PolarHBondContact O-N 2.91Å; R131-R133 PolarHBondContact O-N 3.49Å
132P46.2Very low49.6Very low42 Ų42116.4 Ų116.427%0.27360%0.604SS.*  trans-56.6131.4170.3-23.533.8000110.3G134P132-G134 PolarHBondContact O-N 2.79Å; P132-G134 VanDerWaalsContact O-N 3.17Å
133R42.7Very low52.2Low262 Ų262110.9 Ų110.999%0.98958%0.584SS**THydrogen-bonded Turntrans-68110.9170.9-81.5-179-91.1-159.6-5.6108R131R131-R133 PolarHBondContact O-N 3.49Å
134G53Low54.9Low71 Ų71103.5 Ų103.573%0.73254%0.544SS*.THydrogen-bonded Turntrans153-26.8-179.500000114.4P132P132-G134 PolarHBondContact O-N 2.79Å; P132-G134 VanDerWaalsContact O-N 3.17Å
135L52Low57.3Low32 Ų3299.1 Ų99.117%0.16851%0.507CS..SBendtrans-88.5126.5176.8-77.5137.7000111.5F226 F266L135-F226 HydrophobicContact CD1-CD1 3.53Å; L135-F226 HydrophobicContact CD1-CE1 3.71Å; L135-F226 HydrophobicContact CD2-CE1 4.33Å; L135-F266 HydrophobicContact CD2-CD1 4.41Å; L135-F266 HydrophobicContact CD2-CD2 4.48Å; L135-F266 HydrophobicContact CD2-CE1 4.21Å; L135-F266 HydrophobicContact CD2-CE2 4.3Å; L135-F266 HydrophobicContact CD2-CZ 4.14Å
136P51Low59.9Low44 Ų4497 Ų9729%0.28649%0.492SS..  trans-49.2135.6174-30.331.8000113.7S138 F139P136-S138 VanDerWaalsContact C-N 3.29Å; P136-S138 PolarHBondContact O-N 3.04Å; P136-F139 HydrophobicContact CB-CD2 4.2Å; P136-F139 HydrophobicContact CB-CE2 3.5Å; P136-F139 HydrophobicContact CB-CZ 3.85Å; P136-F139 HydrophobicContact CG-CE2 3.55Å; P136-F139 HydrophobicContact CG-CZ 3.94Å
137P47.6Very low62.6Low120 Ų12091.2 Ų91.278%0.77947%0.468SS*.THydrogen-bonded Turntrans-84.345.4-163.134.8-38.6000115.3
138S52.9Low65.5Low103 Ų10381.8 Ų81.872%0.7243%0.427SS*.THydrogen-bonded Turntrans-162.616.7169.657.20000116.8P136 N140P136-S138 VanDerWaalsContact C-N 3.29Å; P136-S138 PolarHBondContact O-N 3.04Å; S138-N140 PolarHBondContact O-N 2.76Å
139F62.3Low68.4Low61 Ų6177.7 Ų77.727%0.26840%0.401SS..  trans-67.1128.8171.8-60.5-54.4000111.5P136 F266 F277 P279P136-F139 HydrophobicContact CB-CD2 4.2Å; P136-F139 HydrophobicContact CB-CE2 3.5Å; P136-F139 HydrophobicContact CB-CZ 3.85Å; P136-F139 HydrophobicContact CG-CE2 3.55Å; P136-F139 HydrophobicContact CG-CZ 3.94Å; F139-F266 HydrophobicContact CD2-CD1 4.28Å; F139-F266 AromaticContact CD2-CE1 3.48Å; F139-F266 HydrophobicContact CD2-CE1 3.48Å; F139-F266 VanDerWaalsContact CD2-CE1 3.48Å; F139-F266 HydrophobicContact CD2-CZ 4.32Å; F139-F266 AromaticContact CE2-CD1 3.95Å; F139-F266 HydrophobicContact CE2-CD1 3.95Å; F139-F266 AromaticContact CE2-CE1 3.61Å; F139-F266 HydrophobicContact CE2-CE1 3.61Å; F139-F266 HydrophobicContact CG-CE1 4.04Å; F139-F266 HydrophobicContact CZ-CE1 4.33Å; F139-F277 WeakPolarHBondContact CZ-O 3.1Å; F139-P279 HydrophobicContact CD1-CG 4.41Å
140N77Confident71.1Confident90 Ų9076.5 Ų76.548%0.48139%0.392SS..  trans-123.6108.6169.9175.9-8.9000105.3S138 D142 Y143S138-N140 PolarHBondContact O-N 2.76Å; N140-D142 PolarHBondContact O-N 3.26Å; N140-D142 WeakPolarHBondContact OD1-CB 3.34Å; N140-D142 PolarHBondContact OD1-N 3.04Å; N140-Y143 VanDerWaalsContact O-CB 3.26Å; N140-Y143 WeakPolarHBondContact O-CB 3.38Å; N140-Y143 PolarHBondContact O-N 3.33Å
141L85.4Confident73.8Confident4 Ų474 Ų742%0.02137%0.367CS..Hα-helixtrans-69.3-25.8-172.3-67.4177.1000112.4Y143 K144 I145 E224 V233 L235 F264 F266 P279L141-Y143 PolarHBondContact O-N 2.9Å; L141-K144 PolarHBondContact O-N 3.36Å; L141-I145 PolarHBondContact O-N 3.23Å; L141-E224 WeakPolarHBondContact CB-OE1 3.12Å; L141-E224 HydrophobicContact CD1-CG 4.26Å; L141-E224 PolarHBondContact N-OE1 3.34Å; L141-E224 VanDerWaalsContact N-OE1 3.08Å; L141-V233 HydrophobicContact CD1-CB 3.92Å; L141-V233 HydrophobicContact CD1-CG1 3.46Å; L141-V233 VanDerWaalsContact CD1-CG1 3.46Å; L141-L235 HydrophobicContact CB-CD1 3.69Å; L141-L235 HydrophobicContact CD1-CB 4.33Å; L141-F264 HydrophobicContact CB-CD2 4.42Å; L141-F264 HydrophobicContact CB-CE2 4.11Å; L141-F264 HydrophobicContact CB-CZ 4.46Å; L141-F264 HydrophobicContact CD1-CD2 3.71Å; L141-F264 HydrophobicContact CD1-CE2 4.17Å; L141-F264 HydrophobicContact CD1-CG 4.27Å; L141-F264 HydrophobicContact CD2-CB 4.08Å; L141-F264 HydrophobicContact CD2-CD1 3.99Å; L141-F264 HydrophobicContact CD2-CD2 3.86Å; L141-F264 HydrophobicContact CD2-CE1 4.34Å; L141-F264 HydrophobicContact CD2-CE2 4.22Å; L141-F264 HydrophobicContact CD2-CG 3.71Å; L141-F264 HydrophobicContact CD2-CZ 4.45Å; L141-F264 HydrophobicContact CG-CD2 4.21Å; L141-F264 HydrophobicContact CG-CE2 4.41Å; L141-F266 HydrophobicContact CD2-CZ 4.46Å; L141-P279 HydrophobicContact CD2-CB 3.94Å; L141-P279 HydrophobicContact CD2-CG 4.31Å
142D86.3Confident76.1Confident39 Ų3966.7 Ų66.721%0.20934%0.34CS..Hα-helixtrans-61.5-30.5169.1-71.2-60000112.3N140 K144 I145 F146 T219 T222N140-D142 PolarHBondContact O-N 3.26Å; N140-D142 WeakPolarHBondContact OD1-CB 3.34Å; N140-D142 PolarHBondContact OD1-N 3.04Å; D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.39Å; D142-I145 PolarHBondContact O-N 3.45Å; D142-F146 WeakPolarHBondContact O-CB 3.45Å; D142-F146 PolarHBondContact O-N 3.48Å; D142-T219 WeakPolarHBondContact OD1-CB 3.32Å; D142-T219 PolarHBondContact OD1-OG1 3.06Å; D142-T222 WeakPolarHBondContact OD1-CG2 2.99Å; D142-T222 WeakPolarHBondContact OD2-CB 3.36Å; D142-T222 PolarHBondContact OD2-OG1 3.04Å
143Y89.5Confident78.4Confident125 Ų12570.3 Ų70.349%0.4935%0.353SS..Hα-helixtrans-67-31.5173.9-174.4-95.2000112.1N140 L141 F146 E147N140-Y143 VanDerWaalsContact O-CB 3.26Å; N140-Y143 WeakPolarHBondContact O-CB 3.38Å; N140-Y143 PolarHBondContact O-N 3.33Å; L141-Y143 PolarHBondContact O-N 2.9Å; Y143-F146 HydrophobicContact CD2-CD1 4.07Å; Y143-F146 AromaticContact CE2-CD1 3.91Å; Y143-F146 HydrophobicContact CE2-CD1 3.91Å; Y143-F146 HydrophobicContact CE2-CE1 4.27Å; Y143-F146 PolarHBondContact O-N 2.97Å; Y143-E147 WeakPolarHBondContact O-CB 3.28Å; Y143-E147 PolarHBondContact O-N 3.05Å
144K91.7Very high80.7Confident14 Ų1462.8 Ų62.86%0.06133%0.329CS..Hα-helixtrans-71.2-35.1175.7-167.559.3177.9170.60111.9L141 D142 E147 M148 E172 F173 F264 P279L141-K144 PolarHBondContact O-N 3.36Å; D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.39Å; K144-E147 WeakPolarHBondContact CD-OE2 3.16Å; K144-E147 WeakPolarHBondContact CE-OE2 3.48Å; K144-E147 IonicContact NZ-OE2 2.74Å; K144-E147 PolarHBondContact NZ-OE2 3.41Å; K144-E147 PolarHBondContact O-N 3.48Å; K144-M148 PolarHBondContact O-N 3.38Å; K144-E172 PolarHBondContact NZ-O 3.12Å; K144-E172 VanDerWaalsContact NZ-O 3.15Å; K144-F173 HydrophobicContact CD-CD1 4.17Å; K144-F173 HydrophobicContact CD-CE1 4.12Å; K144-F264 HydrophobicContact CB-CE1 4.08Å; K144-F264 HydrophobicContact CG-CE1 3.82Å; K144-P279 VanDerWaalsContact CE-O 3.27Å; K144-P279 WeakPolarHBondContact CE-O 3.47Å; K144-P279 HydrophobicContact CG-CG 4.48Å
145I93.9Very high82.3Confident2 Ų261.8 Ų61.81%0.0130%0.303CS..Hα-helixtrans-66.9-41.1170-57-60.7000111.1L141 D142 M148 N149 T219 F264 I281 W284L141-I145 PolarHBondContact O-N 3.23Å; D142-I145 PolarHBondContact O-N 3.45Å; I145-M148 WeakPolarHBondContact O-CB 3.45Å; I145-M148 PolarHBondContact O-N 3.18Å; I145-N149 VanDerWaalsContact O-CG 3.3Å; I145-N149 PolarHBondContact O-N 2.89Å; I145-N149 PolarHBondContact O-ND2 2.96Å; I145-T219 HydrophobicContact CG2-CG2 4.3Å; I145-F264 HydrophobicContact CD1-CZ 4.09Å; I145-I281 HydrophobicContact CD1-CD1 4.42Å; I145-W284 HydrophobicContact CD1-CH2 4.39Å; I145-W284 HydrophobicContact CD1-CZ3 3.87Å
146F93.1Very high83.7Confident119 Ų11962.1 Ų62.152%0.52231%0.308SS..Hα-helixtrans-62.5-41.7174.2173.8-96.3000112.7D142 Y143 N149 R150D142-F146 WeakPolarHBondContact O-CB 3.45Å; D142-F146 PolarHBondContact O-N 3.48Å; Y143-F146 HydrophobicContact CD2-CD1 4.07Å; Y143-F146 AromaticContact CE2-CD1 3.91Å; Y143-F146 HydrophobicContact CE2-CD1 3.91Å; Y143-F146 HydrophobicContact CE2-CE1 4.27Å; Y143-F146 PolarHBondContact O-N 2.97Å; F146-N149 PolarHBondContact O-N 3.34Å; F146-R150 PolarHBondContact O-N 3.23Å
147E94.1Very high84.9Confident63 Ų6366 Ų6629%0.29433%0.326SS..Hα-helixtrans-61.6-43.2173.9-173.5178.5-115.600111.3Y143 K144 N149 R150 R151 F173Y143-E147 WeakPolarHBondContact O-CB 3.28Å; Y143-E147 PolarHBondContact O-N 3.05Å; K144-E147 WeakPolarHBondContact CD-OE2 3.16Å; K144-E147 WeakPolarHBondContact CE-OE2 3.48Å; K144-E147 IonicContact NZ-OE2 2.74Å; K144-E147 PolarHBondContact NZ-OE2 3.41Å; K144-E147 PolarHBondContact O-N 3.48Å; E147-N149 PolarHBondContact O-N 3.1Å; E147-R150 WeakPolarHBondContact O-CB 3.5Å; E147-R150 PolarHBondContact O-N 2.98Å; E147-R151 PolarHBondContact O-N 2.93Å; E147-F173 HydrophobicContact CB-CE1 4.14Å; E147-F173 HydrophobicContact CG-CE1 3.98Å; E147-F173 HydrophobicContact CG-CZ 4Å
148M95.8Very high86.7Confident0 Ų063.1 Ų63.10%030%0.304CS..Hα-helixtrans-60-44.6174.7-168.5-170.367.800112.1K144 I145 R150 R151 L152 F169 F173 Y217 W284K144-M148 PolarHBondContact O-N 3.38Å; I145-M148 WeakPolarHBondContact O-CB 3.45Å; I145-M148 PolarHBondContact O-N 3.18Å; M148-R150 PolarHBondContact O-N 3.23Å; M148-R151 PolarHBondContact O-N 2.8Å; M148-L152 WeakPolarHBondContact O-CG 3.49Å; M148-L152 PolarHBondContact O-N 3.34Å; M148-F169 HydrophobicContact CG-CE2 3.77Å; M148-F169 HydrophobicContact CG-CZ 3.73Å; M148-F169 HydrophobicContact SD-CZ 4.21Å; M148-F173 VanDerWaalsContact CA-CE1 3.44Å; M148-F173 HydrophobicContact CB-CD1 3.63Å; M148-F173 HydrophobicContact CB-CE1 3.65Å; M148-F173 HydrophobicContact CB-CG 4.12Å; M148-F173 HydrophobicContact CB-CZ 4.14Å; M148-F173 HydrophobicContact CG-CD1 3.93Å; M148-F173 HydrophobicContact CG-CD2 4.12Å; M148-F173 HydrophobicContact CG-CE1 4.28Å; M148-F173 HydrophobicContact CG-CE2 4.47Å; M148-F173 HydrophobicContact CG-CG 3.88Å; M148-F173 VanDerWaalsContact N-CE1 3.35Å; M148-Y217 HydrophobicContact CE-CD2 3.5Å; M148-Y217 HydrophobicContact CE-CE2 3.82Å; M148-Y217 HydrophobicContact CE-CG 4.44Å; M148-W284 HydrophobicContact CE-CH2 3.65Å; M148-W284 HydrophobicContact CE-CZ3 3.82Å; M148-W284 HydrophobicContact SD-CH2 4.44Å; M148-W284 HydrophobicContact SD-CZ3 4.06Å
149N96.9Very high88Confident20 Ų2062.9 Ų62.911%0.10730%0.301CS..Hα-helixtrans-60-45.4174.8-67.9-25.4000111.7I145 F146 E147 R151 L152 Q153 Y216 Y217I145-N149 VanDerWaalsContact O-CG 3.3Å; I145-N149 PolarHBondContact O-N 2.89Å; I145-N149 PolarHBondContact O-ND2 2.96Å; F146-N149 PolarHBondContact O-N 3.34Å; E147-N149 PolarHBondContact O-N 3.1Å; N149-R151 VanDerWaalsContact C-N 3.28Å; N149-R151 PolarHBondContact O-N 3.08Å; N149-L152 PolarHBondContact O-N 3.22Å; N149-Q153 PolarHBondContact O-N 3.49Å; N149-Q153 VanDerWaalsContact O-N 3.1Å; N149-Y216 WeakPolarHBondContact OD1-CA 3.42Å; N149-Y217 PolarHBondContact ND2-O 2.9Å; N149-Y217 PolarHBondContact OD1-N 3.49Å
150R96.4Very high89Confident140 Ų14067 Ų6753%0.52833%0.325SS..Hα-helixtrans-61.4-37.2176.7-175.1-176.8-179.8-158.8-0.9111.7F146 E147 M148 Q153 Q154F146-R150 PolarHBondContact O-N 3.23Å; E147-R150 WeakPolarHBondContact O-CB 3.5Å; E147-R150 PolarHBondContact O-N 2.98Å; M148-R150 PolarHBondContact O-N 3.23Å; R150-Q153 PolarHBondContact O-N 3.33Å; R150-Q154 WeakPolarHBondContact O-CG 3.38Å; R150-Q154 PolarHBondContact O-N 3.45Å
151R95.6Very high89.4Confident47 Ų4766.8 Ų66.818%0.17732%0.324CS..Hα-helixtrans-68.2-40.8175.8-165.377.2170.674.919.5111.9E147 M148 N149 Q153 Q154 W165 F169 E172 F173E147-R151 PolarHBondContact O-N 2.93Å; M148-R151 PolarHBondContact O-N 2.8Å; N149-R151 VanDerWaalsContact C-N 3.28Å; N149-R151 PolarHBondContact O-N 3.08Å; R151-Q153 VanDerWaalsContact C-N 3.3Å; R151-Q153 PolarHBondContact O-N 2.91Å; R151-Q154 CarbonylContact O-C 3.59Å; R151-Q154 WeakPolarHBondContact O-CA 3.26Å; R151-Q154 WeakPolarHBondContact O-CB 3.46Å; R151-Q154 PolarHBondContact O-N 2.97Å; R151-W165 HydrophobicContact CG-CH2 4.46Å; R151-W165 HydrophobicContact CG-CZ2 4.38Å; R151-W165 VanDerWaalsContact NH1-NE1 3.15Å; R151-W165 VanDerWaalsContact O-CZ2 3.32Å; R151-W165 WeakPolarHBondContact O-CZ2 3.3Å; R151-F169 HydrophobicContact CB-CD2 4.32Å; R151-F169 HydrophobicContact CB-CE2 4.42Å; R151-F169 HydrophobicContact CG-CD2 3.86Å; R151-F169 HydrophobicContact CG-CE2 4.45Å; R151-E172 WeakPolarHBondContact CD-OE2 3.43Å; R151-E172 IonicContact CZ-OE2 2.63Å; R151-E172 IonicContact NE-OE1 2.78Å; R151-E172 IonicContact NE-OE2 3.71Å; R151-E172 PolarHBondContact NE-OE2 2.83Å; R151-E172 IonicContact NH2-OE2 3.96Å; R151-F173 HydrophobicContact CB-CE2 3.81Å; R151-F173 HydrophobicContact CB-CZ 3.99Å; R151-F173 HydrophobicContact CG-CE2 3.88Å; R151-F173 HydrophobicContact CG-CZ 4.43Å
152L96Very high89.6Confident3 Ų367 Ų672%0.01633%0.327CS..Hα-helixtrans-62-34.2175.3-72.6168.3000112.9M148 N149 Q154 R155 W166 F169 F208 L215M148-L152 WeakPolarHBondContact O-CG 3.49Å; M148-L152 PolarHBondContact O-N 3.34Å; N149-L152 PolarHBondContact O-N 3.22Å; L152-Q154 PolarHBondContact O-N 2.86Å; L152-R155 PolarHBondContact O-N 2.81Å; L152-W166 HydrophobicContact CD2-CH2 4.07Å; L152-W166 HydrophobicContact CD2-CZ3 4.01Å; L152-F169 HydrophobicContact CD1-CZ 4.5Å; L152-F169 HydrophobicContact CD2-CE1 4.49Å; L152-F169 HydrophobicContact CD2-CE2 3.81Å; L152-F169 HydrophobicContact CD2-CZ 3.8Å; L152-F169 HydrophobicContact CG-CE2 3.86Å; L152-F169 HydrophobicContact CG-CZ 4.08Å; L152-F208 HydrophobicContact CD2-CE2 4.32Å; L152-F208 HydrophobicContact CD2-CZ 4.41Å; L152-L215 HydrophobicContact CD1-CD2 4.11Å; L152-L215 HydrophobicContact CD1-CG 4.16Å
153Q92.5Very high89.7Confident117 Ų11768.1 Ų68.155%0.54734%0.337SS..THydrogen-bonded Turntrans-68.5-16171.6-70.8176-25.500113.6N149 R150 R151 E214N149-Q153 PolarHBondContact O-N 3.49Å; N149-Q153 VanDerWaalsContact O-N 3.1Å; R150-Q153 PolarHBondContact O-N 3.33Å; R151-Q153 VanDerWaalsContact C-N 3.3Å; R151-Q153 PolarHBondContact O-N 2.91Å; Q153-E214 PolarHBondContact NE2-OE1 3.3Å
154Q91Very high89.9Confident105 Ų10568 Ų6849%0.49135%0.345SS..THydrogen-bonded Turntrans-104.229.9177.9-63.4174.7-7.400111.9R150 R151 L152 W165R150-Q154 WeakPolarHBondContact O-CG 3.38Å; R150-Q154 PolarHBondContact O-N 3.45Å; R151-Q154 CarbonylContact O-C 3.59Å; R151-Q154 WeakPolarHBondContact O-CA 3.26Å; R151-Q154 WeakPolarHBondContact O-CB 3.46Å; R151-Q154 PolarHBondContact O-N 2.97Å; L152-Q154 PolarHBondContact O-N 2.86Å; Q154-W165 VanDerWaalsContact O-CZ2 3.28Å; Q154-W165 WeakPolarHBondContact O-CZ2 3.12Å; Q154-W165 PolarHBondContact O-NE1 2.81Å; Q154-W165 VanDerWaalsContact O-NE1 3.1Å
155R88.1Confident90.1Very high49 Ų4968.9 Ų68.919%0.18535%0.348CS..  trans-57.2136.9174-170.1-173.965.5-109.2-2.5110.4L152 D157 W165 W166 I213L152-R155 PolarHBondContact O-N 2.81Å; R155-D157 IonicContact CZ-OD1 3.75Å; R155-D157 IonicContact NE-OD1 2.86Å; R155-D157 PolarHBondContact NE-OD1 2.94Å; R155-D157 IonicContact NH2-OD1 3.57Å; R155-D157 PolarHBondContact NH2-OD1 2.97Å; R155-D157 IonicContact NH2-OD2 2.76Å; R155-W165 VanDerWaalsContact CA-CZ2 3.4Å; R155-W165 HydrophobicContact CB-CH2 4.37Å; R155-W165 HydrophobicContact CB-CZ2 4.3Å; R155-W166 HydrophobicContact CG-CZ2 4.1Å; R155-I213 PolarHBondContact NH1-O 3.35Å
156S80.6Confident90.1Very high40 Ų4069.2 Ų69.228%0.2835%0.349SS..  trans-79.9124.7164.6-167.60000109.6D158S156-D158 VanDerWaalsContact C-N 3.28Å; S156-D158 WeakPolarHBondContact OG-CB 3.46Å; S156-D158 PolarHBondContact OG-N 3.11Å
157D77Confident90.2Very high125 Ų12566.8 Ų66.867%0.66834%0.341SS*.  trans-86.80.8171.5-68.8-37.5000112.8R155 P159R155-D157 IonicContact CZ-OD1 3.75Å; R155-D157 IonicContact NE-OD1 2.86Å; R155-D157 PolarHBondContact NE-OD1 2.94Å; R155-D157 IonicContact NH2-OD1 3.57Å; R155-D157 PolarHBondContact NH2-OD1 2.97Å; R155-D157 IonicContact NH2-OD2 2.76Å; D157-P159 WeakPolarHBondContact O-CD 3.26Å
158D84Confident90.2Very high59 Ų5966 Ų6632%0.31635%0.345SS..  trans-69.8114.5171.61758.6000110.6S156 D160 N161 A162S156-D158 VanDerWaalsContact C-N 3.28Å; S156-D158 WeakPolarHBondContact OG-CB 3.46Å; S156-D158 PolarHBondContact OG-N 3.11Å; D158-D160 VanDerWaalsContact C-N 3.31Å; D158-D160 PolarHBondContact O-N 3.5Å; D158-D160 PolarHBondContact OD1-N 3.31Å; D158-D160 VanDerWaalsContact OD1-N 3.14Å; D158-N161 PolarHBondContact OD2-ND2 3.24Å; D158-A162 WeakPolarHBondContact O-CB 3.45Å; D158-A162 PolarHBondContact O-N 3.36Å
159P81.3Confident90.2Very high99 Ų9966 Ų6664%0.64335%0.345SS*.THydrogen-bonded Turntrans-66.2-30-174.928.1-35.7000113.4D157 A162D157-P159 WeakPolarHBondContact O-CD 3.26Å; P159-A162 WeakPolarHBondContact O-CB 3.44Å; P159-A162 PolarHBondContact O-N 2.84Å
160D83.2Confident90.2Very high146 Ų14665 Ų6578%0.78134%0.34SS*.THydrogen-bonded Turntrans-72.5-40.2-175.4-67.5-19.3000110.6D158D158-D160 VanDerWaalsContact C-N 3.31Å; D158-D160 PolarHBondContact O-N 3.5Å; D158-D160 PolarHBondContact OD1-N 3.31Å; D158-D160 VanDerWaalsContact OD1-N 3.14Å
161N85.9Confident90.1Very high86 Ų8661 Ų6146%0.4633%0.333SS..THydrogen-bonded Turntrans-89.1-5.8177.4-73.2-58.7000114.1D158 S163 L164 W165D158-N161 PolarHBondContact OD2-ND2 3.24Å; N161-S163 PolarHBondContact O-N 3.32Å; N161-L164 PolarHBondContact O-N 2.97Å; N161-W165 PolarHBondContact O-N 2.9Å
162A88.6Confident89.9Confident10 Ų1061.8 Ų61.88%0.08334%0.339CS..Hα-helixtrans-56.5-43-174.400000113.3D158 P159 W165 W166D158-A162 WeakPolarHBondContact O-CB 3.45Å; D158-A162 PolarHBondContact O-N 3.36Å; P159-A162 WeakPolarHBondContact O-CB 3.44Å; P159-A162 PolarHBondContact O-N 2.84Å; A162-W165 PolarHBondContact O-N 3.38Å; A162-W166 PolarHBondContact O-N 3.19Å
163S89.6Confident89.9Confident61 Ų6161.7 Ų61.743%0.42734%0.338SS..Hα-helixtrans-63-49.1-179-161.20000111.6N161 W165 W166 D167N161-S163 PolarHBondContact O-N 3.32Å; S163-W165 VanDerWaalsContact C-N 3.28Å; S163-W165 PolarHBondContact O-N 2.9Å; S163-W166 PolarHBondContact O-N 3.34Å; S163-W166 VanDerWaalsContact O-N 3.11Å; S163-D167 PolarHBondContact O-N 3.49Å; S163-D167 VanDerWaalsContact O-OD2 3.13Å
164L92.8Very high90.1Very high124 Ų12456.1 Ų56.165%0.64931%0.312SS*.Hα-helixtrans-62.3-37180-176.463000111.7N161 D167 A168N161-L164 PolarHBondContact O-N 2.97Å; L164-D167 PolarHBondContact O-N 2.6Å; L164-A168 VanDerWaalsContact O-CB 3.28Å; L164-A168 WeakPolarHBondContact O-CB 3.48Å; L164-A168 PolarHBondContact O-N 3.33Å
165W95.2Very high90.3Very high32 Ų3251.5 Ų51.512%0.12129%0.291CS..Hα-helixtrans-62.4-44.6174-170.6108.5000111.7R151 Q154 R155 N161 A162 S163 A168 F169R151-W165 HydrophobicContact CG-CH2 4.46Å; R151-W165 HydrophobicContact CG-CZ2 4.38Å; R151-W165 VanDerWaalsContact NH1-NE1 3.15Å; R151-W165 VanDerWaalsContact O-CZ2 3.32Å; R151-W165 WeakPolarHBondContact O-CZ2 3.3Å; Q154-W165 VanDerWaalsContact O-CZ2 3.28Å; Q154-W165 WeakPolarHBondContact O-CZ2 3.12Å; Q154-W165 PolarHBondContact O-NE1 2.81Å; Q154-W165 VanDerWaalsContact O-NE1 3.1Å; R155-W165 VanDerWaalsContact CA-CZ2 3.4Å; R155-W165 HydrophobicContact CB-CH2 4.37Å; R155-W165 HydrophobicContact CB-CZ2 4.3Å; N161-W165 PolarHBondContact O-N 2.9Å; A162-W165 PolarHBondContact O-N 3.38Å; S163-W165 VanDerWaalsContact C-N 3.28Å; S163-W165 PolarHBondContact O-N 2.9Å; W165-A168 PolarHBondContact O-N 2.8Å; W165-F169 HydrophobicContact CE3-CB 4.11Å; W165-F169 HydrophobicContact CH2-CB 4.27Å; W165-F169 HydrophobicContact CH2-CD2 4.09Å; W165-F169 HydrophobicContact CH2-CG 4.35Å; W165-F169 HydrophobicContact CZ3-CB 3.76Å; W165-F169 HydrophobicContact CZ3-CD2 4.19Å; W165-F169 HydrophobicContact CZ3-CG 4Å; W165-F169 WeakPolarHBondContact O-CB 3.43Å; W165-F169 PolarHBondContact O-N 2.83Å
166W95.5Very high90.5Very high9 Ų954.2 Ų54.23%0.03431%0.309CS..Hα-helixtrans-67.3-38.1178.3-76.7116.7000112.9L152 R155 A162 S163 F169 A170 P201 F204 R205 F208L152-W166 HydrophobicContact CD2-CH2 4.07Å; L152-W166 HydrophobicContact CD2-CZ3 4.01Å; R155-W166 HydrophobicContact CG-CZ2 4.1Å; A162-W166 PolarHBondContact O-N 3.19Å; S163-W166 PolarHBondContact O-N 3.34Å; S163-W166 VanDerWaalsContact O-N 3.11Å; W166-F169 HydrophobicContact CE3-CD1 4.04Å; W166-F169 HydrophobicContact CE3-CG 4.44Å; W166-F169 HydrophobicContact CZ3-CD1 4.11Å; W166-F169 HydrophobicContact CZ3-CE1 4.37Å; W166-F169 HydrophobicContact CZ3-CG 4.46Å; W166-A170 WeakPolarHBondContact O-CB 3.34Å; W166-A170 PolarHBondContact O-N 2.92Å; W166-P201 HydrophobicContact CB-CB 3.92Å; W166-F204 HydrophobicContact CE3-CB 3.78Å; W166-F204 HydrophobicContact CH2-CB 3.94Å; W166-F204 HydrophobicContact CZ3-CB 3.32Å; W166-F204 HydrophobicContact CZ3-CG 4.26Å; W166-R205 HydrophobicContact CD2-CB 4.18Å; W166-R205 HydrophobicContact CG-CB 4.24Å; W166-F208 AromaticContact CH2-CD2 3.66Å; W166-F208 HydrophobicContact CH2-CD2 3.66Å; W166-F208 AromaticContact CH2-CE2 3.43Å; W166-F208 HydrophobicContact CH2-CE2 3.43Å; W166-F208 VanDerWaalsContact CH2-CE2 3.43Å; W166-F208 HydrophobicContact CH2-CZ 4.47Å; W166-F208 AromaticContact CZ2-CD2 3.63Å; W166-F208 HydrophobicContact CZ2-CD2 3.63Å; W166-F208 AromaticContact CZ2-CE2 3.91Å; W166-F208 HydrophobicContact CZ2-CE2 3.91Å
