A0A096N7H6_PAPAN Loading...

RNA-binding protein 34

AlphaFold DB , UniProt , Accession A0A096N7H6, Species PAPAN (Papio anubis, Olive baboon), Gene RBM34, Length 429 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
1M35.2Very low38.6Very low240 Ų240179.4 Ų179.4100%1.18288%0.877SS**  0153.70-58.2178.5-165.200108.3
2A39.3Very low38.5Very low89 Ų89181.5 Ų181.574%0.73688%0.878SS**  trans44.2134.1146.800000120.7
3L38.7Very low38.1Very low165 Ų165185.7 Ų185.786%0.86488%0.879SS**  cis-157.5166.72.8-111164.3000110
4E46.4Very low37.6Very low192 Ų192179.4 Ų179.490%0.89787%0.865SS**  trans-76.2158.4177.6-60173.393.900113.3
5G39.2Very low37.7Very low72 Ų72174.3 Ų174.374%0.74285%0.849SS**  trans-171.680.9179.200000120
6M37.6Very low37.7Very low171 Ų171173.6 Ų173.684%0.84284%0.844SS**  trans66.8121.8140.7-52.1-175.882.800123.6
7N35.3Very low37.6Very low130 Ų130174.1 Ų174.170%0.69584%0.844SS**  trans66.4105.3132.4-73.3-33.8000124.1
8K44.3Very low37.3Very low199 Ų199168.7 Ų168.787%0.86584%0.841SS**  14.6112128-65.1177.6178.8174.70118.5
9R35.9Very low37.4Very low248 Ų248169.1 Ų169.194%0.93684%0.84SS**  trans-168.8123.9141.6-105.1164.1-170-172.74.6110.8
10K37.6Very low37.8Very low216 Ų216167.1 Ų167.194%0.93983%0.833SS**  trans-139136.7156.9-85.2-164.8173.7-176.10110.6
11R34.5Very low38.9Very low251 Ų251163.9 Ų163.995%0.94782%0.824SS**  trans-124.8158.2170.8-97.7-176.4167.3-173.8-3.7108
12K37.4Very low39.2Very low205 Ų205159.9 Ų159.989%0.89181%0.807SS**  trans-21.8136.9172.4-68.2-175.7167.4-167.30118
13R33.8Very low39.3Very low236 Ų236162.7 Ų162.789%0.89181%0.81SS**  trans-176.9122.2131.3-101.7174.9-174.6-172.50.1107.6
14S31.9Very low39.2Very low97 Ų97157.7 Ų157.768%0.67880%0.799SS**  71144.883.975.70000111.7
15V38.3Very low38.8Very low104 Ų104154 Ų15463%0.6379%0.789SS**  cis-175.1150.24.3125.10000105.5
16E38.1Very low38.7Very low163 Ų163161.4 Ų161.476%0.76279%0.794SS**  cis-121-78.2-9.2-153.770.2-74.800116.1
17E35.3Very low38.8Very low181 Ų181156.6 Ų156.685%0.84679%0.788SS**  cis-167.7153.15.7-154156.2-77.200111
18G32.6Very low39.2Very low77 Ų77155.9 Ų155.979%0.79479%0.794SS**  trans126.6111.3172.100000117.3
19E39.8Very low40Very low176 Ų176152 Ų15282%0.82279%0.789SS**  trans-97.2177.8-173.5-48.9170.9144.700112.6
20N44.3Very low40.8Very low130 Ų130146.4 Ų146.470%0.69579%0.785SS**  cis-168.1-179.332-101.9-54.7000108.7
21P61.6Low41.3Very low99 Ų99139.5 Ų139.564%0.64377%0.774SS**  -133-177.3-50.140.1-22.1000114.2
22D40.6Very low41.8Very low157 Ų157135.3 Ų135.384%0.8477%0.771SS**  trans28.9140.6156.7-61.6-159.6000122.7
23D41.9Very low41.9Very low147 Ų147136.2 Ų136.279%0.78677%0.77SS**  cis-164.6-164-21.3-157.928.7000106.1
24G36.1Very low42.7Very low61 Ų61137.1 Ų137.163%0.62977%0.774SS**  cis176.4170.45.300000119.5
25V38.7Very low43.2Very low113 Ų113139 Ų13969%0.68578%0.781SS**  trans43.6109.1152.8-174.90000121.7
26R37.7Very low43.4Very low228 Ų228137.2 Ų137.286%0.8678%0.784SS**  trans91110140.4-162.6179.6-55-102.6-1.7120.3
27G38.9Very low43.6Very low70 Ų70139.1 Ų139.172%0.72279%0.792SS**  trans-101.9178.816000000113.8
28S43.5Very low43.8Very low115 Ų115137.2 Ų137.280%0.80479%0.793SS**  trans-153.9163.2177.8-82.60000111.3
29P62.1Low44.2Very low118 Ų118137.8 Ų137.877%0.76679%0.79SS**PPolyproline II helixtrans-90.9166.2-15034.8-37.3000116.3
30P52.9Low44.1Very low131 Ų131134.9 Ų134.985%0.85179%0.789SS**PPolyproline II helixtrans-76.5145.4176.232.4-36.1000113.1
31G47.3Very low44.2Very low70 Ų70134.7 Ų134.772%0.72280%0.798SS**PPolyproline II helixtrans-92133.3-173.200000116.4
32D44.4Very low43.2Very low163 Ų163138.3 Ų138.387%0.87281%0.811SS**  trans47.8113.6133.5-57.4-14.8000121.7
33Y40Very low43Very low225 Ų225136.1 Ų136.188%0.88281%0.807SS**  trans-71.8147.2153.7-84.1-112.6000111.1
34R49.8Very low42.7Very low254 Ų254140.8 Ų140.896%0.95881%0.814SS**  trans-128.7139.7157.8-119.6-176.1-176.4-135.51.1111.1
35V43.2Very low42.5Very low137 Ų137140.8 Ų140.883%0.8381%0.814SS**  trans-115.7137.9-173.2173.60000110.4
36G41.8Very low42.4Very low67 Ų67143.7 Ų143.769%0.69182%0.82SS**  trans98.1111.1152.700000116.9
37Q43.8Very low42.4Very low202 Ų202140.8 Ų140.894%0.94482%0.816SS**  -155.9155.6125.7-108.7172.621.700109.5
38V39.4Very low42.2Very low141 Ų141145.1 Ų145.186%0.85582%0.817SS**  trans-126.2133.6-167.8173.10000110.7
39A40.7Very low41.9Very low90 Ų90145 Ų14574%0.74482%0.816SS**  trans18.4112.5162.300000120
40S38.5Very low40.6Very low114 Ų114151 Ų15180%0.79782%0.824SS**  -171.7127.9119.156.30000111.7
41S44.5Very low39.7Very low127 Ų127148.4 Ų148.489%0.88882%0.82SS**  trans-154.483.9171.4-590000110.8
42L41.4Very low39.7Very low174 Ų174148.8 Ų148.891%0.91182%0.824SS**  trans-79.4168.3161.8-82.2160.8000110
43C37.4Very low39.7Very low111 Ų111147.1 Ų147.175%0.7582%0.82SS**  trans-85.8172.9-156.1-45.70000116.5
44R34.9Very low40.4Very low245 Ų245140.4 Ų140.493%0.92582%0.819SS**  trans84.2149171.8-48.5170-166.4-93.62.9114.2
45G32.4Very low40.7Very low62 Ų62138.2 Ų138.264%0.63981%0.811SS**  cis-130.3167.4-5.200000111.1
46E35.8Very low41.1Very low174 Ų174138.2 Ų138.281%0.81381%0.806SS**  59.7135.671.6-78.8-170.8140.400114.1
47H37.2Very low41.6Very low166 Ų166139.8 Ų139.877%0.76981%0.812SS**  cis-163.2175.5-11.8-143.815000107.6
48H36.1Very low42.3Very low162 Ų162134.2 Ų134.275%0.7580%0.8SS**  cis-153.7162.52.4-8.6-138.2000109.3
49S36.3Very low43.1Very low112 Ų112133.5 Ų133.578%0.78379%0.791SS**  trans-157.8119.7141.9-165.80000114
50R33.8Very low43.7Very low245 Ų245138.7 Ų138.793%0.92580%0.797SS**  trans50.399.4151.5-165.9178-177.7-179.10.4119.5
51G35.3Very low44.3Very low75 Ų75137.7 Ų137.777%0.77379%0.79SS**  trans172.1111.3159.800000111.8
52G46.6Very low44.4Very low79 Ų79137.1 Ų137.181%0.81479%0.786SS**  trans-79.7142.6-172.500000114.2
53T43.8Very low44.7Very low127 Ų127136.5 Ų136.578%0.77978%0.783SS**  trans-160.8118156.440000110.9R55T53-R55 PolarHBondContact O-N 3.25Å
54G55.2Low45.6Very low84 Ų84139.2 Ų139.287%0.86679%0.785SS**  trans-75.1114.4167.200000110
55R57.4Low46.4Very low208 Ų208132.1 Ų132.179%0.78577%0.77SS**  trans-150.3-0.6178.3-115171.4-166.6-166.62117.9T53T53-R55 PolarHBondContact O-N 3.25Å
56L51.4Low47.7Very low138 Ų138137.9 Ų137.972%0.72378%0.781SS**SBendtrans-110.1-18.9-176.2-65.2177.9000115.3A58 L59L56-A58 PolarHBondContact O-N 2.94Å; L56-A58 VanDerWaalsContact O-N 3.13Å; L56-L59 HydrophobicContact CD2-CD1 4.14Å; L56-L59 PolarHBondContact O-N 3.26Å
57A52.6Low48.7Very low99 Ų99136.1 Ų136.182%0.81878%0.776SS**G310 helixtrans-63.8-15.6173.300000113.6
58A57.9Low49.5Very low85 Ų85136.2 Ų136.270%0.70278%0.776SS**G310 helixtrans-84.30.5-177.900000114.8L56L56-A58 PolarHBondContact O-N 2.94Å; L56-A58 VanDerWaalsContact O-N 3.13Å
59L55.4Low50.5Low126 Ų126134.8 Ų134.866%0.6678%0.781SS**G310 helixtrans-102.8-9.4-175.7-65.7177.9000114.9L56L56-L59 HydrophobicContact CD2-CD1 4.14Å; L56-L59 PolarHBondContact O-N 3.26Å
60F53.6Low51.4Low200 Ų200135.7 Ų135.788%0.87778%0.782SS**SBendtrans-130.710.6-178.8-71-76.9000114.4
61S50.4Low52.4Low92 Ų92133.7 Ų133.764%0.64378%0.776SS**  trans-94.897.2169.1-170.40000109.3L63S61-L63 PolarHBondContact O-N 3.15Å
62S46.7Very low53.4Low115 Ų115135.8 Ų135.880%0.80477%0.773SS**  trans-75.8104.4174.553.40000109.7E64S62-E64 PolarHBondContact O-N 3.14Å; S62-E64 VanDerWaalsContact O-N 3.14Å
63L49.1Very low53.4Low162 Ų162136.2 Ų136.285%0.84876%0.762SS**  trans-70108.4176.5-15279.7000109.9S61 P65S61-L63 PolarHBondContact O-N 3.15Å; L63-P65 WeakPolarHBondContact O-CD 3.36Å
64E56.2Low53.8Low167 Ų167136.2 Ų136.278%0.7876%0.761SS**  trans-77115.7178.1-174.1170.6-170.900110.4S62 Q66S62-E64 PolarHBondContact O-N 3.14Å; S62-E64 VanDerWaalsContact O-N 3.14Å; E64-Q66 PolarHBondContact O-N 2.95Å
65P51Low53.2Low96 Ų96138 Ų13862%0.62376%0.758SS**  trans-82102.5-176.632.5-32.5000110.5L63 I67L63-P65 WeakPolarHBondContact O-CD 3.36Å; P65-I67 VanDerWaalsContact C-N 3.3Å; P65-I67 HydrophobicContact CB-CD1 4.01Å; P65-I67 HydrophobicContact CB-CG1 4.16Å; P65-I67 HydrophobicContact CG-CD1 4.49Å; P65-I67 PolarHBondContact O-N 3Å
66Q59.5Low52.7Low183 Ų183137.2 Ų137.286%0.85576%0.76SS**  trans-59.688.3166.6-78.2-77.1-7.300110.6E64E64-Q66 PolarHBondContact O-N 2.95Å
67I57.3Low52.1Low138 Ų138139.1 Ų139.171%0.70877%0.765SS**  trans-116.1117.4177-64.3173000108P65P65-I67 VanDerWaalsContact C-N 3.3Å; P65-I67 HydrophobicContact CB-CD1 4.01Å; P65-I67 HydrophobicContact CB-CG1 4.16Å; P65-I67 HydrophobicContact CG-CD1 4.49Å; P65-I67 PolarHBondContact O-N 3Å
68Q52.8Low51.2Low168 Ų168140.9 Ų140.979%0.78577%0.766SS**  trans-66.3142178.1-64.7176.7-6.200110.9V70Q68-V70 PolarHBondContact O-N 3.47Å; Q68-V70 VanDerWaalsContact O-N 3.12Å
69P58.2Low50.1Low132 Ų132143.2 Ų143.286%0.85777%0.765SS**  trans-72.6106.7-174.428.1-34.5000112.1
70V55Low49Very low130 Ų130146.1 Ų146.179%0.78877%0.772SS**  trans-84.3112.4171.4179.40000109.7Q68 V72Q68-V70 PolarHBondContact O-N 3.47Å; Q68-V70 VanDerWaalsContact O-N 3.12Å; V70-V72 PolarHBondContact O-N 3.12Å
71Y55.5Low48Very low203 Ų203145.4 Ų145.480%0.79677%0.769SS**  trans-74.5120.4177.7-178.5-95.8000111.5P73Y71-P73 HydrophobicContact CD1-CG 4.32Å; Y71-P73 HydrophobicContact CE1-CB 4.49Å; Y71-P73 HydrophobicContact CE1-CG 4.01Å
72V55.5Low47Very low119 Ų119152 Ų15272%0.72178%0.78SS**  trans-112.5118174.7-178.30000109.3V70V70-V72 PolarHBondContact O-N 3.12Å
73P47.8Very low46.3Very low89 Ų89155.1 Ų155.158%0.57878%0.779SS**PPolyproline II helixtrans-65.2143.6-179.9-22.132.9000113.7Y71Y71-P73 HydrophobicContact CD1-CG 4.32Å; Y71-P73 HydrophobicContact CE1-CB 4.49Å; Y71-P73 HydrophobicContact CE1-CG 4.01Å
74V52.1Low45.3Very low126 Ų126157 Ų15776%0.76478%0.775SS**PPolyproline II helixtrans-67.6129.5175.2179.70000110.7K76V74-K76 PolarHBondContact O-N 3.41Å
75P42.7Very low44Very low123 Ų123154.9 Ų154.980%0.79977%0.769SS**PPolyproline II helixtrans-63.4119171.5-20.833000111.2
76K45.3Very low43Very low190 Ų190157.8 Ų157.883%0.82677%0.774SS**PPolyproline II helixtrans-79.7130.5174.7-67.3-178.8179.31780110.5V74V74-K76 PolarHBondContact O-N 3.41Å
77E39.8Very low41.6Very low178 Ų178157.1 Ų157.183%0.83277%0.771SS**PPolyproline II helixtrans-62.7142.3166.7-61.1-168.7150.500110.6
78T32.7Very low40.4Very low137 Ų137159.1 Ų159.184%0.8478%0.777SS**  trans-130.6132.7169.950.90000111.1
79I35.6Very low39.2Very low134 Ų134159.2 Ų159.269%0.68778%0.778SS**  trans-121.1143.4-172.1-67172.1000108.9
80K33Very low37.8Very low186 Ų186157.6 Ų157.681%0.80977%0.769SS**  trans100.2113169.2-69.4131.9179.3-178.80119.3
81K31.8Very low36.3Very low186 Ų186157.3 Ų157.381%0.80977%0.768SS**  40.9121.8116.6-63.2178.3179175.50121.5
82R30.1Very low35.1Very low231 Ų231151.7 Ų151.787%0.87276%0.758SS**  trans78122.1130.9-73.5-177.9168.7-179.6-3.6122.2
83K32.3Very low34Very low179 Ų179154.6 Ų154.678%0.77876%0.764SS**  trans89.3127.8134-92.1-167.7172.5-172.10122
84R27.8Very low33.2Very low202 Ų202157.8 Ų157.876%0.76278%0.775SS**  trans84.8116.9139.9-87.1-168.2168.6171.3-6.7121.7
85N28.3Very low32.2Very low122 Ų122158.8 Ų158.865%0.65277%0.771SS**  70.7153.8123.2-78.442000123.8
86E30.9Very low31.5Very low157 Ų157163.4 Ų163.473%0.73477%0.772SS**  trans66.5158.2160.1-70.6134.8-12400118
87E29.8Very low31.2Very low169 Ų169159.9 Ų159.979%0.7977%0.769SS**  -157.7173.3-56.2-148.8144.6-125.900108.5
88E31.5Very low30.7Very low180 Ų180158.4 Ų158.484%0.84177%0.766SS**  trans58.8178.1169.5-64.2-172.817300118.2
89E27.4Very low30.6Very low171 Ų171159.7 Ų159.780%0.79977%0.767SS**  -152.5-148.5-67.6-148-169.3-140.300109
90S28.6Very low30.3Very low97 Ų97161.3 Ų161.368%0.67877%0.772SS**  trans72120.2-17470.70000116
91T24.7Very low30.3Very low124 Ų124160.9 Ų160.976%0.76177%0.773SS**  76.313652.367.10000114
92S29.6Very low30.4Very low85 Ų85157.3 Ų157.359%0.59477%0.769SS**  cis-169.6161.3-4.242.10000112.2
93Q32.7Very low30.5Very low181 Ų181150.6 Ų150.685%0.84676%0.762SS**  trans68.1150.7156.8-70.9161.119.900115.5
94I31.1Very low30.9Very low155 Ų155152.3 Ų152.380%0.79577%0.77SS**  cis-156.2176.5-4-141.7171.5000107
95E30.6Very low31.2Very low147 Ų147152.1 Ų152.169%0.68777%0.774SS**  cis-151.9-148.7-0.4-164.5-130.3-136.800108.9
96R28.9Very low31.5Very low220 Ų220153 Ų15383%0.8378%0.784SS**  trans-164.2139.9172-74.6-172.2178.7172.1-0.7111.1
97P39.1Very low31.6Very low117 Ų117155.4 Ų155.476%0.7679%0.792SS**  -126.8141.4108.12.218.9000112.1
98L27.5Very low31.9Very low146 Ų146151.8 Ų151.876%0.76479%0.791SS**  cis89.394.944.8-155.2-174.8000113
99L31.2Very low32.5Very low165 Ų165153 Ų15386%0.86479%0.794SS**  trans-165.6165141.2-106.6171.1000111.2
100Q29.4Very low33.6Very low168 Ų168151.8 Ų151.879%0.78579%0.786SS**  trans-104.7177.3-174.2-58.7170.3-51.700110.2
101E32.9Very low34.7Very low177 Ų177156.6 Ų156.683%0.82779%0.794SS**  cis-151.6-177.433.9-114.4-121.9141.100112.3
102P35.1Very low36.2Very low111 Ų111156.1 Ų156.172%0.72178%0.783SS**  trans-99.3153-146.337.5-38.2000118.3
103A31.5Very low38.3Very low90 Ų90155.5 Ų155.574%0.74478%0.776SS**  trans-125.4128165.100000112.2K105A103-K105 PolarHBondContact O-N 3.37Å
104K40.7Very low39.9Very low215 Ų215152.9 Ų152.994%0.93577%0.768SS**  trans-69.3121.8-173.3-63.5166.5-177.6167.40112.3
105K33.1Very low41.8Very low197 Ų197148.7 Ų148.786%0.85776%0.756SS**  trans-134.5122.3168.4-72.5-174.7179.2173.70113.7A103A103-K105 PolarHBondContact O-N 3.37Å
106V35.2Very low44.1Very low140 Ų140144.3 Ų144.385%0.84874%0.736SS**  trans21115.7155.8-169.20000118.4A108V106-A108 PolarHBondContact O-N 2.85Å; V106-A108 VanDerWaalsContact O-N 3.14Å
107K32.8Very low46.3Very low209 Ų209138.7 Ų138.791%0.90972%0.717SS**  trans-64.2109.7168-70-176.2178.1-179.50111.5
108A37.6Very low48Very low93 Ų93141 Ų14177%0.76972%0.715SS**  trans-66.9148.2165.500000111.1V106 K110V106-A108 PolarHBondContact O-N 2.85Å; V106-A108 VanDerWaalsContact O-N 3.14Å; A108-K110 PolarHBondContact O-N 3.14Å; A108-K110 VanDerWaalsContact O-N 3.08Å
109K43.6Very low50.3Low206 Ų206138.5 Ų138.590%0.89670%0.702SS**  trans-71.4103.5176.7-70.5-175.2177.7-178.30110.2K111K109-K111 PolarHBondContact O-N 3.3Å; K109-K111 VanDerWaalsContact O-N 3.12Å
110K49.3Very low52.5Low145 Ų145132.9 Ų132.963%0.6368%0.68SS**  trans-52.5115.8171.8-165.7-169.4-174.6-160.30108.8A108 H112 E116A108-K110 PolarHBondContact O-N 3.14Å; A108-K110 VanDerWaalsContact O-N 3.08Å; K110-H112 PolarHBondContact O-N 3.26Å; K110-E116 IonicContact NZ-OE1 3.99Å; K110-E116 PolarHBondContact NZ-OE1 3.26Å
111K53.3Low54.7Low198 Ų198130.2 Ų130.286%0.86167%0.671SS**  trans-70.5110.3171.5-74.9-178.1-179.5174.90107.4K109 T113K109-K111 PolarHBondContact O-N 3.3Å; K109-K111 VanDerWaalsContact O-N 3.12Å; K111-T113 PolarHBondContact O-N 2.84Å
112H55.5Low57Low113 Ų113129.7 Ų129.752%0.52366%0.661SS.*  trans-57.6133.6-179.7-79.5-62.7000111.8K110 E116 K117K110-H112 PolarHBondContact O-N 3.26Å; H112-E116 WeakPolarHBondContact CA-OE2 3.43Å; H112-E116 HydrophobicContact CB-CB 4.22Å; H112-E116 WeakPolarHBondContact CB-OE2 3.49Å; H112-E116 IonicContact CE1-OE2 2.69Å; H112-E116 IonicContact CG-OE2 2.67Å; H112-E116 IonicContact ND1-OE1 3.9Å; H112-E116 IonicContact ND1-OE2 3.64Å; H112-E116 PolarHBondContact ND1-OE2 3.05Å; H112-K117 HydrophobicContact CB-CG 4.42Å; H112-K117 WeakPolarHBondContact O-CE 3.47Å; H112-K117 PolarHBondContact O-NZ 3.18Å
113T72.9Confident59.3Low72 Ų72129.9 Ų129.944%0.44265%0.653SS.*  trans-67.1161.6178.770.70000109.9K111 A115 E116 K117K111-T113 PolarHBondContact O-N 2.84Å; T113-A115 PolarHBondContact O-N 3.06Å; T113-E116 PolarHBondContact N-OE2 3.42Å; T113-E116 PolarHBondContact O-N 2.89Å; T113-E116 WeakPolarHBondContact OG1-CG 3.13Å; T113-E116 PolarHBondContact OG1-N 3.41Å; T113-K117 WeakPolarHBondContact O-CG 3.49Å; T113-K117 PolarHBondContact O-N 2.95Å; T113-K117 VanDerWaalsContact O-N 3.14Å
114N65.9Low61.3Low127 Ų127129.1 Ų129.168%0.67964%0.642SS**Hα-helixtrans-67.2-20.1177.8-70.2-15.8000112.4K117 K118N114-K117 PolarHBondContact OD1-NZ 3.21Å; N114-K118 WeakPolarHBondContact O-CB 3.18Å; N114-K118 PolarHBondContact O-N 3.01Å; N114-K118 VanDerWaalsContact O-N 3.15Å
115A71.2Confident63.1Low66 Ų66121.5 Ų121.555%0.54562%0.619SS.*Hα-helixtrans-70.3-49.6169.900000111.9T113 K117 K118 L119T113-A115 PolarHBondContact O-N 3.06Å; A115-K117 VanDerWaalsContact C-N 3.27Å; A115-K117 PolarHBondContact O-N 2.86Å; A115-K118 PolarHBondContact O-N 2.77Å; A115-L119 PolarHBondContact O-N 3.4Å
116E78.8Confident65Low56 Ų56116.1 Ų116.126%0.26260%0.599SS.*Hα-helixtrans-57.8-39.3177.2-69.6169.5148.900111.4K110 H112 T113 A120K110-E116 IonicContact NZ-OE1 3.99Å; K110-E116 PolarHBondContact NZ-OE1 3.26Å; H112-E116 WeakPolarHBondContact CA-OE2 3.43Å; H112-E116 HydrophobicContact CB-CB 4.22Å; H112-E116 WeakPolarHBondContact CB-OE2 3.49Å; H112-E116 IonicContact CE1-OE2 2.69Å; H112-E116 IonicContact CG-OE2 2.67Å; H112-E116 IonicContact ND1-OE1 3.9Å; H112-E116 IonicContact ND1-OE2 3.64Å; H112-E116 PolarHBondContact ND1-OE2 3.05Å; T113-E116 PolarHBondContact N-OE2 3.42Å; T113-E116 PolarHBondContact O-N 2.89Å; T113-E116 WeakPolarHBondContact OG1-CG 3.13Å; T113-E116 PolarHBondContact OG1-N 3.41Å; E116-A120 PolarHBondContact O-N 3.02Å
117K75.8Confident66.9Low101 Ų101112.1 Ų112.144%0.43958%0.581SS.*Hα-helixtrans-66.7-37173.4-63.9172.5-161.4153.90113.4H112 T113 N114 A115 N121H112-K117 HydrophobicContact CB-CG 4.42Å; H112-K117 WeakPolarHBondContact O-CE 3.47Å; H112-K117 PolarHBondContact O-NZ 3.18Å; T113-K117 WeakPolarHBondContact O-CG 3.49Å; T113-K117 PolarHBondContact O-N 2.95Å; T113-K117 VanDerWaalsContact O-N 3.14Å; N114-K117 PolarHBondContact OD1-NZ 3.21Å; A115-K117 VanDerWaalsContact C-N 3.27Å; A115-K117 PolarHBondContact O-N 2.86Å; K117-N121 WeakPolarHBondContact O-CB 3.42Å; K117-N121 VanDerWaalsContact O-CG 3.27Å; K117-N121 PolarHBondContact O-N 3.46Å; K117-N121 PolarHBondContact O-OD1 3.26Å
118K74.3Confident68.8Low166 Ų166105.1 Ų105.172%0.72256%0.558SS**Hα-helixtrans-71.7-33.3-179.4-163.2175.6-176.5-175.80111.3N114 A115 R122N114-K118 WeakPolarHBondContact O-CB 3.18Å; N114-K118 PolarHBondContact O-N 3.01Å; N114-K118 VanDerWaalsContact O-N 3.15Å; A115-K118 PolarHBondContact O-N 2.77Å; K118-R122 PolarHBondContact O-N 2.78Å; K118-R122 VanDerWaalsContact O-N 3.14Å
119L75.5Confident70.5Confident93 Ų93103 Ų10349%0.48754%0.541SS..Hα-helixtrans-65-54.4169.4-76166.7000111.5A115 N121 R122 E123A115-L119 PolarHBondContact O-N 3.4Å; L119-N121 VanDerWaalsContact C-N 3.26Å; L119-N121 PolarHBondContact O-N 3.13Å; L119-R122 CarbonylContact O-C 3.53Å; L119-R122 WeakPolarHBondContact O-CA 3.4Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.2Å; L119-E123 WeakPolarHBondContact O-CG 3.42Å; L119-E123 PolarHBondContact O-N 2.88Å
120A77.5Confident71.9Confident48 Ų4898.2 Ų98.240%0.39753%0.525SS..Hα-helixtrans-56.4-38.7178.600000112.9E116 S124E116-A120 PolarHBondContact O-N 3.02Å; A120-S124 WeakPolarHBondContact O-CB 3.45Å; A120-S124 PolarHBondContact O-N 3.37Å; A120-S124 PolarHBondContact O-OG 2.89Å
121N77.1Confident72.9Confident111 Ų11196.1 Ų96.159%0.59452%0.52SS*.Hα-helixtrans-64.5-41.4173-74.22000112.1K117 L119 S124 A125K117-N121 WeakPolarHBondContact O-CB 3.42Å; K117-N121 VanDerWaalsContact O-CG 3.27Å; K117-N121 PolarHBondContact O-N 3.46Å; K117-N121 PolarHBondContact O-OD1 3.26Å; L119-N121 VanDerWaalsContact C-N 3.26Å; L119-N121 PolarHBondContact O-N 3.13Å; N121-S124 PolarHBondContact O-N 3.26Å; N121-S124 PolarHBondContact O-OG 2.96Å; N121-A125 PolarHBondContact O-N 3.38Å
122R80Confident73.6Confident167 Ų16792.9 Ų92.963%0.6351%0.508SS*.Hα-helixtrans-67.1-41.6178.2-163.2-178.288.9111.60112K118 L119 A125 L126K118-R122 PolarHBondContact O-N 2.78Å; K118-R122 VanDerWaalsContact O-N 3.14Å; L119-R122 CarbonylContact O-C 3.53Å; L119-R122 WeakPolarHBondContact O-CA 3.4Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.2Å; R122-A125 PolarHBondContact O-N 2.82Å; R122-L126 WeakPolarHBondContact O-CG 3.37Å; R122-L126 PolarHBondContact O-N 3.17Å
123E83.3Confident74.1Confident115 Ų11593 Ų9354%0.53751%0.509SS..Hα-helixtrans-61.4-43.8173.9-71158-164.800111L119 A125 L126 A127L119-E123 WeakPolarHBondContact O-CG 3.42Å; L119-E123 PolarHBondContact O-N 2.88Å; E123-A125 VanDerWaalsContact C-N 3.3Å; E123-A125 PolarHBondContact O-N 3.12Å; E123-L126 PolarHBondContact O-N 3.11Å; E123-A127 WeakPolarHBondContact O-CB 3.45Å; E123-A127 PolarHBondContact O-N 2.98Å
124S73.7Confident73.8Confident74 Ų7494.1 Ų94.152%0.51751%0.509SS..Hα-helixtrans-64.5-32.1175.874.20000113.6A120 N121 S128A120-S124 WeakPolarHBondContact O-CB 3.45Å; A120-S124 PolarHBondContact O-N 3.37Å; A120-S124 PolarHBondContact O-OG 2.89Å; N121-S124 PolarHBondContact O-N 3.26Å; N121-S124 PolarHBondContact O-OG 2.96Å; S124-S128 PolarHBondContact O-N 3.41Å; S124-S128 PolarHBondContact O-OG 3.17Å
125A79.8Confident73.7Confident55 Ų5591.6 Ų91.646%0.45550%0.495SS..Hα-helixtrans-74.8-37.6177.800000112.5N121 R122 E123 S128 A129N121-A125 PolarHBondContact O-N 3.38Å; R122-A125 PolarHBondContact O-N 2.82Å; E123-A125 VanDerWaalsContact C-N 3.3Å; E123-A125 PolarHBondContact O-N 3.12Å; A125-S128 WeakPolarHBondContact CA-OG 3.47Å; A125-S128 PolarHBondContact O-N 3.18Å; A125-S128 PolarHBondContact O-OG 3.28Å; A125-A129 PolarHBondContact O-N 2.71Å; A125-A129 VanDerWaalsContact O-N 3.13Å
126L72.6Confident72.8Confident83 Ų8394.7 Ų94.744%0.43550%0.498SS..Hα-helixtrans-63.6-50.9171.8-71.3164.7000110.4R122 E123 S128 A129 D130R122-L126 WeakPolarHBondContact O-CG 3.37Å; R122-L126 PolarHBondContact O-N 3.17Å; E123-L126 PolarHBondContact O-N 3.11Å; L126-S128 PolarHBondContact O-N 3.25Å; L126-S128 VanDerWaalsContact O-N 3.11Å; L126-A129 WeakPolarHBondContact O-CA 3.45Å; L126-A129 WeakPolarHBondContact O-CB 3.46Å; L126-A129 PolarHBondContact O-N 3.48Å; L126-D130 VanDerWaalsContact O-CG 3.25Å; L126-D130 PolarHBondContact O-N 2.98Å
127A75.3Confident71.6Confident57 Ų5797.6 Ų97.647%0.47151%0.511SS..Hα-helixtrans-61.2-23.7178.500000114.2E123 L131E123-A127 WeakPolarHBondContact O-CB 3.45Å; E123-A127 PolarHBondContact O-N 2.98Å; A127-L131 WeakPolarHBondContact O-CB 3.42Å
128S72.6Confident70.6Confident61 Ų6198.6 Ų98.643%0.42752%0.516SS..Hα-helixtrans-78-36.9168.5480000113.4S124 A125 L126 L131 E132S124-S128 PolarHBondContact O-N 3.41Å; S124-S128 PolarHBondContact O-OG 3.17Å; A125-S128 WeakPolarHBondContact CA-OG 3.47Å; A125-S128 PolarHBondContact O-N 3.18Å; A125-S128 PolarHBondContact O-OG 3.28Å; L126-S128 PolarHBondContact O-N 3.25Å; L126-S128 VanDerWaalsContact O-N 3.11Å; S128-L131 PolarHBondContact O-N 3.31Å; S128-E132 WeakPolarHBondContact O-CG 3.29Å; S128-E132 PolarHBondContact O-N 3.09Å
129A72.5Confident69.5Low50 Ų5096 Ų9641%0.41351%0.506SS..Hα-helixtrans-66.7-45177.500000111.6A125 L126 L131 E132 E133A125-A129 PolarHBondContact O-N 2.71Å; A125-A129 VanDerWaalsContact O-N 3.13Å; L126-A129 WeakPolarHBondContact O-CA 3.45Å; L126-A129 WeakPolarHBondContact O-CB 3.46Å; L126-A129 PolarHBondContact O-N 3.48Å; A129-L131 PolarHBondContact O-N 2.98Å; A129-E132 PolarHBondContact O-N 2.99Å; A129-E133 PolarHBondContact O-N 3.14Å