167D94.6Very high91.1Very high68 Ų6856.6 Ų56.636%0.36432%0.319SS..Hα-helixtrans-68.2-40175.8-70-44.2000111.6S163 L164 A170 S171 P201S163-D167 PolarHBondContact O-N 3.49Å; S163-D167 VanDerWaalsContact O-OD2 3.13Å; L164-D167 PolarHBondContact O-N 2.6Å; D167-A170 PolarHBondContact O-N 2.68Å; D167-S171 PolarHBondContact O-N 3.08Å; D167-S171 PolarHBondContact O-OG 2.58Å; D167-P201 WeakPolarHBondContact OD1-CG 3.42Å
168A94.7Very high92.1Very high46 Ų4650.7 Ų50.738%0.3829%0.287SS..Hα-helixtrans-64.7-46.2173.300000112.2L164 W165 A170 S171 E172L164-A168 VanDerWaalsContact O-CB 3.28Å; L164-A168 WeakPolarHBondContact O-CB 3.48Å; L164-A168 PolarHBondContact O-N 3.33Å; W165-A168 PolarHBondContact O-N 2.8Å; A168-A170 VanDerWaalsContact C-N 3.32Å; A168-A170 PolarHBondContact O-N 2.91Å; A168-S171 PolarHBondContact O-N 2.57Å; A168-S171 VanDerWaalsContact O-N 3.16Å; A168-E172 WeakPolarHBondContact O-CB 3.44Å; A168-E172 PolarHBondContact O-N 2.83Å
169F95.7Very high92.7Very high0 Ų050.4 Ų50.40%029%0.288CS..Hα-helixtrans-54.2-48.3172.9167.3-93000111.2M148 R151 L152 W165 W166 S171 E172 F173 F174 F204M148-F169 HydrophobicContact CG-CE2 3.77Å; M148-F169 HydrophobicContact CG-CZ 3.73Å; M148-F169 HydrophobicContact SD-CZ 4.21Å; R151-F169 HydrophobicContact CB-CD2 4.32Å; R151-F169 HydrophobicContact CB-CE2 4.42Å; R151-F169 HydrophobicContact CG-CD2 3.86Å; R151-F169 HydrophobicContact CG-CE2 4.45Å; L152-F169 HydrophobicContact CD1-CZ 4.5Å; L152-F169 HydrophobicContact CD2-CE1 4.49Å; L152-F169 HydrophobicContact CD2-CE2 3.81Å; L152-F169 HydrophobicContact CD2-CZ 3.8Å; L152-F169 HydrophobicContact CG-CE2 3.86Å; L152-F169 HydrophobicContact CG-CZ 4.08Å; W165-F169 HydrophobicContact CE3-CB 4.11Å; W165-F169 HydrophobicContact CH2-CB 4.27Å; W165-F169 HydrophobicContact CH2-CD2 4.09Å; W165-F169 HydrophobicContact CH2-CG 4.35Å; W165-F169 HydrophobicContact CZ3-CB 3.76Å; W165-F169 HydrophobicContact CZ3-CD2 4.19Å; W165-F169 HydrophobicContact CZ3-CG 4Å; W165-F169 WeakPolarHBondContact O-CB 3.43Å; W165-F169 PolarHBondContact O-N 2.83Å; W166-F169 HydrophobicContact CE3-CD1 4.04Å; W166-F169 HydrophobicContact CE3-CG 4.44Å; W166-F169 HydrophobicContact CZ3-CD1 4.11Å; W166-F169 HydrophobicContact CZ3-CE1 4.37Å; W166-F169 HydrophobicContact CZ3-CG 4.46Å; F169-S171 VanDerWaalsContact C-N 3.3Å; F169-S171 PolarHBondContact O-N 2.86Å; F169-E172 PolarHBondContact O-N 2.97Å; F169-F173 AromaticContact CD2-CD2 3.8Å; F169-F173 HydrophobicContact CD2-CD2 3.8Å; F169-F173 AromaticContact CD2-CE2 3.96Å; F169-F173 HydrophobicContact CD2-CE2 3.96Å; F169-F173 AromaticContact CE2-CD2 3.7Å; F169-F173 HydrophobicContact CE2-CD2 3.7Å; F169-F173 AromaticContact CE2-CE2 3.98Å; F169-F173 HydrophobicContact CE2-CE2 3.98Å; F169-F173 HydrophobicContact CG-CD2 4.45Å; F169-F173 HydrophobicContact CZ-CD2 4.27Å; F169-F173 WeakPolarHBondContact O-CD2 3.49Å; F169-F173 PolarHBondContact O-N 3.47Å; F169-F174 HydrophobicContact CE1-CE2 4.29Å; F169-F204 HydrophobicContact CD1-CD2 4.49Å; F169-F204 AromaticContact CE1-CD2 3.66Å; F169-F204 HydrophobicContact CE1-CD2 3.66Å; F169-F204 AromaticContact CE1-CE2 3.83Å; F169-F204 HydrophobicContact CE1-CE2 3.83Å; F169-F204 HydrophobicContact CE1-CG 4.07Å; F169-F204 HydrophobicContact CE1-CZ 4.37Å; F169-F204 HydrophobicContact CZ-CD2 4.5Å; F169-F204 HydrophobicContact CZ-CE2 4.43Å
170A96Very high93.5Very high0 Ų045.7 Ų45.70%026%0.257CS..Hα-helixtrans-65.6-32.718000000112.6W166 D167 A168 F174 R197 P201W166-A170 WeakPolarHBondContact O-CB 3.34Å; W166-A170 PolarHBondContact O-N 2.92Å; D167-A170 PolarHBondContact O-N 2.68Å; A168-A170 VanDerWaalsContact C-N 3.32Å; A168-A170 PolarHBondContact O-N 2.91Å; A170-F174 WeakPolarHBondContact O-CA 3.05Å; A170-F174 VanDerWaalsContact O-CB 3.31Å; A170-F174 WeakPolarHBondContact O-CB 3.37Å; A170-F174 PolarHBondContact O-N 3.28Å; A170-R197 VanDerWaalsContact CB-CZ 3.43Å; A170-P201 HydrophobicContact CB-CG 3.71Å
171S93.5Very high94.2Very high54 Ų5438.9 Ų38.938%0.37822%0.221SC..Hα-helixtrans-71.4-28175.5-59.70000113.8D167 A168 F169 R197D167-S171 PolarHBondContact O-N 3.08Å; D167-S171 PolarHBondContact O-OG 2.58Å; A168-S171 PolarHBondContact O-N 2.57Å; A168-S171 VanDerWaalsContact O-N 3.16Å; F169-S171 VanDerWaalsContact C-N 3.3Å; F169-S171 PolarHBondContact O-N 2.86Å; S171-R197 VanDerWaalsContact N-NH2 3.14Å; S171-R197 PolarHBondContact OG-NH2 2.63Å
172E93.3Very high94.8Very high65 Ų6534.9 Ų34.930%0.30420%0.199SC..Hα-helixtrans-77.1-29.9-179.7-171.7-176.2157.600113K144 R151 A168 F169K144-E172 PolarHBondContact NZ-O 3.12Å; K144-E172 VanDerWaalsContact NZ-O 3.15Å; R151-E172 WeakPolarHBondContact CD-OE2 3.43Å; R151-E172 IonicContact CZ-OE2 2.63Å; R151-E172 IonicContact NE-OE1 2.78Å; R151-E172 IonicContact NE-OE2 3.71Å; R151-E172 PolarHBondContact NE-OE2 2.83Å; R151-E172 IonicContact NH2-OE2 3.96Å; A168-E172 WeakPolarHBondContact O-CB 3.44Å; A168-E172 PolarHBondContact O-N 2.83Å; F169-E172 PolarHBondContact O-N 2.97Å
173F95Very high95.2Very high0 Ų035 Ų350%020%0.2CC..Hα-helixtrans-115.9-22.5-175.4-64.9-75.7000115.3K144 E147 M148 R151 F169 I281K144-F173 HydrophobicContact CD-CD1 4.17Å; K144-F173 HydrophobicContact CD-CE1 4.12Å; E147-F173 HydrophobicContact CB-CE1 4.14Å; E147-F173 HydrophobicContact CG-CE1 3.98Å; E147-F173 HydrophobicContact CG-CZ 4Å; M148-F173 VanDerWaalsContact CA-CE1 3.44Å; M148-F173 HydrophobicContact CB-CD1 3.63Å; M148-F173 HydrophobicContact CB-CE1 3.65Å; M148-F173 HydrophobicContact CB-CG 4.12Å; M148-F173 HydrophobicContact CB-CZ 4.14Å; M148-F173 HydrophobicContact CG-CD1 3.93Å; M148-F173 HydrophobicContact CG-CD2 4.12Å; M148-F173 HydrophobicContact CG-CE1 4.28Å; M148-F173 HydrophobicContact CG-CE2 4.47Å; M148-F173 HydrophobicContact CG-CG 3.88Å; M148-F173 VanDerWaalsContact N-CE1 3.35Å; R151-F173 HydrophobicContact CB-CE2 3.81Å; R151-F173 HydrophobicContact CB-CZ 3.99Å; R151-F173 HydrophobicContact CG-CE2 3.88Å; R151-F173 HydrophobicContact CG-CZ 4.43Å; F169-F173 AromaticContact CD2-CD2 3.8Å; F169-F173 HydrophobicContact CD2-CD2 3.8Å; F169-F173 AromaticContact CD2-CE2 3.96Å; F169-F173 HydrophobicContact CD2-CE2 3.96Å; F169-F173 AromaticContact CE2-CD2 3.7Å; F169-F173 HydrophobicContact CE2-CD2 3.7Å; F169-F173 AromaticContact CE2-CE2 3.98Å; F169-F173 HydrophobicContact CE2-CE2 3.98Å; F169-F173 HydrophobicContact CG-CD2 4.45Å; F169-F173 HydrophobicContact CZ-CD2 4.27Å; F169-F173 WeakPolarHBondContact O-CD2 3.49Å; F169-F173 PolarHBondContact O-N 3.47Å; F173-I281 WeakPolarHBondContact O-CB 3.46Å; F173-I281 WeakPolarHBondContact O-CG1 2.97Å; F173-I281 PolarHBondContact O-N 3.38Å
174F96.3Very high95.5Very high0 Ų032.4 Ų32.40%018%0.181CC..EExtended strand (participates in β ladder)trans-119.4145.5-175.7-62.1-96.7000111.9F169 A170 A178 I200 F204 I281 W284F169-F174 HydrophobicContact CE1-CE2 4.29Å; A170-F174 WeakPolarHBondContact O-CA 3.05Å; A170-F174 VanDerWaalsContact O-CB 3.31Å; A170-F174 WeakPolarHBondContact O-CB 3.37Å; A170-F174 PolarHBondContact O-N 3.28Å; F174-A178 HydrophobicContact CB-CB 3.8Å; F174-A178 HydrophobicContact CD1-CB 4.14Å; F174-A178 HydrophobicContact CG-CB 4.47Å; F174-I200 HydrophobicContact CD1-CD1 3.74Å; F174-I200 HydrophobicContact CD1-CG2 4.37Å; F174-I200 HydrophobicContact CD2-CG2 4.02Å; F174-I200 HydrophobicContact CE1-CD1 4.13Å; F174-I200 HydrophobicContact CE1-CG2 4.23Å; F174-I200 HydrophobicContact CE2-CG2 3.88Å; F174-I200 HydrophobicContact CG-CD1 4.16Å; F174-I200 HydrophobicContact CG-CG2 4.28Å; F174-I200 HydrophobicContact CZ-CG2 3.99Å; F174-F204 AromaticContact CE2-CE2 3.82Å; F174-F204 HydrophobicContact CE2-CE2 3.82Å; F174-F204 HydrophobicContact CE2-CZ 4.36Å; F174-F204 AromaticContact CZ-CE2 3.75Å; F174-F204 HydrophobicContact CZ-CE2 3.75Å; F174-F204 HydrophobicContact CZ-CZ 4.04Å; F174-I281 WeakPolarHBondContact CA-O 3.31Å; F174-I281 HydrophobicContact CD1-CB 3.92Å; F174-I281 HydrophobicContact CD1-CG2 4.04Å; F174-I281 HydrophobicContact CE1-CB 4.19Å; F174-I281 HydrophobicContact CE1-CD1 4.48Å; F174-I281 HydrophobicContact CE1-CG2 4.02Å; F174-I281 HydrophobicContact CG-CB 4.49Å; F174-W284 HydrophobicContact CE1-CB 4.15Å; F174-W284 HydrophobicContact CE1-CE3 4.43Å; F174-W284 HydrophobicContact CZ-CE3 4.39Å
175E94.4Very high95.5Very high9 Ų930.1 Ų30.14%0.04217%0.174CC..EExtended strand (participates in β ladder)trans-65.8161.9168.9-77.5-63.7132.900111.9D177 A178 R197 A265 S267 R280 I281 R282E175-D177 WeakPolarHBondContact CB-OD1 3.23Å; E175-D177 PolarHBondContact O-N 3.3Å; E175-A178 HydrophobicContact CB-CB 4.3Å; E175-A178 WeakPolarHBondContact O-CB 3.26Å; E175-A178 PolarHBondContact O-N 3Å; E175-A178 VanDerWaalsContact O-N 3.14Å; E175-R197 VanDerWaalsContact O-CD 3.22Å; E175-R197 WeakPolarHBondContact O-CD 3.41Å; E175-R197 WeakPolarHBondContact O-CG 3.2Å; E175-A265 HydrophobicContact CG-CB 3.75Å; E175-S267 WeakPolarHBondContact OE1-CB 3.49Å; E175-R280 HydrophobicContact CG-CB 4.07Å; E175-R280 WeakPolarHBondContact OE1-CB 3.3Å; E175-R280 IonicContact OE1-CZ 3.78Å; E175-R280 IonicContact OE1-NE 3.57Å; E175-R280 PolarHBondContact OE1-NE 2.93Å; E175-R280 IonicContact OE1-NH2 2.78Å; E175-R280 PolarHBondContact OE1-NH2 2.73Å; E175-R280 IonicContact OE2-CZ 3.62Å; E175-R280 IonicContact OE2-NE 2.96Å; E175-R280 IonicContact OE2-NH2 2.76Å; E175-R280 PolarHBondContact OE2-NH2 3.3Å; E175-I281 PolarHBondContact N-O 2.87Å; E175-R282 HydrophobicContact CB-CB 4.49Å; E175-R282 HydrophobicContact CG-CB 4.26Å
176D93.3Very high95.2Very high105 Ų10529.7 Ų29.756%0.56118%0.175SC*.EExtended strand (participates in β ladder)trans-70.5-22.4178.3-55.6-67.9000112.2R197 R280D176-R197 WeakPolarHBondContact O-CB 3.48Å; D176-R280 IonicContact OD2-CZ 3.34Å; D176-R280 IonicContact OD2-NH1 3.61Å; D176-R280 PolarHBondContact OD2-NH1 3.06Å; D176-R280 IonicContact OD2-NH2 3.27Å; D176-R280 PolarHBondContact OD2-NH2 3.35Å
177D93.8Very high94.8Very high90 Ų9037.2 Ų37.248%0.48121%0.21SC..EExtended strand (participates in β ladder)trans-948.8172.668.6-1.3000113.9E175 R282E175-D177 WeakPolarHBondContact CB-OD1 3.23Å; E175-D177 PolarHBondContact O-N 3.3Å; D177-R282 IonicContact OD1-NE 2.73Å; D177-R282 PolarHBondContact OD1-NE 2.98Å; D177-R282 IonicContact OD1-NH2 3.35Å; D177-R282 IonicContact OD2-CZ 3.77Å; D177-R282 IonicContact OD2-NE 3.06Å; D177-R282 PolarHBondContact OD2-NE 3.32Å; D177-R282 IonicContact OD2-NH2 3.95Å; D177-R282 PolarHBondContact OD2-NH2 3.08Å; D177-R282 VanDerWaalsContact OD2-NH2 3.12Å
178A96.9Very high94.5Very high1 Ų139 Ų391%0.00822%0.22CC..EExtended strand (participates in β ladder)trans-66.7148.3-166.400000115.3F174 E175 G196 R197 I200 I281 R282F174-A178 HydrophobicContact CB-CB 3.8Å; F174-A178 HydrophobicContact CD1-CB 4.14Å; F174-A178 HydrophobicContact CG-CB 4.47Å; E175-A178 HydrophobicContact CB-CB 4.3Å; E175-A178 WeakPolarHBondContact O-CB 3.26Å; E175-A178 PolarHBondContact O-N 3Å; E175-A178 VanDerWaalsContact O-N 3.14Å; A178-G196 CarbonylContact O-C 3.51Å; A178-R197 HydrophobicContact CB-CB 4.47Å; A178-R197 PolarHBondContact O-N 2.95Å; A178-I200 HydrophobicContact CB-CD1 4.14Å; A178-I281 VanDerWaalsContact CB-O 3.28Å; A178-I281 WeakPolarHBondContact CB-O 3.43Å; A178-R282 CarbonylContact C-O 3.55Å; A178-R282 WeakPolarHBondContact CA-O 3.36Å
179T97.1Very high94.4Very high53 Ų5338 Ų3833%0.32521%0.214SC..EExtended strand (participates in β ladder)trans-123.6138.5175.363.70000111.8R282 W284T179-R282 PolarHBondContact N-O 2.9Å; T179-W284 PolarHBondContact O-N 2.97Å
180L98.1Very high94.4Very high1 Ų143.4 Ų43.41%0.00525%0.249CC..EExtended strand (participates in β ladder)trans-118.9118175.4-172.7155.1000109.2L182 T194 I195 I200 Y203 F204 W284L180-L182 HydrophobicContact CD2-CD2 4.27Å; L180-L182 HydrophobicContact CD2-CG 4.04Å; L180-T194 CarbonylContact O-C 3.53Å; L180-T194 WeakPolarHBondContact O-CA 3.39Å; L180-I195 HydrophobicContact CB-CD1 4.44Å; L180-I195 HydrophobicContact CB-CG1 3.87Å; L180-I195 HydrophobicContact CD2-CD1 4.22Å; L180-I195 HydrophobicContact CD2-CG1 4.21Å; L180-I195 PolarHBondContact N-O 3.04Å; L180-I195 PolarHBondContact O-N 3.15Å; L180-I200 HydrophobicContact CB-CD1 3.98Å; L180-I200 HydrophobicContact CB-CG1 3.96Å; L180-I200 HydrophobicContact CD1-CG1 4.44Å; L180-I200 HydrophobicContact CD1-CG2 4.23Å; L180-Y203 HydrophobicContact CD1-CD1 3.61Å; L180-Y203 HydrophobicContact CD1-CE1 3.77Å; L180-Y203 HydrophobicContact CD2-CD1 4.12Å; L180-Y203 HydrophobicContact CD2-CE1 4.05Å; L180-Y203 HydrophobicContact CD2-CG 4.5Å; L180-F204 HydrophobicContact CD1-CE2 4.13Å; L180-F204 HydrophobicContact CD1-CZ 4.32Å; L180-W284 CarbonylContact C-O 3.52Å; L180-W284 WeakPolarHBondContact CA-O 3.47Å; L180-W284 HydrophobicContact CB-CB 4.48Å; L180-W284 HydrophobicContact CD1-CG 4.39Å; L180-W284 HydrophobicContact CG-CB 4.27Å; L180-W284 HydrophobicContact CG-CG 4.17Å
181S97.7Very high94.3Very high3 Ų346.2 Ų46.22%0.02126%0.261CS..EExtended strand (participates in β ladder)trans-111.4132.6176.7-710000110.6R192 Y193 T194 W284 H285 F286S181-R192 PolarHBondContact OG-NH2 3.01Å; S181-Y193 CarbonylContact C-O 3.51Å; S181-Y193 VanDerWaalsContact CA-O 3.32Å; S181-Y193 WeakPolarHBondContact CA-O 3.45Å; S181-T194 PolarHBondContact OG-OG1 3.43Å; S181-W284 PolarHBondContact N-O 3.26Å; S181-H285 VanDerWaalsContact CB-CD2 3.42Å; S181-H285 WeakPolarHBondContact CB-CD2 3.41Å; S181-H285 WeakPolarHBondContact O-CA 3.33Å; S181-F286 PolarHBondContact O-N 2.94Å
182L97.7Very high94.4Very high1 Ų151.2 Ų51.21%0.00527%0.272CS..EExtended strand (participates in β ladder)trans-113.6143.1164.4-60.5178.2000109.2L180 F184 R192 Y193 Y203 F286 L319 L327L180-L182 HydrophobicContact CD2-CD2 4.27Å; L180-L182 HydrophobicContact CD2-CG 4.04Å; L182-F184 HydrophobicContact CB-CD1 4.29Å; L182-F184 HydrophobicContact CB-CE1 4.05Å; L182-R192 WeakPolarHBondContact O-CA 3.41Å; L182-Y193 PolarHBondContact N-O 2.78Å; L182-Y193 PolarHBondContact O-N 3.1Å; L182-Y203 HydrophobicContact CD1-CE2 3.67Å; L182-F286 WeakPolarHBondContact CA-O 3.46Å; L182-F286 HydrophobicContact CD2-CB 3.93Å; L182-F286 HydrophobicContact CD2-CD1 4.28Å; L182-L319 HydrophobicContact CD1-CD1 4.21Å; L182-L327 HydrophobicContact CD1-CD1 3.66Å; L182-L327 HydrophobicContact CD1-CD2 4.07Å
183S97.3Very high94.5Very high13 Ų1349.2 Ų49.29%0.09126%0.262CS..EExtended strand (participates in β ladder)trans-141128.6176.5-58.80000110.8K191 H285 F286 L287 I288S183-K191 WeakPolarHBondContact CA-O 3.33Å; S183-H285 PolarHBondContact OG-NE2 3.1Å; S183-F286 PolarHBondContact N-O 3.35Å; S183-L287 CarbonylContact O-C 3.54Å; S183-L287 WeakPolarHBondContact O-CA 3.29Å; S183-I288 PolarHBondContact O-N 3.33Å
184F96.4Very high94.6Very high6 Ų651.3 Ų51.33%0.02627%0.274CS..EExtended strand (participates in β ladder)trans-163158-173.951.5-94.2000111.6L182 L186 K191 Y193 I288 Q317 L319 L324L182-F184 HydrophobicContact CB-CD1 4.29Å; L182-F184 HydrophobicContact CB-CE1 4.05Å; F184-L186 HydrophobicContact CD2-CD2 4Å; F184-L186 HydrophobicContact CD2-CG 3.92Å; F184-L186 HydrophobicContact CE2-CD1 4.01Å; F184-L186 HydrophobicContact CE2-CD2 3.92Å; F184-L186 HydrophobicContact CE2-CG 3.78Å; F184-K191 HydrophobicContact CE2-CB 4.42Å; F184-K191 PolarHBondContact N-O 2.95Å; F184-K191 PolarHBondContact O-N 3.4Å; F184-Y193 AromaticContact CE1-CD2 3.74Å; F184-Y193 HydrophobicContact CE1-CD2 3.74Å; F184-Y193 HydrophobicContact CE1-CE2 4.11Å; F184-Y193 HydrophobicContact CE2-CD2 4.47Å; F184-Y193 HydrophobicContact CE2-CE2 4.01Å; F184-Y193 AromaticContact CZ-CD2 3.54Å; F184-Y193 HydrophobicContact CZ-CD2 3.54Å; F184-Y193 AromaticContact CZ-CE2 3.42Å; F184-Y193 HydrophobicContact CZ-CE2 3.42Å; F184-Y193 VanDerWaalsContact CZ-CE2 3.42Å; F184-I288 HydrophobicContact CB-CB 4Å; F184-I288 HydrophobicContact CB-CD1 4.3Å; F184-I288 HydrophobicContact CD1-CD1 4Å; F184-I288 HydrophobicContact CG-CD1 4.43Å; F184-Q317 HydrophobicContact CB-CB 4.25Å; F184-Q317 HydrophobicContact CB-CG 4.28Å; F184-Q317 HydrophobicContact CD2-CB 4.23Å; F184-Q317 HydrophobicContact CD2-CG 4.22Å; F184-Q317 HydrophobicContact CG-CB 4.4Å; F184-L319 HydrophobicContact CD1-CD1 4.39Å; F184-L319 HydrophobicContact CE1-CD1 3.73Å; F184-L319 HydrophobicContact CZ-CD1 3.98Å; F184-L324 HydrophobicContact CE2-CD2 3.81Å; F184-L324 HydrophobicContact CZ-CD2 3.51Å
185C92.1Very high94.5Very high76 Ų7651.5 Ų51.551%0.51428%0.275SS..EExtended strand (participates in β ladder)trans-96.1125.2177.1-62.40000111.1Q317C185-Q317 VanDerWaalsContact O-CG 3.26Å; C185-Q317 WeakPolarHBondContact O-CG 3.47Å; C185-Q317 PolarHBondContact O-NE2 2.85Å
186L89Confident94.5Very high24 Ų2452.4 Ų52.413%0.12629%0.287CS..EExtended strand (participates in β ladder)trans-102.3179.3167.5-69.5-175.2000110.3F184 D188 G189 K191 R316 Q317F184-L186 HydrophobicContact CD2-CD2 4Å; F184-L186 HydrophobicContact CD2-CG 3.92Å; F184-L186 HydrophobicContact CE2-CD1 4.01Å; F184-L186 HydrophobicContact CE2-CD2 3.92Å; F184-L186 HydrophobicContact CE2-CG 3.78Å; L186-D188 VanDerWaalsContact CB-OD1 3.24Å; L186-D188 WeakPolarHBondContact CB-OD1 3.28Å; L186-D188 PolarHBondContact O-N 2.92Å; L186-G189 PolarHBondContact N-O 2.71Å; L186-G189 PolarHBondContact O-N 2.69Å; L186-K191 HydrophobicContact CB-CG 4.43Å; L186-K191 HydrophobicContact CD1-CG 4.1Å; L186-K191 HydrophobicContact CG-CG 4.25Å; L186-R316 HydrophobicContact CD2-CB 4.41Å; L186-Q317 HydrophobicContact CD2-CG 4.21Å
187E88.1Confident94.6Very high166 Ų16648.6 Ų48.678%0.77627%0.265SS*.THydrogen-bonded Turntrans-55.5-30.8175-65.4157.1168.800112.4R316E187-R316 VanDerWaalsContact CD-NH1 3.25Å; E187-R316 IonicContact OE1-CZ 2.71Å; E187-R316 IonicContact OE1-NH1 2.69Å; E187-R316 PolarHBondContact OE1-NH1 3.37Å; E187-R316 IonicContact OE1-NH2 3.62Å; E187-R316 IonicContact OE2-CZ 2.92Å; E187-R316 IonicContact OE2-NH1 3.21Å; E187-R316 PolarHBondContact OE2-NH1 2.99Å; E187-R316 IonicContact OE2-NH2 3.75Å
188D88.9Confident94.6Very high107 Ų10750.2 Ų50.257%0.57227%0.273SS*.THydrogen-bonded Turntrans-95.619.8177.567.8-25.7000113.5L186 K191L186-D188 VanDerWaalsContact CB-OD1 3.24Å; L186-D188 WeakPolarHBondContact CB-OD1 3.28Å; L186-D188 PolarHBondContact O-N 2.92Å; D188-K191 WeakPolarHBondContact OD1-CE 3.32Å; D188-K191 IonicContact OD1-NZ 2.82Å; D188-K191 WeakPolarHBondContact OD2-CE 3.48Å; D188-K191 IonicContact OD2-NZ 3.58Å; D188-K191 PolarHBondContact OD2-NZ 2.96Å
189G92.1Very high94.4Very high25 Ų2550.6 Ų50.626%0.25828%0.275SS..EExtended strand (participates in β ladder)trans100.9-168.1171.400000115.3L186 K191L186-G189 PolarHBondContact N-O 2.71Å; L186-G189 PolarHBondContact O-N 2.69Å; G189-K191 PolarHBondContact O-N 3.47Å
190P94.5Very high94.4Very high113 Ų11348 Ų4873%0.73426%0.26SS*.EExtended strand (participates in β ladder)trans-68.1127-179.728-33.8000111.1
191K94.8Very high94.3Very high59 Ų5948.2 Ų48.226%0.25726%0.261SS..EExtended strand (participates in β ladder)trans-112.2144.4174.1-59.9-55.5-177.5-171.10110.8S183 F184 L186 D188 G189 Y193S183-K191 WeakPolarHBondContact CA-O 3.33Å; F184-K191 HydrophobicContact CE2-CB 4.42Å; F184-K191 PolarHBondContact N-O 2.95Å; F184-K191 PolarHBondContact O-N 3.4Å; L186-K191 HydrophobicContact CB-CG 4.43Å; L186-K191 HydrophobicContact CD1-CG 4.1Å; L186-K191 HydrophobicContact CG-CG 4.25Å; D188-K191 WeakPolarHBondContact OD1-CE 3.32Å; D188-K191 IonicContact OD1-NZ 2.82Å; D188-K191 WeakPolarHBondContact OD2-CE 3.48Å; D188-K191 IonicContact OD2-NZ 3.58Å; D188-K191 PolarHBondContact OD2-NZ 2.96Å; G189-K191 PolarHBondContact O-N 3.47Å; K191-Y193 HydrophobicContact CB-CD2 4.34Å; K191-Y193 HydrophobicContact CB-CE2 3.75Å; K191-Y193 HydrophobicContact CG-CE2 4.35Å
192R95.4Very high94.2Very high159 Ų15952.6 Ų52.660%0.628%0.277SS*.EExtended strand (participates in β ladder)trans-128.6127166.8179.4175179.9179.64.2108.6S181 L182 T194S181-R192 PolarHBondContact OG-NH2 3.01Å; L182-R192 WeakPolarHBondContact O-CA 3.41Å; R192-T194 PolarHBondContact NE-OG1 3.37Å
193Y95.8Very high94.1Very high23 Ų2352.6 Ų52.69%0.0928%0.277CS..EExtended strand (participates in β ladder)trans-115120.7173.2-66.1-81.9000107.6S181 L182 F184 K191 L327 R328 V331S181-Y193 CarbonylContact C-O 3.51Å; S181-Y193 VanDerWaalsContact CA-O 3.32Å; S181-Y193 WeakPolarHBondContact CA-O 3.45Å; L182-Y193 PolarHBondContact N-O 2.78Å; L182-Y193 PolarHBondContact O-N 3.1Å; F184-Y193 AromaticContact CE1-CD2 3.74Å; F184-Y193 HydrophobicContact CE1-CD2 3.74Å; F184-Y193 HydrophobicContact CE1-CE2 4.11Å; F184-Y193 HydrophobicContact CE2-CD2 4.47Å; F184-Y193 HydrophobicContact CE2-CE2 4.01Å; F184-Y193 AromaticContact CZ-CD2 3.54Å; F184-Y193 HydrophobicContact CZ-CD2 3.54Å; F184-Y193 AromaticContact CZ-CE2 3.42Å; F184-Y193 HydrophobicContact CZ-CE2 3.42Å; F184-Y193 VanDerWaalsContact CZ-CE2 3.42Å; K191-Y193 HydrophobicContact CB-CD2 4.34Å; K191-Y193 HydrophobicContact CB-CE2 3.75Å; K191-Y193 HydrophobicContact CG-CE2 4.35Å; Y193-L327 HydrophobicContact CD1-CB 3.77Å; Y193-L327 WeakPolarHBondContact CD1-O 3.37Å; Y193-L327 HydrophobicContact CD2-CB 4.41Å; Y193-L327 HydrophobicContact CE1-CB 4.22Å; Y193-L327 HydrophobicContact CG-CB 3.9Å; Y193-R328 HydrophobicContact CE1-CG 4.17Å; Y193-V331 HydrophobicContact CD1-CG2 3.55Å; Y193-V331 HydrophobicContact CE1-CG2 3.99Å