130D73Confident67.9Low105 Ų10593.9 Ų93.956%0.56151%0.507SS*.Hα-helixtrans-56.7-39.1176.4-54.8-27.2000111.3L126 E133 E134L126-D130 VanDerWaalsContact O-CG 3.25Å; L126-D130 PolarHBondContact O-N 2.98Å; D130-E133 PolarHBondContact O-N 2.85Å; D130-E134 PolarHBondContact O-N 2.94Å
131L70.4Confident66.4Low101 Ų10199.8 Ų99.853%0.52953%0.526SS..Hα-helixtrans-77.3-33.9-178.4-161.5153.4000112.2A127 S128 A129 I135A127-L131 WeakPolarHBondContact O-CB 3.42Å; S128-L131 PolarHBondContact O-N 3.31Å; A129-L131 PolarHBondContact O-N 2.98Å; L131-I135 HydrophobicContact CD2-CD1 3.83Å; L131-I135 WeakPolarHBondContact O-CD1 3.48Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.47Å; L131-I135 PolarHBondContact O-N 3Å; L131-I135 VanDerWaalsContact O-N 3.17Å
132E68.5Low64.8Low130 Ų130103.7 Ų103.761%0.60754%0.538SS*.Hα-helixtrans-67.8-37.5169.4-75.1-177.6176.400111.8S128 A129 I135 H136S128-E132 WeakPolarHBondContact O-CG 3.29Å; S128-E132 PolarHBondContact O-N 3.09Å; A129-E132 PolarHBondContact O-N 2.99Å; E132-I135 WeakPolarHBondContact O-CB 3.43Å; E132-I135 PolarHBondContact O-N 3.47Å; E132-H136 PolarHBondContact O-CD2 2.82Å; E132-H136 VanDerWaalsContact O-CD2 3.25Å; E132-H136 PolarHBondContact O-N 3.39Å
133E66.4Low62.7Low116 Ų116106.2 Ų106.254%0.54255%0.547SS..Hα-helixtrans-66.3-43.2174.5-156.2-169.813900111.6A129 D130 I135 H136 Q137A129-E133 PolarHBondContact O-N 3.14Å; D130-E133 PolarHBondContact O-N 2.85Å; E133-I135 PolarHBondContact O-N 3.17Å; E133-H136 PolarHBondContact O-N 3.28Å; E133-Q137 HydrophobicContact CG-CG 4.49Å; E133-Q137 WeakPolarHBondContact O-CG 3.41Å; E133-Q137 PolarHBondContact O-N 3.08Å; E133-Q137 PolarHBondContact OE1-NE2 3.43Å
134E66.6Low60.5Low95 Ų95109.5 Ų109.544%0.44456%0.56SS.*Hα-helixtrans-58.6-36.7175-154.9-150.8-171.700111.9D130 K138D130-E134 PolarHBondContact O-N 2.94Å; E134-K138 WeakPolarHBondContact O-CB 3.38Å; E134-K138 WeakPolarHBondContact O-CD 3.25Å; E134-K138 VanDerWaalsContact O-CG 3.25Å; E134-K138 WeakPolarHBondContact O-CG 3.4Å; E134-K138 PolarHBondContact O-N 2.84Å; E134-K138 WeakPolarHBondContact OE1-CE 3.39Å; E134-K138 IonicContact OE1-NZ 3.54Å; E134-K138 PolarHBondContact OE1-NZ 2.64Å; E134-K138 IonicContact OE2-NZ 2.84Å; E134-K138 PolarHBondContact OE2-NZ 3.22Å
135I61.9Low58.4Low74 Ų74113.8 Ų113.838%0.37958%0.577SS.*Hα-helixtrans-66.6-41.8172.9-71.5166.4000111.1L131 E132 E133 K138 Q139L131-I135 HydrophobicContact CD2-CD1 3.83Å; L131-I135 WeakPolarHBondContact O-CD1 3.48Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.47Å; L131-I135 PolarHBondContact O-N 3Å; L131-I135 VanDerWaalsContact O-N 3.17Å; E132-I135 WeakPolarHBondContact O-CB 3.43Å; E132-I135 PolarHBondContact O-N 3.47Å; E133-I135 PolarHBondContact O-N 3.17Å; I135-K138 PolarHBondContact O-N 3.36Å; I135-Q139 VanDerWaalsContact CG2-NE2 3.33Å; I135-Q139 WeakPolarHBondContact O-CG 3.47Å; I135-Q139 PolarHBondContact O-N 3.24Å; I135-Q139 VanDerWaalsContact O-N 3.09Å
136H52.6Low56Low130 Ų130116.6 Ų116.660%0.60259%0.593SS**Hα-helixtrans-68.9-42.2-179.7-81.8-142.1000112.2E132 E133 K138 Q139 G140E132-H136 PolarHBondContact O-CD2 2.82Å; E132-H136 VanDerWaalsContact O-CD2 3.25Å; E132-H136 PolarHBondContact O-N 3.39Å; E133-H136 PolarHBondContact O-N 3.28Å; H136-K138 VanDerWaalsContact C-N 3.33Å; H136-K138 PolarHBondContact O-N 3.39Å; H136-Q139 PolarHBondContact O-N 3.14Å; H136-Q139 VanDerWaalsContact O-N 3.14Å; H136-G140 PolarHBondContact O-N 3.33Å
137Q54.3Low54Low117 Ų117121.7 Ų121.755%0.54762%0.615SS.*Hα-helixtrans-59.3-43.5174.3-67.3179.115.100111.4E133 Q139 G140E133-Q137 HydrophobicContact CG-CG 4.49Å; E133-Q137 WeakPolarHBondContact O-CG 3.41Å; E133-Q137 PolarHBondContact O-N 3.08Å; E133-Q137 PolarHBondContact OE1-NE2 3.43Å; Q137-Q139 VanDerWaalsContact C-N 3.31Å; Q137-Q139 PolarHBondContact O-N 3.19Å; Q137-G140 PolarHBondContact O-N 3.06Å
138K55.4Low52.5Low122 Ų122124.7 Ų124.753%0.5363%0.629SS.*Hα-helixtrans-66.9-25.4175.7-71.4169.1-173.2171.20113.9E134 I135 H136E134-K138 WeakPolarHBondContact O-CB 3.38Å; E134-K138 WeakPolarHBondContact O-CD 3.25Å; E134-K138 VanDerWaalsContact O-CG 3.25Å; E134-K138 WeakPolarHBondContact O-CG 3.4Å; E134-K138 PolarHBondContact O-N 2.84Å; E134-K138 WeakPolarHBondContact OE1-CE 3.39Å; E134-K138 IonicContact OE1-NZ 3.54Å; E134-K138 PolarHBondContact OE1-NZ 2.64Å; E134-K138 IonicContact OE2-NZ 2.84Å; E134-K138 PolarHBondContact OE2-NZ 3.22Å; I135-K138 PolarHBondContact O-N 3.36Å; H136-K138 VanDerWaalsContact C-N 3.33Å; H136-K138 PolarHBondContact O-N 3.39Å
139Q50.2Low50.3Low113 Ų113125.4 Ų125.453%0.52865%0.646SS.*Hα-helixtrans-81.4-34.3172.6-73.1-176.352.100112.8I135 H136 Q137 Q141 K142I135-Q139 VanDerWaalsContact CG2-NE2 3.33Å; I135-Q139 WeakPolarHBondContact O-CG 3.47Å; I135-Q139 PolarHBondContact O-N 3.24Å; I135-Q139 VanDerWaalsContact O-N 3.09Å; H136-Q139 PolarHBondContact O-N 3.14Å; H136-Q139 VanDerWaalsContact O-N 3.14Å; Q137-Q139 VanDerWaalsContact C-N 3.31Å; Q137-Q139 PolarHBondContact O-N 3.19Å; Q139-Q141 VanDerWaalsContact C-N 3.34Å; Q139-Q141 PolarHBondContact O-N 3.14Å; Q139-K142 PolarHBondContact O-N 3.44Å; Q139-K142 VanDerWaalsContact O-N 3.17Å
140G41.6Very low48.3Very low48 Ų48129 Ų12950%0.49566%0.663SS.*Hα-helixtrans-58.4-41.1-178.500000113.7H136 Q137 K142 R143H136-G140 PolarHBondContact O-N 3.33Å; Q137-G140 PolarHBondContact O-N 3.06Å; G140-K142 PolarHBondContact O-N 2.98Å; G140-R143 PolarHBondContact O-N 3.35Å
141Q46.3Very low46.3Very low172 Ų172133 Ų13380%0.80468%0.675SS**G310 helixtrans-63.8-24.4179.3-69.4-175.9-12.700113.8Q139 R143Q139-Q141 VanDerWaalsContact C-N 3.34Å; Q139-Q141 PolarHBondContact O-N 3.14Å; Q141-R143 VanDerWaalsContact C-N 3.32Å; Q141-R143 PolarHBondContact O-N 3.33Å
142K44.3Very low44.3Very low193 Ų193134.6 Ų134.684%0.83969%0.689SS**G310 helixtrans-81.1-0-179.2-79.5-169.1172.5-174.80115.1Q139 G140Q139-K142 PolarHBondContact O-N 3.44Å; Q139-K142 VanDerWaalsContact O-N 3.17Å; G140-K142 PolarHBondContact O-N 2.98Å
143R36.2Very low42.6Very low220 Ų220132.4 Ų132.483%0.8369%0.693SS**G310 helixtrans-104.75.7-175.1-73.1-168.5172.6-165.5-0.5116.1G140 Q141G140-R143 PolarHBondContact O-N 3.35Å; Q141-R143 VanDerWaalsContact C-N 3.32Å; Q141-R143 PolarHBondContact O-N 3.33Å
144K36.4Very low40.9Very low184 Ų184132.7 Ų132.780%0.870%0.698SS**SBendtrans-116.984.1174.3-70.5-172.3178.1-177.20111.8
145N29.5Very low39.2Very low164 Ų164138.1 Ų138.188%0.87772%0.715SS**  trans165.2103.9138.8-85.6-9.7000111.5
146S30.6Very low37.9Very low114 Ų114143.4 Ų143.480%0.79774%0.735SS**  trans-161.495.3165.864.70000112.5
147Q30.3Very low37.4Very low189 Ų189144.6 Ų144.688%0.88374%0.744SS**  trans-141.7150.8152.5-87.5-68.7-29.800106.9
148P43.6Very low36.3Very low120 Ų120146.7 Ų146.778%0.77976%0.758SS**  trans-105.4156-15338.6-34.9000115.9
149G26.7Very low35.1Very low76 Ų76148.8 Ų148.878%0.78478%0.775SS**  trans-156.877-179.200000116.2
150V28.7Very low34.4Very low125 Ų125150.2 Ų150.276%0.75879%0.787SS**  trans17.3103.6150.7-1710000120.7
151K31.4Very low34.1Very low190 Ų190154.4 Ų154.483%0.82680%0.802SS**  trans65.9149.8140-57.3173.9-178.4176.40123.4
152V29.9Very low33.3Very low135 Ų135151.8 Ų151.882%0.81879%0.794SS**  trans110.2118.4145.7-172.20000118.4
153A31.2Very low33.2Very low83 Ų83150.1 Ų150.169%0.68679%0.794SS**  trans72.1142.7153.800000123.1
154D30.9Very low33.1Very low123 Ų123144.2 Ų144.266%0.65878%0.782SS**  trans47109.4143.1-81.739000119.8
155R31.8Very low33.2Very low208 Ų208142.6 Ų142.679%0.78579%0.788SS**  cis-178.4152.247.2-100.6147.9-171.5-154.2-1.8113.6
156K33.8Very low33.7Very low185 Ų185140.5 Ų140.580%0.80478%0.781SS**  trans67.9127148.6-73-177.2176.6-175.40120.9
157I41.9Very low34Very low155 Ų155140.4 Ų140.480%0.79578%0.78SS**  trans80149.6155.1-57.2155.7000115.4
158L31.8Very low34.6Very low161 Ų161140.6 Ų140.684%0.84378%0.781SS**  trans9486.5-180-55.3180000117.2
159D29.5Very low34.9Very low167 Ų167146 Ų14689%0.89379%0.786SS**  trans-131.3144.6143.9-73-52.9000105.2
160D37.1Very low35.9Very low143 Ų143152.3 Ų152.377%0.76579%0.791SS**  cis-159.1116.1-11.2172.8-40.6000106.1
161V34.2Very low36.8Very low136 Ų136155.7 Ų155.782%0.82480%0.796SS**  trans-155140.5161.7-147.30000113.6
162D30.7Very low38.1Very low117 Ų117153.4 Ų153.463%0.62679%0.791SS**  trans95.175.3141.7-122.5-37.8000121.1T164D162-T164 WeakPolarHBondContact OD1-CB 3.35Å; D162-T164 VanDerWaalsContact OD1-CG2 3.24Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.39Å; D162-T164 PolarHBondContact OD1-OG1 3.02Å
163D41Very low39.5Very low158 Ų158156 Ų15685%0.84580%0.795SS**  trans-96.373.6161-172.34.8000110.9
164T34.2Very low40.9Very low95 Ų95156.7 Ų156.758%0.58379%0.786SS**  trans-13558.6-178.170.50000116.3D162 V166D162-T164 WeakPolarHBondContact OD1-CB 3.35Å; D162-T164 VanDerWaalsContact OD1-CG2 3.24Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.39Å; D162-T164 PolarHBondContact OD1-OG1 3.02Å; T164-V166 PolarHBondContact O-N 2.97Å
165V38.2Very low43.3Very low151 Ų151155.3 Ų155.392%0.91578%0.778SS**  trans-73.571.2169.7-169.60000111.9
166V39.3Very low45.8Very low120 Ų120151.4 Ų151.473%0.72777%0.769SS**  trans-97.2127.8176.2-179.40000111T164 Q168T164-V166 PolarHBondContact O-N 2.97Å; V166-Q168 PolarHBondContact O-N 3.05Å; V166-Q168 VanDerWaalsContact O-N 3.08Å
167S38.5Very low48.1Very low112 Ų112148.7 Ų148.778%0.78376%0.759SS**  trans-48.4109.5-169.3-48.20000115R169S167-R169 VanDerWaalsContact C-N 3.28Å; S167-R169 PolarHBondContact O-N 2.89Å
168Q42.9Very low50.2Low192 Ų192145.9 Ų145.990%0.89774%0.742SS**  trans-71.877.1173.8-63.1-171.711.400112.1V166 K170V166-Q168 PolarHBondContact O-N 3.05Å; V166-Q168 VanDerWaalsContact O-N 3.08Å; Q168-K170 PolarHBondContact O-N 3.29Å
169R49Very low52.7Low235 Ų235142.5 Ų142.589%0.88772%0.722SS**  trans-57.2118.8149.9-75.2-178.8174.3148.22.3106.5S167 K171S167-R169 VanDerWaalsContact C-N 3.28Å; S167-R169 PolarHBondContact O-N 2.89Å; R169-K171 PolarHBondContact O-N 3.13Å
170K47.4Very low55.4Low207 Ų207141.2 Ų141.290%0.971%0.705SS**  trans-46.7103.6-179.9-74.1-172.3177.4-177.30109.5Q168 I172Q168-K170 PolarHBondContact O-N 3.29Å; K170-I172 PolarHBondContact O-N 3.44Å
171K48Very low57.8Low196 Ų196138.6 Ų138.685%0.85269%0.691SS**  trans-72.3102.6-178.7-160.5-177.8-174.8-171.10104.7R169 Q173R169-K171 PolarHBondContact O-N 3.13Å; K171-Q173 PolarHBondContact O-N 3.4Å
172I59Low60.4Low142 Ų142135.5 Ų135.573%0.72867%0.666SS**  trans-52.2120.7173-61.1173.9000105.5K170 I174K170-I172 PolarHBondContact O-N 3.44Å; I172-I174 HydrophobicContact CB-CG1 4.41Å; I172-I174 HydrophobicContact CG2-CG1 4.07Å; I172-I174 PolarHBondContact O-N 3.42Å
173Q59.9Low63.2Low191 Ų191132.7 Ų132.789%0.89365%0.651SS**  trans-72.780.1173-66.8-178.33.500106.5K171 N175K171-Q173 PolarHBondContact O-N 3.4Å; Q173-N175 PolarHBondContact O-N 3.42Å
174I60.3Low65.6Low97 Ų97128.2 Ų128.250%0.49763%0.625SS.*  trans-62.4117171.1-63.2171.7000105.1I172 E176 E179I172-I174 HydrophobicContact CB-CG1 4.41Å; I172-I174 HydrophobicContact CG2-CG1 4.07Å; I172-I174 PolarHBondContact O-N 3.42Å; I174-E176 PolarHBondContact O-N 2.95Å; I174-E176 VanDerWaalsContact O-N 3.14Å; I174-E179 HydrophobicContact CG2-CB 4.27Å