194T95.8Very high94.1Very high44 Ų4452 Ų5227%0.2727%0.272SS..EExtended strand (participates in β ladder)trans-117.4136.6176-53.10000108.1L180 S181 R192L180-T194 CarbonylContact O-C 3.53Å; L180-T194 WeakPolarHBondContact O-CA 3.39Å; S181-T194 PolarHBondContact OG-OG1 3.43Å; R192-T194 PolarHBondContact NE-OG1 3.37Å
195I95.2Very high94Very high3 Ų355.9 Ų55.92%0.01529%0.287CS..EExtended strand (participates in β ladder)trans-136.6144.2176.967.3177.3000110.5L180 L199 I200 Y203 C330L180-I195 HydrophobicContact CB-CD1 4.44Å; L180-I195 HydrophobicContact CB-CG1 3.87Å; L180-I195 HydrophobicContact CD2-CD1 4.22Å; L180-I195 HydrophobicContact CD2-CG1 4.21Å; L180-I195 PolarHBondContact N-O 3.04Å; L180-I195 PolarHBondContact O-N 3.15Å; I195-L199 HydrophobicContact CB-CB 3.99Å; I195-L199 HydrophobicContact CB-CD1 4.23Å; I195-L199 HydrophobicContact CD1-CB 4.16Å; I195-L199 HydrophobicContact CG1-CB 4.43Å; I195-L199 HydrophobicContact CG2-CD1 4.37Å; I195-I200 HydrophobicContact CD1-CG1 4.5Å; I195-I200 HydrophobicContact CG1-CG1 4.42Å; I195-Y203 HydrophobicContact CD1-CG 4.05Å; I195-C330 HydrophobicContact CG2-CB 3.58Å
196G94.9Very high94.2Very high28 Ų2852.3 Ų52.329%0.28926%0.263SS..EExtended strand (participates in β ladder)trans-86.1169.4174.700000113.9A178 N198 L199 I200A178-G196 CarbonylContact O-C 3.51Å; G196-N198 PolarHBondContact O-N 3.29Å; G196-L199 PolarHBondContact O-N 3.47Å; G196-I200 PolarHBondContact O-N 3.02Å
197R94.7Very high94.5Very high26 Ų2651.4 Ų51.410%0.09826%0.258CS..THydrogen-bonded Turntrans-44.5-35-175.8176.857.1-176.9784.3116.4A170 S171 E175 D176 A178 L199 P201A170-R197 VanDerWaalsContact CB-CZ 3.43Å; S171-R197 VanDerWaalsContact N-NH2 3.14Å; S171-R197 PolarHBondContact OG-NH2 2.63Å; E175-R197 VanDerWaalsContact O-CD 3.22Å; E175-R197 WeakPolarHBondContact O-CD 3.41Å; E175-R197 WeakPolarHBondContact O-CG 3.2Å; D176-R197 WeakPolarHBondContact O-CB 3.48Å; A178-R197 HydrophobicContact CB-CB 4.47Å; A178-R197 PolarHBondContact O-N 2.95Å; R197-L199 PolarHBondContact O-N 3.34Å; R197-P201 VanDerWaalsContact O-CD 3.26Å; R197-P201 WeakPolarHBondContact O-CD 3.2Å
198N93.3Very high94.8Very high124 Ų12444.6 Ų44.666%0.66323%0.226SC*.THydrogen-bonded Turntrans-70.4-17.5179.5-65.3-25.4000114G196G196-N198 PolarHBondContact O-N 3.29Å
199L94.2Very high94.9Very high8 Ų844.6 Ų44.64%0.04222%0.222CC..THydrogen-bonded Turntrans-105.3-19-179.3-64.6176.9000112.5W9 I195 G196 R197 R202 Y203 Y326 C330W9-L199 HydrophobicContact CH2-CD2 3.82Å; W9-L199 HydrophobicContact CZ2-CD2 4.44Å; I195-L199 HydrophobicContact CB-CB 3.99Å; I195-L199 HydrophobicContact CB-CD1 4.23Å; I195-L199 HydrophobicContact CD1-CB 4.16Å; I195-L199 HydrophobicContact CG1-CB 4.43Å; I195-L199 HydrophobicContact CG2-CD1 4.37Å; G196-L199 PolarHBondContact O-N 3.47Å; R197-L199 PolarHBondContact O-N 3.34Å; L199-R202 PolarHBondContact O-N 3.24Å; L199-R202 VanDerWaalsContact O-N 3.08Å; L199-Y203 PolarHBondContact O-N 2.89Å; L199-Y326 WeakPolarHBondContact CB-OH 3.42Å; L199-Y326 PolarHBondContact O-OH 3.08Å; L199-Y326 VanDerWaalsContact O-OH 3.1Å; L199-C330 HydrophobicContact CD1-CB 4.12Å
200I96.7Very high94.9Very high0 Ų044.3 Ų44.30%022%0.22CC..Hα-helixtrans-53-46177.3-60.4-178.5000113.2F174 A178 L180 I195 G196 R202 Y203 F204F174-I200 HydrophobicContact CD1-CD1 3.74Å; F174-I200 HydrophobicContact CD1-CG2 4.37Å; F174-I200 HydrophobicContact CD2-CG2 4.02Å; F174-I200 HydrophobicContact CE1-CD1 4.13Å; F174-I200 HydrophobicContact CE1-CG2 4.23Å; F174-I200 HydrophobicContact CE2-CG2 3.88Å; F174-I200 HydrophobicContact CG-CD1 4.16Å; F174-I200 HydrophobicContact CG-CG2 4.28Å; F174-I200 HydrophobicContact CZ-CG2 3.99Å; A178-I200 HydrophobicContact CB-CD1 4.14Å; L180-I200 HydrophobicContact CB-CD1 3.98Å; L180-I200 HydrophobicContact CB-CG1 3.96Å; L180-I200 HydrophobicContact CD1-CG1 4.44Å; L180-I200 HydrophobicContact CD1-CG2 4.23Å; I195-I200 HydrophobicContact CD1-CG1 4.5Å; I195-I200 HydrophobicContact CG1-CG1 4.42Å; G196-I200 PolarHBondContact O-N 3.02Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3.22Å; I200-Y203 PolarHBondContact O-N 3.31Å; I200-F204 HydrophobicContact CG2-CD2 3.92Å; I200-F204 HydrophobicContact CG2-CE2 3.69Å; I200-F204 WeakPolarHBondContact O-CD2 3.45Å; I200-F204 PolarHBondContact O-N 3.14Å
201P95.6Very high94.8Very high4 Ų440.2 Ų40.23%0.02620%0.198CC..Hα-helixtrans-54.4-44.2175.3-2531.7000113W166 D167 A170 R197 R205W166-P201 HydrophobicContact CB-CB 3.92Å; D167-P201 WeakPolarHBondContact OD1-CG 3.42Å; A170-P201 HydrophobicContact CB-CG 3.71Å; R197-P201 VanDerWaalsContact O-CD 3.26Å; R197-P201 WeakPolarHBondContact O-CD 3.2Å; P201-R205 WeakPolarHBondContact O-CB 3.38Å; P201-R205 PolarHBondContact O-N 3.47Å
202R94.5Very high94.8Very high96 Ų9637.7 Ų37.736%0.36219%0.188SC..Hα-helixtrans-75.5-30.9-177.9-68.1-174.7-175.4-154.52.8112.6L199 I200 R205 S206 Y326L199-R202 PolarHBondContact O-N 3.24Å; L199-R202 VanDerWaalsContact O-N 3.08Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3.22Å; R202-R205 PolarHBondContact O-N 3.28Å; R202-S206 WeakPolarHBondContact O-CB 3.47Å; R202-S206 PolarHBondContact O-N 2.89Å; R202-Y326 HydrophobicContact CB-CE2 3.86Å; R202-Y326 VanDerWaalsContact CB-OH 3.3Å; R202-Y326 WeakPolarHBondContact CB-OH 3.37Å
203Y97Very high94.7Very high0 Ų033.3 Ų33.30%018%0.176CC..Hα-helixtrans-58.2-54.8171.1164.8-108.4000111.6L180 L182 I195 L199 I200 R205 S206 I207 T323 Y326 L327L180-Y203 HydrophobicContact CD1-CD1 3.61Å; L180-Y203 HydrophobicContact CD1-CE1 3.77Å; L180-Y203 HydrophobicContact CD2-CD1 4.12Å; L180-Y203 HydrophobicContact CD2-CE1 4.05Å; L180-Y203 HydrophobicContact CD2-CG 4.5Å; L182-Y203 HydrophobicContact CD1-CE2 3.67Å; I195-Y203 HydrophobicContact CD1-CG 4.05Å; L199-Y203 PolarHBondContact O-N 2.89Å; I200-Y203 PolarHBondContact O-N 3.31Å; Y203-R205 VanDerWaalsContact C-N 3.33Å; Y203-R205 PolarHBondContact O-N 3.39Å; Y203-S206 PolarHBondContact O-N 2.96Å; Y203-S206 VanDerWaalsContact O-N 3.13Å; Y203-S206 PolarHBondContact O-OG 3.45Å; Y203-I207 HydrophobicContact CE1-CD1 4.08Å; Y203-I207 HydrophobicContact CE2-CD1 4.26Å; Y203-I207 PolarHBondContact O-N 3.17Å; Y203-T323 HydrophobicContact CD2-CG2 4.3Å; Y203-T323 HydrophobicContact CE2-CG2 3.88Å; Y203-Y326 VanDerWaalsContact CA-CE1 3.46Å; Y203-L327 HydrophobicContact CD2-CD2 4.02Å; Y203-L327 HydrophobicContact CE2-CD2 4.32Å
204F96.8Very high94.7Very high0 Ų035 Ų350%018%0.184CC..Hα-helixtrans-62.5-41.8179.8-75-75.1000111.7W166 F169 F174 L180 I200 S206 I207 F208 L215 Y217W166-F204 HydrophobicContact CE3-CB 3.78Å; W166-F204 HydrophobicContact CH2-CB 3.94Å; W166-F204 HydrophobicContact CZ3-CB 3.32Å; W166-F204 HydrophobicContact CZ3-CG 4.26Å; F169-F204 HydrophobicContact CD1-CD2 4.49Å; F169-F204 AromaticContact CE1-CD2 3.66Å; F169-F204 HydrophobicContact CE1-CD2 3.66Å; F169-F204 AromaticContact CE1-CE2 3.83Å; F169-F204 HydrophobicContact CE1-CE2 3.83Å; F169-F204 HydrophobicContact CE1-CG 4.07Å; F169-F204 HydrophobicContact CE1-CZ 4.37Å; F169-F204 HydrophobicContact CZ-CD2 4.5Å; F169-F204 HydrophobicContact CZ-CE2 4.43Å; F174-F204 AromaticContact CE2-CE2 3.82Å; F174-F204 HydrophobicContact CE2-CE2 3.82Å; F174-F204 HydrophobicContact CE2-CZ 4.36Å; F174-F204 AromaticContact CZ-CE2 3.75Å; F174-F204 HydrophobicContact CZ-CE2 3.75Å; F174-F204 HydrophobicContact CZ-CZ 4.04Å; L180-F204 HydrophobicContact CD1-CE2 4.13Å; L180-F204 HydrophobicContact CD1-CZ 4.32Å; I200-F204 HydrophobicContact CG2-CD2 3.92Å; I200-F204 HydrophobicContact CG2-CE2 3.69Å; I200-F204 WeakPolarHBondContact O-CD2 3.45Å; I200-F204 PolarHBondContact O-N 3.14Å; F204-S206 VanDerWaalsContact C-N 3.32Å; F204-S206 PolarHBondContact O-N 2.9Å; F204-I207 HydrophobicContact CD1-CD1 4.24Å; F204-I207 WeakPolarHBondContact O-CB 3.26Å; F204-I207 PolarHBondContact O-N 2.89Å; F204-F208 WeakPolarHBondContact O-CD2 3.42Å; F204-L215 HydrophobicContact CD1-CD2 4.03Å; F204-L215 HydrophobicContact CE1-CD2 4.4Å; F204-Y217 HydrophobicContact CE1-CE2 4.3Å
205R94.8Very high94.7Very high88 Ų8833 Ų3333%0.33217%0.172SC..Hα-helixtrans-53.9-44.3172.4-177.1175.9165.1146.86.8112.9W166 P201 R202 Y203 I207 F208 E209W166-R205 HydrophobicContact CD2-CB 4.18Å; W166-R205 HydrophobicContact CG-CB 4.24Å; P201-R205 WeakPolarHBondContact O-CB 3.38Å; P201-R205 PolarHBondContact O-N 3.47Å; R202-R205 PolarHBondContact O-N 3.28Å; Y203-R205 VanDerWaalsContact C-N 3.33Å; Y203-R205 PolarHBondContact O-N 3.39Å; R205-I207 PolarHBondContact O-N 3.05Å; R205-F208 PolarHBondContact O-N 2.86Å; R205-F208 VanDerWaalsContact O-N 3.11Å; R205-E209 HydrophobicContact CG-CG 4.28Å; R205-E209 IonicContact CZ-OE1 3.55Å; R205-E209 IonicContact NE-OE1 2.7Å; R205-E209 PolarHBondContact NE-OE1 2.91Å; R205-E209 IonicContact NH2-OE1 3.79Å; R205-E209 PolarHBondContact NH2-OE1 2.85Å; R205-E209 PolarHBondContact O-N 2.87Å
206S95.1Very high94.8Very high1 Ų136 Ų361%0.00718%0.183CC..Hα-helixtrans-62.7-24.5-178.876.20000114.2R202 Y203 F204 G210 T323R202-S206 WeakPolarHBondContact O-CB 3.47Å; R202-S206 PolarHBondContact O-N 2.89Å; Y203-S206 PolarHBondContact O-N 2.96Å; Y203-S206 VanDerWaalsContact O-N 3.13Å; Y203-S206 PolarHBondContact O-OG 3.45Å; F204-S206 VanDerWaalsContact C-N 3.32Å; F204-S206 PolarHBondContact O-N 2.9Å; S206-G210 PolarHBondContact O-N 3.08Å; S206-G210 VanDerWaalsContact O-N 3.15Å; S206-T323 PolarHBondContact O-OG1 2.85Å
207I95.9Very high95Very high5 Ų534.8 Ų34.83%0.02617%0.17CC..Hα-helixtrans-67-46.6174.5-60.2167.1000110Y203 F204 R205 G210 V212 L215 M242 T244 T323Y203-I207 HydrophobicContact CE1-CD1 4.08Å; Y203-I207 HydrophobicContact CE2-CD1 4.26Å; Y203-I207 PolarHBondContact O-N 3.17Å; F204-I207 HydrophobicContact CD1-CD1 4.24Å; F204-I207 WeakPolarHBondContact O-CB 3.26Å; F204-I207 PolarHBondContact O-N 2.89Å; R205-I207 PolarHBondContact O-N 3.05Å; I207-G210 WeakPolarHBondContact O-CA 3.41Å; I207-G210 PolarHBondContact O-N 2.77Å; I207-G210 VanDerWaalsContact O-N 3.14Å; I207-V212 HydrophobicContact CG2-CB 4.1Å; I207-V212 HydrophobicContact CG2-CG1 4.26Å; I207-V212 HydrophobicContact CG2-CG2 3.78Å; I207-V212 WeakPolarHBondContact O-CB 3.41Å; I207-V212 WeakPolarHBondContact O-CG2 3.4Å; I207-L215 HydrophobicContact CD1-CD2 3.87Å; I207-L215 HydrophobicContact CG2-CD2 4.45Å; I207-M242 HydrophobicContact CD1-CE 4.01Å; I207-T244 HydrophobicContact CG2-CG2 4.2Å; I207-T323 HydrophobicContact CG1-CG2 4.09Å
208F94.2Very high95Very high23 Ų2336.4 Ų36.410%0.10118%0.18CC..Hα-helixtrans-73.2-37179.4-61.5-76000112.5L152 W166 F204 R205 G210 G211 V212 L215L152-F208 HydrophobicContact CD2-CE2 4.32Å; L152-F208 HydrophobicContact CD2-CZ 4.41Å; W166-F208 AromaticContact CH2-CD2 3.66Å; W166-F208 HydrophobicContact CH2-CD2 3.66Å; W166-F208 AromaticContact CH2-CE2 3.43Å; W166-F208 HydrophobicContact CH2-CE2 3.43Å; W166-F208 VanDerWaalsContact CH2-CE2 3.43Å; W166-F208 HydrophobicContact CH2-CZ 4.47Å; W166-F208 AromaticContact CZ2-CD2 3.63Å; W166-F208 HydrophobicContact CZ2-CD2 3.63Å; W166-F208 AromaticContact CZ2-CE2 3.91Å; W166-F208 HydrophobicContact CZ2-CE2 3.91Å; F204-F208 WeakPolarHBondContact O-CD2 3.42Å; R205-F208 PolarHBondContact O-N 2.86Å; R205-F208 VanDerWaalsContact O-N 3.11Å; F208-G210 PolarHBondContact O-N 3.12Å; F208-G210 VanDerWaalsContact O-N 3.15Å; F208-G211 PolarHBondContact O-N 2.73Å; F208-V212 HydrophobicContact CD1-CB 4.13Å; F208-V212 HydrophobicContact CD1-CG1 3.91Å; F208-V212 WeakPolarHBondContact CD1-O 3.18Å; F208-V212 HydrophobicContact CE1-CG1 3.92Å; F208-L215 HydrophobicContact CE1-CB 3.98Å; F208-L215 HydrophobicContact CE2-CB 4.46Å; F208-L215 HydrophobicContact CE2-CD2 4.15Å; F208-L215 HydrophobicContact CZ-CB 3.59Å; F208-L215 HydrophobicContact CZ-CD2 4.07Å; F208-L215 HydrophobicContact CZ-CG 4.47Å
209E92.6Very high95.1Very high107 Ų10731.9 Ų31.950%0.516%0.157SC..Hα-helixtrans-60.2-21.3168.5-69.2176.6163.900112.3R205 G211 V322R205-E209 HydrophobicContact CG-CG 4.28Å; R205-E209 IonicContact CZ-OE1 3.55Å; R205-E209 IonicContact NE-OE1 2.7Å; R205-E209 PolarHBondContact NE-OE1 2.91Å; R205-E209 IonicContact NH2-OE1 3.79Å; R205-E209 PolarHBondContact NH2-OE1 2.85Å; R205-E209 PolarHBondContact O-N 2.87Å; E209-G211 VanDerWaalsContact C-N 3.25Å; E209-G211 PolarHBondContact O-N 3.14Å; E209-V322 HydrophobicContact CB-CG1 4.16Å
210G91.7Very high95Very high20 Ų2038.3 Ų38.321%0.20618%0.181CC..THydrogen-bonded Turntrans-73.1-1.7170.500000116.3S206 I207 F208S206-G210 PolarHBondContact O-N 3.08Å; S206-G210 VanDerWaalsContact O-N 3.15Å; I207-G210 WeakPolarHBondContact O-CA 3.41Å; I207-G210 PolarHBondContact O-N 2.77Å; I207-G210 VanDerWaalsContact O-N 3.14Å; F208-G210 PolarHBondContact O-N 3.12Å; F208-G210 VanDerWaalsContact O-N 3.15Å
211G91.8Very high94.5Very high27 Ų2743.8 Ų43.828%0.27822%0.218SC..THydrogen-bonded Turntrans98.27-179.200000115.4F208 E209 H246 C247F208-G211 PolarHBondContact O-N 2.73Å; E209-G211 VanDerWaalsContact C-N 3.25Å; E209-G211 PolarHBondContact O-N 3.14Å; G211-H246 WeakPolarHBondContact O-CA 3.28Å; G211-C247 PolarHBondContact O-N 3.37Å; G211-C247 VanDerWaalsContact O-N 3.08Å
212V94.2Very high94.3Very high6 Ų645.5 Ų45.54%0.03623%0.228CC..EExtended strand (participates in β ladder)trans-72.3138.7171.5176.70000110.1I207 F208 E214 T244 Q245 H246I207-V212 HydrophobicContact CG2-CB 4.1Å; I207-V212 HydrophobicContact CG2-CG1 4.26Å; I207-V212 HydrophobicContact CG2-CG2 3.78Å; I207-V212 WeakPolarHBondContact O-CB 3.41Å; I207-V212 WeakPolarHBondContact O-CG2 3.4Å; F208-V212 HydrophobicContact CD1-CB 4.13Å; F208-V212 HydrophobicContact CD1-CG1 3.91Å; F208-V212 WeakPolarHBondContact CD1-O 3.18Å; F208-V212 HydrophobicContact CE1-CG1 3.92Å; V212-E214 WeakPolarHBondContact CG1-O 3.38Å; V212-T244 HydrophobicContact CG1-CG2 4.05Å; V212-T244 HydrophobicContact CG2-CG2 4.13Å; V212-Q245 CarbonylContact C-O 3.52Å; V212-Q245 WeakPolarHBondContact CA-O 3.48Å; V212-H246 WeakPolarHBondContact CG2-CE1 3.24Å
213I93.8Very high94.1Very high67 Ų6748.3 Ų48.334%0.34424%0.239SC..EExtended strand (participates in β ladder)trans-103-41170.849.9161.6000112.5R155 Q245 C247R155-I213 PolarHBondContact NH1-O 3.35Å; I213-Q245 HydrophobicContact CD1-CG 4.11Å; I213-Q245 HydrophobicContact CG1-CB 4.14Å; I213-Q245 HydrophobicContact CG1-CG 4.16Å; I213-Q245 VanDerWaalsContact CG1-O 3.26Å; I213-Q245 WeakPolarHBondContact CG1-O 3.37Å; I213-Q245 PolarHBondContact N-O 3.37Å; I213-C247 HydrophobicContact CG2-CB 4.07Å; I213-C247 VanDerWaalsContact CG2-SG 3.52Å
214E95.1Very high93.8Very high58 Ų5851.2 Ų51.227%0.27125%0.252SS..EExtended strand (participates in β ladder)trans-125.5138.7179.8-170.8-179.9-155.500110.8Q153 V212 Y216 T244 Q245Q153-E214 PolarHBondContact NE2-OE1 3.3Å; V212-E214 WeakPolarHBondContact CG1-O 3.38Å; E214-Y216 HydrophobicContact CG-CD1 3.95Å; E214-Y216 HydrophobicContact CG-CE1 4.24Å; E214-T244 CarbonylContact O-C 3.57Å; E214-T244 VanDerWaalsContact O-CA 3.3Å; E214-T244 WeakPolarHBondContact O-CA 3.46Å; E214-Q245 HydrophobicContact CB-CB 4.24Å; E214-Q245 PolarHBondContact O-N 3.45Å
215L97.3Very high93.5Very high1 Ų154.3 Ų54.31%0.00527%0.271CS..EExtended strand (participates in β ladder)trans-135.7131.4174.8167.665.2000109.1L152 F204 I207 F208 Y217 M242 V243 T244L152-L215 HydrophobicContact CD1-CD2 4.11Å; L152-L215 HydrophobicContact CD1-CG 4.16Å; F204-L215 HydrophobicContact CD1-CD2 4.03Å; F204-L215 HydrophobicContact CE1-CD2 4.4Å; I207-L215 HydrophobicContact CD1-CD2 3.87Å; I207-L215 HydrophobicContact CG2-CD2 4.45Å; F208-L215 HydrophobicContact CE1-CB 3.98Å; F208-L215 HydrophobicContact CE2-CB 4.46Å; F208-L215 HydrophobicContact CE2-CD2 4.15Å; F208-L215 HydrophobicContact CZ-CB 3.59Å; F208-L215 HydrophobicContact CZ-CD2 4.07Å; F208-L215 HydrophobicContact CZ-CG 4.47Å; L215-Y217 HydrophobicContact CD1-CE2 4.24Å; L215-Y217 HydrophobicContact CD2-CE2 4.48Å; L215-Y217 HydrophobicContact CG-CE2 4.36Å; L215-M242 HydrophobicContact CD1-CE 3.69Å; L215-M242 HydrophobicContact CD1-CG 3.82Å; L215-M242 HydrophobicContact CD1-SD 4.47Å; L215-V243 WeakPolarHBondContact CA-O 3.44Å; L215-T244 HydrophobicContact CB-CG2 4.4Å; L215-T244 HydrophobicContact CD1-CG2 3.57Å
216Y97.4Very high93Very high66 Ų6653.5 Ų53.526%0.25927%0.27SS..EExtended strand (participates in β ladder)trans-152.2158.8168.856.4-96.7000112.2N149 E214 I218 V243N149-Y216 WeakPolarHBondContact OD1-CA 3.42Å; E214-Y216 HydrophobicContact CG-CD1 3.95Å; E214-Y216 HydrophobicContact CG-CE1 4.24Å; Y216-I218 HydrophobicContact CD2-CD1 4.5Å; Y216-I218 HydrophobicContact CD2-CG1 3.97Å; Y216-I218 HydrophobicContact CE2-CD1 3.92Å; Y216-I218 HydrophobicContact CE2-CG1 3.9Å; Y216-V243 HydrophobicContact CD2-CB 4.05Å; Y216-V243 HydrophobicContact CD2-CG2 4.27Å; Y216-V243 HydrophobicContact CE1-CB 4.27Å; Y216-V243 HydrophobicContact CE1-CG1 4.32Å; Y216-V243 HydrophobicContact CE2-CB 3.52Å; Y216-V243 HydrophobicContact CE2-CG1 4.12Å; Y216-V243 HydrophobicContact CE2-CG2 3.62Å; Y216-V243 PolarHBondContact N-O 3.39Å; Y216-V243 VanDerWaalsContact N-O 3.11Å; Y216-V243 PolarHBondContact O-N 2.78Å
217Y97.5Very high92.2Very high3 Ų358.2 Ų58.21%0.01229%0.292CS..EExtended strand (participates in β ladder)trans-111.1122.7177.5-62.6-90.2000110.7M148 N149 F204 L215 T240 S241 M242 W284M148-Y217 HydrophobicContact CE-CD2 3.5Å; M148-Y217 HydrophobicContact CE-CE2 3.82Å; M148-Y217 HydrophobicContact CE-CG 4.44Å; N149-Y217 PolarHBondContact ND2-O 2.9Å; N149-Y217 PolarHBondContact OD1-N 3.49Å; F204-Y217 HydrophobicContact CE1-CE2 4.3Å; L215-Y217 HydrophobicContact CD1-CE2 4.24Å; L215-Y217 HydrophobicContact CD2-CE2 4.48Å; L215-Y217 HydrophobicContact CG-CE2 4.36Å; Y217-T240 HydrophobicContact CD1-CG2 4.41Å; Y217-S241 WeakPolarHBondContact CA-O 3.36Å; Y217-M242 HydrophobicContact CD1-CB 3.75Å; Y217-M242 HydrophobicContact CD1-CG 4.1Å; Y217-M242 HydrophobicContact CE1-CB 3.57Å; Y217-M242 HydrophobicContact CE1-CG 3.53Å; Y217-M242 HydrophobicContact CE1-SD 3.8Å; Y217-W284 HydrophobicContact CD1-CH2 4.24Å; Y217-W284 AromaticContact CD1-CZ2 3.94Å; Y217-W284 HydrophobicContact CD1-CZ2 3.94Å; Y217-W284 HydrophobicContact CD2-CH2 4.12Å; Y217-W284 HydrophobicContact CD2-CZ2 4.4Å; Y217-W284 HydrophobicContact CE1-CH2 4.31Å; Y217-W284 AromaticContact CE1-CZ2 3.67Å; Y217-W284 HydrophobicContact CE1-CZ2 3.67Å; Y217-W284 HydrophobicContact CE2-CH2 4.2Å; Y217-W284 HydrophobicContact CE2-CZ2 4.15Å; Y217-W284 HydrophobicContact CG-CH2 4.15Å; Y217-W284 HydrophobicContact CG-CZ2 4.3Å; Y217-W284 AromaticContact CZ-CZ2 3.79Å
218I96.5Very high91.2Very high60 Ų6064.4 Ų64.431%0.30832%0.321SS..EExtended strand (participates in β ladder)trans-97112.4170.2-55.5175.4000108.3Y216 R220 T240 S241 V243Y216-I218 HydrophobicContact CD2-CD1 4.5Å; Y216-I218 HydrophobicContact CD2-CG1 3.97Å; Y216-I218 HydrophobicContact CE2-CD1 3.92Å; Y216-I218 HydrophobicContact CE2-CG1 3.9Å; I218-R220 HydrophobicContact CG2-CG 4.1Å; I218-T240 CarbonylContact O-C 3.55Å; I218-T240 VanDerWaalsContact O-CA 3.31Å; I218-T240 WeakPolarHBondContact O-CA 3.37Å; I218-S241 PolarHBondContact N-O 3.05Å; I218-S241 PolarHBondContact O-N 3.48Å; I218-V243 HydrophobicContact CD1-CG2 4.34Å
219T94.4Very high90.2Very high30 Ų3069.4 Ų69.418%0.18436%0.356CS..EExtended strand (participates in β ladder)trans-88.7140.3167.653.10000110.5D142 I145 T222 C237 T240 L260D142-T219 WeakPolarHBondContact OD1-CB 3.32Å; D142-T219 PolarHBondContact OD1-OG1 3.06Å; I145-T219 HydrophobicContact CG2-CG2 4.3Å; T219-T222 HydrophobicContact CG2-CG2 4.34Å; T219-C237 HydrophobicContact CG2-CB 4.37Å; T219-T240 HydrophobicContact CG2-CG2 4.38Å; T219-L260 HydrophobicContact CG2-CD2 4.27Å
220R91.9Very high89.3Confident142 Ų14267.2 Ų67.254%0.53635%0.352SS..EExtended strand (participates in β ladder)trans-134.1139.2174.1-59.2-177.4-178172.73.5110.7I218 T222 C237 H239I218-R220 HydrophobicContact CG2-CG 4.1Å; R220-T222 VanDerWaalsContact C-N 3.33Å; R220-T222 PolarHBondContact O-N 3.16Å; R220-C237 PolarHBondContact N-SG 3.3Å; R220-C237 PolarHBondContact O-SG 3.21Å; R220-H239 HydrophobicContact CB-CB 4.15Å; R220-H239 PolarHBondContact N-O 3.29Å; R220-H239 VanDerWaalsContact N-O 3.08Å
221C86.5Confident88.8Confident115 Ų11569.5 Ų69.578%0.77736%0.36SS*.SBendtrans53.447177.3-57.30000113.3
222T91.1Very high88.5Confident40 Ų4068.2 Ų68.225%0.24535%0.347CS..  trans-62.7147.417948.30000112.9D142 T219 R220 L235 C237D142-T222 WeakPolarHBondContact OD1-CG2 2.99Å; D142-T222 WeakPolarHBondContact OD2-CB 3.36Å; D142-T222 PolarHBondContact OD2-OG1 3.04Å; T219-T222 HydrophobicContact CG2-CG2 4.34Å; R220-T222 VanDerWaalsContact C-N 3.33Å; R220-T222 PolarHBondContact O-N 3.16Å; T222-L235 HydrophobicContact CG2-CD1 4.34Å; T222-L235 HydrophobicContact CG2-CD2 4.25Å; T222-L235 HydrophobicContact CG2-CG 4.36Å; T222-C237 HydrophobicContact CG2-CB 3.83Å
223R91.1Very high88.3Confident155 Ų15568 Ų6859%0.58535%0.346SS*.EExtended strand (participates in β ladder)trans-125.7115.6176.9-63.6176.163.1-142.9-1.7108.8D236R223-D236 HydrophobicContact CB-CB 4.46Å; R223-D236 PolarHBondContact N-O 3.41Å; R223-D236 IonicContact NH1-OD2 3.77Å; R223-D236 PolarHBondContact O-N 2.89Å
224E90.7Very high88.3Confident62 Ų6267.1 Ų67.129%0.2934%0.341SS..EExtended strand (participates in β ladder)trans-91128173.3-60.6-178.7159.400109.9L141 F226 V233 I234L141-E224 WeakPolarHBondContact CB-OE1 3.12Å; L141-E224 HydrophobicContact CD1-CG 4.26Å; L141-E224 PolarHBondContact N-OE1 3.34Å; L141-E224 VanDerWaalsContact N-OE1 3.08Å; E224-F226 HydrophobicContact CB-CE2 4.44Å; E224-V233 HydrophobicContact CB-CG1 4.27Å; E224-I234 CarbonylContact C-O 3.44Å; E224-I234 WeakPolarHBondContact CA-O 3.46Å
225T89.1Confident88.2Confident65 Ų6564.3 Ų64.340%0.39933%0.328SS..EExtended strand (participates in β ladder)trans-123.5126.9170.652.30000110.7I234T225-I234 PolarHBondContact N-O 3.11Å; T225-I234 PolarHBondContact O-N 3.36Å
226F84.6Confident88.1Confident71 Ų7165.3 Ų65.331%0.31133%0.333SS..EExtended strand (participates in β ladder)trans-89.3124.9-178.2-65.6-96.6000109.7L135 E224 V233L135-F226 HydrophobicContact CD1-CD1 3.53Å; L135-F226 HydrophobicContact CD1-CE1 3.71Å; L135-F226 HydrophobicContact CD2-CE1 4.33Å; E224-F226 HydrophobicContact CB-CE2 4.44Å; F226-V233 HydrophobicContact CD1-CB 4.43Å; F226-V233 HydrophobicContact CD1-CG1 4.23Å; F226-V233 HydrophobicContact CD1-CG2 3.32Å; F226-V233 HydrophobicContact CE1-CB 4.47Å; F226-V233 HydrophobicContact CE1-CG1 4.09Å; F226-V233 HydrophobicContact CE1-CG2 3.46Å; F226-V233 VanDerWaalsContact CE1-CG2 3.46Å; F226-V233 HydrophobicContact CG-CG1 4.49Å; F226-V233 HydrophobicContact CG-CG2 4.15Å; F226-V233 HydrophobicContact CZ-CG1 4.22Å; F226-V233 HydrophobicContact CZ-CG2 4.38Å
227H78.4Confident88.1Confident100 Ų10062.2 Ų62.246%0.46332%0.321SS..EExtended strand (participates in β ladder)trans-107122.8179.6-166.5-93.4000111.1S230 N231 A232H227-S230 PolarHBondContact ND1-OG 3.05Å; H227-N231 PolarHBondContact O-N 3.44Å; H227-A232 PolarHBondContact N-O 3.28Å; H227-A232 PolarHBondContact O-N 2.77Å
228Q75.8Confident88Confident134 Ų13466.8 Ų66.863%0.62634%0.342SS*.THydrogen-bonded Turntrans-111.7143.4171.1-69.8-162-21.300109.3
229P73.2Confident88Confident128 Ų12869 Ų6983%0.83135%0.351SS*.THydrogen-bonded Turncis-90.3-4.713.235.5-37.1000115.7N231P229-N231 PolarHBondContact O-N 2.89Å
230S73.9Confident88.1Confident61 Ų6167.7 Ų67.743%0.42734%0.343SS..THydrogen-bonded Turntrans-65.8-5.8-170.653.20000116.2H227 A232H227-S230 PolarHBondContact ND1-OG 3.05Å; S230-A232 PolarHBondContact O-N 3.15Å; S230-A232 VanDerWaalsContact O-N 3.13Å
231N80.4Confident88.4Confident68 Ų6861.2 Ų61.236%0.36432%0.319SS..THydrogen-bonded Turntrans49.334.3-172.9-162.545.7000112.8H227 P229 F266H227-N231 PolarHBondContact O-N 3.44Å; P229-N231 PolarHBondContact O-N 2.89Å; N231-F266 WeakPolarHBondContact O-CD2 3.45Å
232A85.6Confident88.9Confident1 Ų155.8 Ų55.81%0.00828%0.283CS..EExtended strand (participates in β ladder)trans-100.2149.9177.200000109.9H227 S230 E263 F264H227-A232 PolarHBondContact N-O 3.28Å; H227-A232 PolarHBondContact O-N 2.77Å; S230-A232 PolarHBondContact O-N 3.15Å; S230-A232 VanDerWaalsContact O-N 3.13Å; A232-E263 HydrophobicContact CB-CG 3.95Å; A232-E263 WeakPolarHBondContact CB-OE1 3.44Å; A232-F264 WeakPolarHBondContact CA-O 3.22Å
233V90.4Very high89.2Confident2 Ų254.2 Ų54.21%0.01227%0.273CS..EExtended strand (participates in β ladder)trans-123.6124.4175.6-174.90000109.2L141 E224 F226 F264 F266L141-V233 HydrophobicContact CD1-CB 3.92Å; L141-V233 HydrophobicContact CD1-CG1 3.46Å; L141-V233 VanDerWaalsContact CD1-CG1 3.46Å; E224-V233 HydrophobicContact CB-CG1 4.27Å; F226-V233 HydrophobicContact CD1-CB 4.43Å; F226-V233 HydrophobicContact CD1-CG1 4.23Å; F226-V233 HydrophobicContact CD1-CG2 3.32Å; F226-V233 HydrophobicContact CE1-CB 4.47Å; F226-V233 HydrophobicContact CE1-CG1 4.09Å; F226-V233 HydrophobicContact CE1-CG2 3.46Å; F226-V233 VanDerWaalsContact CE1-CG2 3.46Å; F226-V233 HydrophobicContact CG-CG1 4.49Å; F226-V233 HydrophobicContact CG-CG2 4.15Å; F226-V233 HydrophobicContact CZ-CG1 4.22Å; F226-V233 HydrophobicContact CZ-CG2 4.38Å; V233-F264 PolarHBondContact N-O 2.87Å; V233-F264 PolarHBondContact O-N 3.21Å; V233-F266 HydrophobicContact CB-CE2 3.97Å; V233-F266 HydrophobicContact CG2-CD2 4.44Å; V233-F266 HydrophobicContact CG2-CE2 3.51Å; V233-F266 HydrophobicContact CG2-CZ 4.08Å
234I92.9Very high89.5Confident47 Ų4747 Ų4724%0.24125%0.246CC..EExtended strand (participates in β ladder)trans-94.7122-179.9-61.2167000107.8E224 T225 L261 C262 E263E224-I234 CarbonylContact C-O 3.44Å; E224-I234 WeakPolarHBondContact CA-O 3.46Å; T225-I234 PolarHBondContact N-O 3.11Å; T225-I234 PolarHBondContact O-N 3.36Å; I234-L261 HydrophobicContact CG2-CD1 3.49Å; I234-L261 VanDerWaalsContact CG2-CD1 3.49Å; I234-L261 HydrophobicContact CG2-CG 4.39Å; I234-C262 CarbonylContact C-O 3.56Å; I234-C262 VanDerWaalsContact CA-O 3.31Å; I234-C262 WeakPolarHBondContact CA-O 3.48Å; I234-E263 HydrophobicContact CG1-CG 4.27Å
235L94.2Very high89.7Confident0 Ų046.8 Ų46.80%025%0.245CC..EExtended strand (participates in β ladder)trans-95.6116.6166.8178.9153.6000108L141 T222 C237 L261 C262 F264L141-L235 HydrophobicContact CB-CD1 3.69Å; L141-L235 HydrophobicContact CD1-CB 4.33Å; T222-L235 HydrophobicContact CG2-CD1 4.34Å; T222-L235 HydrophobicContact CG2-CD2 4.25Å; T222-L235 HydrophobicContact CG2-CG 4.36Å; L235-C237 HydrophobicContact CD2-CB 3.97Å; L235-L261 WeakPolarHBondContact O-CA 3.28Å; L235-C262 HydrophobicContact CB-CB 4.35Å; L235-C262 PolarHBondContact N-O 3.11Å; L235-C262 PolarHBondContact O-N 2.84Å; L235-F264 HydrophobicContact CB-CD2 4.43Å; L235-F264 HydrophobicContact CB-CE2 4.03Å; L235-F264 HydrophobicContact CD1-CE2 4.37Å
236D95.6Very high89.9Confident22 Ų2243.7 Ų43.712%0.11823%0.226CC..EExtended strand (participates in β ladder)trans-110.5113.5174.8-179.420.8000109.2R223 R259 L261R223-D236 HydrophobicContact CB-CB 4.46Å; R223-D236 PolarHBondContact N-O 3.41Å; R223-D236 IonicContact NH1-OD2 3.77Å; R223-D236 PolarHBondContact O-N 2.89Å; D236-R259 IonicContact OD1-CZ 3.23Å; D236-R259 VanDerWaalsContact OD1-CZ 3.27Å; D236-R259 IonicContact OD1-NE 2.66Å; D236-R259 PolarHBondContact OD1-NE 3.35Å; D236-R259 IonicContact OD1-NH2 2.95Å; D236-R259 PolarHBondContact OD1-NH2 2.91Å; D236-R259 IonicContact OD2-CZ 2.69Å; D236-R259 IonicContact OD2-NE 3.08Å; D236-R259 IonicContact OD2-NH2 2.77Å; D236-R259 PolarHBondContact OD2-NH2 2.95Å; D236-L261 HydrophobicContact CB-CD1 3.97Å
237C95.9Very high89.9Confident0 Ų043.1 Ų43.10%023%0.23CC..EExtended strand (participates in β ladder)trans-123102.2179.9-175.30000110.4T219 R220 T222 L235 H239 T240 R259 L260T219-C237 HydrophobicContact CG2-CB 4.37Å; R220-C237 PolarHBondContact N-SG 3.3Å; R220-C237 PolarHBondContact O-SG 3.21Å; T222-C237 HydrophobicContact CG2-CB 3.83Å; L235-C237 HydrophobicContact CD2-CB 3.97Å; C237-H239 PolarHBondContact O-N 3.19Å; C237-H239 PolarHBondContact SG-O 2.99Å; C237-T240 WeakPolarHBondContact CB-OG1 3.5Å; C237-T240 PolarHBondContact O-OG1 3.14Å; C237-T240 PolarHBondContact SG-OG1 2.97Å; C237-R259 CarbonylContact O-C 3.5Å; C237-R259 WeakPolarHBondContact O-CA 3.39Å; C237-L260 HydrophobicContact CB-CB 4.48Å; C237-L260 PolarHBondContact N-O 3.13Å; C237-L260 PolarHBondContact O-N 2.7Å
238E95.9Very high89.8Confident99 Ų9946.1 Ų46.146%0.46324%0.242SC..EExtended strand (participates in β ladder)trans-66.7-23.6179.5-177.3160-146.400114R289E238-R289 PolarHBondContact O-NH1 3.48Å; E238-R289 IonicContact OE1-CZ 3.25Å; E238-R289 IonicContact OE1-NH1 3.12Å; E238-R289 IonicContact OE1-NH2 3.44Å; E238-R289 PolarHBondContact OE1-NH2 3.41Å
239H96Very high89.5Confident108 Ų10843.4 Ų43.450%0.524%0.236SC..EExtended strand (participates in β ladder)trans-122.473.3-175.8-62.290.3000109.9R220 C237R220-H239 HydrophobicContact CB-CB 4.15Å; R220-H239 PolarHBondContact N-O 3.29Å; R220-H239 VanDerWaalsContact N-O 3.08Å; C237-H239 PolarHBondContact O-N 3.19Å; C237-H239 PolarHBondContact SG-O 2.99Å
240T97.2Very high89.6Confident1 Ų139.3 Ų39.31%0.00621%0.205CC..EExtended strand (participates in β ladder)trans-104.1128.1172.1-59.20000110.7Y217 I218 T219 C237 G258 L260 F286Y217-T240 HydrophobicContact CD1-CG2 4.41Å; I218-T240 CarbonylContact O-C 3.55Å; I218-T240 VanDerWaalsContact O-CA 3.31Å; I218-T240 WeakPolarHBondContact O-CA 3.37Å; T219-T240 HydrophobicContact CG2-CG2 4.38Å; C237-T240 WeakPolarHBondContact CB-OG1 3.5Å; C237-T240 PolarHBondContact O-OG1 3.14Å; C237-T240 PolarHBondContact SG-OG1 2.97Å; T240-G258 PolarHBondContact N-O 3.18Å; T240-G258 PolarHBondContact O-N 3.15Å; T240-G258 VanDerWaalsContact O-O 3.1Å; T240-L260 HydrophobicContact CG2-CB 3.9Å; T240-L260 HydrophobicContact CG2-CD2 4.11Å; T240-L260 WeakPolarHBondContact OG1-CB 3.34Å; T240-F286 HydrophobicContact CG2-CE2 4.05Å
241S97.5Very high90.1Very high6 Ų641.8 Ų41.84%0.04221%0.211CC..EExtended strand (participates in β ladder)trans-108113.3173.3-54.60000109.4Y217 I218 T256 D257Y217-S241 WeakPolarHBondContact CA-O 3.36Å; I218-S241 PolarHBondContact N-O 3.05Å; I218-S241 PolarHBondContact O-N 3.48Å; S241-T256 WeakPolarHBondContact CA-O 3.33Å; S241-D257 VanDerWaalsContact CB-OD1 3.23Å; S241-D257 WeakPolarHBondContact CB-OD1 3.34Å; S241-D257 PolarHBondContact OG-OD1 2.83Å
242M98Very high90.6Very high1 Ų138.7 Ų38.71%0.00520%0.195CC..EExtended strand (participates in β ladder)trans-84113.2165.3172.7-177.5166.300107.9I207 L215 Y217 T244 T256 F286 L319I207-M242 HydrophobicContact CD1-CE 4.01Å; L215-M242 HydrophobicContact CD1-CE 3.69Å; L215-M242 HydrophobicContact CD1-CG 3.82Å; L215-M242 HydrophobicContact CD1-SD 4.47Å; Y217-M242 HydrophobicContact CD1-CB 3.75Å; Y217-M242 HydrophobicContact CD1-CG 4.1Å; Y217-M242 HydrophobicContact CE1-CB 3.57Å; Y217-M242 HydrophobicContact CE1-CG 3.53Å; Y217-M242 HydrophobicContact CE1-SD 3.8Å; M242-T244 HydrophobicContact CE-CG2 3.99Å; M242-T256 PolarHBondContact N-O 3.13Å; M242-T256 PolarHBondContact O-N 3.06Å; M242-F286 HydrophobicContact CB-CE1 3.8Å; M242-F286 HydrophobicContact CB-CZ 3.88Å; M242-F286 HydrophobicContact SD-CD1 4.5Å; M242-F286 HydrophobicContact SD-CE1 4.06Å; M242-L319 HydrophobicContact CE-CD2 4.28Å
243V97.5Very high91Very high7 Ų740.3 Ų40.34%0.04221%0.206CC..EExtended strand (participates in β ladder)trans-106.4132.1-179.4-1720000109.2L215 Y216 I218 Q255L215-V243 WeakPolarHBondContact CA-O 3.44Å; Y216-V243 HydrophobicContact CD2-CB 4.05Å; Y216-V243 HydrophobicContact CD2-CG2 4.27Å; Y216-V243 HydrophobicContact CE1-CB 4.27Å; Y216-V243 HydrophobicContact CE1-CG1 4.32Å; Y216-V243 HydrophobicContact CE2-CB 3.52Å; Y216-V243 HydrophobicContact CE2-CG1 4.12Å; Y216-V243 HydrophobicContact CE2-CG2 3.62Å; Y216-V243 PolarHBondContact N-O 3.39Å; Y216-V243 VanDerWaalsContact N-O 3.11Å; Y216-V243 PolarHBondContact O-N 2.78Å; I218-V243 HydrophobicContact CD1-CG2 4.34Å; V243-Q255 HydrophobicContact CG2-CG 4.34Å
244T97Very high91.2Very high3 Ų340.2 Ų40.22%0.01821%0.206CC..EExtended strand (participates in β ladder)trans-127.5130.4174.2510000110.6I207 V212 E214 L215 M242 H246 V254I207-T244 HydrophobicContact CG2-CG2 4.2Å; V212-T244 HydrophobicContact CG1-CG2 4.05Å; V212-T244 HydrophobicContact CG2-CG2 4.13Å; E214-T244 CarbonylContact O-C 3.57Å; E214-T244 VanDerWaalsContact O-CA 3.3Å; E214-T244 WeakPolarHBondContact O-CA 3.46Å; L215-T244 HydrophobicContact CB-CG2 4.4Å; L215-T244 HydrophobicContact CD1-CG2 3.57Å; M242-T244 HydrophobicContact CE-CG2 3.99Å; T244-H246 PolarHBondContact O-CD2 2.83Å; T244-H246 PolarHBondContact OG1-NE2 3.46Å; T244-V254 PolarHBondContact N-O 2.94Å; T244-V254 PolarHBondContact O-N 3.26Å; T244-V254 PolarHBondContact OG1-O 3.17Å
245Q94.7Very high91.4Very high58 Ų5840.3 Ų40.327%0.27121%0.205SC..EExtended strand (participates in β ladder)trans-99.6127170.6-170.6175.34500109.4V212 I213 E214V212-Q245 CarbonylContact C-O 3.52Å; V212-Q245 WeakPolarHBondContact CA-O 3.48Å; I213-Q245 HydrophobicContact CD1-CG 4.11Å; I213-Q245 HydrophobicContact CG1-CB 4.14Å; I213-Q245 HydrophobicContact CG1-CG 4.16Å; I213-Q245 VanDerWaalsContact CG1-O 3.26Å; I213-Q245 WeakPolarHBondContact CG1-O 3.37Å; I213-Q245 PolarHBondContact N-O 3.37Å; E214-Q245 HydrophobicContact CB-CB 4.24Å; E214-Q245 PolarHBondContact O-N 3.45Å
246H93.4Very high91.6Very high1 Ų140.3 Ų40.31%0.00521%0.205CC..EExtended strand (participates in β ladder)trans-104.6146.4-179.1-59.7-107.6000109.8G211 V212 T244 M251 T252 F314G211-H246 WeakPolarHBondContact O-CA 3.28Å; V212-H246 WeakPolarHBondContact CG2-CE1 3.24Å; T244-H246 PolarHBondContact O-CD2 2.83Å; T244-H246 PolarHBondContact OG1-NE2 3.46Å; H246-M251 CarbonylContact O-C 3.6Å; H246-M251 VanDerWaalsContact O-CA 3.28Å; H246-M251 WeakPolarHBondContact O-CA 3.42Å; H246-T252 PolarHBondContact N-O 3.22Å; H246-T252 PolarHBondContact O-N 2.68Å; H246-F314 HydrophobicContact CB-CE2 4.42Å; H246-F314 HydrophobicContact CB-CZ 4.03Å; H246-F314 AromaticContact CD2-CZ 3.81Å; H246-F314 AromaticContact CE1-CE2 3.77Å; H246-F314 AromaticContact CE1-CZ 3.89Å; H246-F314 AromaticContact CG-CE2 3.86Å; H246-F314 AromaticContact CG-CZ 3.55Å; H246-F314 AromaticContact ND1-CE2 3.45Å; H246-F314 WeakPolarHBondContact ND1-CE2 3.43Å; H246-F314 AromaticContact ND1-CZ 3.63Å
247C85.3Confident91.7Very high59 Ų5940.9 Ų40.940%0.39921%0.208SC..  trans-94.7-22.8173-97.50000113.5G211 I213 F250G211-C247 PolarHBondContact O-N 3.37Å; G211-C247 VanDerWaalsContact O-N 3.08Å; I213-C247 HydrophobicContact CG2-CB 4.07Å; I213-C247 VanDerWaalsContact CG2-SG 3.52Å; C247-F250 CarbonylContact C-O 3.54Å
248K76.7Confident91.8Very high163 Ų16341 Ų4171%0.70921%0.21SC*.SBendtrans-134.6145.2-176.5-64.5179.2-178.8176.10108.9F250K248-F250 VanDerWaalsContact C-N 3.31Å
249P68.4Low91.9Very high76 Ų7640.7 Ų40.749%0.49420%0.204SC..SBendcis-70.7-23.8-2.228.8-34.6000113.3
250F74.8Confident91.9Very high42 Ų4235.6 Ų35.618%0.18418%0.18CC..SBendtrans-133.5169.8176.3-51.9-69.3000109.4C247 K248 T252 I299 F306 L310C247-F250 CarbonylContact C-O 3.54Å; K248-F250 VanDerWaalsContact C-N 3.31Å; F250-T252 PolarHBondContact O-N 3.11Å; F250-I299 HydrophobicContact CB-CD1 3.54Å; F250-I299 HydrophobicContact CD1-CD1 3.77Å; F250-I299 HydrophobicContact CD2-CD1 4.36Å; F250-I299 HydrophobicContact CG-CD1 3.6Å; F250-F306 HydrophobicContact CD1-CZ 4.39Å; F250-F306 AromaticContact CE1-CE2 3.81Å; F250-F306 HydrophobicContact CE1-CE2 3.81Å; F250-F306 AromaticContact CE1-CZ 3.49Å; F250-F306 HydrophobicContact CE1-CZ 3.49Å; F250-F306 VanDerWaalsContact CE1-CZ 3.49Å; F250-F306 AromaticContact CZ-CE2 3.72Å; F250-F306 HydrophobicContact CZ-CE2 3.72Å; F250-F306 AromaticContact CZ-CZ 3.71Å; F250-F306 HydrophobicContact CZ-CZ 3.71Å; F250-L310 HydrophobicContact CD1-CD2 4.42Å; F250-L310 HydrophobicContact CD2-CD2 3.37Å; F250-L310 HydrophobicContact CE1-CD2 4.36Å; F250-L310 HydrophobicContact CE2-CD2 3.29Å; F250-L310 HydrophobicContact CE2-CG 4.41Å; F250-L310 HydrophobicContact CG-CD2 3.98Å; F250-L310 HydrophobicContact CZ-CD2 3.82Å
251M84.5Confident91.9Very high113 Ų11338.3 Ų38.356%0.55720%0.195SC*.SBendtrans-74.254.5177.5-66.3-175.774.600112.5H246 P296H246-M251 CarbonylContact O-C 3.6Å; H246-M251 VanDerWaalsContact O-CA 3.28Å; H246-M251 WeakPolarHBondContact O-CA 3.42Å; M251-P296 HydrophobicContact CB-CG 4.26Å; M251-P296 WeakPolarHBondContact O-CD 3.13Å; M251-P296 WeakPolarHBondContact O-CG 3.24Å
252T90.4Very high91.8Very high3 Ų338 Ų382%0.01819%0.193CC..  trans-83.2135.3-172.4-54.40000110.8H246 F250 V254 E293 Y294 I295 F314H246-T252 PolarHBondContact N-O 3.22Å; H246-T252 PolarHBondContact O-N 2.68Å; F250-T252 PolarHBondContact O-N 3.11Å; T252-V254 HydrophobicContact CG2-CG2 4.26Å; T252-E293 HydrophobicContact CG2-CB 4.06Å; T252-Y294 WeakPolarHBondContact CG2-O 3.41Å; T252-I295 HydrophobicContact CG2-CG1 4.3Å; T252-F314 HydrophobicContact CG2-CE1 3.92Å
253S94.1Very high91.7Very high36 Ų3640.3 Ų40.325%0.25220%0.204SC..EExtended strand (participates in β ladder)trans-98121.7170.6-178.30000109.4Y294S253-Y294 PolarHBondContact N-O 2.86Å; S253-Y294 WeakPolarHBondContact O-CB 3.37Å; S253-Y294 PolarHBondContact O-N 2.95Å
254V96.1Very high91.5Very high0 Ų040 Ų400%020%0.202CC..EExtended strand (participates in β ladder)trans-107.3115.7179.4-177.90000108.8T244 T252 N292 E293 F314 T315T244-V254 PolarHBondContact N-O 2.94Å; T244-V254 PolarHBondContact O-N 3.26Å; T244-V254 PolarHBondContact OG1-O 3.17Å; T252-V254 HydrophobicContact CG2-CG2 4.26Å; V254-N292 WeakPolarHBondContact CA-O 3.44Å; V254-E293 HydrophobicContact CG1-CG 4.27Å; V254-E293 HydrophobicContact CG2-CB 4.38Å; V254-E293 HydrophobicContact CG2-CG 3.97Å; V254-F314 HydrophobicContact CG2-CE1 4.02Å; V254-F314 HydrophobicContact CG2-CZ 3.84Å; V254-T315 HydrophobicContact CG1-CG2 4.21Å; V254-T315 HydrophobicContact CG2-CG2 4.03Å
255Q97.1Very high91.1Very high48 Ų4840.1 Ų40.122%0.22420%0.203CC..EExtended strand (participates in β ladder)trans-100.8121.8175.1-178.1178.9-47.100109.3V243 D257 H291 N292 Y294V243-Q255 HydrophobicContact CG2-CG 4.34Å; Q255-D257 VanDerWaalsContact NE2-CG 3.33Å; Q255-D257 PolarHBondContact NE2-OD1 2.87Å; Q255-D257 PolarHBondContact NE2-OD2 2.85Å; Q255-H291 CarbonylContact O-C 3.47Å; Q255-H291 VanDerWaalsContact O-CA 3.26Å; Q255-H291 WeakPolarHBondContact O-CA 3.46Å; Q255-N292 PolarHBondContact N-O 3.35Å; Q255-N292 PolarHBondContact O-N 2.78Å; Q255-Y294 HydrophobicContact CB-CD2 4.43Å; Q255-Y294 HydrophobicContact CB-CE2 3.8Å
256T98Very high90.6Very high0 Ų038.3 Ų38.30%019%0.194CC..EExtended strand (participates in β ladder)trans-113.1109.7-179.2-49.80000108.3S241 M242 F286 I288 H291 G318S241-T256 WeakPolarHBondContact CA-O 3.33Å; M242-T256 PolarHBondContact N-O 3.13Å; M242-T256 PolarHBondContact O-N 3.06Å; T256-F286 HydrophobicContact CG2-CE1 4.15Å; T256-F286 HydrophobicContact CG2-CZ 4.48Å; T256-I288 HydrophobicContact CG2-CB 4.22Å; T256-I288 HydrophobicContact CG2-CD1 3.87Å; T256-I288 HydrophobicContact CG2-CG1 3.8Å; T256-I288 HydrophobicContact CG2-CG2 3.44Å; T256-I288 VanDerWaalsContact CG2-CG2 3.44Å; T256-H291 HydrophobicContact CG2-CB 4.48Å; T256-G318 WeakPolarHBondContact OG1-CA 3.27Å
257D97.8Very high89.4Confident34 Ų3439.8 Ų39.818%0.18220%0.204CC..EExtended strand (participates in β ladder)trans-100134-173.8-67.3-46.1000111.1S241 Q255 R289 T290S241-D257 VanDerWaalsContact CB-OD1 3.23Å; S241-D257 WeakPolarHBondContact CB-OD1 3.34Å; S241-D257 PolarHBondContact OG-OD1 2.83Å; Q255-D257 VanDerWaalsContact NE2-CG 3.33Å; Q255-D257 PolarHBondContact NE2-OD1 2.87Å; Q255-D257 PolarHBondContact NE2-OD2 2.85Å; D257-R289 PolarHBondContact O-N 3.44Å; D257-T290 PolarHBondContact N-O 2.86Å; D257-T290 PolarHBondContact O-N 3.31Å
258G97.1Very high88.5Confident3 Ų341.3 Ų41.33%0.03121%0.214CC..EExtended strand (participates in β ladder)trans-166.1-178.7-173.600000114T240 L287T240-G258 PolarHBondContact N-O 3.18Å; T240-G258 PolarHBondContact O-N 3.15Å; T240-G258 VanDerWaalsContact O-O 3.1Å; G258-L287 CarbonylContact C-O 3.5Å; G258-L287 WeakPolarHBondContact CA-O 3.34Å
259R97.5Very high87.7Confident93 Ų9335.5 Ų35.535%0.35119%0.192SC..EExtended strand (participates in β ladder)trans-97.3126.6169.8176.3174.8-174.7-160.85.4109D236 C237 L287D236-R259 IonicContact OD1-CZ 3.23Å; D236-R259 VanDerWaalsContact OD1-CZ 3.27Å; D236-R259 IonicContact OD1-NE 2.66Å; D236-R259 PolarHBondContact OD1-NE 3.35Å; D236-R259 IonicContact OD1-NH2 2.95Å; D236-R259 PolarHBondContact OD1-NH2 2.91Å; D236-R259 IonicContact OD2-CZ 2.69Å; D236-R259 IonicContact OD2-NE 3.08Å; D236-R259 IonicContact OD2-NH2 2.77Å; D236-R259 PolarHBondContact OD2-NH2 2.95Å; C237-R259 CarbonylContact O-C 3.5Å; C237-R259 WeakPolarHBondContact O-CA 3.39Å; R259-L287 HydrophobicContact CB-CB 4.41Å; R259-L287 PolarHBondContact N-O 2.85Å; R259-L287 PolarHBondContact O-N 2.99Å