175N80.4Confident68.4Low94 Ų94128 Ų12850%0.50361%0.613SS.*  trans-63.5118.3-177.3-16726.8000108.3Q173 E177 E178 E179Q173-N175 PolarHBondContact O-N 3.42Å; N175-E177 PolarHBondContact O-N 3.43Å; N175-E178 HydrophobicContact CB-CB 4.15Å; N175-E178 WeakPolarHBondContact O-CA 3.44Å; N175-E178 WeakPolarHBondContact O-CB 3.46Å; N175-E178 PolarHBondContact O-N 3.17Å; N175-E179 PolarHBondContact O-N 2.72Å
176E84.1Confident71Confident126 Ų126121.1 Ų121.159%0.58957%0.572SS**Hα-helixtrans-60.3-34.6-169.3-71-161.4-175.300112.2I174 E178 E179 R180I174-E176 PolarHBondContact O-N 2.95Å; I174-E176 VanDerWaalsContact O-N 3.14Å; E176-E178 VanDerWaalsContact C-N 3.31Å; E176-E178 PolarHBondContact O-N 2.83Å; E176-E179 PolarHBondContact O-N 2.84Å; E176-R180 WeakPolarHBondContact O-CD 3.31Å; E176-R180 VanDerWaalsContact O-CG 3.23Å; E176-R180 WeakPolarHBondContact O-CG 3.34Å; E176-R180 PolarHBondContact O-N 3.12Å; E176-R180 IonicContact OE2-CZ 3.67Å; E176-R180 IonicContact OE2-NE 2.9Å; E176-R180 IonicContact OE2-NH2 3.2Å; E176-R180 PolarHBondContact OE2-NH2 2.82Å
177E82.7Confident73.7Confident128 Ų128115.4 Ų115.460%0.59854%0.537SS*.Hα-helixtrans-60.2-40.2174.1-59.9175.4158.100111.7N175 E179 R180 L181N175-E177 PolarHBondContact O-N 3.43Å; E177-E179 VanDerWaalsContact C-N 3.35Å; E177-R180 PolarHBondContact O-N 3.29Å; E177-L181 VanDerWaalsContact O-CB 3.32Å; E177-L181 WeakPolarHBondContact O-CB 3.45Å; E177-L181 WeakPolarHBondContact O-CD1 3.49Å; E177-L181 VanDerWaalsContact O-CG 3.24Å; E177-L181 WeakPolarHBondContact O-CG 3.36Å; E177-L181 PolarHBondContact O-N 2.8Å
178E85.3Confident76.3Confident95 Ų95111.5 Ų111.544%0.44451%0.506SS..Hα-helixtrans-70.4-31.9177.7-154.1-147173.100111.5N175 E176 K182N175-E178 HydrophobicContact CB-CB 4.15Å; N175-E178 WeakPolarHBondContact O-CA 3.44Å; N175-E178 WeakPolarHBondContact O-CB 3.46Å; N175-E178 PolarHBondContact O-N 3.17Å; E176-E178 VanDerWaalsContact C-N 3.31Å; E176-E178 PolarHBondContact O-N 2.83Å; E178-K182 WeakPolarHBondContact O-CB 3.15Å; E178-K182 VanDerWaalsContact O-CD 3.24Å; E178-K182 WeakPolarHBondContact O-CD 3.11Å; E178-K182 WeakPolarHBondContact O-CG 3.38Å; E178-K182 PolarHBondContact O-N 3.25Å; E178-K182 VanDerWaalsContact O-N 3.12Å; E178-K182 VanDerWaalsContact OE1-CE 3.22Å; E178-K182 WeakPolarHBondContact OE1-CE 3.49Å; E178-K182 IonicContact OE1-NZ 3.6Å; E178-K182 PolarHBondContact OE1-NZ 2.79Å; E178-K182 IonicContact OE2-NZ 2.81Å; E178-K182 PolarHBondContact OE2-NZ 2.95Å
179E85.7Confident78.7Confident90 Ų90102.4 Ų102.442%0.42146%0.464SS..Hα-helixtrans-73.9-35.2171.3-172.6160.3-176.900112I174 N175 E176 E177 K182 N183I174-E179 HydrophobicContact CG2-CB 4.27Å; N175-E179 PolarHBondContact O-N 2.72Å; E176-E179 PolarHBondContact O-N 2.84Å; E177-E179 VanDerWaalsContact C-N 3.35Å; E179-K182 PolarHBondContact O-N 3.17Å; E179-N183 WeakPolarHBondContact O-CB 3.48Å; E179-N183 PolarHBondContact O-N 3.23Å; E179-N183 PolarHBondContact O-ND2 2.88Å; E179-N183 VanDerWaalsContact O-ND2 3.09Å
180R84.9Confident80.7Confident140 Ų14091.3 Ų91.353%0.52842%0.423SS..Hα-helixtrans-63-51.4172.5-68.7159.6-164.4-106.75.2111.6E176 E177 K182 N183 E184E176-R180 WeakPolarHBondContact O-CD 3.31Å; E176-R180 VanDerWaalsContact O-CG 3.23Å; E176-R180 WeakPolarHBondContact O-CG 3.34Å; E176-R180 PolarHBondContact O-N 3.12Å; E176-R180 IonicContact OE2-CZ 3.67Å; E176-R180 IonicContact OE2-NE 2.9Å; E176-R180 IonicContact OE2-NH2 3.2Å; E176-R180 PolarHBondContact OE2-NH2 2.82Å; E177-R180 PolarHBondContact O-N 3.29Å; R180-K182 PolarHBondContact O-N 3.08Å; R180-N183 WeakPolarHBondContact O-CA 3.37Å; R180-N183 WeakPolarHBondContact O-CB 3.26Å; R180-N183 PolarHBondContact O-N 3.25Å; R180-E184 PolarHBondContact O-N 3.04Å
181L87.5Confident82.7Confident88 Ų8882.1 Ų82.146%0.46138%0.383SS..Hα-helixtrans-60.7-25.1174.9-72.3166.9000113.6E177 E184 R185E177-L181 VanDerWaalsContact O-CB 3.32Å; E177-L181 WeakPolarHBondContact O-CB 3.45Å; E177-L181 WeakPolarHBondContact O-CD1 3.49Å; E177-L181 VanDerWaalsContact O-CG 3.24Å; E177-L181 WeakPolarHBondContact O-CG 3.36Å; E177-L181 PolarHBondContact O-N 2.8Å; L181-E184 WeakPolarHBondContact CA-OE2 3.44Å; L181-R185 PolarHBondContact O-NE 2.99Å; L181-R185 PolarHBondContact O-NH2 3.11Å
182K88.5Confident84.8Confident71 Ų7172.8 Ų72.831%0.30934%0.343SS..Hα-helixtrans-78.8-42.7169.1-75.8163.5-169.9167.70111.2E178 E179 R180 R185 T186E178-K182 WeakPolarHBondContact O-CB 3.15Å; E178-K182 VanDerWaalsContact O-CD 3.24Å; E178-K182 WeakPolarHBondContact O-CD 3.11Å; E178-K182 WeakPolarHBondContact O-CG 3.38Å; E178-K182 PolarHBondContact O-N 3.25Å; E178-K182 VanDerWaalsContact O-N 3.12Å; E178-K182 VanDerWaalsContact OE1-CE 3.22Å; E178-K182 WeakPolarHBondContact OE1-CE 3.49Å; E178-K182 IonicContact OE1-NZ 3.6Å; E178-K182 PolarHBondContact OE1-NZ 2.79Å; E178-K182 IonicContact OE2-NZ 2.81Å; E178-K182 PolarHBondContact OE2-NZ 2.95Å; E179-K182 PolarHBondContact O-N 3.17Å; R180-K182 PolarHBondContact O-N 3.08Å; K182-R185 CarbonylContact O-C 3.6Å; K182-R185 VanDerWaalsContact O-C 3.28Å; K182-R185 WeakPolarHBondContact O-CA 3.33Å; K182-R185 PolarHBondContact O-N 3.32Å; K182-R185 VanDerWaalsContact O-N 3.17Å; K182-T186 WeakPolarHBondContact O-CG2 3.49Å; K182-T186 PolarHBondContact O-N 3.07Å
183N90.3Very high86.3Confident58 Ų5866.1 Ų66.131%0.3131%0.309SS..Hα-helixtrans-64.7-38.7-178.4-74-31.4000112.9E179 R180 R185 T186E179-N183 WeakPolarHBondContact O-CB 3.48Å; E179-N183 PolarHBondContact O-N 3.23Å; E179-N183 PolarHBondContact O-ND2 2.88Å; E179-N183 VanDerWaalsContact O-ND2 3.09Å; R180-N183 WeakPolarHBondContact O-CA 3.37Å; R180-N183 WeakPolarHBondContact O-CB 3.26Å; R180-N183 PolarHBondContact O-N 3.25Å; N183-R185 VanDerWaalsContact C-N 3.34Å; N183-T186 WeakPolarHBondContact CA-OG1 3.17Å; N183-T186 PolarHBondContact O-N 2.93Å; N183-T186 PolarHBondContact O-OG1 3.47Å
184E90.7Very high87.7Confident64 Ų6459.1 Ų59.130%0.29928%0.279SS..Hα-helixtrans-58.2-45.3169.8-73.8142.4-162.600111.4R180 L181 T186 L277R180-E184 PolarHBondContact O-N 3.04Å; L181-E184 WeakPolarHBondContact CA-OE2 3.44Å; E184-T186 PolarHBondContact O-N 3.01Å; E184-L277 WeakPolarHBondContact O-CD2 3.26Å
185R93.6Very high89Confident90 Ų9059.6 Ų59.634%0.3429%0.287SS..THydrogen-bonded Turntrans-76.54.2172.7-72.7-177-82.3-174.6-8.3114.9L181 K182 N183 F250 K251 E253L181-R185 PolarHBondContact O-NE 2.99Å; L181-R185 PolarHBondContact O-NH2 3.11Å; K182-R185 CarbonylContact O-C 3.6Å; K182-R185 VanDerWaalsContact O-C 3.28Å; K182-R185 WeakPolarHBondContact O-CA 3.33Å; K182-R185 PolarHBondContact O-N 3.32Å; K182-R185 VanDerWaalsContact O-N 3.17Å; N183-R185 VanDerWaalsContact C-N 3.34Å; R185-F250 PolarHBondContact O-N 2.95Å; R185-K251 WeakPolarHBondContact CD-O 3.29Å; R185-K251 PolarHBondContact NH1-O 3.04Å; R185-E253 HydrophobicContact CG-CB 3.94Å; R185-E253 HydrophobicContact CG-CG 4.48Å
186T94.2Very high89.3Confident8 Ų855.4 Ų55.45%0.04927%0.265CS..EExtended strand (participates in β ladder)trans-105.2133174.266.10000113.5K182 N183 E184 V248 V249 A278K182-T186 WeakPolarHBondContact O-CG2 3.49Å; K182-T186 PolarHBondContact O-N 3.07Å; N183-T186 WeakPolarHBondContact CA-OG1 3.17Å; N183-T186 PolarHBondContact O-N 2.93Å; N183-T186 PolarHBondContact O-OG1 3.47Å; E184-T186 PolarHBondContact O-N 3.01Å; T186-V248 VanDerWaalsContact CA-O 3.29Å; T186-V248 WeakPolarHBondContact CA-O 3.45Å; T186-V249 HydrophobicContact CG2-CB 4.13Å; T186-V249 HydrophobicContact CG2-CG1 4.13Å; T186-V249 HydrophobicContact CG2-CG2 3.69Å; T186-A278 PolarHBondContact O-N 2.95Å; T186-A278 WeakPolarHBondContact OG1-CB 3.14Å
187V94.4Very high89.6Confident0 Ų053 Ų530%026%0.256CS..EExtended strand (participates in β ladder)trans-100.8128.3171176.70000109.1V189 Y247 V248 F250 A256 A259 V275 D276V187-V189 HydrophobicContact CG1-CG2 4.04Å; V187-Y247 WeakPolarHBondContact O-CA 3.4Å; V187-V248 PolarHBondContact N-O 2.81Å; V187-V248 PolarHBondContact O-N 3.02Å; V187-F250 HydrophobicContact CB-CE2 4.04Å; V187-F250 HydrophobicContact CG2-CD2 4.02Å; V187-F250 HydrophobicContact CG2-CE2 3.6Å; V187-A256 HydrophobicContact CG2-CB 3.61Å; V187-A259 HydrophobicContact CG2-CB 4.19Å; V187-V275 HydrophobicContact CG1-CG1 3.31Å; V187-D276 CarbonylContact C-O 3.53Å; V187-D276 WeakPolarHBondContact CA-O 3.24Å; V187-D276 WeakPolarHBondContact CG1-O 3.34Å
188F93.6Very high90Very high30 Ų3052.4 Ų52.413%0.13225%0.251CS..EExtended strand (participates in β ladder)trans-80.9125.8167.5172.3-97.5000109.7N245 Y247 V275 D276F188-N245 HydrophobicContact CE2-CB 3.8Å; F188-N245 HydrophobicContact CZ-CB 4.09Å; F188-Y247 HydrophobicContact CB-CD1 4.39Å; F188-Y247 HydrophobicContact CB-CE1 4.22Å; F188-Y247 HydrophobicContact CD2-CD1 4.37Å; F188-Y247 AromaticContact CD2-CE1 3.83Å; F188-Y247 HydrophobicContact CD2-CE1 3.83Å; F188-Y247 HydrophobicContact CD2-CE2 4.41Å; F188-Y247 AromaticContact CD2-CZ 3.84Å; F188-V275 WeakPolarHBondContact O-CA 3.36Å; F188-D276 HydrophobicContact CB-CB 4.42Å; F188-D276 HydrophobicContact CD1-CB 4.29Å; F188-D276 PolarHBondContact N-O 2.74Å; F188-D276 PolarHBondContact O-N 2.81Å
189V92.8Very high90.4Very high0 Ų056.6 Ų56.60%027%0.268CS..EExtended strand (participates in β ladder)trans-119.7107.4177.3-169.90000109.1V187 L192 L201 F205 N245 A246 V248 I273 R274V187-V189 HydrophobicContact CG1-CG2 4.04Å; V189-L192 HydrophobicContact CB-CD1 4.12Å; V189-L192 HydrophobicContact CG1-CD1 3.84Å; V189-L192 HydrophobicContact CG1-CD2 3.88Å; V189-L192 HydrophobicContact CG1-CG 3.89Å; V189-L201 HydrophobicContact CG1-CD2 4.46Å; V189-F205 HydrophobicContact CG1-CE2 4.33Å; V189-F205 HydrophobicContact CG1-CZ 4.39Å; V189-F205 HydrophobicContact CG2-CE2 3.85Å; V189-F205 HydrophobicContact CG2-CZ 3.86Å; V189-N245 CarbonylContact O-C 3.55Å; V189-N245 WeakPolarHBondContact O-CA 3.33Å; V189-A246 PolarHBondContact N-O 3.5Å; V189-A246 PolarHBondContact O-N 3.37Å; V189-V248 HydrophobicContact CG2-CG2 3.96Å; V189-I273 HydrophobicContact CG1-CB 4.17Å; V189-I273 HydrophobicContact CG1-CD1 4.22Å; V189-I273 HydrophobicContact CG1-CG2 4.33Å; V189-R274 CarbonylContact C-O 3.46Å; V189-R274 WeakPolarHBondContact CA-O 3.38Å
190G91.3Very high90.7Very high3 Ų358 Ų583%0.03127%0.273CS..EExtended strand (participates in β ladder)trans-99.4163.5179.500000113.6L192 I273 R274G190-L192 VanDerWaalsContact C-N 3.34Å; G190-L192 PolarHBondContact O-N 2.81Å; G190-I273 WeakPolarHBondContact O-CA 3.37Å; G190-R274 PolarHBondContact N-O 3.48Å; G190-R274 PolarHBondContact O-N 3.17Å
191N90.7Very high91.1Very high13 Ų1351.3 Ų51.37%0.0725%0.248CC..EExtended strand (participates in β ladder)trans60.334.4177.4-162.343.7000115.2N243 I244 R272N191-N243 PolarHBondContact OD1-ND2 3.46Å; N191-I244 PolarHBondContact N-O 3.26Å; N191-R272 PolarHBondContact ND2-O 2.86Å
192L91.8Very high91.3Very high0 Ų051.1 Ų51.10%024%0.243CC..EExtended strand (participates in β ladder)trans-77.5141.6172.7-67.7162.3000110.2V189 G190 L201 N243 I244 A246 I267 I273V189-L192 HydrophobicContact CB-CD1 4.12Å; V189-L192 HydrophobicContact CG1-CD1 3.84Å; V189-L192 HydrophobicContact CG1-CD2 3.88Å; V189-L192 HydrophobicContact CG1-CG 3.89Å; G190-L192 VanDerWaalsContact C-N 3.34Å; G190-L192 PolarHBondContact O-N 2.81Å; L192-L201 HydrophobicContact CD1-CD1 3.98Å; L192-L201 HydrophobicContact CD1-CD2 4.07Å; L192-L201 HydrophobicContact CD2-CD2 3.8Å; L192-N243 CarbonylContact O-C 3.59Å; L192-N243 WeakPolarHBondContact O-CA 3.34Å; L192-I244 HydrophobicContact CB-CG1 3.96Å; L192-I244 PolarHBondContact N-O 3.48Å; L192-I244 WeakPolarHBondContact O-CG1 3.47Å; L192-I244 PolarHBondContact O-N 3.32Å; L192-A246 HydrophobicContact CD1-CB 3.62Å; L192-I267 HydrophobicContact CD2-CD1 3.94Å; L192-I273 HydrophobicContact CD2-CG2 3.66Å; L192-I273 HydrophobicContact CG-CG2 4.39Å