260L97.7Very high87.2Confident0 Ų037.5 Ų37.50%021%0.205CC..EExtended strand (participates in β ladder)trans-102.1127.1171-177.864000109.3T219 C237 T240 W284 H285 F286T219-L260 HydrophobicContact CG2-CD2 4.27Å; C237-L260 HydrophobicContact CB-CB 4.48Å; C237-L260 PolarHBondContact N-O 3.13Å; C237-L260 PolarHBondContact O-N 2.7Å; T240-L260 HydrophobicContact CG2-CB 3.9Å; T240-L260 HydrophobicContact CG2-CD2 4.11Å; T240-L260 WeakPolarHBondContact OG1-CB 3.34Å; L260-W284 HydrophobicContact CD1-CD2 3.89Å; L260-W284 VanDerWaalsContact CD1-CE2 3.46Å; L260-W284 HydrophobicContact CD1-CE3 4.4Å; L260-W284 HydrophobicContact CD1-CG 4.36Å; L260-W284 HydrophobicContact CD1-CH2 4.11Å; L260-W284 HydrophobicContact CD1-CZ2 3.58Å; L260-W284 HydrophobicContact CD2-CH2 3.86Å; L260-W284 HydrophobicContact CD2-CZ2 4.07Å; L260-W284 HydrophobicContact CD2-CZ3 4.32Å; L260-H285 WeakPolarHBondContact CA-O 3.47Å; L260-F286 HydrophobicContact CB-CD2 4.26Å; L260-F286 HydrophobicContact CD1-CB 4.16Å; L260-F286 HydrophobicContact CD1-CD2 4.39Å
261L96.9Very high86.5Confident59 Ų5939.2 Ų39.231%0.30923%0.234SC..EExtended strand (participates in β ladder)trans-118.4115.1170.6-176.871.8000107.8I234 L235 D236 H285I234-L261 HydrophobicContact CG2-CD1 3.49Å; I234-L261 VanDerWaalsContact CG2-CD1 3.49Å; I234-L261 HydrophobicContact CG2-CG 4.39Å; L235-L261 WeakPolarHBondContact O-CA 3.28Å; D236-L261 HydrophobicContact CB-CD1 3.97Å; L261-H285 HydrophobicContact CB-CB 4.34Å; L261-H285 PolarHBondContact N-O 2.91Å; L261-H285 PolarHBondContact O-N 3.34Å
262C95.9Very high85.4Confident0 Ų039 Ų390%023%0.232CC..EExtended strand (participates in β ladder)trans-117.4132.6178-71.40000110.6I234 L235 F264 T283I234-C262 CarbonylContact C-O 3.56Å; I234-C262 VanDerWaalsContact CA-O 3.31Å; I234-C262 WeakPolarHBondContact CA-O 3.48Å; L235-C262 HydrophobicContact CB-CB 4.35Å; L235-C262 PolarHBondContact N-O 3.11Å; L235-C262 PolarHBondContact O-N 2.84Å; C262-F264 HydrophobicContact CB-CD2 4.17Å; C262-F264 HydrophobicContact CB-CE2 3.62Å; C262-F264 HydrophobicContact CB-CZ 4.3Å; C262-T283 CarbonylContact C-O 3.56Å; C262-T283 WeakPolarHBondContact CA-O 3.31Å
263E94.9Very high83.8Confident49 Ų4946 Ų4623%0.22927%0.274CS..EExtended strand (participates in β ladder)trans-103.3120.6165.7-172-171.9155.100108.8A232 I234 R282 T283A232-E263 HydrophobicContact CB-CG 3.95Å; A232-E263 WeakPolarHBondContact CB-OE1 3.44Å; I234-E263 HydrophobicContact CG1-CG 4.27Å; E263-R282 PolarHBondContact O-N 2.96Å; E263-T283 PolarHBondContact N-O 2.76Å; E263-T283 PolarHBondContact O-N 2.76Å; E263-T283 PolarHBondContact OE2-OG1 2.87Å
264F93.1Very high82Confident0 Ų048.6 Ų48.60%029%0.288CS..EExtended strand (participates in β ladder)trans-98.7126.3174.4-68.9-94.8000110.3L141 K144 I145 A232 V233 L235 C262 F266 P279 R280 I281L141-F264 HydrophobicContact CB-CD2 4.42Å; L141-F264 HydrophobicContact CB-CE2 4.11Å; L141-F264 HydrophobicContact CB-CZ 4.46Å; L141-F264 HydrophobicContact CD1-CD2 3.71Å; L141-F264 HydrophobicContact CD1-CE2 4.17Å; L141-F264 HydrophobicContact CD1-CG 4.27Å; L141-F264 HydrophobicContact CD2-CB 4.08Å; L141-F264 HydrophobicContact CD2-CD1 3.99Å; L141-F264 HydrophobicContact CD2-CD2 3.86Å; L141-F264 HydrophobicContact CD2-CE1 4.34Å; L141-F264 HydrophobicContact CD2-CE2 4.22Å; L141-F264 HydrophobicContact CD2-CG 3.71Å; L141-F264 HydrophobicContact CD2-CZ 4.45Å; L141-F264 HydrophobicContact CG-CD2 4.21Å; L141-F264 HydrophobicContact CG-CE2 4.41Å; K144-F264 HydrophobicContact CB-CE1 4.08Å; K144-F264 HydrophobicContact CG-CE1 3.82Å; I145-F264 HydrophobicContact CD1-CZ 4.09Å; A232-F264 WeakPolarHBondContact CA-O 3.22Å; V233-F264 PolarHBondContact N-O 2.87Å; V233-F264 PolarHBondContact O-N 3.21Å; L235-F264 HydrophobicContact CB-CD2 4.43Å; L235-F264 HydrophobicContact CB-CE2 4.03Å; L235-F264 HydrophobicContact CD1-CE2 4.37Å; C262-F264 HydrophobicContact CB-CD2 4.17Å; C262-F264 HydrophobicContact CB-CE2 3.62Å; C262-F264 HydrophobicContact CB-CZ 4.3Å; F264-F266 HydrophobicContact CB-CE2 4.48Å; F264-P279 HydrophobicContact CB-CB 4.28Å; F264-P279 HydrophobicContact CD1-CB 3.95Å; F264-P279 HydrophobicContact CG-CB 4.46Å; F264-R280 CarbonylContact C-O 3.55Å; F264-R280 VanDerWaalsContact CA-O 3.31Å; F264-R280 WeakPolarHBondContact CA-O 3.4Å; F264-I281 HydrophobicContact CD1-CG1 3.81Å; F264-I281 HydrophobicContact CE1-CD1 4.04Å; F264-I281 HydrophobicContact CE1-CG1 3.36Å; F264-I281 HydrophobicContact CZ-CD1 4.23Å; F264-I281 HydrophobicContact CZ-CG1 3.86Å
265A89.6Confident80Confident6 Ų655 Ų555%0.0532%0.322CS..EExtended strand (participates in β ladder)trans-93.3143.9167.600000109.8E175 P279 R280 R282E175-A265 HydrophobicContact CG-CB 3.75Å; A265-P279 WeakPolarHBondContact O-CA 3.26Å; A265-R280 PolarHBondContact N-O 3.06Å; A265-R280 PolarHBondContact O-N 3.42Å; A265-R282 HydrophobicContact CB-CB 4.31Å
266F82.7Confident78.2Confident20 Ų2057.1 Ų57.19%0.08834%0.335CS..EExtended strand (participates in β ladder)trans-101.879.1175.2-70.5-94.9000107.6L135 F139 L141 N231 V233 F264 F277 P279L135-F266 HydrophobicContact CD2-CD1 4.41Å; L135-F266 HydrophobicContact CD2-CD2 4.48Å; L135-F266 HydrophobicContact CD2-CE1 4.21Å; L135-F266 HydrophobicContact CD2-CE2 4.3Å; L135-F266 HydrophobicContact CD2-CZ 4.14Å; F139-F266 HydrophobicContact CD2-CD1 4.28Å; F139-F266 AromaticContact CD2-CE1 3.48Å; F139-F266 HydrophobicContact CD2-CE1 3.48Å; F139-F266 VanDerWaalsContact CD2-CE1 3.48Å; F139-F266 HydrophobicContact CD2-CZ 4.32Å; F139-F266 AromaticContact CE2-CD1 3.95Å; F139-F266 HydrophobicContact CE2-CD1 3.95Å; F139-F266 AromaticContact CE2-CE1 3.61Å; F139-F266 HydrophobicContact CE2-CE1 3.61Å; F139-F266 HydrophobicContact CG-CE1 4.04Å; F139-F266 HydrophobicContact CZ-CE1 4.33Å; L141-F266 HydrophobicContact CD2-CZ 4.46Å; N231-F266 WeakPolarHBondContact O-CD2 3.45Å; V233-F266 HydrophobicContact CB-CE2 3.97Å; V233-F266 HydrophobicContact CG2-CD2 4.44Å; V233-F266 HydrophobicContact CG2-CE2 3.51Å; V233-F266 HydrophobicContact CG2-CZ 4.08Å; F264-F266 HydrophobicContact CB-CE2 4.48Å; F266-F277 HydrophobicContact CB-CB 4.13Å; F266-F277 HydrophobicContact CB-CD1 4.39Å; F266-F277 HydrophobicContact CD1-CB 4.15Å; F266-F277 WeakPolarHBondContact O-CD1 3.44Å; F266-P279 HydrophobicContact CD1-CB 4.44Å; F266-P279 HydrophobicContact CE1-CB 3.9Å; F266-P279 HydrophobicContact CE1-CG 4.47Å; F266-P279 HydrophobicContact CZ-CB 4.02Å
267S69.8Low77Confident31 Ų3160.3 Ų60.322%0.21735%0.349CS..EExtended strand (participates in β ladder)trans-91.4137.3-178.2-164.50000110.5E175 V269E175-S267 WeakPolarHBondContact OE1-CB 3.49Å; S267-V269 PolarHBondContact O-N 2.79Å
268P66.4Low76.2Confident92 Ų9261.4 Ų61.460%0.59735%0.354SS*.PPolyproline II helixtrans-68.1119.1169.928.8-32.4000109P270 F277P268-P270 WeakPolarHBondContact O-CD 3.46Å; P268-F277 HydrophobicContact CB-CE1 4.35Å
269V60Low75.8Confident40 Ų4061.9 Ų61.924%0.24236%0.357CS..PPolyproline II helixtrans-70.1120.5-179.1178.40000109.6S267 G271 H272 I278S267-V269 PolarHBondContact O-N 2.79Å; V269-G271 PolarHBondContact O-N 2.78Å; V269-G271 VanDerWaalsContact O-N 3.12Å; V269-H272 HydrophobicContact CB-CB 4.43Å; V269-H272 PolarHBondContact O-N 3.09Å; V269-H272 VanDerWaalsContact O-N 3.09Å; V269-I278 HydrophobicContact CG2-CB 4Å; V269-I278 HydrophobicContact CG2-CD1 4Å; V269-I278 HydrophobicContact CG2-CG1 3.93Å
270P57.3Low75.5Confident119 Ų11958.4 Ų58.477%0.77334%0.344SS*.THydrogen-bonded Turntrans-58.2119.8178.4-24.434.9000111.2P268P268-P270 WeakPolarHBondContact O-CD 3.46Å
271G60.2Low75.4Confident77 Ų7758.4 Ų58.479%0.79434%0.344SS*.THydrogen-bonded Turntrans101.6-10.7-179.400000115.6V269V269-G271 PolarHBondContact O-N 2.78Å; V269-G271 VanDerWaalsContact O-N 3.12Å
272H60.3Low75.3Confident110 Ų11059 Ų5951%0.50934%0.342SS..  trans-82.2124.3165.2-99.8-118.2000110.3V269 V274V269-H272 HydrophobicContact CB-CB 4.43Å; V269-H272 PolarHBondContact O-N 3.09Å; V269-H272 VanDerWaalsContact O-N 3.09Å; H272-V274 VanDerWaalsContact C-N 3.32Å
273V57.4Low75.4Confident149 Ų14960.8 Ų60.890%0.90335%0.353SS*.  trans-84.5-10.5179-174.20000112
274V56.6Low75.5Confident90 Ų9058.5 Ų58.555%0.54534%0.342SS..SBendtrans-96.4143.3178.5-170.30000109H272 D276H272-V274 VanDerWaalsContact C-N 3.32Å; V274-D276 HydrophobicContact CG1-CB 4.4Å; V274-D276 WeakPolarHBondContact CG1-OD2 3.31Å; V274-D276 PolarHBondContact O-N 3.12Å
275D53.3Low75.8Confident136 Ų13660.7 Ų60.773%0.72735%0.352SS*.  trans-65.530.8173.2-67.7-53.1000113.9F277D275-F277 VanDerWaalsContact C-N 3.3Å; D275-F277 HydrophobicContact CB-CE2 4.46Å; D275-F277 VanDerWaalsContact O-CD2 3.24Å; D275-F277 WeakPolarHBondContact O-CD2 3.43Å; D275-F277 PolarHBondContact O-N 2.99Å
276D60.7Low76.2Confident91 Ų9160.4 Ų60.449%0.48735%0.35SS..  trans-78.180.1176.1-70.6-29000109.1V274 I278V274-D276 HydrophobicContact CG1-CB 4.4Å; V274-D276 WeakPolarHBondContact CG1-OD2 3.31Å; V274-D276 PolarHBondContact O-N 3.12Å; D276-I278 WeakPolarHBondContact O-CG1 3.26Å; D276-I278 PolarHBondContact O-N 2.91Å
277F71.7Confident76.9Confident68 Ų6862.5 Ų62.530%0.29836%0.362SS..  trans-60.495.9169.7-68.2-84.6000110.2F139 F266 P268 D275 P279F139-F277 WeakPolarHBondContact CZ-O 3.1Å; F266-F277 HydrophobicContact CB-CB 4.13Å; F266-F277 HydrophobicContact CB-CD1 4.39Å; F266-F277 HydrophobicContact CD1-CB 4.15Å; F266-F277 WeakPolarHBondContact O-CD1 3.44Å; P268-F277 HydrophobicContact CB-CE1 4.35Å; D275-F277 VanDerWaalsContact C-N 3.3Å; D275-F277 HydrophobicContact CB-CE2 4.46Å; D275-F277 VanDerWaalsContact O-CD2 3.24Å; D275-F277 WeakPolarHBondContact O-CD2 3.43Å; D275-F277 PolarHBondContact O-N 2.99Å; F277-P279 WeakPolarHBondContact O-CD 3.44Å
278I81.2Confident78.3Confident57 Ų5761.5 Ų61.529%0.29235%0.354SS..EExtended strand (participates in β ladder)trans-73.5123.1176.7-55.3-168.1000108.3V269 D276 R280V269-I278 HydrophobicContact CG2-CB 4Å; V269-I278 HydrophobicContact CG2-CD1 4Å; V269-I278 HydrophobicContact CG2-CG1 3.93Å; D276-I278 WeakPolarHBondContact O-CG1 3.26Å; D276-I278 PolarHBondContact O-N 2.91Å; I278-R280 PolarHBondContact O-N 2.94Å; I278-R280 VanDerWaalsContact O-N 3.13Å
279P88.2Confident79.7Confident13 Ų1362.5 Ų62.58%0.08435%0.346CS..EExtended strand (participates in β ladder)trans-69111.817527.5-32.7000109.5F139 L141 K144 F264 A265 F266 F277F139-P279 HydrophobicContact CD1-CG 4.41Å; L141-P279 HydrophobicContact CD2-CB 3.94Å; L141-P279 HydrophobicContact CD2-CG 4.31Å; K144-P279 VanDerWaalsContact CE-O 3.27Å; K144-P279 WeakPolarHBondContact CE-O 3.47Å; K144-P279 HydrophobicContact CG-CG 4.48Å; F264-P279 HydrophobicContact CB-CB 4.28Å; F264-P279 HydrophobicContact CD1-CB 3.95Å; F264-P279 HydrophobicContact CG-CB 4.46Å; A265-P279 WeakPolarHBondContact O-CA 3.26Å; F266-P279 HydrophobicContact CD1-CB 4.44Å; F266-P279 HydrophobicContact CE1-CB 3.9Å; F266-P279 HydrophobicContact CE1-CG 4.47Å; F266-P279 HydrophobicContact CZ-CB 4.02Å; F277-P279 WeakPolarHBondContact O-CD 3.44Å
280R92.1Very high81.4Confident19 Ų1964.3 Ų64.37%0.07236%0.357CS..EExtended strand (participates in β ladder)trans-107.7152.4170.3-52.6-170.4-65.4173.21.4110.1E175 D176 F264 A265 I278 R282E175-R280 HydrophobicContact CG-CB 4.07Å; E175-R280 WeakPolarHBondContact OE1-CB 3.3Å; E175-R280 IonicContact OE1-CZ 3.78Å; E175-R280 IonicContact OE1-NE 3.57Å; E175-R280 PolarHBondContact OE1-NE 2.93Å; E175-R280 IonicContact OE1-NH2 2.78Å; E175-R280 PolarHBondContact OE1-NH2 2.73Å; E175-R280 IonicContact OE2-CZ 3.62Å; E175-R280 IonicContact OE2-NE 2.96Å; E175-R280 IonicContact OE2-NH2 2.76Å; E175-R280 PolarHBondContact OE2-NH2 3.3Å; D176-R280 IonicContact OD2-CZ 3.34Å; D176-R280 IonicContact OD2-NH1 3.61Å; D176-R280 PolarHBondContact OD2-NH1 3.06Å; D176-R280 IonicContact OD2-NH2 3.27Å; D176-R280 PolarHBondContact OD2-NH2 3.35Å; F264-R280 CarbonylContact C-O 3.55Å; F264-R280 VanDerWaalsContact CA-O 3.31Å; F264-R280 WeakPolarHBondContact CA-O 3.4Å; A265-R280 PolarHBondContact N-O 3.06Å; A265-R280 PolarHBondContact O-N 3.42Å; I278-R280 PolarHBondContact O-N 2.94Å; I278-R280 VanDerWaalsContact O-N 3.13Å; R280-R282 PolarHBondContact O-N 3.49Å
281I95.6Very high83.2Confident1 Ų160.4 Ų60.41%0.00533%0.328CS..EExtended strand (participates in β ladder)trans-82.9114.9-174.6-58.1170.4000108.7I145 F173 F174 E175 A178 F264 T283 W284I145-I281 HydrophobicContact CD1-CD1 4.42Å; F173-I281 WeakPolarHBondContact O-CB 3.46Å; F173-I281 WeakPolarHBondContact O-CG1 2.97Å; F173-I281 PolarHBondContact O-N 3.38Å; F174-I281 WeakPolarHBondContact CA-O 3.31Å; F174-I281 HydrophobicContact CD1-CB 3.92Å; F174-I281 HydrophobicContact CD1-CG2 4.04Å; F174-I281 HydrophobicContact CE1-CB 4.19Å; F174-I281 HydrophobicContact CE1-CD1 4.48Å; F174-I281 HydrophobicContact CE1-CG2 4.02Å; F174-I281 HydrophobicContact CG-CB 4.49Å; E175-I281 PolarHBondContact N-O 2.87Å; A178-I281 VanDerWaalsContact CB-O 3.28Å; A178-I281 WeakPolarHBondContact CB-O 3.43Å; F264-I281 HydrophobicContact CD1-CG1 3.81Å; F264-I281 HydrophobicContact CE1-CD1 4.04Å; F264-I281 HydrophobicContact CE1-CG1 3.36Å; F264-I281 HydrophobicContact CZ-CD1 4.23Å; F264-I281 HydrophobicContact CZ-CG1 3.86Å; I281-T283 WeakPolarHBondContact CG2-O 2.98Å; I281-W284 HydrophobicContact CD1-CE3 3.81Å; I281-W284 HydrophobicContact CD1-CZ3 3.96Å; I281-W284 HydrophobicContact CG2-CB 4.06Å; I281-W284 HydrophobicContact CG2-CE3 4.39Å
282R95.1Very high84.9Confident71 Ų7160.1 Ų60.127%0.26831%0.309SS..EExtended strand (participates in β ladder)trans-86-40.7170.6172.8173.9-77.2143.7-2.4111.4E175 D177 A178 T179 E263 A265 R280E175-R282 HydrophobicContact CB-CB 4.49Å; E175-R282 HydrophobicContact CG-CB 4.26Å; D177-R282 IonicContact OD1-NE 2.73Å; D177-R282 PolarHBondContact OD1-NE 2.98Å; D177-R282 IonicContact OD1-NH2 3.35Å; D177-R282 IonicContact OD2-CZ 3.77Å; D177-R282 IonicContact OD2-NE 3.06Å; D177-R282 PolarHBondContact OD2-NE 3.32Å; D177-R282 IonicContact OD2-NH2 3.95Å; D177-R282 PolarHBondContact OD2-NH2 3.08Å; D177-R282 VanDerWaalsContact OD2-NH2 3.12Å; A178-R282 CarbonylContact C-O 3.55Å; A178-R282 WeakPolarHBondContact CA-O 3.36Å; T179-R282 PolarHBondContact N-O 2.9Å; E263-R282 PolarHBondContact O-N 2.96Å; A265-R282 HydrophobicContact CB-CB 4.31Å; R280-R282 PolarHBondContact O-N 3.49Å
283T97.1Very high86.6Confident38 Ų3856.5 Ų56.523%0.23329%0.292CS..EExtended strand (participates in β ladder)trans-126.5125.7179.6-51.70000109C262 E263 I281C262-T283 CarbonylContact C-O 3.56Å; C262-T283 WeakPolarHBondContact CA-O 3.31Å; E263-T283 PolarHBondContact N-O 2.76Å; E263-T283 PolarHBondContact O-N 2.76Å; E263-T283 PolarHBondContact OE2-OG1 2.87Å; I281-T283 WeakPolarHBondContact CG2-O 2.98Å
284W98Very high88.2Confident0 Ų055 Ų550%027%0.271CS..EExtended strand (participates in β ladder)trans-118.2114.6168.7178.7-72.9000108.5I145 M148 F174 T179 L180 S181 Y217 L260 I281I145-W284 HydrophobicContact CD1-CH2 4.39Å; I145-W284 HydrophobicContact CD1-CZ3 3.87Å; M148-W284 HydrophobicContact CE-CH2 3.65Å; M148-W284 HydrophobicContact CE-CZ3 3.82Å; M148-W284 HydrophobicContact SD-CH2 4.44Å; M148-W284 HydrophobicContact SD-CZ3 4.06Å; F174-W284 HydrophobicContact CE1-CB 4.15Å; F174-W284 HydrophobicContact CE1-CE3 4.43Å; F174-W284 HydrophobicContact CZ-CE3 4.39Å; T179-W284 PolarHBondContact O-N 2.97Å; L180-W284 CarbonylContact C-O 3.52Å; L180-W284 WeakPolarHBondContact CA-O 3.47Å; L180-W284 HydrophobicContact CB-CB 4.48Å; L180-W284 HydrophobicContact CD1-CG 4.39Å; L180-W284 HydrophobicContact CG-CB 4.27Å; L180-W284 HydrophobicContact CG-CG 4.17Å; S181-W284 PolarHBondContact N-O 3.26Å; Y217-W284 HydrophobicContact CD1-CH2 4.24Å; Y217-W284 AromaticContact CD1-CZ2 3.94Å; Y217-W284 HydrophobicContact CD1-CZ2 3.94Å; Y217-W284 HydrophobicContact CD2-CH2 4.12Å; Y217-W284 HydrophobicContact CD2-CZ2 4.4Å; Y217-W284 HydrophobicContact CE1-CH2 4.31Å; Y217-W284 AromaticContact CE1-CZ2 3.67Å; Y217-W284 HydrophobicContact CE1-CZ2 3.67Å; Y217-W284 HydrophobicContact CE2-CH2 4.2Å; Y217-W284 HydrophobicContact CE2-CZ2 4.15Å; Y217-W284 HydrophobicContact CG-CH2 4.15Å; Y217-W284 HydrophobicContact CG-CZ2 4.3Å; Y217-W284 AromaticContact CZ-CZ2 3.79Å; L260-W284 HydrophobicContact CD1-CD2 3.89Å; L260-W284 VanDerWaalsContact CD1-CE2 3.46Å; L260-W284 HydrophobicContact CD1-CE3 4.4Å; L260-W284 HydrophobicContact CD1-CG 4.36Å; L260-W284 HydrophobicContact CD1-CH2 4.11Å; L260-W284 HydrophobicContact CD1-CZ2 3.58Å; L260-W284 HydrophobicContact CD2-CH2 3.86Å; L260-W284 HydrophobicContact CD2-CZ2 4.07Å; L260-W284 HydrophobicContact CD2-CZ3 4.32Å; I281-W284 HydrophobicContact CD1-CE3 3.81Å; I281-W284 HydrophobicContact CD1-CZ3 3.96Å; I281-W284 HydrophobicContact CG2-CB 4.06Å; I281-W284 HydrophobicContact CG2-CE3 4.39Å
285H98.3Very high89.7Confident46 Ų4653.3 Ų53.321%0.21326%0.258CS..EExtended strand (participates in β ladder)trans-124.9112.9174.2-177.6-153000110.9S181 S183 L260 L261S181-H285 VanDerWaalsContact CB-CD2 3.42Å; S181-H285 WeakPolarHBondContact CB-CD2 3.41Å; S181-H285 WeakPolarHBondContact O-CA 3.33Å; S183-H285 PolarHBondContact OG-NE2 3.1Å; L260-H285 WeakPolarHBondContact CA-O 3.47Å; L261-H285 HydrophobicContact CB-CB 4.34Å; L261-H285 PolarHBondContact N-O 2.91Å; L261-H285 PolarHBondContact O-N 3.34Å
286F98.2Very high91.3Very high0 Ų048.5 Ų48.50%024%0.235CC..EExtended strand (participates in β ladder)trans-109.5111.6176-172.7-131.7000110.7S181 L182 S183 T240 M242 T256 L260 I288S181-F286 PolarHBondContact O-N 2.94Å; L182-F286 WeakPolarHBondContact CA-O 3.46Å; L182-F286 HydrophobicContact CD2-CB 3.93Å; L182-F286 HydrophobicContact CD2-CD1 4.28Å; S183-F286 PolarHBondContact N-O 3.35Å; T240-F286 HydrophobicContact CG2-CE2 4.05Å; M242-F286 HydrophobicContact CB-CE1 3.8Å; M242-F286 HydrophobicContact CB-CZ 3.88Å; M242-F286 HydrophobicContact SD-CD1 4.5Å; M242-F286 HydrophobicContact SD-CE1 4.06Å; T256-F286 HydrophobicContact CG2-CE1 4.15Å; T256-F286 HydrophobicContact CG2-CZ 4.48Å; L260-F286 HydrophobicContact CB-CD2 4.26Å; L260-F286 HydrophobicContact CD1-CB 4.16Å; L260-F286 HydrophobicContact CD1-CD2 4.39Å; F286-I288 HydrophobicContact CD1-CD1 4.36Å; F286-I288 HydrophobicContact CD1-CG1 3.73Å; F286-I288 HydrophobicContact CE1-CD1 4.28Å; F286-I288 HydrophobicContact CE1-CG1 3.58Å; F286-I288 HydrophobicContact CZ-CG1 4.29Å
287L97.9Very high92.5Very high65 Ų6554.9 Ų54.934%0.3425%0.252SS..EExtended strand (participates in β ladder)trans-94.599.4175.2176.671.3000108.9S183 G258 R259S183-L287 CarbonylContact O-C 3.54Å; S183-L287 WeakPolarHBondContact O-CA 3.29Å; G258-L287 CarbonylContact C-O 3.5Å; G258-L287 WeakPolarHBondContact CA-O 3.34Å; R259-L287 HydrophobicContact CB-CB 4.41Å; R259-L287 PolarHBondContact N-O 2.85Å; R259-L287 PolarHBondContact O-N 2.99Å
288I97.9Very high93Very high9 Ų957.3 Ų57.35%0.04628%0.276CS..EExtended strand (participates in β ladder)trans-72.9130.6177.2-55.8167000108.5S183 F184 T256 F286 Q317 L319S183-I288 PolarHBondContact O-N 3.33Å; F184-I288 HydrophobicContact CB-CB 4Å; F184-I288 HydrophobicContact CB-CD1 4.3Å; F184-I288 HydrophobicContact CD1-CD1 4Å; F184-I288 HydrophobicContact CG-CD1 4.43Å; T256-I288 HydrophobicContact CG2-CB 4.22Å; T256-I288 HydrophobicContact CG2-CD1 3.87Å; T256-I288 HydrophobicContact CG2-CG1 3.8Å; T256-I288 HydrophobicContact CG2-CG2 3.44Å; T256-I288 VanDerWaalsContact CG2-CG2 3.44Å; F286-I288 HydrophobicContact CD1-CD1 4.36Å; F286-I288 HydrophobicContact CD1-CG1 3.73Å; F286-I288 HydrophobicContact CE1-CD1 4.28Å; F286-I288 HydrophobicContact CE1-CG1 3.58Å; F286-I288 HydrophobicContact CZ-CG1 4.29Å; I288-Q317 HydrophobicContact CG2-CB 4.38Å; I288-L319 HydrophobicContact CD1-CD1 4.25Å; I288-L319 HydrophobicContact CD1-CG 4.32Å
289R96.1Very high93Very high114 Ų11456.9 Ų56.943%0.4327%0.274SS..EExtended strand (participates in β ladder)trans-106-45.1178.3-68.5168.8165.8173.7-13.5111.4E238 D257E238-R289 PolarHBondContact O-NH1 3.48Å; E238-R289 IonicContact OE1-CZ 3.25Å; E238-R289 IonicContact OE1-NH1 3.12Å; E238-R289 IonicContact OE1-NH2 3.44Å; E238-R289 PolarHBondContact OE1-NH2 3.41Å; D257-R289 PolarHBondContact O-N 3.44Å
290T96Very high92.4Very high77 Ų7760.6 Ų60.647%0.47229%0.292SS..EExtended strand (participates in β ladder)trans-149158.5-175.348.50000110.5D257D257-T290 PolarHBondContact N-O 2.86Å; D257-T290 PolarHBondContact O-N 3.31Å
291H96.2Very high91.4Very high38 Ų3862.2 Ų62.218%0.17631%0.306CS..EExtended strand (participates in β ladder)trans-139.3149.7170.767.3-66.1000110.2Q255 T256 N313 Q317 G318Q255-H291 CarbonylContact O-C 3.47Å; Q255-H291 VanDerWaalsContact O-CA 3.26Å; Q255-H291 WeakPolarHBondContact O-CA 3.46Å; T256-H291 HydrophobicContact CG2-CB 4.48Å; H291-N313 PolarHBondContact NE2-ND2 3.25Å; H291-Q317 WeakPolarHBondContact ND1-CA 3.22Å; H291-Q317 PolarHBondContact ND1-OE1 3.45Å; H291-Q317 VanDerWaalsContact ND1-OE1 3.12Å; H291-G318 PolarHBondContact CD2-N 2.88Å; H291-G318 VanDerWaalsContact CD2-N 3.28Å; H291-G318 VanDerWaalsContact CG-N 3.27Å