193P90.8Very high91.6Very high3 Ų351.7 Ų51.72%0.01926%0.256CS..EExtended strand (participates in β ladder)trans-67.8149.2173.829.3-34.9000110.9T195 C196 A268 F271P193-T195 PolarHBondContact O-N 2.95Å; P193-T195 VanDerWaalsContact O-N 3.07Å; P193-C196 HydrophobicContact CG-CB 4.29Å; P193-C196 WeakPolarHBondContact O-CB 3.41Å; P193-C196 PolarHBondContact O-N 2.8Å; P193-A268 HydrophobicContact CG-CB 4.09Å; P193-F271 HydrophobicContact CB-CD1 3.77Å; P193-F271 HydrophobicContact CB-CD2 3.96Å; P193-F271 HydrophobicContact CB-CE1 3.76Å; P193-F271 HydrophobicContact CB-CE2 3.96Å; P193-F271 HydrophobicContact CB-CG 3.87Å; P193-F271 HydrophobicContact CB-CZ 3.86Å; P193-F271 HydrophobicContact CG-CB 4.43Å; P193-F271 HydrophobicContact CG-CD1 4.36Å; P193-F271 HydrophobicContact CG-CD2 4.43Å; P193-F271 HydrophobicContact CG-CG 4.16Å
194V87.6Confident91.7Very high44 Ų4451 Ų5127%0.26725%0.25SS..THydrogen-bonded Turntrans-58.6-25.7179.6-166.60000113C196 I237 Q241 K242 I244V194-C196 PolarHBondContact O-N 3.36Å; V194-I237 HydrophobicContact CG1-CB 4.43Å; V194-I237 HydrophobicContact CG1-CD1 3.4Å; V194-I237 HydrophobicContact CG1-CG1 4.48Å; V194-I237 HydrophobicContact CG1-CG2 4.11Å; V194-Q241 HydrophobicContact CG2-CG 4.33Å; V194-Q241 WeakPolarHBondContact CG2-O 3.41Å; V194-K242 VanDerWaalsContact CG2-C 3.49Å; V194-K242 WeakPolarHBondContact CG2-O 3.43Å; V194-K242 PolarHBondContact N-O 3.28Å; V194-I244 HydrophobicContact CG2-CG2 4.19Å
195T87.6Confident91.9Very high107 Ų10748 Ų4866%0.65624%0.236SC*.THydrogen-bonded Turntrans-72.5-8.7177.556.60000114.1P193 N197P193-T195 PolarHBondContact O-N 2.95Å; P193-T195 VanDerWaalsContact O-N 3.07Å; T195-N197 PolarHBondContact O-N 2.83Å; T195-N197 VanDerWaalsContact O-N 3.11Å
196C87.9Confident91.8Very high6 Ų651.6 Ų51.64%0.04125%0.254CS..  trans-72104.5-179.2-98.80000113.1P193 V194 F216 I267P193-C196 HydrophobicContact CG-CB 4.29Å; P193-C196 WeakPolarHBondContact O-CB 3.41Å; P193-C196 PolarHBondContact O-N 2.8Å; V194-C196 PolarHBondContact O-N 3.36Å; C196-F216 WeakPolarHBondContact O-CZ 3.45Å; C196-I267 WeakPolarHBondContact SG-CG2 3.44Å
197N90.8Very high91.8Very high75 Ų7557 Ų5740%0.40128%0.279SS..  trans-73.4151.9170.6-65.5-63.9000111.8T195 K199 K200 R235T195-N197 PolarHBondContact O-N 2.83Å; T195-N197 VanDerWaalsContact O-N 3.11Å; N197-K199 PolarHBondContact O-N 3.07Å; N197-K200 PolarHBondContact O-N 2.88Å; N197-R235 PolarHBondContact OD1-NH2 2.86Å
198K91.4Very high91.8Very high116 Ų11658.5 Ų58.550%0.50429%0.285SS..Hα-helixtrans-50.6-32.8176.9-60.6-166.4-176.7-159.40113.8L201 K202 V214 F216K198-L201 PolarHBondContact O-N 3.14Å; K198-K202 PolarHBondContact O-N 2.8Å; K198-V214 HydrophobicContact CD-CB 4.44Å; K198-V214 WeakPolarHBondContact CE-O 3.43Å; K198-V214 HydrophobicContact CG-CG1 4.49Å; K198-V214 PolarHBondContact NZ-O 2.9Å; K198-F216 HydrophobicContact CG-CD2 4.32Å; K198-F216 HydrophobicContact CG-CE2 3.5Å; K198-F216 HydrophobicContact CG-CZ 4.1Å
199K92Very high91.8Very high182 Ų18258.2 Ų58.279%0.79129%0.29SS*.Hα-helixtrans-60.2-44.4176.5-66.9-170.4178.3-173.80112.3N197 K202 S203N197-K199 PolarHBondContact O-N 3.07Å; K199-K202 PolarHBondContact O-N 3.27Å; K199-S203 PolarHBondContact O-N 3.34Å; K199-S203 PolarHBondContact O-OG 3.06Å
200K92.3Very high91.9Very high119 Ų11964.1 Ų64.152%0.51732%0.318SS..Hα-helixtrans-63.8-42.1179-74-163.7171.5-1650112N197 S203 F204N197-K200 PolarHBondContact O-N 2.88Å; K200-S203 PolarHBondContact O-N 2.82Å; K200-S203 PolarHBondContact O-OG 3.39Å; K200-F204 WeakPolarHBondContact O-CB 3.17Å; K200-F204 PolarHBondContact O-N 3.13Å
201L92.6Very high92.1Very high1 Ų164.7 Ų64.71%0.00532%0.32CS..Hα-helixtrans-63.1-45.3172.8-81.5172.5000111.9V189 L192 K198 S203 F204 F205 V214 F216 A246 I267V189-L201 HydrophobicContact CG1-CD2 4.46Å; L192-L201 HydrophobicContact CD1-CD1 3.98Å; L192-L201 HydrophobicContact CD1-CD2 4.07Å; L192-L201 HydrophobicContact CD2-CD2 3.8Å; K198-L201 PolarHBondContact O-N 3.14Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 2.56Å; L201-F204 PolarHBondContact O-N 3.34Å; L201-F205 HydrophobicContact CD2-CD2 4.22Å; L201-F205 HydrophobicContact CD2-CE2 3.9Å; L201-F205 PolarHBondContact O-N 2.99Å; L201-F205 VanDerWaalsContact O-N 3.12Å; L201-V214 HydrophobicContact CD1-CG1 3.79Å; L201-F216 HydrophobicContact CD1-CE1 3.58Å; L201-F216 HydrophobicContact CD1-CZ 3.93Å; L201-A246 HydrophobicContact CD1-CB 3.96Å; L201-I267 HydrophobicContact CD2-CD1 4.38Å
202K93.6Very high92.3Very high84 Ų8469.3 Ų69.337%0.36534%0.341SS..Hα-helixtrans-64.6-32.9178.8-77.9-145.1176.2-158.40113.1K198 K199 K206 I211 E212 V214K198-K202 PolarHBondContact O-N 2.8Å; K199-K202 PolarHBondContact O-N 3.27Å; K202-K206 WeakPolarHBondContact O-CB 3.45Å; K202-K206 PolarHBondContact O-N 2.92Å; K202-I211 HydrophobicContact CB-CD1 4.3Å; K202-I211 HydrophobicContact CD-CB 4.34Å; K202-I211 HydrophobicContact CD-CG2 4.24Å; K202-I211 HydrophobicContact CG-CB 4.49Å; K202-I211 HydrophobicContact CG-CD1 4.19Å; K202-I211 HydrophobicContact CG-CG2 4.23Å; K202-I211 PolarHBondContact NZ-O 2.78Å; K202-E212 PolarHBondContact NZ-O 3.04Å; K202-V214 HydrophobicContact CG-CG2 3.99Å
203S93.6Very high92.3Very high82 Ų8271.6 Ų71.657%0.57336%0.357SS*.Hα-helixtrans-73.2-43.5172.953.70000112.4K199 K200 L201 F205 K206K199-S203 PolarHBondContact O-N 3.34Å; K199-S203 PolarHBondContact O-OG 3.06Å; K200-S203 PolarHBondContact O-N 2.82Å; K200-S203 PolarHBondContact O-OG 3.39Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 2.56Å; S203-F205 VanDerWaalsContact C-N 3.33Å; S203-F205 PolarHBondContact O-N 3.33Å; S203-K206 WeakPolarHBondContact O-CB 3.45Å; S203-K206 PolarHBondContact O-N 3.47Å
204F92.7Very high92.5Very high44 Ų4471.9 Ų71.919%0.19336%0.359CS..Hα-helixtrans-62.9-36.3-177.5-173.2-89.6000113.4K200 L201 R262 A265 I267 I273K200-F204 WeakPolarHBondContact O-CB 3.17Å; K200-F204 PolarHBondContact O-N 3.13Å; L201-F204 PolarHBondContact O-N 3.34Å; F204-R262 HydrophobicContact CE1-CB 3.93Å; F204-R262 HydrophobicContact CE1-CG 3.91Å; F204-R262 HydrophobicContact CZ-CB 4.35Å; F204-R262 HydrophobicContact CZ-CG 4.25Å; F204-A265 HydrophobicContact CZ-CB 3.85Å; F204-I267 HydrophobicContact CB-CD1 4.45Å; F204-I267 HydrophobicContact CD1-CD1 3.95Å; F204-I267 HydrophobicContact CD2-CD1 4.05Å; F204-I267 HydrophobicContact CD2-CG1 3.92Å; F204-I267 HydrophobicContact CE1-CD1 4.15Å; F204-I267 HydrophobicContact CE1-CG1 4.38Å; F204-I267 HydrophobicContact CE2-CD1 4.24Å; F204-I267 HydrophobicContact CE2-CG1 3.77Å; F204-I267 HydrophobicContact CG-CD1 3.89Å; F204-I267 HydrophobicContact CG-CG1 4.28Å; F204-I267 HydrophobicContact CZ-CD1 4.28Å; F204-I267 HydrophobicContact CZ-CG1 4.01Å; F204-I273 HydrophobicContact CE1-CD1 3.74Å; F204-I273 HydrophobicContact CZ-CD1 4.16Å
205F94.2Very high92.6Very high0 Ų077.1 Ų77.10%037%0.374CS..THydrogen-bonded Turntrans-982179.1-72.4-73.1000114.2V189 L201 S203 E207 Y208 I211 F250 A259 R262 I273 V275V189-F205 HydrophobicContact CG1-CE2 4.33Å; V189-F205 HydrophobicContact CG1-CZ 4.39Å; V189-F205 HydrophobicContact CG2-CE2 3.85Å; V189-F205 HydrophobicContact CG2-CZ 3.86Å; L201-F205 HydrophobicContact CD2-CD2 4.22Å; L201-F205 HydrophobicContact CD2-CE2 3.9Å; L201-F205 PolarHBondContact O-N 2.99Å; L201-F205 VanDerWaalsContact O-N 3.12Å; S203-F205 VanDerWaalsContact C-N 3.33Å; S203-F205 PolarHBondContact O-N 3.33Å; F205-E207 PolarHBondContact O-N 3.3Å; F205-Y208 HydrophobicContact CD1-CD2 4.25Å; F205-Y208 PolarHBondContact O-N 3.12Å; F205-I211 HydrophobicContact CB-CD1 3.67Å; F205-I211 HydrophobicContact CB-CG1 4.5Å; F205-F250 HydrophobicContact CB-CE1 4.3Å; F205-F250 HydrophobicContact CB-CZ 3.96Å; F205-F250 HydrophobicContact CD1-CZ 4.26Å; F205-F250 HydrophobicContact CG-CZ 4.31Å; F205-A259 HydrophobicContact CD1-CB 3.84Å; F205-A259 HydrophobicContact CE1-CB 3.95Å; F205-R262 HydrophobicContact CE1-CB 4.41Å; F205-I273 HydrophobicContact CZ-CD1 4.01Å; F205-V275 HydrophobicContact CE1-CG1 4.45Å; F205-V275 HydrophobicContact CZ-CG2 4.27Å
206K93.2Very high92.7Very high166 Ų16674.3 Ų74.372%0.72235%0.353SS*.THydrogen-bonded Turntrans-59.4-32.6179-170-172172.7-163.30112.5K202 S203 Y208 G209K202-K206 WeakPolarHBondContact O-CB 3.45Å; K202-K206 PolarHBondContact O-N 2.92Å; S203-K206 WeakPolarHBondContact O-CB 3.45Å; S203-K206 PolarHBondContact O-N 3.47Å; K206-Y208 PolarHBondContact O-N 3.41Å; K206-G209 PolarHBondContact O-N 3.28Å
207E93.6Very high92.6Very high123 Ų12380.6 Ų80.658%0.57538%0.376SS*.THydrogen-bonded Turntrans-57.4-33.5-179.5-170.2-178.9122.600113.3F205 R262F205-E207 PolarHBondContact O-N 3.3Å; E207-R262 IonicContact OE1-CZ 3.48Å; E207-R262 IonicContact OE1-NH2 3.39Å; E207-R262 PolarHBondContact OE1-NH2 3.49Å; E207-R262 IonicContact OE2-CZ 2.78Å; E207-R262 IonicContact OE2-NH1 2.77Å; E207-R262 IonicContact OE2-NH2 3.76Å; E207-R262 PolarHBondContact OE2-NH2 3.38Å
208Y93Very high92.2Very high30 Ų3079.4 Ų79.412%0.11837%0.373CS..THydrogen-bonded Turntrans-94.3-16.8-175.2-58.5-61.6000114.2F205 K206 A255 Q258 A259 R262F205-Y208 HydrophobicContact CD1-CD2 4.25Å; F205-Y208 PolarHBondContact O-N 3.12Å; K206-Y208 PolarHBondContact O-N 3.41Å; Y208-A255 WeakPolarHBondContact O-CA 3.43Å; Y208-A255 WeakPolarHBondContact O-CB 3.03Å; Y208-Q258 HydrophobicContact CD1-CB 3.73Å; Y208-Q258 HydrophobicContact CG-CB 4.24Å; Y208-A259 HydrophobicContact CD2-CB 4.25Å; Y208-A259 HydrophobicContact CG-CB 4.43Å; Y208-R262 HydrophobicContact CE2-CG 3.56Å; Y208-R262 VanDerWaalsContact OH-CZ 3.24Å; Y208-R262 PolarHBondContact OH-NE 2.84Å; Y208-R262 PolarHBondContact OH-NH2 3.14Å; Y208-R262 VanDerWaalsContact OH-NH2 3.13Å
209G94.3Very high91.7Very high24 Ų2475 Ų7525%0.24736%0.355CS..  trans157.2-179.6176.800000114.7K206 I211K206-G209 PolarHBondContact O-N 3.28Å; G209-I211 PolarHBondContact O-N 2.99Å
210Q94.8Very high91.2Very high125 Ų12566.8 Ų66.858%0.58432%0.319SS*.  trans-83115.4-175.7-166.6167.782.600111.6K251Q210-K251 HydrophobicContact CB-CD 4.29Å; Q210-K251 HydrophobicContact CG-CD 4.3Å; Q210-K251 PolarHBondContact O-N 3.4Å
211I96.1Very high90.7Very high15 Ų1562.3 Ų62.38%0.07730%0.302CS..EExtended strand (participates in β ladder)trans-83.3118.9-178.9-58.8158.4000109.9K202 F205 G209 V214 V248 V249 F250K202-I211 HydrophobicContact CB-CD1 4.3Å; K202-I211 HydrophobicContact CD-CB 4.34Å; K202-I211 HydrophobicContact CD-CG2 4.24Å; K202-I211 HydrophobicContact CG-CB 4.49Å; K202-I211 HydrophobicContact CG-CD1 4.19Å; K202-I211 HydrophobicContact CG-CG2 4.23Å; K202-I211 PolarHBondContact NZ-O 2.78Å; F205-I211 HydrophobicContact CB-CD1 3.67Å; F205-I211 HydrophobicContact CB-CG1 4.5Å; G209-I211 PolarHBondContact O-N 2.99Å; I211-V214 HydrophobicContact CG2-CG2 3.86Å; I211-V248 HydrophobicContact CB-CG1 4.49Å; I211-V248 HydrophobicContact CD1-CG1 4.29Å; I211-V248 HydrophobicContact CG1-CG1 4.04Å; I211-V248 HydrophobicContact CG2-CG1 3.65Å; I211-V249 CarbonylContact C-O 3.57Å; I211-V249 WeakPolarHBondContact CG2-O 3.39Å; I211-F250 HydrophobicContact CD1-CE1 4.4Å; I211-F250 HydrophobicContact CG1-CD1 3.88Å; I211-F250 HydrophobicContact CG1-CE1 3.61Å; I211-F250 HydrophobicContact CG1-CZ 4.26Å
212E94.1Very high90.2Very high110 Ų11063.5 Ų63.551%0.51431%0.313SS..EExtended strand (participates in β ladder)trans-67.4-71.7171.6-171.3-154.6136.700109.7K202 V249K202-E212 PolarHBondContact NZ-O 3.04Å; E212-V249 HydrophobicContact CB-CB 4.29Å; E212-V249 HydrophobicContact CB-CG1 4.28Å; E212-V249 PolarHBondContact N-O 2.93Å; E212-V249 WeakPolarHBondContact OE2-CG1 3.45Å
213S92.9Very high88.9Confident47 Ų4766.3 Ų66.333%0.32933%0.327SS..EExtended strand (participates in β ladder)trans-134.4161.4-173.188.50000114V249S213-V249 PolarHBondContact N-O 3Å; S213-V249 PolarHBondContact O-N 3Å; S213-V249 WeakPolarHBondContact OG-CG2 3.42Å
214V93.8Very high87.8Confident9 Ų966.5 Ų66.56%0.05534%0.342CS..EExtended strand (participates in β ladder)trans-135.5120.7178.8-179.50000109.5K198 L201 K202 I211 Y247 V248K198-V214 HydrophobicContact CD-CB 4.44Å; K198-V214 WeakPolarHBondContact CE-O 3.43Å; K198-V214 HydrophobicContact CG-CG1 4.49Å; K198-V214 PolarHBondContact NZ-O 2.9Å; L201-V214 HydrophobicContact CD1-CG1 3.79Å; K202-V214 HydrophobicContact CG-CG2 3.99Å; I211-V214 HydrophobicContact CG2-CG2 3.86Å; V214-Y247 WeakPolarHBondContact CA-O 3.36Å; V214-V248 HydrophobicContact CG2-CG1 4.46Å; V214-V248 HydrophobicContact CG2-CG2 4.49Å
215R91.1Very high86.5Confident155 Ų15566 Ų6659%0.58534%0.343SS*.EExtended strand (participates in β ladder)trans-119.5103.8-173.3-179.9-172.6-173.6-172.75.8110.2A246 Y247R215-A246 CarbonylContact O-C 3.49Å; R215-A246 WeakPolarHBondContact O-CA 3.35Å; R215-Y247 PolarHBondContact N-O 3.43Å; R215-Y247 PolarHBondContact O-N 2.82Å
216F89.9Confident85.4Confident48 Ų4870.4 Ų70.421%0.21137%0.366CS..EExtended strand (participates in β ladder)trans-68.9146.5171.1-66.4-62000111.8C196 K198 L201 L219 I244 N245 A246C196-F216 WeakPolarHBondContact O-CZ 3.45Å; K198-F216 HydrophobicContact CG-CD2 4.32Å; K198-F216 HydrophobicContact CG-CE2 3.5Å; K198-F216 HydrophobicContact CG-CZ 4.1Å; L201-F216 HydrophobicContact CD1-CE1 3.58Å; L201-F216 HydrophobicContact CD1-CZ 3.93Å; F216-L219 HydrophobicContact CB-CD1 3.74Å; F216-I244 HydrophobicContact CD1-CD1 3.7Å; F216-I244 HydrophobicContact CE1-CD1 3.87Å; F216-I244 HydrophobicContact CG-CD1 4.34Å; F216-N245 WeakPolarHBondContact CA-O 3.34Å; F216-A246 HydrophobicContact CD1-CB 3.85Å; F216-A246 HydrophobicContact CE1-CB 4.15Å
217R85.6Confident84.5Confident138 Ų13866.3 Ų66.352%0.52136%0.358SS..EExtended strand (participates in β ladder)trans-136.9168.3179.7-172.559-172.2-172.90109.6L219 N245 Y247R217-L219 PolarHBondContact O-N 2.83Å; R217-L219 VanDerWaalsContact O-N 3.14Å; R217-N245 PolarHBondContact N-O 2.91Å; R217-N245 PolarHBondContact O-N 3.09Å; R217-Y247 HydrophobicContact CB-CD2 4.43Å; R217-Y247 HydrophobicContact CB-CE2 4.14Å; R217-Y247 HydrophobicContact CG-CE2 4.23Å
218S82.3Confident83.7Confident50 Ų5066.6 Ų66.635%0.3536%0.357SS..  trans65.39.9178-46.30000115.7I220 Q241 N245S218-I220 PolarHBondContact O-N 2.9Å; S218-Q241 PolarHBondContact O-NE2 3.27Å; S218-N245 PolarHBondContact OG-ND2 2.8Å
219L81.1Confident82.8Confident22 Ų2273.5 Ų73.512%0.11539%0.388CS..PPolyproline II helixtrans-65.9120.3173.7-73.3158000110.9F216 R217 A232 I237 I244F216-L219 HydrophobicContact CB-CD1 3.74Å; R217-L219 PolarHBondContact O-N 2.83Å; R217-L219 VanDerWaalsContact O-N 3.14Å; L219-A232 HydrophobicContact CD1-CB 3.77Å; L219-I237 HydrophobicContact CD2-CD1 3.54Å; L219-I237 HydrophobicContact CD2-CG1 4.13Å; L219-I244 HydrophobicContact CD2-CG2 3.67Å; L219-I244 HydrophobicContact CG-CG2 4.21Å
220I81.3Confident82.1Confident10 Ų1075.6 Ų75.65%0.05139%0.393CS..PPolyproline II helixtrans-99116176.4-58.6178.8000108S218 I237 H238 V323S218-I220 PolarHBondContact O-N 2.9Å; I220-I237 WeakPolarHBondContact O-CA 3.32Å; I220-H238 HydrophobicContact CB-CB 4.39Å; I220-H238 HydrophobicContact CG2-CB 3.98Å; I220-H238 PolarHBondContact O-N 3.32Å; I220-H238 VanDerWaalsContact O-N 3.12Å; I220-V323 WeakPolarHBondContact CG2-O 3.24Å
221P81.1Confident81.4Confident25 Ų2569.8 Ų69.816%0.16237%0.366CS..BIsolated β-bridgetrans-57.2148.3171.6-22.133.7000111.3E223 K228 A231P221-E223 PolarHBondContact O-N 3.02Å; P221-K228 HydrophobicContact CG-CG 4.07Å; P221-A231 HydrophobicContact CB-CB 3.71Å; P221-A231 HydrophobicContact CG-CB 3.82Å
222A81.3Confident80.5Confident27 Ų2770.8 Ų70.822%0.22338%0.377CS..PPolyproline II helixtrans-59.9133.2159.200000108.9G224 T225 K236A222-G224 PolarHBondContact O-N 3.13Å; A222-T225 VanDerWaalsContact O-CB 3.31Å; A222-T225 WeakPolarHBondContact O-CB 3.15Å; A222-T225 PolarHBondContact O-N 2.87Å; A222-T225 PolarHBondContact O-OG1 2.84Å; A222-K236 HydrophobicContact CB-CB 4.5Å; A222-K236 PolarHBondContact N-O 3.25Å
223E66.5Low79.7Confident142 Ų14271.9 Ų71.966%0.66439%0.385SS*.THydrogen-bonded Turntrans-49.1135.1-175.9-74.3-66.1171.500111.7P221P221-E223 PolarHBondContact O-N 3.02Å
224G70.6Confident79.1Confident86 Ų8675.6 Ų75.689%0.88740%0.395SS*.THydrogen-bonded Turntrans81.3-3.2-172.500000116.5A222A222-G224 PolarHBondContact O-N 3.13Å
225T67Low78.3Confident35 Ų3583.5 Ų83.522%0.21542%0.424CS..  trans-95.4131.9176.6-58.30000113.8A222 K236A222-T225 VanDerWaalsContact O-CB 3.31Å; A222-T225 WeakPolarHBondContact O-CB 3.15Å; A222-T225 PolarHBondContact O-N 2.87Å; A222-T225 PolarHBondContact O-OG1 2.84Å; T225-K236 HydrophobicContact CG2-CB 4.05Å; T225-K236 HydrophobicContact CG2-CD 4.14Å
226L69.2Low77.9Confident92 Ų9281.9 Ų81.948%0.48242%0.421SS..  trans-9.5145.5159.4-62.4164.7000118.1L230 K234L226-L230 HydrophobicContact CB-CB 3.8Å; L226-L230 HydrophobicContact CB-CD1 3.92Å; L226-L230 HydrophobicContact CD1-CB 4.47Å; L226-L230 HydrophobicContact CD1-CD1 4.3Å; L226-L230 HydrophobicContact CD2-CD1 4.28Å; L226-L230 HydrophobicContact CG-CD1 4.41Å; L226-K234 HydrophobicContact CD1-CD 4.49Å
227S74.6Confident77.5Confident80 Ų8081 Ų8156%0.55942%0.418SS*.THydrogen-bonded Turntrans-33.1145.9-177.377.30000116.4K229 L230 A231S227-K229 CarbonylContact O-C 3.28Å; S227-K229 PolarHBondContact O-N 2.91Å; S227-L230 WeakPolarHBondContact O-CA 3.5Å; S227-L230 WeakPolarHBondContact O-CB 3.27Å; S227-L230 PolarHBondContact O-N 2.81Å; S227-A231 PolarHBondContact O-N 3.12Å
228K77.4Confident77.3Confident128 Ų12876.5 Ų76.556%0.55740%0.403SS*.Hα-helixtrans-49.6-27.1-168-53.4-167.3-179.5-164.50115.9P221 A232P221-K228 HydrophobicContact CG-CG 4.07Å; K228-A232 WeakPolarHBondContact O-CB 3.37Å; K228-A232 PolarHBondContact O-N 2.69Å
229K74.7Confident77.3Confident175 Ų17579.2 Ų79.276%0.76142%0.42SS*.Hα-helixtrans-67.9-44.9171.2-68.3-177.1179179.60112.7S227 A232 I233S227-K229 CarbonylContact O-C 3.28Å; S227-K229 PolarHBondContact O-N 2.91Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 2.83Å; K229-I233 WeakPolarHBondContact O-CG1 3.22Å; K229-I233 PolarHBondContact O-N 3.18Å; K229-I233 VanDerWaalsContact O-N 3.13Å
230L78.5Confident77.3Confident69 Ų6980.5 Ų80.536%0.36143%0.427SS..Hα-helixtrans-72.4-38-179.7-66.2170.4000111.8L226 S227 A232 I233 K234L226-L230 HydrophobicContact CB-CB 3.8Å; L226-L230 HydrophobicContact CB-CD1 3.92Å; L226-L230 HydrophobicContact CD1-CB 4.47Å; L226-L230 HydrophobicContact CD1-CD1 4.3Å; L226-L230 HydrophobicContact CD2-CD1 4.28Å; L226-L230 HydrophobicContact CG-CD1 4.41Å; S227-L230 WeakPolarHBondContact O-CA 3.5Å; S227-L230 WeakPolarHBondContact O-CB 3.27Å; S227-L230 PolarHBondContact O-N 2.81Å; L230-A232 VanDerWaalsContact C-N 3.3Å; L230-A232 PolarHBondContact O-N 2.68Å; L230-I233 PolarHBondContact O-N 2.9Å; L230-K234 WeakPolarHBondContact O-CB 3.47Å; L230-K234 PolarHBondContact O-N 3.18Å
231A81.4Confident77.2Confident2 Ų280.9 Ų80.92%0.01743%0.428CS..Hα-helixtrans-57.4-42.9170.400000112P221 S227 R235 K236P221-A231 HydrophobicContact CB-CB 3.71Å; P221-A231 HydrophobicContact CG-CB 3.82Å; S227-A231 PolarHBondContact O-N 3.12Å; A231-R235 CarbonylContact O-C 3.57Å; A231-R235 WeakPolarHBondContact O-CA 3.46Å; A231-R235 PolarHBondContact O-N 3.14Å; A231-K236 PolarHBondContact O-N 3.16Å
232A76.4Confident77.3Confident36 Ų3685.5 Ų85.530%0.29845%0.446SS..Hα-helixtrans-63-44.3175.700000112.9L219 K228 K229 L230 R235L219-A232 HydrophobicContact CD1-CB 3.77Å; K228-A232 WeakPolarHBondContact O-CB 3.37Å; K228-A232 PolarHBondContact O-N 2.69Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 2.83Å; L230-A232 VanDerWaalsContact C-N 3.3Å; L230-A232 PolarHBondContact O-N 2.68Å; A232-R235 PolarHBondContact O-N 3.37Å
233I77.4Confident77.6Confident133 Ų13385 Ų8568%0.68244%0.44SS*.Hα-helixtrans-66.5-45.7179.2-68162.7000110.9K229 L230 R235K229-I233 WeakPolarHBondContact O-CG1 3.22Å; K229-I233 PolarHBondContact O-N 3.18Å; K229-I233 VanDerWaalsContact O-N 3.13Å; L230-I233 PolarHBondContact O-N 2.9Å; I233-R235 PolarHBondContact O-N 2.67Å
234K80Confident78.7Confident126 Ų12678.5 Ų78.555%0.54841%0.409SS..THydrogen-bonded Turntrans-78.40.2178.1-65.1-172.5174.9-173.40113.6L226 L230 K236L226-K234 HydrophobicContact CD1-CD 4.49Å; L230-K234 WeakPolarHBondContact O-CB 3.47Å; L230-K234 PolarHBondContact O-N 3.18Å; K234-K236 HydrophobicContact CB-CG 4.29Å; K234-K236 PolarHBondContact O-N 3.21Å
235R76.9Confident79.7Confident175 Ų17576.5 Ų76.566%0.6638%0.378SS*.THydrogen-bonded Turntrans48.823.6-172.5-64.1-178.7175.4145.4-3.6114.7N197 A231 A232 I233 I237N197-R235 PolarHBondContact OD1-NH2 2.86Å; A231-R235 CarbonylContact O-C 3.57Å; A231-R235 WeakPolarHBondContact O-CA 3.46Å; A231-R235 PolarHBondContact O-N 3.14Å; A232-R235 PolarHBondContact O-N 3.37Å; I233-R235 PolarHBondContact O-N 2.67Å; R235-I237 PolarHBondContact O-N 3.2Å
236K82.8Confident81Confident120 Ų12074.9 Ų74.952%0.52237%0.368SS..  trans-83.180.9177.1-74.1-161.6171.5-161.40109.7A222 T225 A231 K234A222-K236 HydrophobicContact CB-CB 4.5Å; A222-K236 PolarHBondContact N-O 3.25Å; T225-K236 HydrophobicContact CG2-CB 4.05Å; T225-K236 HydrophobicContact CG2-CD 4.14Å; A231-K236 PolarHBondContact O-N 3.16Å; K234-K236 HydrophobicContact CB-CG 4.29Å; K234-K236 PolarHBondContact O-N 3.21Å
237I82.1Confident82.2Confident30 Ų3074 Ų7415%0.15436%0.359CS..BIsolated β-bridgetrans-114.4148.8-173.5-64161.9000108.6V194 L219 I220 R235 Q241V194-I237 HydrophobicContact CG1-CB 4.43Å; V194-I237 HydrophobicContact CG1-CD1 3.4Å; V194-I237 HydrophobicContact CG1-CG1 4.48Å; V194-I237 HydrophobicContact CG1-CG2 4.11Å; L219-I237 HydrophobicContact CD2-CD1 3.54Å; L219-I237 HydrophobicContact CD2-CG1 4.13Å; I220-I237 WeakPolarHBondContact O-CA 3.32Å; R235-I237 PolarHBondContact O-N 3.2Å; I237-Q241 HydrophobicContact CG2-CB 4.23Å; I237-Q241 HydrophobicContact CG2-CG 4.4Å
238H80.9Confident83.1Confident43 Ų4370.2 Ų70.220%0.19933%0.332CS..  trans-61.6131.6-177.5-157.2-86000111.7I220 D240 Q241I220-H238 HydrophobicContact CB-CB 4.39Å; I220-H238 HydrophobicContact CG2-CB 3.98Å; I220-H238 PolarHBondContact O-N 3.32Å; I220-H238 VanDerWaalsContact O-N 3.12Å; H238-D240 IonicContact CE1-OD2 2.84Å; H238-D240 PolarHBondContact CE1-OD2 2.72Å; H238-D240 IonicContact ND1-OD2 3.97Å; H238-D240 PolarHBondContact O-N 3.42Å; H238-Q241 WeakPolarHBondContact O-CB 3.45Å; H238-Q241 PolarHBondContact O-N 2.89Å
239P81.9Confident84Confident108 Ų10864.9 Ų64.970%0.70131%0.311SS*.THydrogen-bonded Turntrans-64.2-31.6-169.123.1-34.4000114.8Q241P239-Q241 PolarHBondContact O-N 3.29Å
240D80.3Confident85Confident49 Ų4956.6 Ų56.626%0.26228%0.275SS..THydrogen-bonded Turntrans-70.5-15.9173.9-59.8-90.9000113.5H238 K242 K297 R320H238-D240 IonicContact CE1-OD2 2.84Å; H238-D240 PolarHBondContact CE1-OD2 2.72Å; H238-D240 IonicContact ND1-OD2 3.97Å; H238-D240 PolarHBondContact O-N 3.42Å; D240-K242 PolarHBondContact O-N 2.85Å; D240-K242 VanDerWaalsContact O-N 3.17Å; D240-K297 IonicContact OD1-NZ 3.82Å; D240-K297 PolarHBondContact OD1-NZ 3.03Å; D240-R320 PolarHBondContact O-NH1 3.25Å