292N95.6Very high90.4Very high71 Ų7168.4 Ų68.438%0.3835%0.347SS..EExtended strand (participates in β ladder)trans-131.6134.4176.8-64.1-66.6000109.5V254 Q255 Y294V254-N292 WeakPolarHBondContact CA-O 3.44Å; Q255-N292 PolarHBondContact N-O 3.35Å; Q255-N292 PolarHBondContact O-N 2.78Å; N292-Y294 HydrophobicContact CB-CE1 4.41Å; N292-Y294 HydrophobicContact CB-CE2 3.96Å
293E94.6Very high89.6Confident34 Ų3469.8 Ų69.816%0.15936%0.356CS..EExtended strand (participates in β ladder)trans-104.8115.3175.1-54.7-166179.500109.6T252 V254 N313 F314 T315T252-E293 HydrophobicContact CG2-CB 4.06Å; V254-E293 HydrophobicContact CG1-CG 4.27Å; V254-E293 HydrophobicContact CG2-CB 4.38Å; V254-E293 HydrophobicContact CG2-CG 3.97Å; E293-N313 WeakPolarHBondContact OE1-CB 3.31Å; E293-N313 WeakPolarHBondContact OE2-CA 3.35Å; E293-F314 PolarHBondContact OE1-N 3.35Å; E293-F314 WeakPolarHBondContact OE2-CD1 3.34Å; E293-F314 WeakPolarHBondContact OE2-CE1 3.24Å; E293-F314 PolarHBondContact OE2-N 3.49Å; E293-T315 WeakPolarHBondContact OE1-CA 3Å; E293-T315 VanDerWaalsContact OE1-CB 3.28Å; E293-T315 WeakPolarHBondContact OE1-CB 3.32Å; E293-T315 PolarHBondContact OE1-N 3.14Å; E293-T315 PolarHBondContact OE1-OG1 2.91Å
294Y92.3Very high88.5Confident116 Ų11672.9 Ų72.946%0.45538%0.377SS..EExtended strand (participates in β ladder)trans-100.3108.9-177.4-62.1-70.9000111.3T252 S253 Q255 N292T252-Y294 WeakPolarHBondContact CG2-O 3.41Å; S253-Y294 PolarHBondContact N-O 2.86Å; S253-Y294 WeakPolarHBondContact O-CB 3.37Å; S253-Y294 PolarHBondContact O-N 2.95Å; Q255-Y294 HydrophobicContact CB-CD2 4.43Å; Q255-Y294 HydrophobicContact CB-CE2 3.8Å; N292-Y294 HydrophobicContact CB-CE1 4.41Å; N292-Y294 HydrophobicContact CB-CE2 3.96Å
295I88.5Confident87.6Confident55 Ų5575 Ų7528%0.28240%0.398SS..  trans-90.1128.2-178.8-58.2-179.3000109.5T252 R297 I299 L300 L310T252-I295 HydrophobicContact CG2-CG1 4.3Å; I295-R297 PolarHBondContact O-N 3.46Å; I295-I299 HydrophobicContact CG2-CD1 3.46Å; I295-I299 VanDerWaalsContact CG2-CD1 3.46Å; I295-I299 HydrophobicContact CG2-CG1 3.76Å; I295-L300 HydrophobicContact CG2-CD2 4.42Å; I295-L310 HydrophobicContact CD1-CB 4.08Å; I295-L310 HydrophobicContact CD1-CD2 4.28Å; I295-L310 WeakPolarHBondContact CD1-O 3.27Å; I295-L310 HydrophobicContact CG2-CD2 4.24Å
296P86.5Confident86.6Confident36 Ų3675.6 Ų75.623%0.23440%0.401CS..  trans-59.4132.8176.8-25.334.5000112.6M251 C298 I299M251-P296 HydrophobicContact CB-CG 4.26Å; M251-P296 WeakPolarHBondContact O-CD 3.13Å; M251-P296 WeakPolarHBondContact O-CG 3.24Å; P296-C298 PolarHBondContact O-N 3.26Å; P296-C298 VanDerWaalsContact O-N 3.1Å; P296-I299 HydrophobicContact CB-CG1 4.49Å; P296-I299 WeakPolarHBondContact O-CG1 3.4Å; P296-I299 PolarHBondContact O-N 2.82Å
297R85.4Confident85.7Confident225 Ų22580.3 Ų80.385%0.84943%0.425SS*.G310 helixtrans-60.4-25.4-179.7-65.5-176.2-174.9166.82.2113.8I295 I299 L300I295-R297 PolarHBondContact O-N 3.46Å; R297-I299 VanDerWaalsContact C-N 3.26Å; R297-I299 PolarHBondContact O-N 2.88Å; R297-L300 HydrophobicContact CB-CD1 4.49Å; R297-L300 PolarHBondContact O-N 2.99Å
298C82.6Confident84.9Confident118 Ų11882.5 Ų82.580%0.79743%0.434SS*.G310 helixtrans-69-18.3-179.555.80000114.4P296P296-C298 PolarHBondContact O-N 3.26Å; P296-C298 VanDerWaalsContact O-N 3.1Å
299I80Confident84Confident49 Ų4987.8 Ų87.825%0.25146%0.458SS..G310 helixtrans-94.3-2.4176.262153.6000113.3F250 I295 P296 R297 S301 F306 L310F250-I299 HydrophobicContact CB-CD1 3.54Å; F250-I299 HydrophobicContact CD1-CD1 3.77Å; F250-I299 HydrophobicContact CD2-CD1 4.36Å; F250-I299 HydrophobicContact CG-CD1 3.6Å; I295-I299 HydrophobicContact CG2-CD1 3.46Å; I295-I299 VanDerWaalsContact CG2-CD1 3.46Å; I295-I299 HydrophobicContact CG2-CG1 3.76Å; P296-I299 HydrophobicContact CB-CG1 4.49Å; P296-I299 WeakPolarHBondContact O-CG1 3.4Å; P296-I299 PolarHBondContact O-N 2.82Å; R297-I299 VanDerWaalsContact C-N 3.26Å; R297-I299 PolarHBondContact O-N 2.88Å; I299-S301 PolarHBondContact O-N 3.43Å; I299-F306 WeakPolarHBondContact O-CE1 3.45Å; I299-L310 HydrophobicContact CD1-CD2 3.89Å
300L75.9Confident83.2Confident91 Ų9183.1 Ų83.148%0.47644%0.442SS..  trans-73.590.1178.9-62.3176.4000110.5I295 R297 L310I295-L300 HydrophobicContact CG2-CD2 4.42Å; R297-L300 HydrophobicContact CB-CD1 4.49Å; R297-L300 PolarHBondContact O-N 2.99Å; L300-L310 HydrophobicContact CD2-CD1 3.97Å
301S72.6Confident82.6Confident52 Ų5283.2 Ų83.236%0.36445%0.446SS..  trans-73.8143.7168.8-174.50000110.6I299 E303I299-S301 PolarHBondContact O-N 3.43Å; S301-E303 PolarHBondContact O-N 2.93Å; S301-E303 PolarHBondContact OG-N 3Å
302P74.7Confident82.2Confident131 Ų13187.3 Ų87.385%0.85146%0.463SS*.SBendtrans-723172.631.4-36.6000114
303E76.8Confident81.9Confident100 Ų10088.5 Ų88.547%0.46747%0.469SS..  trans-70119.9175.9-151.5-6514000110S301 G305 F306 L307S301-E303 PolarHBondContact O-N 2.93Å; S301-E303 PolarHBondContact OG-N 3Å; E303-G305 PolarHBondContact O-N 2.83Å; E303-G305 WeakPolarHBondContact OE2-CA 3.35Å; E303-G305 PolarHBondContact OE2-N 3.46Å; E303-F306 HydrophobicContact CB-CB 4.25Å; E303-F306 PolarHBondContact O-N 2.89Å; E303-F306 PolarHBondContact OE2-N 2.87Å; E303-L307 PolarHBondContact O-N 3.13Å
304P75Confident81.6Confident103 Ų10389.4 Ų89.467%0.66947%0.473SS*.Hα-helixtrans-70.3-31.2-167.525.7-34.7000114.3E308P304-E308 PolarHBondContact O-N 2.8Å
305G78.4Confident81.7Confident44 Ų4484 Ų8445%0.45445%0.452SS..Hα-helixtrans-70.7-38.2177.700000111.9E303 L307 E308 Q309E303-G305 PolarHBondContact O-N 2.83Å; E303-G305 WeakPolarHBondContact OE2-CA 3.35Å; E303-G305 PolarHBondContact OE2-N 3.46Å; G305-L307 VanDerWaalsContact C-N 3.34Å; G305-L307 PolarHBondContact O-N 2.95Å; G305-E308 PolarHBondContact O-N 2.74Å; G305-Q309 PolarHBondContact O-N 2.93Å
306F78.2Confident81.9Confident60 Ų6086.2 Ų86.226%0.26346%0.457SS..Hα-helixtrans-63.3-38.1176-170.5-108.3000112.6F250 I299 E303 Q309 L310F250-F306 HydrophobicContact CD1-CZ 4.39Å; F250-F306 AromaticContact CE1-CE2 3.81Å; F250-F306 HydrophobicContact CE1-CE2 3.81Å; F250-F306 AromaticContact CE1-CZ 3.49Å; F250-F306 HydrophobicContact CE1-CZ 3.49Å; F250-F306 VanDerWaalsContact CE1-CZ 3.49Å; F250-F306 AromaticContact CZ-CE2 3.72Å; F250-F306 HydrophobicContact CZ-CE2 3.72Å; F250-F306 AromaticContact CZ-CZ 3.71Å; F250-F306 HydrophobicContact CZ-CZ 3.71Å; I299-F306 WeakPolarHBondContact O-CE1 3.45Å; E303-F306 HydrophobicContact CB-CB 4.25Å; E303-F306 PolarHBondContact O-N 2.89Å; E303-F306 PolarHBondContact OE2-N 2.87Å; F306-Q309 PolarHBondContact O-N 3.03Å; F306-L310 HydrophobicContact CD1-CD1 3.81Å; F306-L310 HydrophobicContact CD1-CG 4.29Å; F306-L310 HydrophobicContact CE1-CD1 3.55Å; F306-L310 HydrophobicContact CE1-CD2 4.42Å; F306-L310 HydrophobicContact CE1-CG 4.04Å; F306-L310 HydrophobicContact CZ-CD1 4.35Å; F306-L310 HydrophobicContact CZ-CD2 4.46Å; F306-L310 HydrophobicContact CZ-CG 4.43Å; F306-L310 WeakPolarHBondContact O-CG 3.34Å; F306-L310 PolarHBondContact O-N 3.41Å
307L78.2Confident82.3Confident98 Ų9886.6 Ų86.651%0.51346%0.456SS..Hα-helixtrans-68.9-32.9178.3-169.1138.9000112.8E303 G305 Q309 L310 S311E303-L307 PolarHBondContact O-N 3.13Å; G305-L307 VanDerWaalsContact C-N 3.34Å; G305-L307 PolarHBondContact O-N 2.95Å; L307-Q309 VanDerWaalsContact C-N 3.32Å; L307-L310 PolarHBondContact O-N 2.92Å; L307-S311 PolarHBondContact O-N 2.99Å
308E81.7Confident82.7Confident112 Ų11276 Ų7652%0.52342%0.417SS..Hα-helixtrans-67.8-31.6172.3-158.4-151.3125.900112.4P304 G305 S311 K312P304-E308 PolarHBondContact O-N 2.8Å; G305-E308 PolarHBondContact O-N 2.74Å; E308-S311 PolarHBondContact O-OG 3.48Å; E308-K312 WeakPolarHBondContact O-CE 3.42Å; E308-K312 WeakPolarHBondContact OE1-CE 3.32Å; E308-K312 IonicContact OE1-NZ 3.67Å; E308-K312 PolarHBondContact OE1-NZ 2.74Å
309Q79.8Confident83.4Confident120 Ų12070.6 Ų70.656%0.56138%0.379SS*.Hα-helixtrans-70.7-38.7172.9-173.5175.8-6.400111.6G305 F306 L307 S311G305-Q309 PolarHBondContact O-N 2.93Å; F306-Q309 PolarHBondContact O-N 3.03Å; L307-Q309 VanDerWaalsContact C-N 3.32Å; Q309-S311 VanDerWaalsContact C-N 3.32Å; Q309-S311 PolarHBondContact O-N 2.8Å
310L79.1Confident84.1Confident15 Ų1568.6 Ų68.68%0.07937%0.37CS..Hα-helixtrans-68.6-25.6175.9-72.4176.9000113.8F250 I295 I299 L300 F306 L307 K312F250-L310 HydrophobicContact CD1-CD2 4.42Å; F250-L310 HydrophobicContact CD2-CD2 3.37Å; F250-L310 HydrophobicContact CE1-CD2 4.36Å; F250-L310 HydrophobicContact CE2-CD2 3.29Å; F250-L310 HydrophobicContact CE2-CG 4.41Å; F250-L310 HydrophobicContact CG-CD2 3.98Å; F250-L310 HydrophobicContact CZ-CD2 3.82Å; I295-L310 HydrophobicContact CD1-CB 4.08Å; I295-L310 HydrophobicContact CD1-CD2 4.28Å; I295-L310 WeakPolarHBondContact CD1-O 3.27Å; I295-L310 HydrophobicContact CG2-CD2 4.24Å; I299-L310 HydrophobicContact CD1-CD2 3.89Å; L300-L310 HydrophobicContact CD2-CD1 3.97Å; F306-L310 HydrophobicContact CD1-CD1 3.81Å; F306-L310 HydrophobicContact CD1-CG 4.29Å; F306-L310 HydrophobicContact CE1-CD1 3.55Å; F306-L310 HydrophobicContact CE1-CD2 4.42Å; F306-L310 HydrophobicContact CE1-CG 4.04Å; F306-L310 HydrophobicContact CZ-CD1 4.35Å; F306-L310 HydrophobicContact CZ-CD2 4.46Å; F306-L310 HydrophobicContact CZ-CG 4.43Å; F306-L310 WeakPolarHBondContact O-CG 3.34Å; F306-L310 PolarHBondContact O-N 3.41Å; L307-L310 PolarHBondContact O-N 2.92Å; L310-K312 PolarHBondContact O-N 3.23Å
311S81.9Confident85Confident80 Ų8068.1 Ų68.156%0.55937%0.368SS*.THydrogen-bonded Turntrans-76.1-8.6-178.672.20000114.3L307 E308 Q309L307-S311 PolarHBondContact O-N 2.99Å; E308-S311 PolarHBondContact O-OG 3.48Å; Q309-S311 VanDerWaalsContact C-N 3.32Å; Q309-S311 PolarHBondContact O-N 2.8Å
312K88.3Confident86.1Confident124 Ų12468.7 Ų68.754%0.53937%0.369SS..SBendtrans-96.6112.2-177.5-67.2167.4-171167.80110E308 L310 F314E308-K312 WeakPolarHBondContact O-CE 3.42Å; E308-K312 WeakPolarHBondContact OE1-CE 3.32Å; E308-K312 IonicContact OE1-NZ 3.67Å; E308-K312 PolarHBondContact OE1-NZ 2.74Å; L310-K312 PolarHBondContact O-N 3.23Å; K312-F314 PolarHBondContact O-N 2.86Å
313N89.5Confident87.1Confident96 Ų9662.6 Ų62.651%0.51333%0.329SS..  trans-52.2130.3173.8-70.920000110.7H291 E293H291-N313 PolarHBondContact NE2-ND2 3.25Å; E293-N313 WeakPolarHBondContact OE1-CB 3.31Å; E293-N313 WeakPolarHBondContact OE2-CA 3.35Å
314F88.9Confident87.9Confident53 Ų5357.8 Ų57.823%0.23231%0.307CS..SBendtrans-94.5-14176.474.2-80.3000112.4H246 T252 V254 E293 K312H246-F314 HydrophobicContact CB-CE2 4.42Å; H246-F314 HydrophobicContact CB-CZ 4.03Å; H246-F314 AromaticContact CD2-CZ 3.81Å; H246-F314 AromaticContact CE1-CE2 3.77Å; H246-F314 AromaticContact CE1-CZ 3.89Å; H246-F314 AromaticContact CG-CE2 3.86Å; H246-F314 AromaticContact CG-CZ 3.55Å; H246-F314 AromaticContact ND1-CE2 3.45Å; H246-F314 WeakPolarHBondContact ND1-CE2 3.43Å; H246-F314 AromaticContact ND1-CZ 3.63Å; T252-F314 HydrophobicContact CG2-CE1 3.92Å; V254-F314 HydrophobicContact CG2-CE1 4.02Å; V254-F314 HydrophobicContact CG2-CZ 3.84Å; E293-F314 PolarHBondContact OE1-N 3.35Å; E293-F314 WeakPolarHBondContact OE2-CD1 3.34Å; E293-F314 WeakPolarHBondContact OE2-CE1 3.24Å; E293-F314 PolarHBondContact OE2-N 3.49Å; K312-F314 PolarHBondContact O-N 2.86Å
315T93.2Very high88.9Confident3 Ų356.7 Ų56.72%0.01830%0.295CS..SBendtrans-97160.5169.175.20000111.6V254 E293 G318 L319V254-T315 HydrophobicContact CG1-CG2 4.21Å; V254-T315 HydrophobicContact CG2-CG2 4.03Å; E293-T315 WeakPolarHBondContact OE1-CA 3Å; E293-T315 VanDerWaalsContact OE1-CB 3.28Å; E293-T315 WeakPolarHBondContact OE1-CB 3.32Å; E293-T315 PolarHBondContact OE1-N 3.14Å; E293-T315 PolarHBondContact OE1-OG1 2.91Å; T315-G318 WeakPolarHBondContact OG1-CA 3.11Å; T315-G318 PolarHBondContact OG1-N 3.45Å; T315-L319 WeakPolarHBondContact CA-O 3.35Å; T315-L319 WeakPolarHBondContact CB-O 3.18Å
316R93.5Very high89.7Confident100 Ų10056.3 Ų56.338%0.37728%0.28SS..BIsolated β-bridgetrans-122.5113.8170.5-74.2172168.7-107.9-4107.7L186 E187 G318 L319 L324L186-R316 HydrophobicContact CD2-CB 4.41Å; E187-R316 VanDerWaalsContact CD-NH1 3.25Å; E187-R316 IonicContact OE1-CZ 2.71Å; E187-R316 IonicContact OE1-NH1 2.69Å; E187-R316 PolarHBondContact OE1-NH1 3.37Å; E187-R316 IonicContact OE1-NH2 3.62Å; E187-R316 IonicContact OE2-CZ 2.92Å; E187-R316 IonicContact OE2-NH1 3.21Å; E187-R316 PolarHBondContact OE2-NH1 2.99Å; E187-R316 IonicContact OE2-NH2 3.75Å; R316-G318 PolarHBondContact O-N 3.17Å; R316-L319 PolarHBondContact N-O 3.23Å; R316-L319 PolarHBondContact O-N 3.29Å; R316-L324 HydrophobicContact CB-CD1 3.71Å
317Q94.6Very high90.5Very high45 Ų4553.5 Ų53.521%0.2127%0.268CS..THydrogen-bonded Turntrans54.938.7-169.1-59.4-61.8-0.800113.5F184 C185 L186 I288 H291 L319F184-Q317 HydrophobicContact CB-CB 4.25Å; F184-Q317 HydrophobicContact CB-CG 4.28Å; F184-Q317 HydrophobicContact CD2-CB 4.23Å; F184-Q317 HydrophobicContact CD2-CG 4.22Å; F184-Q317 HydrophobicContact CG-CB 4.4Å; C185-Q317 VanDerWaalsContact O-CG 3.26Å; C185-Q317 WeakPolarHBondContact O-CG 3.47Å; C185-Q317 PolarHBondContact O-NE2 2.85Å; L186-Q317 HydrophobicContact CD2-CG 4.21Å; I288-Q317 HydrophobicContact CG2-CB 4.38Å; H291-Q317 WeakPolarHBondContact ND1-CA 3.22Å; H291-Q317 PolarHBondContact ND1-OE1 3.45Å; H291-Q317 VanDerWaalsContact ND1-OE1 3.12Å; Q317-L319 PolarHBondContact O-N 3.02Å
318G94.5Very high91.2Very high3 Ų353.4 Ų53.43%0.03126%0.261CS..THydrogen-bonded Turntrans76.7-3.3178.900000115T256 H291 T315 R316T256-G318 WeakPolarHBondContact OG1-CA 3.27Å; H291-G318 PolarHBondContact CD2-N 2.88Å; H291-G318 VanDerWaalsContact CD2-N 3.28Å; H291-G318 VanDerWaalsContact CG-N 3.27Å; T315-G318 WeakPolarHBondContact OG1-CA 3.11Å; T315-G318 PolarHBondContact OG1-N 3.45Å; R316-G318 PolarHBondContact O-N 3.17Å
319L96.2Very high91.7Very high3 Ų352.9 Ų52.92%0.01626%0.261CS..BIsolated β-bridgetrans-100.7140.4178.3-58.6179.9000111.3L182 F184 M242 I288 T315 R316 Q317 T323 L324 L327L182-L319 HydrophobicContact CD1-CD1 4.21Å; F184-L319 HydrophobicContact CD1-CD1 4.39Å; F184-L319 HydrophobicContact CE1-CD1 3.73Å; F184-L319 HydrophobicContact CZ-CD1 3.98Å; M242-L319 HydrophobicContact CE-CD2 4.28Å; I288-L319 HydrophobicContact CD1-CD1 4.25Å; I288-L319 HydrophobicContact CD1-CG 4.32Å; T315-L319 WeakPolarHBondContact CA-O 3.35Å; T315-L319 WeakPolarHBondContact CB-O 3.18Å; R316-L319 PolarHBondContact N-O 3.23Å; R316-L319 PolarHBondContact O-N 3.29Å; Q317-L319 PolarHBondContact O-N 3.02Å; L319-T323 HydrophobicContact CD2-CG2 4.4Å; L319-L324 HydrophobicContact CB-CD1 4.35Å; L319-L324 HydrophobicContact CB-CD2 4.04Å; L319-L324 HydrophobicContact CB-CG 3.91Å; L319-L324 HydrophobicContact CD1-CD2 3.91Å; L319-L327 HydrophobicContact CD1-CD1 4.1Å
320T94.9Very high92.3Very high8 Ų847.2 Ų47.25%0.04923%0.234CC..  trans-71.9154.6174.661.20000111.2V322 T323 L324T320-V322 PolarHBondContact O-N 3.49Å; T320-T323 PolarHBondContact O-N 3.23Å; T320-T323 VanDerWaalsContact O-N 3.11Å; T320-T323 PolarHBondContact OG1-N 2.85Å; T320-T323 PolarHBondContact OG1-OG1 2.83Å; T320-L324 PolarHBondContact O-N 3.45Å
321N94.6Very high92.6Very high81 Ų8149.8 Ų49.843%0.43325%0.251SS..Hα-helixtrans-58.6-31.7176.1-70.3-52.2000112.7L324 N325N321-L324 PolarHBondContact O-N 3.01Å; N321-N325 VanDerWaalsContact O-CB 3.29Å; N321-N325 WeakPolarHBondContact O-CB 3.47Å; N321-N325 PolarHBondContact O-N 3.32Å; N321-N325 PolarHBondContact O-ND2 3.29Å
322V95.3Very high92.7Very high64 Ų6450.9 Ų50.939%0.38825%0.249SC..Hα-helixtrans-60.1-53173.1179.50000110.5E209 T320 L324 N325 Y326E209-V322 HydrophobicContact CB-CG1 4.16Å; T320-V322 PolarHBondContact O-N 3.49Å; V322-L324 PolarHBondContact O-N 3.12Å; V322-N325 PolarHBondContact O-N 2.95Å; V322-Y326 WeakPolarHBondContact O-CB 3.37Å; V322-Y326 PolarHBondContact O-N 3.2Å
323T96.1Very high92.2Very high2 Ų246.8 Ų46.81%0.01223%0.233CC..Hα-helixtrans-60.4-44.1178-48.30000111.6Y203 S206 I207 L319 T320 Y326 L327Y203-T323 HydrophobicContact CD2-CG2 4.3Å; Y203-T323 HydrophobicContact CE2-CG2 3.88Å; S206-T323 PolarHBondContact O-OG1 2.85Å; I207-T323 HydrophobicContact CG1-CG2 4.09Å; L319-T323 HydrophobicContact CD2-CG2 4.4Å; T320-T323 PolarHBondContact O-N 3.23Å; T320-T323 VanDerWaalsContact O-N 3.11Å; T320-T323 PolarHBondContact OG1-N 2.85Å; T320-T323 PolarHBondContact OG1-OG1 2.83Å; T323-Y326 PolarHBondContact O-N 3.34Å; T323-L327 HydrophobicContact CG2-CD1 4.13Å; T323-L327 VanDerWaalsContact O-CG 3.27Å; T323-L327 WeakPolarHBondContact O-CG 3.39Å; T323-L327 PolarHBondContact O-N 3.22Å
324L95.3Very high91.5Very high0 Ų047.4 Ų47.40%023%0.233CC..Hα-helixtrans-65.8-39.5179.6-72.3171.2000112.8F184 R316 L319 T320 N321 V322 L327 R328F184-L324 HydrophobicContact CE2-CD2 3.81Å; F184-L324 HydrophobicContact CZ-CD2 3.51Å; R316-L324 HydrophobicContact CB-CD1 3.71Å; L319-L324 HydrophobicContact CB-CD1 4.35Å; L319-L324 HydrophobicContact CB-CD2 4.04Å; L319-L324 HydrophobicContact CB-CG 3.91Å; L319-L324 HydrophobicContact CD1-CD2 3.91Å; T320-L324 PolarHBondContact O-N 3.45Å; N321-L324 PolarHBondContact O-N 3.01Å; V322-L324 PolarHBondContact O-N 3.12Å; L324-L327 PolarHBondContact O-N 3.21Å; L324-R328 WeakPolarHBondContact O-CD 3.5Å; L324-R328 VanDerWaalsContact O-CG 3.24Å; L324-R328 WeakPolarHBondContact O-CG 3.28Å; L324-R328 PolarHBondContact O-N 3.4Å
325N95.3Very high90.9Very high79 Ų7948.5 Ų48.542%0.42225%0.246SC..Hα-helixtrans-67.9-40.3175.3-71.2-16.5000111.3N321 V322 L327 R328 L329N321-N325 VanDerWaalsContact O-CB 3.29Å; N321-N325 WeakPolarHBondContact O-CB 3.47Å; N321-N325 PolarHBondContact O-N 3.32Å; N321-N325 PolarHBondContact O-ND2 3.29Å; V322-N325 PolarHBondContact O-N 2.95Å; N325-L327 PolarHBondContact O-N 2.98Å; N325-R328 PolarHBondContact O-N 3.31Å; N325-R328 PolarHBondContact OD1-NH1 3.08Å; N325-L329 WeakPolarHBondContact O-CG 2.93Å; N325-L329 PolarHBondContact O-N 2.98Å
326Y95.3Very high90.3Very high36 Ų3651.7 Ų51.714%0.14126%0.261CS..Hα-helixtrans-58.3-46.7172.1175.1-99.6000112.3L199 R202 Y203 V322 T323 R328 L329 C330L199-Y326 WeakPolarHBondContact CB-OH 3.42Å; L199-Y326 PolarHBondContact O-OH 3.08Å; L199-Y326 VanDerWaalsContact O-OH 3.1Å; R202-Y326 HydrophobicContact CB-CE2 3.86Å; R202-Y326 VanDerWaalsContact CB-OH 3.3Å; R202-Y326 WeakPolarHBondContact CB-OH 3.37Å; Y203-Y326 VanDerWaalsContact CA-CE1 3.46Å; V322-Y326 WeakPolarHBondContact O-CB 3.37Å; V322-Y326 PolarHBondContact O-N 3.2Å; T323-Y326 PolarHBondContact O-N 3.34Å; Y326-R328 PolarHBondContact O-N 3.4Å; Y326-L329 PolarHBondContact O-N 2.66Å; Y326-C330 WeakPolarHBondContact CE1-SG 3.2Å; Y326-C330 PolarHBondContact O-N 3.37Å; Y326-C330 PolarHBondContact O-SG 3.43Å; Y326-C330 PolarHBondContact OH-SG 3.11Å
327L94.3Very high89.6Confident1 Ų151.5 Ų51.51%0.00526%0.264CS..Hα-helixtrans-63-39.2177.2-70.1165.8000112.7L182 Y193 Y203 L319 T323 L324 N325 C330 V331L182-L327 HydrophobicContact CD1-CD1 3.66Å; L182-L327 HydrophobicContact CD1-CD2 4.07Å; Y193-L327 HydrophobicContact CD1-CB 3.77Å; Y193-L327 WeakPolarHBondContact CD1-O 3.37Å; Y193-L327 HydrophobicContact CD2-CB 4.41Å; Y193-L327 HydrophobicContact CE1-CB 4.22Å; Y193-L327 HydrophobicContact CG-CB 3.9Å; Y203-L327 HydrophobicContact CD2-CD2 4.02Å; Y203-L327 HydrophobicContact CE2-CD2 4.32Å; L319-L327 HydrophobicContact CD1-CD1 4.1Å; T323-L327 HydrophobicContact CG2-CD1 4.13Å; T323-L327 VanDerWaalsContact O-CG 3.27Å; T323-L327 WeakPolarHBondContact O-CG 3.39Å; T323-L327 PolarHBondContact O-N 3.22Å; L324-L327 PolarHBondContact O-N 3.21Å; N325-L327 PolarHBondContact O-N 2.98Å; L327-C330 PolarHBondContact O-N 3.17Å; L327-V331 PolarHBondContact O-N 3.43Å
328R93.5Very high88.9Confident97 Ų9754.1 Ų54.137%0.36628%0.277SS..Hα-helixtrans-61.4-42.6173.4-72.2162.9179158.1-4.9112.1Y193 L324 N325 Y326 C330Y193-R328 HydrophobicContact CE1-CG 4.17Å; L324-R328 WeakPolarHBondContact O-CD 3.5Å; L324-R328 VanDerWaalsContact O-CG 3.24Å; L324-R328 WeakPolarHBondContact O-CG 3.28Å; L324-R328 PolarHBondContact O-N 3.4Å; N325-R328 PolarHBondContact O-N 3.31Å; N325-R328 PolarHBondContact OD1-NH1 3.08Å; Y326-R328 PolarHBondContact O-N 3.4Å; R328-C330 VanDerWaalsContact C-N 3.35Å
329L92.8Very high88.3Confident100 Ų10054.9 Ų54.952%0.52428%0.28SS..Hα-helixtrans-63.4-40175.3-69.5169.2000111.6N325 Y326 V331 I332 L333N325-L329 WeakPolarHBondContact O-CG 2.93Å; N325-L329 PolarHBondContact O-N 2.98Å; Y326-L329 PolarHBondContact O-N 2.66Å; L329-V331 VanDerWaalsContact C-N 3.33Å; L329-V331 PolarHBondContact O-N 3.37Å; L329-I332 PolarHBondContact O-N 2.94Å; L329-I332 VanDerWaalsContact O-N 3.1Å; L329-L333 VanDerWaalsContact O-CG 3.3Å; L329-L333 WeakPolarHBondContact O-CG 3.27Å; L329-L333 PolarHBondContact O-N 2.9Å