241Q79.6Confident85.8Confident17 Ų1757.9 Ų57.98%0.07928%0.277CS..  trans-77.3102.2174.3-178.9165.131.500109.8V194 S218 I237 H238 P239 N243V194-Q241 HydrophobicContact CG2-CG 4.33Å; V194-Q241 WeakPolarHBondContact CG2-O 3.41Å; S218-Q241 PolarHBondContact O-NE2 3.27Å; I237-Q241 HydrophobicContact CG2-CB 4.23Å; I237-Q241 HydrophobicContact CG2-CG 4.4Å; H238-Q241 WeakPolarHBondContact O-CB 3.45Å; H238-Q241 PolarHBondContact O-N 2.89Å; P239-Q241 PolarHBondContact O-N 3.29Å; Q241-N243 VanDerWaalsContact CG-O 3.26Å; Q241-N243 WeakPolarHBondContact CG-O 3.08Å; Q241-N243 PolarHBondContact NE2-O 2.84Å
242K84.2Confident86.5Confident123 Ų12362.9 Ų62.954%0.53530%0.3SS..  trans-92.3-21.1174.5-64.1-175.2179.5-177.10113.4V194 D240 F271V194-K242 VanDerWaalsContact CG2-C 3.49Å; V194-K242 WeakPolarHBondContact CG2-O 3.43Å; V194-K242 PolarHBondContact N-O 3.28Å; D240-K242 PolarHBondContact O-N 2.85Å; D240-K242 VanDerWaalsContact O-N 3.17Å; K242-F271 HydrophobicContact CB-CZ 4.45Å; K242-F271 WeakPolarHBondContact O-CE1 3.24Å
243N88.1Confident87.2Confident17 Ų1766.5 Ų66.59%0.09131%0.311CS..EExtended strand (participates in β ladder)trans-130.7151.4-17656.6-2000114.7N191 L192 Q241 F271 E300 R320N191-N243 PolarHBondContact OD1-ND2 3.46Å; L192-N243 CarbonylContact O-C 3.59Å; L192-N243 WeakPolarHBondContact O-CA 3.34Å; Q241-N243 VanDerWaalsContact CG-O 3.26Å; Q241-N243 WeakPolarHBondContact CG-O 3.08Å; Q241-N243 PolarHBondContact NE2-O 2.84Å; N243-F271 HydrophobicContact CB-CE1 4.44Å; N243-E300 PolarHBondContact ND2-OE1 3.45Å; N243-R320 WeakPolarHBondContact OD1-CD 3.46Å; N243-R320 PolarHBondContact OD1-NE 2.9Å; N243-R320 VanDerWaalsContact OD1-NE 3.13Å
244I89.2Confident88Confident5 Ų563.7 Ų63.73%0.02630%0.303CS..EExtended strand (participates in β ladder)trans-133.6167.7-179.861.3174.6000110.2N191 L192 V194 F216 L219N191-I244 PolarHBondContact N-O 3.26Å; L192-I244 HydrophobicContact CB-CG1 3.96Å; L192-I244 PolarHBondContact N-O 3.48Å; L192-I244 WeakPolarHBondContact O-CG1 3.47Å; L192-I244 PolarHBondContact O-N 3.32Å; V194-I244 HydrophobicContact CG2-CG2 4.19Å; F216-I244 HydrophobicContact CD1-CD1 3.7Å; F216-I244 HydrophobicContact CE1-CD1 3.87Å; F216-I244 HydrophobicContact CG-CD1 4.34Å; L219-I244 HydrophobicContact CD2-CG2 3.67Å; L219-I244 HydrophobicContact CG-CG2 4.21Å
245N91.9Very high88.8Confident44 Ų4457.8 Ų57.824%0.23528%0.278CS..EExtended strand (participates in β ladder)trans-115.5158173.5-61.2-18.1000110F188 V189 F216 R217 S218F188-N245 HydrophobicContact CE2-CB 3.8Å; F188-N245 HydrophobicContact CZ-CB 4.09Å; V189-N245 CarbonylContact O-C 3.55Å; V189-N245 WeakPolarHBondContact O-CA 3.33Å; F216-N245 WeakPolarHBondContact CA-O 3.34Å; R217-N245 PolarHBondContact N-O 2.91Å; R217-N245 PolarHBondContact O-N 3.09Å; S218-N245 PolarHBondContact OG-ND2 2.8Å
246A93.3Very high89.5Confident0 Ų049.4 Ų49.40%025%0.246CC..EExtended strand (participates in β ladder)trans-136.2155.6172.200000111.4V189 L192 L201 R215 F216V189-A246 PolarHBondContact N-O 3.5Å; V189-A246 PolarHBondContact O-N 3.37Å; L192-A246 HydrophobicContact CD1-CB 3.62Å; L201-A246 HydrophobicContact CD1-CB 3.96Å; R215-A246 CarbonylContact O-C 3.49Å; R215-A246 WeakPolarHBondContact O-CA 3.35Å; F216-A246 HydrophobicContact CD1-CB 3.85Å; F216-A246 HydrophobicContact CE1-CB 4.15Å
247Y94.3Very high90Very high73 Ų7347.1 Ų47.129%0.28624%0.242SC..EExtended strand (participates in β ladder)trans-110.4133.4158.8-62.8-93000108V187 F188 V214 R215 R217 A278V187-Y247 WeakPolarHBondContact O-CA 3.4Å; F188-Y247 HydrophobicContact CB-CD1 4.39Å; F188-Y247 HydrophobicContact CB-CE1 4.22Å; F188-Y247 HydrophobicContact CD2-CD1 4.37Å; F188-Y247 AromaticContact CD2-CE1 3.83Å; F188-Y247 HydrophobicContact CD2-CE1 3.83Å; F188-Y247 HydrophobicContact CD2-CE2 4.41Å; F188-Y247 AromaticContact CD2-CZ 3.84Å; V214-Y247 WeakPolarHBondContact CA-O 3.36Å; R215-Y247 PolarHBondContact N-O 3.43Å; R215-Y247 PolarHBondContact O-N 2.82Å; R217-Y247 HydrophobicContact CB-CD2 4.43Å; R217-Y247 HydrophobicContact CB-CE2 4.14Å; R217-Y247 HydrophobicContact CG-CE2 4.23Å; Y247-A278 HydrophobicContact CD1-CB 3.96Å; Y247-A278 HydrophobicContact CE1-CB 3.92Å
248V94.8Very high90.6Very high1 Ų149.7 Ų49.71%0.00625%0.254CS..EExtended strand (participates in β ladder)trans-114.3117.5177.7-179.50000107.3T186 V187 V189 I211 V214 F250T186-V248 VanDerWaalsContact CA-O 3.29Å; T186-V248 WeakPolarHBondContact CA-O 3.45Å; V187-V248 PolarHBondContact N-O 2.81Å; V187-V248 PolarHBondContact O-N 3.02Å; V189-V248 HydrophobicContact CG2-CG2 3.96Å; I211-V248 HydrophobicContact CB-CG1 4.49Å; I211-V248 HydrophobicContact CD1-CG1 4.29Å; I211-V248 HydrophobicContact CG1-CG1 4.04Å; I211-V248 HydrophobicContact CG2-CG1 3.65Å; V214-V248 HydrophobicContact CG2-CG1 4.46Å; V214-V248 HydrophobicContact CG2-CG2 4.49Å; V248-F250 HydrophobicContact CB-CE2 4.31Å; V248-F250 HydrophobicContact CG1-CD2 4.28Å; V248-F250 HydrophobicContact CG1-CE2 3.75Å; V248-F250 HydrophobicContact CG1-CZ 3.96Å
249V94.9Very high91.2Very high17 Ų1747.7 Ų47.710%0.10324%0.244CC..EExtended strand (participates in β ladder)trans-92.4120.4177.4-166.80000108.3T186 I211 E212 S213T186-V249 HydrophobicContact CG2-CB 4.13Å; T186-V249 HydrophobicContact CG2-CG1 4.13Å; T186-V249 HydrophobicContact CG2-CG2 3.69Å; I211-V249 CarbonylContact C-O 3.57Å; I211-V249 WeakPolarHBondContact CG2-O 3.39Å; E212-V249 HydrophobicContact CB-CB 4.29Å; E212-V249 HydrophobicContact CB-CG1 4.28Å; E212-V249 PolarHBondContact N-O 2.93Å; E212-V249 WeakPolarHBondContact OE2-CG1 3.45Å; S213-V249 PolarHBondContact N-O 3Å; S213-V249 PolarHBondContact O-N 3Å; S213-V249 WeakPolarHBondContact OG-CG2 3.42Å
250F96.1Very high91.7Very high1 Ų145.2 Ų45.20%0.00423%0.225CC..EExtended strand (participates in β ladder)trans-93.3156.8170.2-67.5-90.5000110.4R185 V187 F205 I211 V248 E252 A255 A256 A259R185-F250 PolarHBondContact O-N 2.95Å; V187-F250 HydrophobicContact CB-CE2 4.04Å; V187-F250 HydrophobicContact CG2-CD2 4.02Å; V187-F250 HydrophobicContact CG2-CE2 3.6Å; F205-F250 HydrophobicContact CB-CE1 4.3Å; F205-F250 HydrophobicContact CB-CZ 3.96Å; F205-F250 HydrophobicContact CD1-CZ 4.26Å; F205-F250 HydrophobicContact CG-CZ 4.31Å; I211-F250 HydrophobicContact CD1-CE1 4.4Å; I211-F250 HydrophobicContact CG1-CD1 3.88Å; I211-F250 HydrophobicContact CG1-CE1 3.61Å; I211-F250 HydrophobicContact CG1-CZ 4.26Å; V248-F250 HydrophobicContact CB-CE2 4.31Å; V248-F250 HydrophobicContact CG1-CD2 4.28Å; V248-F250 HydrophobicContact CG1-CE2 3.75Å; V248-F250 HydrophobicContact CG1-CZ 3.96Å; F250-E252 WeakPolarHBondContact CB-O 3.32Å; F250-A255 HydrophobicContact CB-CB 4.06Å; F250-A255 HydrophobicContact CD1-CB 3.61Å; F250-A255 HydrophobicContact CE1-CB 4.23Å; F250-A255 HydrophobicContact CG-CB 3.93Å; F250-A256 HydrophobicContact CD2-CB 4.12Å; F250-A259 HydrophobicContact CE2-CB 4.22Å; F250-A259 HydrophobicContact CZ-CB 3.99Å
251K94.9Very high92.2Very high95 Ų9550.9 Ų50.941%0.41325%0.247SC..SBendtrans-68.2-41.2168.4-74-171.6168.5-175.70112.1R185 Q210R185-K251 WeakPolarHBondContact CD-O 3.29Å; R185-K251 PolarHBondContact NH1-O 3.04Å; Q210-K251 HydrophobicContact CB-CD 4.29Å; Q210-K251 HydrophobicContact CG-CD 4.3Å; Q210-K251 PolarHBondContact O-N 3.4Å
252E95.4Very high92.7Very high108 Ų10853 Ų5351%0.50525%0.254SS..SBendtrans-104.2144.3-176.5-49.8-47.4134.500111.3F250 A255F250-E252 WeakPolarHBondContact CB-O 3.32Å; E252-A255 HydrophobicContact CB-CB 4.24Å
253E93Very high93Very high112 Ų11248.6 Ų48.652%0.52324%0.237SC..Hα-helixtrans-74-37.4174.9-167-164.7150.400111.9R185 A255 A256 T257R185-E253 HydrophobicContact CG-CB 3.94Å; R185-E253 HydrophobicContact CG-CG 4.48Å; E253-A255 PolarHBondContact O-N 3.1Å; E253-A256 WeakPolarHBondContact O-CA 3.36Å; E253-A256 WeakPolarHBondContact O-CB 3.26Å; E253-A256 PolarHBondContact O-N 3.44Å; E253-T257 PolarHBondContact O-N 2.78Å
254S93.9Very high93Very high74 Ų7448.1 Ų48.152%0.51724%0.236SC..Hα-helixtrans-54.5-37.5175.657.40000112.3T257 Q258S254-T257 PolarHBondContact O-N 3.01Å; S254-Q258 WeakPolarHBondContact O-CB 3.47Å; S254-Q258 VanDerWaalsContact O-CG 3.27Å; S254-Q258 WeakPolarHBondContact O-CG 3.08Å; S254-Q258 PolarHBondContact O-N 3.32Å
255A95.1Very high93Very high1 Ų149.2 Ų49.21%0.00825%0.246CC..Hα-helixtrans-65.2-37.6174.800000113Y208 F250 E252 E253 A259Y208-A255 WeakPolarHBondContact O-CA 3.43Å; Y208-A255 WeakPolarHBondContact O-CB 3.03Å; F250-A255 HydrophobicContact CB-CB 4.06Å; F250-A255 HydrophobicContact CD1-CB 3.61Å; F250-A255 HydrophobicContact CE1-CB 4.23Å; F250-A255 HydrophobicContact CG-CB 3.93Å; E252-A255 HydrophobicContact CB-CB 4.24Å; E253-A255 PolarHBondContact O-N 3.1Å; A255-A259 VanDerWaalsContact O-CB 3.32Å; A255-A259 WeakPolarHBondContact O-CB 3.45Å; A255-A259 PolarHBondContact O-N 2.82Å
256A93.1Very high92.9Very high0 Ų052.7 Ų52.70%026%0.26CS..Hα-helixtrans-66.4-45.4176.100000111.2V187 F250 E253 A259 L277V187-A256 HydrophobicContact CG2-CB 3.61Å; F250-A256 HydrophobicContact CD2-CB 4.12Å; E253-A256 WeakPolarHBondContact O-CA 3.36Å; E253-A256 WeakPolarHBondContact O-CB 3.26Å; E253-A256 PolarHBondContact O-N 3.44Å; A256-A259 PolarHBondContact O-N 2.99Å; A256-L277 HydrophobicContact CB-CD2 4.11Å
257T93.3Very high92.6Very high72 Ų7254.1 Ų54.144%0.44227%0.268SS..Hα-helixtrans-64.9-39176-61.90000112.3E253 S254 L260E253-T257 PolarHBondContact O-N 2.78Å; S254-T257 PolarHBondContact O-N 3.01Å; T257-L260 WeakPolarHBondContact O-CB 3.24Å; T257-L260 PolarHBondContact O-N 2.95Å
258Q94.4Very high92.2Very high84 Ų8452 Ų5239%0.39327%0.266SS..Hα-helixtrans-66.9-38.1174.1-72.8179.826.200112.8Y208 S254 L260 K261Y208-Q258 HydrophobicContact CD1-CB 3.73Å; Y208-Q258 HydrophobicContact CG-CB 4.24Å; S254-Q258 WeakPolarHBondContact O-CB 3.47Å; S254-Q258 VanDerWaalsContact O-CG 3.27Å; S254-Q258 WeakPolarHBondContact O-CG 3.08Å; S254-Q258 PolarHBondContact O-N 3.32Å; Q258-L260 PolarHBondContact O-N 3.26Å; Q258-K261 VanDerWaalsContact O-CB 3.28Å; Q258-K261 WeakPolarHBondContact O-CB 3.03Å; Q258-K261 WeakPolarHBondContact O-CG 3.38Å; Q258-K261 PolarHBondContact O-N 2.78Å
259A93.9Very high91.6Very high0 Ų059.2 Ų59.20%030%0.304CS..Hα-helixtrans-61.5-23.9-179.800000113.6V187 F205 Y208 F250 A255 A256 K261 R262V187-A259 HydrophobicContact CG2-CB 4.19Å; F205-A259 HydrophobicContact CD1-CB 3.84Å; F205-A259 HydrophobicContact CE1-CB 3.95Å; Y208-A259 HydrophobicContact CD2-CB 4.25Å; Y208-A259 HydrophobicContact CG-CB 4.43Å; F250-A259 HydrophobicContact CE2-CB 4.22Å; F250-A259 HydrophobicContact CZ-CB 3.99Å; A255-A259 VanDerWaalsContact O-CB 3.32Å; A255-A259 WeakPolarHBondContact O-CB 3.45Å; A255-A259 PolarHBondContact O-N 2.82Å; A256-A259 PolarHBondContact O-N 2.99Å; A259-K261 PolarHBondContact O-N 3.04Å; A259-K261 VanDerWaalsContact O-N 3.14Å; A259-R262 PolarHBondContact O-N 3.17Å
260L91.3Very high91.1Very high57 Ų5759.6 Ų59.630%0.29831%0.311SS..G310 helixtrans-55.1-27171.8-62.1176.7000113T257 Q258 R262 N263 V275 L277T257-L260 WeakPolarHBondContact O-CB 3.24Å; T257-L260 PolarHBondContact O-N 2.95Å; Q258-L260 PolarHBondContact O-N 3.26Å; L260-R262 PolarHBondContact O-N 3.47Å; L260-R262 VanDerWaalsContact O-N 3.1Å; L260-N263 VanDerWaalsContact O-CB 3.29Å; L260-N263 WeakPolarHBondContact O-CB 3.4Å; L260-N263 PolarHBondContact O-N 2.81Å; L260-V275 HydrophobicContact CD2-CG1 4.44Å; L260-L277 HydrophobicContact CD1-CD1 4.14Å; L260-L277 HydrophobicContact CD1-CG 4.19Å; L260-L277 HydrophobicContact CD2-CG 4.3Å