330C90.8Very high87.6Confident1 Ų157.8 Ų57.81%0.00729%0.294CS..Hα-helixtrans-59.3-39.6-179.4-66.60000113.6I195 L199 Y326 L327 R328 I332 L333 E334I195-C330 HydrophobicContact CG2-CB 3.58Å; L199-C330 HydrophobicContact CD1-CB 4.12Å; Y326-C330 WeakPolarHBondContact CE1-SG 3.2Å; Y326-C330 PolarHBondContact O-N 3.37Å; Y326-C330 PolarHBondContact O-SG 3.43Å; Y326-C330 PolarHBondContact OH-SG 3.11Å; L327-C330 PolarHBondContact O-N 3.17Å; R328-C330 VanDerWaalsContact C-N 3.35Å; C330-I332 PolarHBondContact O-N 3.21Å; C330-L333 PolarHBondContact O-N 3.1Å; C330-E334 PolarHBondContact O-N 3.34Å; C330-E334 VanDerWaalsContact O-N 3.11Å
331V85.7Confident86.9Confident70 Ų7060.3 Ų60.342%0.42432%0.316SS..Hα-helixtrans-63.4-30.5177.71740000112.3Y193 L327 L329 P335Y193-V331 HydrophobicContact CD1-CG2 3.55Å; Y193-V331 HydrophobicContact CE1-CG2 3.99Å; L327-V331 PolarHBondContact O-N 3.43Å; L329-V331 VanDerWaalsContact C-N 3.33Å; L329-V331 PolarHBondContact O-N 3.37Å; V331-P335 VanDerWaalsContact O-CD 3.27Å; V331-P335 WeakPolarHBondContact O-CD 3.3Å
332I83.9Confident86.3Confident102 Ų10258.7 Ų58.752%0.52331%0.307SS..Hα-helixtrans-82.6-38.2176.1-57.3172.2000110.2L329 C330 E334 P335 M336L329-I332 PolarHBondContact O-N 2.94Å; L329-I332 VanDerWaalsContact O-N 3.1Å; C330-I332 PolarHBondContact O-N 3.21Å; I332-E334 PolarHBondContact O-N 3.33Å; I332-P335 WeakPolarHBondContact O-CD 3.43Å; I332-P335 WeakPolarHBondContact O-CG 3.43Å; I332-M336 HydrophobicContact CG2-CG 4.46Å; I332-M336 HydrophobicContact CG2-SD 3.9Å; I332-M336 VanDerWaalsContact O-CG 3.29Å; I332-M336 WeakPolarHBondContact O-CG 3.29Å; I332-M336 PolarHBondContact O-N 2.98Å
333L78.9Confident85.8Confident38 Ų3858.6 Ų58.620%0.19930%0.302CS..Hα-helixtrans-66.3-32.9-177.7-73.6171.3000113.4W9 L329 C330 M336 Q337W9-L333 HydrophobicContact CZ2-CD1 4.36Å; L329-L333 VanDerWaalsContact O-CG 3.3Å; L329-L333 WeakPolarHBondContact O-CG 3.27Å; L329-L333 PolarHBondContact O-N 2.9Å; C330-L333 PolarHBondContact O-N 3.1Å; L333-M336 CarbonylContact O-C 3.52Å; L333-M336 WeakPolarHBondContact O-CB 3.49Å; L333-M336 PolarHBondContact O-N 3.43Å; L333-Q337 WeakPolarHBondContact O-CG 3.39Å; L333-Q337 PolarHBondContact O-N 3.22Å
334E73.1Confident85.2Confident109 Ų10965.4 Ų65.451%0.50933%0.331SS..Hα-helixtrans-58.7-57.5-179.5-175168.9-146.300113.3C330 I332 M336 Q337C330-E334 PolarHBondContact O-N 3.34Å; C330-E334 VanDerWaalsContact O-N 3.11Å; I332-E334 PolarHBondContact O-N 3.33Å; E334-M336 PolarHBondContact O-N 3.07Å; E334-Q337 WeakPolarHBondContact O-CB 3.34Å; E334-Q337 PolarHBondContact O-N 3.31Å; E334-Q337 VanDerWaalsContact O-N 3.07Å
335P76.7Confident84.7Confident77 Ų7769.6 Ų69.650%0.536%0.361SS..Hα-helixtrans-65.6-25.7173.426.8-35000112.9V331 I332 Q337V331-P335 VanDerWaalsContact O-CD 3.27Å; V331-P335 WeakPolarHBondContact O-CD 3.3Å; I332-P335 WeakPolarHBondContact O-CD 3.43Å; I332-P335 WeakPolarHBondContact O-CG 3.43Å; P335-Q337 VanDerWaalsContact C-N 3.28Å; P335-Q337 PolarHBondContact O-N 3.39Å
336M80Confident83.9Confident69 Ų6968.3 Ų68.334%0.3436%0.357SS..Hα-helixtrans-69.4-20.2172.7-71.4-174.382.700113.4I332 L333 E334 L339 M340I332-M336 HydrophobicContact CG2-CG 4.46Å; I332-M336 HydrophobicContact CG2-SD 3.9Å; I332-M336 VanDerWaalsContact O-CG 3.29Å; I332-M336 WeakPolarHBondContact O-CG 3.29Å; I332-M336 PolarHBondContact O-N 2.98Å; L333-M336 CarbonylContact O-C 3.52Å; L333-M336 WeakPolarHBondContact O-CB 3.49Å; L333-M336 PolarHBondContact O-N 3.43Å; E334-M336 PolarHBondContact O-N 3.07Å; M336-L339 PolarHBondContact O-N 3.47Å; M336-M340 HydrophobicContact CB-CE 4.43Å; M336-M340 HydrophobicContact CE-CE 3.97Å; M336-M340 VanDerWaalsContact O-CB 3.28Å; M336-M340 WeakPolarHBondContact O-CB 3.46Å; M336-M340 WeakPolarHBondContact O-CG 3.32Å; M336-M340 PolarHBondContact O-N 3.1Å
337Q79.3Confident83.3Confident97 Ų9772.2 Ų72.245%0.45339%0.39SS..Hα-helixtrans-66-41.4176.8-75.1170.223.600111.9L333 E334 P335 L339 M340 A341L333-Q337 WeakPolarHBondContact O-CG 3.39Å; L333-Q337 PolarHBondContact O-N 3.22Å; E334-Q337 WeakPolarHBondContact O-CB 3.34Å; E334-Q337 PolarHBondContact O-N 3.31Å; E334-Q337 VanDerWaalsContact O-N 3.07Å; P335-Q337 VanDerWaalsContact C-N 3.28Å; P335-Q337 PolarHBondContact O-N 3.39Å; Q337-L339 VanDerWaalsContact C-N 3.35Å; Q337-M340 PolarHBondContact O-N 2.78Å; Q337-A341 WeakPolarHBondContact O-CB 3.32Å; Q337-A341 PolarHBondContact O-N 2.84Å
338E79.6Confident82.7Confident100 Ų10075.2 Ų75.247%0.46741%0.405SS..Hα-helixtrans-61.2-45.2174.1-162.8-176.6164.700110.3A341 L342 F357 K361E338-A341 PolarHBondContact O-N 3.27Å; E338-L342 PolarHBondContact O-N 3.08Å; E338-L342 VanDerWaalsContact O-N 3.1Å; E338-F357 HydrophobicContact CB-CE2 4.47Å; E338-F357 HydrophobicContact CB-CZ 4.22Å; E338-F357 HydrophobicContact CG-CE2 3.78Å; E338-F357 HydrophobicContact CG-CZ 3.86Å; E338-F357 VanDerWaalsContact OE1-CE2 3.32Å; E338-F357 WeakPolarHBondContact OE1-CE2 3.27Å; E338-F357 WeakPolarHBondContact OE1-CZ 3.38Å; E338-F357 WeakPolarHBondContact OE2-CZ 3.28Å; E338-K361 VanDerWaalsContact CD-NZ 3.27Å; E338-K361 WeakPolarHBondContact OE1-CE 3.19Å; E338-K361 IonicContact OE1-NZ 3.39Å; E338-K361 PolarHBondContact OE1-NZ 3.4Å; E338-K361 VanDerWaalsContact OE1-NZ 3.08Å; E338-K361 IonicContact OE2-NZ 3.59Å; E338-K361 PolarHBondContact OE2-NZ 2.96Å
339L83.4Confident82.3Confident18 Ų1872.9 Ų72.99%0.09440%0.404CS..Hα-helixtrans-63.8-46.3176.8-17276.7000113M336 Q337 A341 L342 Q343 C353 L354 F357M336-L339 PolarHBondContact O-N 3.47Å; Q337-L339 VanDerWaalsContact C-N 3.35Å; L339-A341 VanDerWaalsContact C-N 3.32Å; L339-A341 PolarHBondContact O-N 3.36Å; L339-L342 PolarHBondContact O-N 2.99Å; L339-Q343 WeakPolarHBondContact O-CB 3.44Å; L339-Q343 PolarHBondContact O-N 3.47Å; L339-C353 HydrophobicContact CD1-CB 4.3Å; L339-L354 HydrophobicContact CD1-CB 4.2Å; L339-L354 HydrophobicContact CD1-CD1 4.19Å; L339-L354 HydrophobicContact CD2-CB 4.28Å; L339-L354 HydrophobicContact CD2-CD1 4.13Å; L339-F357 HydrophobicContact CD1-CB 3.9Å; L339-F357 HydrophobicContact CD1-CD1 4.14Å; L339-F357 HydrophobicContact CD1-CG 4.06Å
340M80Confident81.9Confident65 Ų6571.8 Ų71.832%0.3240%0.403SS..Hα-helixtrans-66.2-34.5-179.7-76179.3179.900111.8M336 Q337 K344M336-M340 HydrophobicContact CB-CE 4.43Å; M336-M340 HydrophobicContact CE-CE 3.97Å; M336-M340 VanDerWaalsContact O-CB 3.28Å; M336-M340 WeakPolarHBondContact O-CB 3.46Å; M336-M340 WeakPolarHBondContact O-CG 3.32Å; M336-M340 PolarHBondContact O-N 3.1Å; Q337-M340 PolarHBondContact O-N 2.78Å; M340-K344 WeakPolarHBondContact O-CB 3.46Å; M340-K344 VanDerWaalsContact O-CG 3.27Å; M340-K344 WeakPolarHBondContact O-CG 3.45Å; M340-K344 PolarHBondContact O-N 3.45Å; M340-K344 VanDerWaalsContact O-N 3.1Å
341A82.1Confident81.7Confident61 Ų6181.5 Ų81.550%0.50444%0.439SS..Hα-helixtrans-64.7-46.9172.700000110.9Q337 E338 L339 K344 S345Q337-A341 WeakPolarHBondContact O-CB 3.32Å; Q337-A341 PolarHBondContact O-N 2.84Å; E338-A341 PolarHBondContact O-N 3.27Å; L339-A341 VanDerWaalsContact C-N 3.32Å; L339-A341 PolarHBondContact O-N 3.36Å; A341-K344 PolarHBondContact O-N 2.69Å; A341-S345 PolarHBondContact O-N 2.74Å; A341-S345 VanDerWaalsContact O-N 3.14Å
342L81.1Confident81.9Confident46 Ų4681.2 Ų81.224%0.24144%0.435CS..Hα-helixtrans-61.3-46.6176.3-175.464.5000111.8E338 L339 K344 S345 C346 F357E338-L342 PolarHBondContact O-N 3.08Å; E338-L342 VanDerWaalsContact O-N 3.1Å; L339-L342 PolarHBondContact O-N 2.99Å; L342-K344 VanDerWaalsContact C-N 3.3Å; L342-K344 PolarHBondContact O-N 3.32Å; L342-S345 PolarHBondContact O-N 3.46Å; L342-S345 PolarHBondContact O-OG 3.33Å; L342-C346 WeakPolarHBondContact O-CB 3.45Å; L342-C346 PolarHBondContact O-N 3.01Å; L342-C346 PolarHBondContact O-SG 3.14Å; L342-F357 HydrophobicContact CD2-CB 4.11Å; L342-F357 HydrophobicContact CD2-CD2 3.92Å; L342-F357 HydrophobicContact CD2-CG 4.48Å
343Q84.3Confident82.1Confident62 Ų6276.3 Ų76.329%0.2941%0.41SS..Hα-helixtrans-57.7-42.7178.3-166.4-153.3-35.800111.6L339 S345 C346 S347 I348 C353L339-Q343 WeakPolarHBondContact O-CB 3.44Å; L339-Q343 PolarHBondContact O-N 3.47Å; Q343-S345 VanDerWaalsContact C-N 3.31Å; Q343-S345 PolarHBondContact O-N 2.89Å; Q343-C346 PolarHBondContact O-N 3.02Å; Q343-S347 PolarHBondContact O-N 3.38Å; Q343-I348 WeakPolarHBondContact CG-O 3.46Å; Q343-C353 HydrophobicContact CB-CB 4.17Å; Q343-C353 HydrophobicContact CG-CB 4.2Å; Q343-C353 PolarHBondContact N-SG 3.43Å; Q343-C353 VanDerWaalsContact N-SG 3.43Å
344K84.2Confident82.6Confident145 Ų14578.5 Ų78.563%0.6342%0.422SS*.Hα-helixtrans-63.4-33.4175.5-76.2173.4178.8-177.90112.9M340 A341 L342M340-K344 WeakPolarHBondContact O-CB 3.46Å; M340-K344 VanDerWaalsContact O-CG 3.27Å; M340-K344 WeakPolarHBondContact O-CG 3.45Å; M340-K344 PolarHBondContact O-N 3.45Å; M340-K344 VanDerWaalsContact O-N 3.1Å; A341-K344 PolarHBondContact O-N 2.69Å; L342-K344 VanDerWaalsContact C-N 3.3Å; L342-K344 PolarHBondContact O-N 3.32Å
345S83.7Confident83.3Confident88 Ų8879.8 Ų79.862%0.61543%0.426SS*.Hα-helixtrans-80-30.2176.263.10000114.3A341 L342 Q343A341-S345 PolarHBondContact O-N 2.74Å; A341-S345 VanDerWaalsContact O-N 3.14Å; L342-S345 PolarHBondContact O-N 3.46Å; L342-S345 PolarHBondContact O-OG 3.33Å; Q343-S345 VanDerWaalsContact C-N 3.31Å; Q343-S345 PolarHBondContact O-N 2.89Å
346C78.8Confident83.8Confident52 Ų5278.5 Ų78.535%0.35142%0.418SS..Hα-helixtrans-98.6-11-172.9-65.60000114.5L342 Q343 I348L342-C346 WeakPolarHBondContact O-CB 3.45Å; L342-C346 PolarHBondContact O-N 3.01Å; L342-C346 PolarHBondContact O-SG 3.14Å; Q343-C346 PolarHBondContact O-N 3.02Å; C346-I348 HydrophobicContact CB-CD1 3.89Å; C346-I348 HydrophobicContact CB-CG1 3.8Å; C346-I348 HydrophobicContact CB-CG2 4.49Å; C346-I348 WeakPolarHBondContact O-CG2 3.41Å; C346-I348 PolarHBondContact O-N 3.1Å
347S83Confident84.1Confident118 Ų11876.3 Ų76.383%0.82541%0.407SS*.  trans51.217-176.861.10000116.5Q343Q343-S347 PolarHBondContact O-N 3.38Å
348I82.5Confident84.4Confident64 Ų6477.4 Ų77.433%0.32841%0.414SS..  trans-83.9164.1175.657.5-176.9000112.3Q343 C346 C353Q343-I348 WeakPolarHBondContact CG-O 3.46Å; C346-I348 HydrophobicContact CB-CD1 3.89Å; C346-I348 HydrophobicContact CB-CG1 3.8Å; C346-I348 HydrophobicContact CB-CG2 4.49Å; C346-I348 WeakPolarHBondContact O-CG2 3.41Å; C346-I348 PolarHBondContact O-N 3.1Å; I348-C353 HydrophobicContact CD1-CB 3.88Å; I348-C353 HydrophobicContact CG1-CB 3.93Å
349S85.7Confident84.8Confident49 Ų4978.2 Ų78.234%0.34342%0.416SS..  trans-58.5148.2175.896.80000111.1R351 D352 C353S349-R351 PolarHBondContact O-N 3.4Å; S349-R351 PolarHBondContact OG-N 2.91Å; S349-D352 WeakPolarHBondContact CB-OD2 3.49Å; S349-D352 PolarHBondContact O-N 3.34Å; S349-D352 VanDerWaalsContact O-N 3.13Å; S349-D352 VanDerWaalsContact OG-CG 3.29Å; S349-D352 PolarHBondContact OG-N 3.18Å; S349-D352 VanDerWaalsContact OG-N 3.1Å; S349-D352 PolarHBondContact OG-OD2 3.13Å; S349-C353 WeakPolarHBondContact O-CB 3.43Å; S349-C353 PolarHBondContact O-N 3.43Å
350P83.7Confident85Confident76 Ų7682.7 Ų82.749%0.49444%0.436SS..Hα-helixtrans-56.3-34.2177-21.528.5000113.2L354P350-L354 WeakPolarHBondContact O-CB 3.34Å; P350-L354 PolarHBondContact O-N 3.01Å; P350-L354 VanDerWaalsContact O-N 3.08Å
351R87.1Confident85.2Confident206 Ų20684.3 Ų84.378%0.77744%0.442SS*.Hα-helixtrans-69.2-41.5178.1-75-170.1175.6-169.10.7111.9S349 L354 K355S349-R351 PolarHBondContact O-N 3.4Å; S349-R351 PolarHBondContact OG-N 2.91Å; R351-L354 PolarHBondContact O-N 3.44Å; R351-K355 WeakPolarHBondContact O-CG 3.13Å; R351-K355 PolarHBondContact O-N 3.08Å
352D88.8Confident85.5Confident63 Ų6388.5 Ų88.534%0.33745%0.445SS..Hα-helixtrans-78.9-29.4-178.6-55.8-51.1000111.9S349 L354 K355 S356S349-D352 WeakPolarHBondContact CB-OD2 3.49Å; S349-D352 PolarHBondContact O-N 3.34Å; S349-D352 VanDerWaalsContact O-N 3.13Å; S349-D352 VanDerWaalsContact OG-CG 3.29Å; S349-D352 PolarHBondContact OG-N 3.18Å; S349-D352 VanDerWaalsContact OG-N 3.1Å; S349-D352 PolarHBondContact OG-OD2 3.13Å; D352-L354 VanDerWaalsContact C-N 3.32Å; D352-K355 PolarHBondContact O-N 3.45Å; D352-K355 IonicContact OD1-NZ 3.35Å; D352-K355 PolarHBondContact OD1-NZ 2.95Å; D352-S356 WeakPolarHBondContact O-CB 3.43Å; D352-S356 PolarHBondContact O-N 3.34Å; D352-S356 PolarHBondContact O-OG 3.46Å
353C88Confident85.8Confident0 Ų090.5 Ų90.50%045%0.453CS..Hα-helixtrans-57.3-46.8164.8-166.60000110.9L339 Q343 I348 S349 S356 F357L339-C353 HydrophobicContact CD1-CB 4.3Å; Q343-C353 HydrophobicContact CB-CB 4.17Å; Q343-C353 HydrophobicContact CG-CB 4.2Å; Q343-C353 PolarHBondContact N-SG 3.43Å; Q343-C353 VanDerWaalsContact N-SG 3.43Å; I348-C353 HydrophobicContact CD1-CB 3.88Å; I348-C353 HydrophobicContact CG1-CB 3.93Å; S349-C353 WeakPolarHBondContact O-CB 3.43Å; S349-C353 PolarHBondContact O-N 3.43Å; C353-S356 PolarHBondContact O-N 2.91Å; C353-F357 WeakPolarHBondContact O-CB 3.16Å; C353-F357 PolarHBondContact O-N 3.46Å
354L88.8Confident85.9Confident83 Ų8390.3 Ų90.344%0.43546%0.461SS..Hα-helixtrans-64-45.4178.4-178.562.8000112.1L339 P350 R351 D352 F357 M358L339-L354 HydrophobicContact CD1-CB 4.2Å; L339-L354 HydrophobicContact CD1-CD1 4.19Å; L339-L354 HydrophobicContact CD2-CB 4.28Å; L339-L354 HydrophobicContact CD2-CD1 4.13Å; P350-L354 WeakPolarHBondContact O-CB 3.34Å; P350-L354 PolarHBondContact O-N 3.01Å; P350-L354 VanDerWaalsContact O-N 3.08Å; R351-L354 PolarHBondContact O-N 3.44Å; D352-L354 VanDerWaalsContact C-N 3.32Å; L354-F357 PolarHBondContact O-N 3.31Å; L354-M358 HydrophobicContact CD1-CG 3.84Å; L354-M358 HydrophobicContact CD1-SD 4.47Å; L354-M358 HydrophobicContact CG-CG 4.3Å; L354-M358 WeakPolarHBondContact O-CB 3.49Å; L354-M358 WeakPolarHBondContact O-CG 3.49Å; L354-M358 PolarHBondContact O-N 3.46Å
355K88.7Confident85.7Confident136 Ų13688.8 Ų88.859%0.59146%0.456SS*.Hα-helixtrans-56.6-52.6175.1-69.6172.8-169.4161.50111.3R351 D352 F357 M358 F359R351-K355 WeakPolarHBondContact O-CG 3.13Å; R351-K355 PolarHBondContact O-N 3.08Å; D352-K355 PolarHBondContact O-N 3.45Å; D352-K355 IonicContact OD1-NZ 3.35Å; D352-K355 PolarHBondContact OD1-NZ 2.95Å; K355-F357 PolarHBondContact O-N 2.96Å; K355-M358 PolarHBondContact O-N 3.44Å; K355-F359 VanDerWaalsContact O-CB 3.28Å; K355-F359 WeakPolarHBondContact O-CB 3.44Å; K355-F359 PolarHBondContact O-N 2.92Å
356S86.6Confident85.4Confident50 Ų5087.3 Ų87.335%0.3544%0.442SS..Hα-helixtrans-61.6-44.2-177.7-57.50000111.8D352 C353 F359 Q360D352-S356 WeakPolarHBondContact O-CB 3.43Å; D352-S356 PolarHBondContact O-N 3.34Å; D352-S356 PolarHBondContact O-OG 3.46Å; C353-S356 PolarHBondContact O-N 2.91Å; S356-F359 PolarHBondContact O-N 2.58Å; S356-Q360 WeakPolarHBondContact O-CB 3.31Å; S356-Q360 VanDerWaalsContact O-CG 3.31Å; S356-Q360 WeakPolarHBondContact O-CG 3.46Å; S356-Q360 PolarHBondContact O-N 3.1Å
357F86.2Confident85.3Confident23 Ų2388.5 Ų88.510%0.10145%0.447CS..Hα-helixtrans-65.3-45.9179.3178.9-102.1000112.9E338 L339 L342 C353 L354 K355 F359 Q360 K361E338-F357 HydrophobicContact CB-CE2 4.47Å; E338-F357 HydrophobicContact CB-CZ 4.22Å; E338-F357 HydrophobicContact CG-CE2 3.78Å; E338-F357 HydrophobicContact CG-CZ 3.86Å; E338-F357 VanDerWaalsContact OE1-CE2 3.32Å; E338-F357 WeakPolarHBondContact OE1-CE2 3.27Å; E338-F357 WeakPolarHBondContact OE1-CZ 3.38Å; E338-F357 WeakPolarHBondContact OE2-CZ 3.28Å; L339-F357 HydrophobicContact CD1-CB 3.9Å; L339-F357 HydrophobicContact CD1-CD1 4.14Å; L339-F357 HydrophobicContact CD1-CG 4.06Å; L342-F357 HydrophobicContact CD2-CB 4.11Å; L342-F357 HydrophobicContact CD2-CD2 3.92Å; L342-F357 HydrophobicContact CD2-CG 4.48Å; C353-F357 WeakPolarHBondContact O-CB 3.16Å; C353-F357 PolarHBondContact O-N 3.46Å; L354-F357 PolarHBondContact O-N 3.31Å; K355-F357 PolarHBondContact O-N 2.96Å; F357-F359 VanDerWaalsContact C-N 3.31Å; F357-F359 PolarHBondContact O-N 3.47Å; F357-Q360 PolarHBondContact O-N 3.24Å; F357-K361 HydrophobicContact CE1-CD 3.94Å; F357-K361 HydrophobicContact CE2-CD 4.44Å; F357-K361 HydrophobicContact CZ-CD 3.87Å; F357-K361 VanDerWaalsContact CZ-NZ 3.28Å; F357-K361 PolarHBondContact O-N 3.31Å
358M86.2Confident84.5Confident121 Ų12187.7 Ų87.760%0.59644%0.437SS*.Hα-helixtrans-63.7-39.3176.4-68.4-71-8100111.2L354 K355 K361 W362L354-M358 HydrophobicContact CD1-CG 3.84Å; L354-M358 HydrophobicContact CD1-SD 4.47Å; L354-M358 HydrophobicContact CG-CG 4.3Å; L354-M358 WeakPolarHBondContact O-CB 3.49Å; L354-M358 WeakPolarHBondContact O-CG 3.49Å; L354-M358 PolarHBondContact O-N 3.46Å; K355-M358 PolarHBondContact O-N 3.44Å; M358-K361 PolarHBondContact O-N 2.82Å; M358-W362 WeakPolarHBondContact O-CB 3.28Å; M358-W362 PolarHBondContact O-N 3.46Å
359F88.7Confident83.4Confident117 Ų11789.8 Ų89.851%0.51345%0.445SS..Hα-helixtrans-66.1-41.9176.1-172-122.7000112.3K355 S356 F357 W362 Q363K355-F359 VanDerWaalsContact O-CB 3.28Å; K355-F359 WeakPolarHBondContact O-CB 3.44Å; K355-F359 PolarHBondContact O-N 2.92Å; S356-F359 PolarHBondContact O-N 2.58Å; F357-F359 VanDerWaalsContact C-N 3.31Å; F357-F359 PolarHBondContact O-N 3.47Å; F359-W362 AromaticContact CD2-CE3 3.91Å; F359-W362 HydrophobicContact CD2-CE3 3.91Å; F359-W362 HydrophobicContact CD2-CZ3 4.3Å; F359-W362 AromaticContact CE2-CE3 3.85Å; F359-W362 HydrophobicContact CE2-CE3 3.85Å; F359-W362 AromaticContact CE2-CZ3 3.75Å; F359-W362 HydrophobicContact CE2-CZ3 3.75Å; F359-W362 PolarHBondContact O-N 2.93Å; F359-Q363 WeakPolarHBondContact O-CG 3.35Å; F359-Q363 PolarHBondContact O-N 3.42Å
360Q85.8Confident82Confident112 Ų11294.5 Ų94.552%0.52346%0.462SS..Hα-helixtrans-62.6-46.2173.9-76.2173.9-2.600112.2S356 F357 W362 Q363 A364S356-Q360 WeakPolarHBondContact O-CB 3.31Å; S356-Q360 VanDerWaalsContact O-CG 3.31Å; S356-Q360 WeakPolarHBondContact O-CG 3.46Å; S356-Q360 PolarHBondContact O-N 3.1Å; F357-Q360 PolarHBondContact O-N 3.24Å; Q360-W362 VanDerWaalsContact C-N 3.32Å; Q360-W362 PolarHBondContact O-N 2.84Å; Q360-Q363 PolarHBondContact O-N 2.94Å; Q360-A364 WeakPolarHBondContact O-CB 3.38Å; Q360-A364 PolarHBondContact O-N 3.3Å
361K84.2Confident80.6Confident99 Ų9996.2 Ų96.243%0.4346%0.463SS..Hα-helixtrans-63.2-37.7175.9-79-166.8173.1179.80112.2E338 F357 M358 H365E338-K361 VanDerWaalsContact CD-NZ 3.27Å; E338-K361 WeakPolarHBondContact OE1-CE 3.19Å; E338-K361 IonicContact OE1-NZ 3.39Å; E338-K361 PolarHBondContact OE1-NZ 3.4Å; E338-K361 VanDerWaalsContact OE1-NZ 3.08Å; E338-K361 IonicContact OE2-NZ 3.59Å; E338-K361 PolarHBondContact OE2-NZ 2.96Å; F357-K361 HydrophobicContact CE1-CD 3.94Å; F357-K361 HydrophobicContact CE2-CD 4.44Å; F357-K361 HydrophobicContact CZ-CD 3.87Å; F357-K361 VanDerWaalsContact CZ-NZ 3.28Å; F357-K361 PolarHBondContact O-N 3.31Å; M358-K361 PolarHBondContact O-N 2.82Å; K361-H365 PolarHBondContact O-N 2.89Å; K361-H365 VanDerWaalsContact O-N 3.14Å
362W88.9Confident79Confident149 Ų14990.5 Ų90.556%0.56445%0.454SS*.Hα-helixtrans-62.9-49.8172.3175.181.8000111.9M358 F359 Q360 A364 H365 N366M358-W362 WeakPolarHBondContact O-CB 3.28Å; M358-W362 PolarHBondContact O-N 3.46Å; F359-W362 AromaticContact CD2-CE3 3.91Å; F359-W362 HydrophobicContact CD2-CE3 3.91Å; F359-W362 HydrophobicContact CD2-CZ3 4.3Å; F359-W362 AromaticContact CE2-CE3 3.85Å; F359-W362 HydrophobicContact CE2-CE3 3.85Å; F359-W362 AromaticContact CE2-CZ3 3.75Å; F359-W362 HydrophobicContact CE2-CZ3 3.75Å; F359-W362 PolarHBondContact O-N 2.93Å; Q360-W362 VanDerWaalsContact C-N 3.32Å; Q360-W362 PolarHBondContact O-N 2.84Å; W362-A364 PolarHBondContact O-N 3.44Å; W362-H365 PolarHBondContact O-N 3.36Å; W362-N366 PolarHBondContact NE1-ND2 3.14Å; W362-N366 PolarHBondContact O-N 3.46Å; W362-N366 VanDerWaalsContact O-N 3.12Å; W362-N366 PolarHBondContact O-ND2 3.49Å
363Q87.6Confident77.2Confident88 Ų8895.1 Ų95.141%0.41148%0.476SS..Hα-helixtrans-58-47177.3-74.8-172.10.900112.1F359 Q360 H365 N366 V367F359-Q363 WeakPolarHBondContact O-CG 3.35Å; F359-Q363 PolarHBondContact O-N 3.42Å; Q360-Q363 PolarHBondContact O-N 2.94Å; Q363-H365 VanDerWaalsContact C-N 3.31Å; Q363-H365 PolarHBondContact O-N 2.94Å; Q363-N366 PolarHBondContact O-N 3.46Å; Q363-N366 VanDerWaalsContact O-N 3.14Å; Q363-V367 WeakPolarHBondContact O-CG2 3.43Å; Q363-V367 PolarHBondContact O-N 3.14Å
364A85.9Confident75.4Confident57 Ų57102.4 Ų102.447%0.47151%0.51SS..Hα-helixtrans-57.2-43.7178.800000112.1Q360 W362 N366 V367 V368Q360-A364 WeakPolarHBondContact O-CB 3.38Å; Q360-A364 PolarHBondContact O-N 3.3Å; W362-A364 PolarHBondContact O-N 3.44Å; A364-N366 PolarHBondContact O-N 3.07Å; A364-V367 PolarHBondContact O-N 2.88Å; A364-V368 WeakPolarHBondContact O-CG2 3.42Å; A364-V368 PolarHBondContact O-N 3.03Å
365H80Confident73.4Confident113 Ų113108 Ų10852%0.52353%0.527SS..Hα-helixtrans-62.9-41.1176.7-172.4-86.9000112.7K361 W362 Q363 V368 Q369K361-H365 PolarHBondContact O-N 2.89Å; K361-H365 VanDerWaalsContact O-N 3.14Å; W362-H365 PolarHBondContact O-N 3.36Å; Q363-H365 VanDerWaalsContact C-N 3.31Å; Q363-H365 PolarHBondContact O-N 2.94Å; H365-V368 PolarHBondContact O-N 3.35Å; H365-Q369 PolarHBondContact O-N 3.49Å
366N79Confident71Confident58 Ų58104.8 Ų104.831%0.3153%0.532SS..Hα-helixtrans-67.1-41.4177.8-75.8-89.1000112.3W362 Q363 A364 V368 Q369 Q370W362-N366 PolarHBondContact NE1-ND2 3.14Å; W362-N366 PolarHBondContact O-N 3.46Å; W362-N366 VanDerWaalsContact O-N 3.12Å; W362-N366 PolarHBondContact O-ND2 3.49Å; Q363-N366 PolarHBondContact O-N 3.46Å; Q363-N366 VanDerWaalsContact O-N 3.14Å; A364-N366 PolarHBondContact O-N 3.07Å; N366-V368 VanDerWaalsContact C-N 3.33Å; N366-V368 PolarHBondContact O-N 3.27Å; N366-Q369 PolarHBondContact O-N 2.77Å; N366-Q370 PolarHBondContact O-N 3.09Å
367V75.6Confident68.9Low76 Ų76110.7 Ų110.746%0.46155%0.554SS.*Hα-helixtrans-65.1-36.2177.3173.40000111.6Q363 A364 H371Q363-V367 WeakPolarHBondContact O-CG2 3.43Å; Q363-V367 PolarHBondContact O-N 3.14Å; A364-V367 PolarHBondContact O-N 2.88Å; V367-H371 PolarHBondContact O-N 3.12Å; V367-H371 VanDerWaalsContact O-N 3.13Å; V367-H371 PolarHBondContact O-ND1 3.32Å
368V66.1Low66.8Low102 Ų102117.8 Ų117.862%0.61859%0.592SS**Hα-helixtrans-67.6-42.6173.8170.30000111.3A364 H365 N366 H371 S372A364-V368 WeakPolarHBondContact O-CG2 3.42Å; A364-V368 PolarHBondContact O-N 3.03Å; H365-V368 PolarHBondContact O-N 3.35Å; N366-V368 VanDerWaalsContact C-N 3.33Å; N366-V368 PolarHBondContact O-N 3.27Å; V368-H371 PolarHBondContact O-N 3.43Å; V368-S372 PolarHBondContact O-N 2.96Å; V368-S372 VanDerWaalsContact O-N 3.09Å
369Q59.3Low64.6Low108 Ų108115.7 Ų115.751%0.50560%0.602SS.*Hα-helixtrans-62.2-44174.4-81.4-172.6-28.800112.4H365 N366 H371 S372 M373H365-Q369 PolarHBondContact O-N 3.49Å; N366-Q369 PolarHBondContact O-N 2.77Å; Q369-H371 PolarHBondContact O-N 3.04Å; Q369-S372 PolarHBondContact O-N 3.29Å; Q369-S372 PolarHBondContact O-OG 3.22Å; Q369-M373 PolarHBondContact O-N 3.22Å
370Q56.4Low62Low148 Ų148119.3 Ų119.369%0.69262%0.62SS**Hα-helixtrans-62-41.3177.1-77.1-174.1-18.500113.1N366 S372 M373 H374N366-Q370 PolarHBondContact O-N 3.09Å; Q370-S372 VanDerWaalsContact C-N 3.31Å; Q370-S372 PolarHBondContact O-N 3Å; Q370-M373 PolarHBondContact O-N 3.42Å; Q370-H374 PolarHBondContact O-N 3.28Å
371H54.1Low60.2Low112 Ų112123.6 Ų123.652%0.51964%0.637SS.*Hα-helixtrans-65.4-32.3175.2-7998.6000113V367 V368 Q369 M373 H374V367-H371 PolarHBondContact O-N 3.12Å; V367-H371 VanDerWaalsContact O-N 3.13Å; V367-H371 PolarHBondContact O-ND1 3.32Å; V368-H371 PolarHBondContact O-N 3.43Å; Q369-H371 PolarHBondContact O-N 3.04Å; H371-M373 PolarHBondContact O-N 3.41Å; H371-H374 PolarHBondContact O-N 3.38Å
372S53.7Low58.2Low85 Ų85125.3 Ų125.359%0.59466%0.659SS**Hα-helixtrans-64.7-27.4175.376.40000113.6V368 Q369 Q370V368-S372 PolarHBondContact O-N 2.96Å; V368-S372 VanDerWaalsContact O-N 3.09Å; Q369-S372 PolarHBondContact O-N 3.29Å; Q369-S372 PolarHBondContact O-OG 3.22Å; Q370-S372 VanDerWaalsContact C-N 3.31Å; Q370-S372 PolarHBondContact O-N 3Å
373M52.2Low55.8Low160 Ų160122.2 Ų122.279%0.78867%0.673SS**Hα-helixtrans-86-25.5179.4-66.6-68.7-76.800113.5Q369 Q370 H371Q369-M373 PolarHBondContact O-N 3.22Å; Q370-M373 PolarHBondContact O-N 3.42Å; H371-M373 PolarHBondContact O-N 3.41Å
374H50.5Low53.7Low154 Ų154121.3 Ų121.371%0.71369%0.687SS**Hα-helixtrans-88.5-16-172.6-156.566.5000115Q370 H371Q370-H374 PolarHBondContact O-N 3.28Å; H371-H374 PolarHBondContact O-N 3.38Å
375Y44.9Very low51.7Low200 Ų200124.6 Ų124.678%0.78470%0.704SS**THydrogen-bonded Turntrans-92.85.3177.5-83-81.4000114.7
376G39.5Very low50Low69 Ų69125.4 Ų125.471%0.71172%0.719SS**SBendtrans-88.51.5-176.900000116.9
377H43.2Very low48.3Very low174 Ų174127.8 Ų127.881%0.80675%0.746SS**SBendtrans-13923.9-165.6-157.754000116.7
378L41.6Very low46.4Very low172 Ų172128.6 Ų128.690%0.90176%0.761SS**  trans-134.495.2172.3-70.6174.6000110.2
379G39.5Very low45.3Very low77 Ų77131.3 Ų131.379%0.79477%0.77SS**  trans-173.89.7-174.600000119.1F381G379-F381 PolarHBondContact O-N 2.61Å
380E35.1Very low44.2Very low193 Ų193131.2 Ų131.290%0.90278%0.782SS**  trans-87.894.3171.7-83.8-176.5114.600111.4
381F47.2Very low43.5Very low201 Ų201133.2 Ų133.288%0.88279%0.791SS**  trans-137121.5161.5-91.5-78.3000110.3G379 G383G379-F381 PolarHBondContact O-N 2.61Å; F381-G383 PolarHBondContact O-N 3.33Å
382P41.3Very low42.7Very low136 Ų136133.8 Ų133.888%0.88381%0.805SS**  trans-87.7108.3-17932.7-31.7000111.3
383G38.4Very low41.8Very low84 Ų84138 Ų13887%0.86682%0.817SS**  trans147.5103.3164.600000115.7F381F381-G383 PolarHBondContact O-N 3.33Å
384G43.8Very low41.7Very low68 Ų68138.9 Ų138.970%0.70182%0.822SS**  trans158.2125.3170.200000111.7
385P44.8Very low41.5Very low127 Ų127135.9 Ų135.983%0.82582%0.816SS**PPolyproline II helixtrans-79.8140.8-17631.9-34.1000111.9A387P385-A387 PolarHBondContact O-N 3.14Å
386P43.6Very low41.8Very low130 Ų130132.5 Ų132.584%0.84482%0.818SS**PPolyproline II helixtrans-79.9116.7177.931-32.6000111.3
387A44.3Very low41.9Very low107 Ų107138.6 Ų138.688%0.88483%0.828SS**PPolyproline II helixtrans-81.3130.8165.900000110P385P385-A387 PolarHBondContact O-N 3.14Å
388A35.9Very low41.9Very low93 Ų93137.8 Ų137.877%0.76983%0.83SS**PPolyproline II helixtrans-86.7132.1-165.400000114.9
389I42.1Very low42.3Very low159 Ų159133.6 Ų133.682%0.81582%0.82SS**  trans-144.590.9150.5-55.5-177000106.5
390S36.6Very low42.2Very low106 Ų106136.1 Ų136.174%0.74182%0.822SS**  61.584.291-61.10000114.7
391Q40.7Very low42.6Very low190 Ų190138.8 Ų138.889%0.88882%0.824SS**  trans-132.2150.1150.9-77.2-1532.700110.9
392P38.1Very low42Very low124 Ų124134.1 Ų134.181%0.80581%0.814SS**  trans-89.2139-156.832.9-33.7000114.7
393M35.4Very low42.1Very low175 Ų175134.1 Ų134.186%0.86281%0.812SS**  trans-54.5131.9169.5174.6-179.4167.300113
394M49Very low42.3Very low178 Ų178134.3 Ų134.388%0.87780%0.8SS**  trans-121.2118.2164.8-150.717385.200108.6
395P46.8Very low42.1Very low91 Ų91140.2 Ų140.259%0.59181%0.806SS**  trans-87.3146.1-176.133.7-33.4000111.9
396P50.7Low41.6Very low129 Ų129144.7 Ų144.784%0.83881%0.807SS**  trans-76.5131.9166.831.3-31.7000110.3
397E41.8Very low41.6Very low196 Ų196149.2 Ų149.292%0.91681%0.807SS**  trans-104.9118.5174.4-175.7176.5-161.100108.9
398D43.9Very low41.2Very low157 Ų157152.8 Ų152.884%0.8480%0.803SS**  trans-141126.4176.9-128.6-32.2000112.2
399A49.7Very low41.6Very low85 Ų85160.1 Ų160.170%0.70281%0.81SS**  trans42.3132.116400000122.2
400P37.2Very low41.3Very low129 Ų129161.9 Ų161.984%0.83881%0.812SS**  trans-85.4140.3178.734.5-34.7000113.8
401R42.5Very low41.5Very low249 Ų249159.9 Ų159.994%0.9481%0.808SS**  trans-150.1150.1155.5-107.6169.7-168.8-134.51.5112.3
402P36.6Very low41.7Very low103 Ų103155.8 Ų155.867%0.66980%0.801SS**  trans-119.4157.8-150.641.7-31.5000117.1
403T41.5Very low41.9Very low137 Ų137156 Ų15684%0.8481%0.805SS**  trans67.1139.7166.793.30000115.3
404S43.8Very low42Very low87 Ų87151.5 Ų151.561%0.60880%0.803SS**  cis-175.3128.443-169.50000112.5
405K39.1Very low41.4Very low193 Ų193147.2 Ų147.284%0.83981%0.805SS**  trans62.3133.5145.5-63.9171.7-173.7173.50122.4
406R35.4Very low40.8Very low221 Ų221147.5 Ų147.583%0.83482%0.815SS**  trans80.7130140.4-167.8174.1171.4-1422.9115.2
407R43.1Very low40.2Very low224 Ų224149.7 Ų149.785%0.84582%0.82SS**  cis-154.1172.928.7-154.3169172.1175.9-5.3112.9
408K35.9Very low40Very low183 Ų183144.5 Ų144.580%0.79681%0.81SS**  trans-121.1141.4-164.5165.2-172.2-177.9176.90113.3
409R42.8Very low39.9Very low246 Ų246142.5 Ų142.593%0.92881%0.808SS**  trans177.5143.3152.1-103.7167.7173.5175.4-4.2108.3
410K36.5Very low39.3Very low197 Ų197143.9 Ų143.986%0.85781%0.813SS**  cis140.2122.4-17.3178-177.2177-171.70107.6
411G41.1Very low39.3Very low64 Ų64141.9 Ų141.966%0.6682%0.815SS**  trans124.5139.9158.700000113
412S44Very low38.8Very low104 Ų104134.1 Ų134.173%0.72781%0.813SS**  cis154.8146.2-23.7450000107
413S42.2Very low38.8Very low129 Ų129133.2 Ų133.290%0.90282%0.822SS**  trans62.1144.817761.10000116.3
414G38.9Very low38.5Very low80 Ų80136.3 Ų136.383%0.82582%0.824SS**  cis165.7175.9-3.600000110.9
415G36.1Very low38.4Very low88 Ų88141.5 Ų141.591%0.90784%0.836SS**  trans110.1102.7169.100000114.8
416A34.6Very low38.3Very low97 Ų97142.1 Ų142.180%0.80284%0.838SS**  trans-95.2152.7161.800000109.4
417N37.8Very low38.6Very low175 Ų175136.5 Ų136.594%0.93684%0.839SS**  trans-155.2151.2139.4-123.5-12.1000112.1
418A37.2Very low38.4Very low86 Ų86130.3 Ų130.371%0.71184%0.836SS**  trans-115163.6-174.900000111.6
419S41.2Very low38.6Very low115 Ų115126.1 Ų126.180%0.80484%0.835SS**  trans139.1155.3164.156.70000110.5
420S38.7Very low38.5Very low114 Ų114120.2 Ų120.280%0.79783%0.832SS**  cis-171.6148-30.653.80000108.8
421G35.6Very low38.7Very low87 Ų87116.7 Ų116.790%0.89783%0.829SS**  trans86.6151.2171.700000114.4
422G32.1Very low38.7Very low86 Ų86118.1 Ų118.189%0.88784%0.835SS**  cis138.8102.9-1.100000111.6
423G37.2Very low38.6Very low84 Ų84119.2 Ų119.287%0.86684%0.84SS**  trans-176.2124.6179.100000114
424K35.6Very low38.4Very low202 Ų202118.1 Ų118.188%0.87884%0.838SS**  trans-94.7148.9178.3-71.7171.4172.3171.10112.1
425K40.5Very low38.4Very low196 Ų196120 Ų12085%0.85284%0.839SS**  trans156.6117.5131.4-85.1159.9-175.5-178.60108.5
426K38.1Very low38.7Very low206 Ų206119.6 Ų119.690%0.89683%0.827SS**  86.5139.171.8-104.7-160.5176.9-168.60113.7
427A40.7Very low38.9Very low103 Ų103123 Ų12385%0.85183%0.831SS**  trans79.9151.9175.500000117.2
428A40.7Very low39.1Very low94 Ų94123.8 Ų123.878%0.77783%0.827SS**  cis-169.6146.4-33.200000109.9
429A40Very low39.3Very low95 Ų95125 Ų12579%0.78583%0.827SS**  trans38.2120.6153.700000121.9
430S40.6Very low39Very low122 Ų122126.6 Ų126.685%0.85383%0.832SS**  -168127.5121.7-790000110.7
431P39.4Very low39Very low123 Ų123126.8 Ų126.880%0.79983%0.828SS**  trans-109.5179.6177.440.3-33.1000113.8
432A42.5Very low39.1Very low95 Ų95128.5 Ų128.579%0.78582%0.822SS**  trans83.5158.6167.200000116.9
433P41Very low39.7Very low127 Ų127132.6 Ų132.683%0.82582%0.818SS**  cis-120.9165.22.839.6-25.9000115.8
434A38.1Very low39.6Very low106 Ų106135.2 Ų135.288%0.87682%0.816SS**  trans-99.5146.2167.400000111
435S38.7Very low40.1Very low120 Ų120132.5 Ų132.584%0.83981%0.812SS**  trans-152.1145.5165.959.30000108.5
436A43.1Very low40.3Very low78 Ų78129.2 Ų129.265%0.64581%0.808SS**  cis-142.7131.9-9.100000109.8
437N39Very low41Very low168 Ų168127.6 Ų127.690%0.89881%0.805SS**PPolyproline II helixtrans-97.3120.9165.4-105.442.7000108.3P439N437-P439 WeakPolarHBondContact O-CD 3.33Å
438F42.1Very low41.6Very low193 Ų193128.9 Ų128.985%0.84680%0.802SS**PPolyproline II helixtrans-84.5122.6170.9-83.3-86.7000110.5
439P41Very low42.3Very low111 Ų111130.4 Ų130.472%0.72180%0.802SS**PPolyproline II helixtrans-81.8130.4170.132.3-30.9000110.2N437 T441N437-P439 WeakPolarHBondContact O-CD 3.33Å; P439-T441 PolarHBondContact O-N 3.25Å
440V35.2Very low42.8Very low149 Ų149130.6 Ų130.690%0.90380%0.797SS**  trans-72.3115.4167.8175.10000108.2
441T38.7Very low43.3Very low117 Ų117133.8 Ų133.872%0.71880%0.799SS**  trans-106.6141.6167.9177.90000110.1P439 H443P439-T441 PolarHBondContact O-N 3.25Å; T441-H443 PolarHBondContact O-N 3.18Å
442T35.8Very low44.2Very low124 Ų124133.8 Ų133.876%0.76180%0.799SS**  trans-74.8115.7-169.447.70000112.5
443H45.8Very low44.7Very low172 Ų172134.8 Ų134.880%0.79680%0.8SS**  trans-135.2132.4151.6-89.7-86.3000109.8T441T441-H443 PolarHBondContact O-N 3.18Å
444V34.4Very low44.7Very low138 Ų138138 Ų13884%0.83681%0.806SS**  trans-102.798.4-179.6-90.20000108.8
445D46.2Very low45.5Very low146 Ų146141.7 Ų141.778%0.78181%0.807SS**  trans-110.6102.8169.2-78.7-44.7000109.9M447D445-M447 PolarHBondContact O-N 2.93Å
446V45.3Very low45.9Very low127 Ų127139.6 Ų139.677%0.7781%0.805SS**  trans-89.293.7172-179.70000107.9V448V446-V448 HydrophobicContact CG1-CG2 4.05Å; V446-V448 PolarHBondContact O-N 2.94Å
447M52.9Low46Very low171 Ų171139.6 Ų139.684%0.84281%0.813SS**  trans-80.998.4167.6-86.8-160.6-9000110.5D445 V449D445-M447 PolarHBondContact O-N 2.93Å; M447-V449 HydrophobicContact CB-CG2 4.49Å; M447-V449 PolarHBondContact O-N 3.09Å
448V53.8Low46Very low131 Ų131140.2 Ų140.279%0.79481%0.81SS**  trans-73106.7164.2-178.30000107.8V446V446-V448 HydrophobicContact CG1-CG2 4.05Å; V446-V448 PolarHBondContact O-N 2.94Å
449V54.7Low46.2Very low126 Ų126141.5 Ų141.576%0.76482%0.816SS**  trans-101.7110.6173.5-176.40000108.7M447M447-V449 HydrophobicContact CB-CG2 4.49Å; M447-V449 PolarHBondContact O-N 3.09Å
450S51.5Low46.7Very low99 Ų99139.1 Ų139.169%0.69281%0.811SS**PPolyproline II helixtrans-65.7152.3175.245.60000112.7P452S450-P452 WeakPolarHBondContact O-CD 3.42Å
451E49.3Very low47.3Very low188 Ų188140.4 Ų140.488%0.87981%0.813SS**PPolyproline II helixtrans-55.9131.2177.7-60.6-177.9162.700113
452P58.5Low48.3Very low124 Ų124143.9 Ų143.981%0.80582%0.821SS**PPolyproline II helixtrans-88.6117.4160.3-8.727.7000110.2S450S450-P452 WeakPolarHBondContact O-CD 3.42Å
453S52.6Low49.3Very low115 Ų115144.4 Ų144.480%0.80482%0.819SS**PPolyproline II helixtrans-55.7155.5175.5-64.40000114M455S453-M455 PolarHBondContact O-N 2.92Å
454M42.3Very low49.9Very low194 Ų194144.9 Ų144.996%0.95682%0.822SS**PPolyproline II helixtrans-47.6126.1170.3-62.7178.5-71.600112.6
455M55.1Low51.3Low184 Ų184148.3 Ų148.391%0.90682%0.82SS**  trans-122.1115.6155.7-167.684.278.500107S453S453-M455 PolarHBondContact O-N 2.92Å
456G46.3Very low51.6Low77 Ų77149.2 Ų149.279%0.79482%0.824SS**  trans-70.2153.6175.600000111.8
457G44.6Very low52.3Low78 Ų78150.9 Ų150.980%0.80483%0.827SS**  trans-166.783.1179.100000109.7
458E40.7Very low52.6Low181 Ų181148 Ų14885%0.84682%0.823SS**  trans-68130.5170.862.1-147.5142.400110.8
459F45.8Very low52.6Low220 Ų220153.4 Ų153.497%0.96583%0.829SS**  trans159.5134.1163-110.9-90.6000107.2
460G50.9Low52.9Low60 Ų60154.9 Ų154.962%0.61983%0.832SS**  cis-171.9153.9-7.200000109.7E462G460-E462 PolarHBondContact O-N 3.13Å; G460-E462 VanDerWaalsContact O-N 3.14Å
461D49Very low53.4Low177 Ų177158.1 Ų158.195%0.94784%0.836SS**  trans-77.586.3-173-62.5-62.5000113.5
462E58.4Low53.7Low190 Ų190156.2 Ų156.289%0.88883%0.832SS**  trans-138.5-0.7176.3-77.8-149.4138.500118.2G460 E464G460-E462 PolarHBondContact O-N 3.13Å; G460-E462 VanDerWaalsContact O-N 3.14Å; E462-E464 VanDerWaalsContact C-N 3.34Å; E462-E464 PolarHBondContact O-N 3.18Å
463D57.8Low53.6Low135 Ų135156.4 Ų156.472%0.72283%0.831SS**  trans-91.930.3-173.3-135.54.2000115.1R465D463-R465 PolarHBondContact O-N 3.2Å; D463-R465 IonicContact OD1-NE 3.18Å; D463-R465 PolarHBondContact OD1-NE 3.42Å
464E58.1Low53.4Low182 Ų182160 Ų16085%0.8584%0.836SS**  trans-74.871.9168.2-74.5-153.9154.400111.7E462 L466E462-E464 VanDerWaalsContact C-N 3.34Å; E462-E464 PolarHBondContact O-N 3.18Å; E464-L466 PolarHBondContact O-N 3.35Å
465R62.9Low53.7Low210 Ų210159.9 Ų159.979%0.79283%0.83SS**  trans-71.994173.5-69.3-177.7-178.6-115.2-4.3111.4D463 I467D463-R465 PolarHBondContact O-N 3.2Å; D463-R465 IonicContact OD1-NE 3.18Å; D463-R465 PolarHBondContact OD1-NE 3.42Å; R465-I467 PolarHBondContact O-N 3.41Å; R465-I467 VanDerWaalsContact O-N 3.09Å
466L53.8Low53.4Low164 Ų164156.3 Ų156.386%0.85981%0.814SS**  trans-43.2108.2171.7-66164000112.4E464 S468E464-L466 PolarHBondContact O-N 3.35Å; L466-S468 PolarHBondContact O-N 3.35Å
467I59.8Low53.4Low162 Ų162158 Ų15883%0.83181%0.811SS**  trans-81.396.8170-57.5176.2000108.1R465 R469R465-I467 PolarHBondContact O-N 3.41Å; R465-I467 VanDerWaalsContact O-N 3.09Å; I467-R469 PolarHBondContact O-N 3.45Å
468S59.2Low53.5Low110 Ų110158.4 Ų158.477%0.76980%0.802SS**  trans-58121.9167.6-75.20000110.1L466 L470L466-S468 PolarHBondContact O-N 3.35Å; S468-L470 PolarHBondContact O-N 3.22Å
469R53.5Low53.6Low246 Ų246155.6 Ų155.693%0.92880%0.797SS**  trans-61.4106.4169.5-81179.2154.696.6-4.2109.1I467I467-R469 PolarHBondContact O-N 3.45Å
470L60.6Low53.2Low157 Ų157151.1 Ų151.182%0.82279%0.793SS**  trans-85.4106.2163.6-16373.4000107.6S468S468-L470 PolarHBondContact O-N 3.22Å
471E61.9Low52.8Low166 Ų166152.5 Ų152.578%0.77680%0.799SS**  trans-74.9130.5169.165.4-178.5-145.900109.6T473E471-T473 PolarHBondContact O-N 2.93Å
472N55.1Low52.5Low149 Ų149150.8 Ų150.880%0.79780%0.795SS**  trans-77.8114.8168.3-79.5-8.3000108
473T57.8Low51.6Low127 Ų127147.6 Ų147.678%0.77979%0.791SS**  trans-58.1137.7168.539.60000110.2E471E471-T473 PolarHBondContact O-N 2.93Å
474Q47.8Very low50.8Low192 Ų192146.5 Ų146.590%0.89779%0.794SS**  trans-64.6140.5-177.9-75.4-179.8-21.700111.5D476Q474-D476 PolarHBondContact O-N 3.36Å
475F47.7Very low50.1Low191 Ų191143.2 Ų143.284%0.83879%0.791SS**  trans-76.2106.6173.5-178.9-92.7000110P477F475-P477 HydrophobicContact CE1-CB 4.18Å
476D49.4Very low49.2Very low108 Ų108141.9 Ų141.958%0.57880%0.796SS**  trans-93.5120.5171.1-172.1-37.6000109.8Q474 S478Q474-D476 PolarHBondContact O-N 3.36Å; D476-S478 VanDerWaalsContact C-N 3.28Å; D476-S478 PolarHBondContact O-N 2.67Å; D476-S478 WeakPolarHBondContact OD1-CB 3.19Å; D476-S478 PolarHBondContact OD1-N 3.46Å; D476-S478 PolarHBondContact OD1-OG 3.35Å
477P47.4Very low48.7Very low113 Ų113140.4 Ų140.473%0.73480%0.796SS**THydrogen-bonded Turntrans-82.611.4-17434.7-37000114.9F475F475-P477 HydrophobicContact CE1-CB 4.18Å
478S47Very low48Very low86 Ų86137.3 Ų137.360%0.60180%0.795SS**THydrogen-bonded Turntrans-92.1-8.7-166.962.60000117.4D476D476-S478 VanDerWaalsContact C-N 3.28Å; D476-S478 PolarHBondContact O-N 2.67Å; D476-S478 WeakPolarHBondContact OD1-CB 3.19Å; D476-S478 PolarHBondContact OD1-N 3.46Å; D476-S478 PolarHBondContact OD1-OG 3.35Å
479T41.7Very low47.4Very low123 Ų123137.7 Ų137.776%0.75579%0.794SS**  trans-137.772.2-166.734.30000115.6
480S38.6Very low47.2Very low126 Ų126133 Ų13388%0.88179%0.793SS**  trans-156.774.115853.40000114
481A40.8Very low46.6Very low88 Ų88130.9 Ų130.973%0.72779%0.788SS**  trans-111.3141.7160.100000109.5
482T44.2Very low45.5Very low141 Ų141132.1 Ų132.187%0.86580%0.796SS**  trans78.3120.617970.60000117.4
483P38.2Very low44.8Very low124 Ų124128.2 Ų128.281%0.80579%0.792SS**  trans-109.1133.717537-28000113
484S42.4Very low44.1Very low112 Ų112127.3 Ų127.378%0.78379%0.79SS**  trans-166.9141.8159.449.30000114.5
485S43Very low43.9Very low113 Ų113123.3 Ų123.379%0.7978%0.783SS**  trans59.1109.4160.458.60000120.5
486M43.3Very low43.8Very low182 Ų182120.2 Ų120.290%0.89778%0.78SS**  trans-79.9163.5143.9-65.3-170.1169.200110.2
487P42.6Very low43.4Very low133 Ų133120.3 Ų120.386%0.86479%0.789SS**  -142.9-175.696.834.6-16.3000115.6
488A46.7Very low43.1Very low97 Ų97119.9 Ų119.980%0.80279%0.789SS**  trans-84168.8-158.100000117.3
489P45.6Very low43Very low118 Ų118120 Ų12077%0.76680%0.795SS**  trans-104156.6-174.339.2-33000114.9
490V49.8Very low42.9Very low148 Ų148121.7 Ų121.790%0.89780%0.795SS**  trans-159.6158.6152.8-97.40000111
491P47.1Very low43Very low111 Ų111123.2 Ų123.272%0.72179%0.788SS**  trans-128-177.8-149.344.3-31.2000117.1
492M40.1Very low43.2Very low192 Ų192127.7 Ų127.795%0.94679%0.793SS**  trans71125.1154.5-74-91-86.100119.4
493G40.4Very low43.4Very low68 Ų68126.6 Ų126.670%0.70179%0.788SS**  trans-179.570.3175.900000116.4
494S42.4Very low43.5Very low107 Ų107124 Ų12475%0.74879%0.785SS**  trans46.3121.3143.361.60000122.9
495S42.5Very low43.7Very low108 Ų108123 Ų12376%0.75578%0.783SS**  79.4151.312080.80000119.4
496V45.7Very low43.8Very low127 Ų127125.6 Ų125.677%0.7779%0.787SS**  cis-168.8157.7-5.1119.70000110.3
497S42.6Very low43.9Very low109 Ų109121.2 Ų121.276%0.76278%0.78SS**  trans70.3151.5160.6-80.20000120.1
498S41.3Very low44.1Very low105 Ų105119.5 Ų119.573%0.73478%0.777SS**  cis-169.2156.5-2.638.10000113.9
499A43.8Very low44.2Very low89 Ų89124.7 Ų124.774%0.73678%0.781SS**  trans71.1151.3157.300000118.2
500Q40Very low44.3Very low158 Ų158130.4 Ų130.474%0.73881%0.805SS**  cis-156.3151.68.5-156.2161.1-65.400113.7
501E41.1Very low44Very low157 Ų157129.5 Ų129.573%0.73480%0.801SS**  trans55.696.1153-77.6166.5148.100124.8
502H43.3Very low43.8Very low182 Ų182130.5 Ų130.584%0.84381%0.805SS**  45.1162101.7-103.7-50.9000123.5
503P48.5Very low44Very low118 Ų118127.1 Ų127.177%0.76680%0.797SS**  -123.5173.9-104.644.9-32.2000115.8
504G41.8Very low44.3Very low71 Ų71130.5 Ų130.573%0.73280%0.803SS**  trans-171.1101.4169.700000118.1
505A46.7Very low44.4Very low90 Ų90132 Ų13274%0.74481%0.806SS**  trans66130.9134.200000123.2
506L43.8Very low44.5Very low168 Ų168133.6 Ų133.688%0.8881%0.809SS**  trans68.2115.6146.9-59160.3000117.8
507A46.9Very low44.4Very low90 Ų90134.1 Ų134.174%0.74481%0.812SS**  cis100.9124.642.900000114.2
508A45.8Very low44.6Very low96 Ų96136 Ų13679%0.79382%0.816SS**  trans65.7100.7156.600000120.5
509K48.8Very low44.8Very low207 Ų207138.6 Ų138.690%0.982%0.823SS**  176.693.6114.5-97.7176.8177.3-179.80112.5
510N47.4Very low44.9Very low237 Ų237143.1 Ų143.1100%1.26783%0.831SS**  -174.20105.6-12423.7000110

Retrieved 510 of 510 residues in 497.4 ms (Link to these results)