261K91.2Very high90.7Very high168 Ų16861.7 Ų61.773%0.7332%0.32SS*.G310 helixtrans-62.4-14.4176-62.7179.1178.7-176.80113.5Q258 A259Q258-K261 VanDerWaalsContact O-CB 3.28Å; Q258-K261 WeakPolarHBondContact O-CB 3.03Å; Q258-K261 WeakPolarHBondContact O-CG 3.38Å; Q258-K261 PolarHBondContact O-N 2.78Å; A259-K261 PolarHBondContact O-N 3.04Å; A259-K261 VanDerWaalsContact O-N 3.14Å
262R90.4Very high90.4Very high60 Ų6059.1 Ų59.123%0.22631%0.308CS..G310 helixtrans-92.99173-69-70.3173.498.5-2114.2F204 F205 E207 Y208 A259 L260 G264 A265F204-R262 HydrophobicContact CE1-CB 3.93Å; F204-R262 HydrophobicContact CE1-CG 3.91Å; F204-R262 HydrophobicContact CZ-CB 4.35Å; F204-R262 HydrophobicContact CZ-CG 4.25Å; F205-R262 HydrophobicContact CE1-CB 4.41Å; E207-R262 IonicContact OE1-CZ 3.48Å; E207-R262 IonicContact OE1-NH2 3.39Å; E207-R262 PolarHBondContact OE1-NH2 3.49Å; E207-R262 IonicContact OE2-CZ 2.78Å; E207-R262 IonicContact OE2-NH1 2.77Å; E207-R262 IonicContact OE2-NH2 3.76Å; E207-R262 PolarHBondContact OE2-NH2 3.38Å; Y208-R262 HydrophobicContact CE2-CG 3.56Å; Y208-R262 VanDerWaalsContact OH-CZ 3.24Å; Y208-R262 PolarHBondContact OH-NE 2.84Å; Y208-R262 PolarHBondContact OH-NH2 3.14Å; Y208-R262 VanDerWaalsContact OH-NH2 3.13Å; A259-R262 PolarHBondContact O-N 3.17Å; L260-R262 PolarHBondContact O-N 3.47Å; L260-R262 VanDerWaalsContact O-N 3.1Å; R262-G264 PolarHBondContact O-N 2.94Å; R262-A265 HydrophobicContact CB-CB 4.35Å; R262-A265 VanDerWaalsContact O-CB 3.27Å; R262-A265 WeakPolarHBondContact O-CB 3.37Å; R262-A265 PolarHBondContact O-N 2.85Å; R262-A265 VanDerWaalsContact O-N 3.08Å
263N91.3Very high90.2Very high32 Ų3254 Ų5417%0.17128%0.284CS..THydrogen-bonded Turntrans-59.9123.8174.2-166.216.3000110.5L260 R274 V275L260-N263 VanDerWaalsContact O-CB 3.29Å; L260-N263 WeakPolarHBondContact O-CB 3.4Å; L260-N263 PolarHBondContact O-N 2.81Å; N263-R274 WeakPolarHBondContact OD1-CA 3.27Å; N263-V275 HydrophobicContact CB-CB 4.07Å; N263-V275 PolarHBondContact OD1-N 2.78Å
264G87.2Confident90.1Very high7 Ų749.9 Ų49.97%0.07226%0.264CS..THydrogen-bonded Turntrans85.42.5-175.800000116.3R262 R272 I273 M314R262-G264 PolarHBondContact O-N 2.94Å; G264-R272 PolarHBondContact O-NE 3.29Å; G264-R272 PolarHBondContact O-NH2 2.91Å; G264-I273 VanDerWaalsContact CA-O 3.28Å; G264-I273 WeakPolarHBondContact CA-O 3.44Å; G264-I273 PolarHBondContact N-O 3.24Å; G264-M314 WeakPolarHBondContact CA-O 3.47Å
265A89.9Confident90Very high27 Ų2746.5 Ų46.522%0.22324%0.24CC..  trans-67.9154.217400000112.3F204 R262 R272 I273F204-A265 HydrophobicContact CZ-CB 3.85Å; R262-A265 HydrophobicContact CB-CB 4.35Å; R262-A265 VanDerWaalsContact O-CB 3.27Å; R262-A265 WeakPolarHBondContact O-CB 3.37Å; R262-A265 PolarHBondContact O-N 2.85Å; R262-A265 VanDerWaalsContact O-N 3.08Å; A265-R272 CarbonylContact O-C 3.49Å; A265-R272 WeakPolarHBondContact O-CA 3.32Å; A265-I273 HydrophobicContact CB-CG1 4.43Å; A265-I273 WeakPolarHBondContact O-CG1 3.23Å; A265-I273 PolarHBondContact O-N 2.88Å
266Q88.8Confident89.8Confident117 Ų11747.6 Ų47.655%0.54725%0.246SC..EExtended strand (participates in β ladder)trans-90.5132.4174.9-67.6-177.740.200110.8R272Q266-R272 HydrophobicContact CG-CG 3.51Å
267I87.7Confident89.8Confident30 Ų3049.8 Ų49.815%0.15426%0.257CS..EExtended strand (participates in β ladder)trans-108.1-22.5173.2-77.9-164.3000112.2L192 C196 L201 F204 F271 I273L192-I267 HydrophobicContact CD2-CD1 3.94Å; C196-I267 WeakPolarHBondContact SG-CG2 3.44Å; L201-I267 HydrophobicContact CD2-CD1 4.38Å; F204-I267 HydrophobicContact CB-CD1 4.45Å; F204-I267 HydrophobicContact CD1-CD1 3.95Å; F204-I267 HydrophobicContact CD2-CD1 4.05Å; F204-I267 HydrophobicContact CD2-CG1 3.92Å; F204-I267 HydrophobicContact CE1-CD1 4.15Å; F204-I267 HydrophobicContact CE1-CG1 4.38Å; F204-I267 HydrophobicContact CE2-CD1 4.24Å; F204-I267 HydrophobicContact CE2-CG1 3.77Å; F204-I267 HydrophobicContact CG-CD1 3.89Å; F204-I267 HydrophobicContact CG-CG1 4.28Å; F204-I267 HydrophobicContact CZ-CD1 4.28Å; F204-I267 HydrophobicContact CZ-CG1 4.01Å; I267-F271 PolarHBondContact N-O 3.19Å; I267-F271 VanDerWaalsContact N-O 3.16Å; I267-I273 HydrophobicContact CB-CG2 4.14Å; I267-I273 HydrophobicContact CD1-CD1 3.96Å; I267-I273 HydrophobicContact CD1-CG2 3.82Å; I267-I273 HydrophobicContact CG1-CD1 4.28Å; I267-I273 HydrophobicContact CG1-CG2 3.87Å
268A85.7Confident89.6Confident30 Ų3047.6 Ų47.625%0.24825%0.247CC..EExtended strand (participates in β ladder)trans-154.6166170.100000108.1P193 G270 F271P193-A268 HydrophobicContact CG-CB 4.09Å; A268-G270 PolarHBondContact O-N 3.09Å; A268-F271 HydrophobicContact CB-CB 4.35Å; A268-F271 HydrophobicContact CB-CD2 4.15Å; A268-F271 PolarHBondContact O-N 3.34Å
269D83.1Confident89Confident152 Ų15246.6 Ų46.681%0.81325%0.249SC*.THydrogen-bonded Turntrans-59.2120.1-172.6-45.3-61.1000111.4F271D269-F271 VanDerWaalsContact C-N 3.26Å; D269-F271 WeakPolarHBondContact O-CD2 3.49Å; D269-F271 PolarHBondContact O-N 2.93Å
270G82.4Confident88.1Confident24 Ų2451.5 Ų51.525%0.24727%0.272CS..THydrogen-bonded Turntrans743.9-175.200000116A268 S301A268-G270 PolarHBondContact O-N 3.09Å; G270-S301 WeakPolarHBondContact O-CB 3.49Å; G270-S301 PolarHBondContact O-OG 3.31Å
271F87.9Confident87Confident45 Ų4554.1 Ų54.120%0.19729%0.291CS..EExtended strand (participates in β ladder)trans-108.485.5176-70.5-89.2000111.6P193 K242 N243 I267 A268 D269P193-F271 HydrophobicContact CB-CD1 3.77Å; P193-F271 HydrophobicContact CB-CD2 3.96Å; P193-F271 HydrophobicContact CB-CE1 3.76Å; P193-F271 HydrophobicContact CB-CE2 3.96Å; P193-F271 HydrophobicContact CB-CG 3.87Å; P193-F271 HydrophobicContact CB-CZ 3.86Å; P193-F271 HydrophobicContact CG-CB 4.43Å; P193-F271 HydrophobicContact CG-CD1 4.36Å; P193-F271 HydrophobicContact CG-CD2 4.43Å; P193-F271 HydrophobicContact CG-CG 4.16Å; K242-F271 HydrophobicContact CB-CZ 4.45Å; K242-F271 WeakPolarHBondContact O-CE1 3.24Å; N243-F271 HydrophobicContact CB-CE1 4.44Å; I267-F271 PolarHBondContact N-O 3.19Å; I267-F271 VanDerWaalsContact N-O 3.16Å; A268-F271 HydrophobicContact CB-CB 4.35Å; A268-F271 HydrophobicContact CB-CD2 4.15Å; A268-F271 PolarHBondContact O-N 3.34Å; D269-F271 VanDerWaalsContact C-N 3.26Å; D269-F271 WeakPolarHBondContact O-CD2 3.49Å; D269-F271 PolarHBondContact O-N 2.93Å
272R89.5Confident85.6Confident41 Ų4148.4 Ų48.416%0.15527%0.272CS..EExtended strand (participates in β ladder)trans-80.3123.8169-67.7-178.280.2-177.4-4.8110.7N191 G264 A265 Q266 E304 V313 M314N191-R272 PolarHBondContact ND2-O 2.86Å; G264-R272 PolarHBondContact O-NE 3.29Å; G264-R272 PolarHBondContact O-NH2 2.91Å; A265-R272 CarbonylContact O-C 3.49Å; A265-R272 WeakPolarHBondContact O-CA 3.32Å; Q266-R272 HydrophobicContact CG-CG 3.51Å; R272-E304 WeakPolarHBondContact CD-OE1 3.37Å; R272-E304 VanDerWaalsContact CD-OE2 3.26Å; R272-E304 WeakPolarHBondContact CD-OE2 3.46Å; R272-E304 IonicContact CZ-OE1 2.73Å; R272-E304 IonicContact NE-OE1 3.32Å; R272-E304 IonicContact NH1-OE1 2.8Å; R272-E304 PolarHBondContact NH1-OE1 2.84Å; R272-V313 PolarHBondContact NH1-O 2.95Å; R272-V313 PolarHBondContact NH2-O 3.43Å; R272-M314 PolarHBondContact NH2-O 3.37Å
273I91.9Very high84.3Confident0 Ų048.6 Ų48.60%028%0.282CS..PPolyproline II helixtrans-79.5145.9-179.763.1173.2000111.4V189 G190 L192 F204 F205 G264 A265 I267 V275V189-I273 HydrophobicContact CG1-CB 4.17Å; V189-I273 HydrophobicContact CG1-CD1 4.22Å; V189-I273 HydrophobicContact CG1-CG2 4.33Å; G190-I273 WeakPolarHBondContact O-CA 3.37Å; L192-I273 HydrophobicContact CD2-CG2 3.66Å; L192-I273 HydrophobicContact CG-CG2 4.39Å; F204-I273 HydrophobicContact CE1-CD1 3.74Å; F204-I273 HydrophobicContact CZ-CD1 4.16Å; F205-I273 HydrophobicContact CZ-CD1 4.01Å; G264-I273 VanDerWaalsContact CA-O 3.28Å; G264-I273 WeakPolarHBondContact CA-O 3.44Å; G264-I273 PolarHBondContact N-O 3.24Å; A265-I273 HydrophobicContact CB-CG1 4.43Å; A265-I273 WeakPolarHBondContact O-CG1 3.23Å; A265-I273 PolarHBondContact O-N 2.88Å; I267-I273 HydrophobicContact CB-CG2 4.14Å; I267-I273 HydrophobicContact CD1-CD1 3.96Å; I267-I273 HydrophobicContact CD1-CG2 3.82Å; I267-I273 HydrophobicContact CG1-CD1 4.28Å; I267-I273 HydrophobicContact CG1-CG2 3.87Å; I273-V275 HydrophobicContact CB-CG2 4.49Å; I273-V275 HydrophobicContact CD1-CG2 3.51Å; I273-V275 HydrophobicContact CG1-CG2 3.78Å
274R90.6Very high83.3Confident26 Ų2650.8 Ų50.810%0.09829%0.288CS..EExtended strand (participates in β ladder)trans-98130.6164.2178.1175.3160114.613108.5V189 G190 N263 D276 A315V189-R274 CarbonylContact C-O 3.46Å; V189-R274 WeakPolarHBondContact CA-O 3.38Å; G190-R274 PolarHBondContact N-O 3.48Å; G190-R274 PolarHBondContact O-N 3.17Å; N263-R274 WeakPolarHBondContact OD1-CA 3.27Å; R274-D276 IonicContact CZ-OD1 3.58Å; R274-D276 IonicContact CZ-OD2 3.19Å; R274-D276 IonicContact NE-OD1 3.85Å; R274-D276 PolarHBondContact NE-OD1 3.13Å; R274-D276 IonicContact NE-OD2 2.98Å; R274-D276 PolarHBondContact NE-OD2 2.89Å; R274-D276 IonicContact NH2-OD1 3.15Å; R274-D276 PolarHBondContact NH2-OD1 2.77Å; R274-D276 IonicContact NH2-OD2 3.86Å; R274-D276 PolarHBondContact NH2-OD2 3.2Å; R274-A315 HydrophobicContact CB-CB 4.12Å; R274-A315 HydrophobicContact CG-CB 4.37Å
275V92Very high83Confident3 Ų352.7 Ų52.72%0.01830%0.296CS..EExtended strand (participates in β ladder)trans-125112.3-178.1-169.40000109.4V187 F188 F205 L260 N263 I273V187-V275 HydrophobicContact CG1-CG1 3.31Å; F188-V275 WeakPolarHBondContact O-CA 3.36Å; F205-V275 HydrophobicContact CE1-CG1 4.45Å; F205-V275 HydrophobicContact CZ-CG2 4.27Å; L260-V275 HydrophobicContact CD2-CG1 4.44Å; N263-V275 HydrophobicContact CB-CB 4.07Å; N263-V275 PolarHBondContact OD1-N 2.78Å; I273-V275 HydrophobicContact CB-CG2 4.49Å; I273-V275 HydrophobicContact CD1-CG2 3.51Å; I273-V275 HydrophobicContact CG1-CG2 3.78Å
276D91.3Very high82.8Confident24 Ų2459.7 Ų59.713%0.12832%0.322CS..EExtended strand (participates in β ladder)trans-125.5160178.3-48.3-44.2000109.8V187 F188 R274V187-D276 CarbonylContact C-O 3.53Å; V187-D276 WeakPolarHBondContact CA-O 3.24Å; V187-D276 WeakPolarHBondContact CG1-O 3.34Å; F188-D276 HydrophobicContact CB-CB 4.42Å; F188-D276 HydrophobicContact CD1-CB 4.29Å; F188-D276 PolarHBondContact N-O 2.74Å; F188-D276 PolarHBondContact O-N 2.81Å; R274-D276 IonicContact CZ-OD1 3.58Å; R274-D276 IonicContact CZ-OD2 3.19Å; R274-D276 IonicContact NE-OD1 3.85Å; R274-D276 PolarHBondContact NE-OD1 3.13Å; R274-D276 IonicContact NE-OD2 2.98Å; R274-D276 PolarHBondContact NE-OD2 2.89Å; R274-D276 IonicContact NH2-OD1 3.15Å; R274-D276 PolarHBondContact NH2-OD1 2.77Å; R274-D276 IonicContact NH2-OD2 3.86Å; R274-D276 PolarHBondContact NH2-OD2 3.2Å
277L91.3Very high82.9Confident46 Ų4658 Ų5824%0.24131%0.311CS..EExtended strand (participates in β ladder)trans-68151159.7-78161.1000109.5E184 A256 L260 E280E184-L277 WeakPolarHBondContact O-CD2 3.26Å; A256-L277 HydrophobicContact CB-CD2 4.11Å; L260-L277 HydrophobicContact CD1-CD1 4.14Å; L260-L277 HydrophobicContact CD1-CG 4.19Å; L260-L277 HydrophobicContact CD2-CG 4.3Å; L277-E280 HydrophobicContact CB-CB 4.03Å
278A89.3Confident83Confident27 Ų2756.9 Ų56.922%0.22331%0.305CS..SBendtrans-86.4-24.3176.100000114T186 Y247T186-A278 PolarHBondContact O-N 2.95Å; T186-A278 WeakPolarHBondContact OG1-CB 3.14Å; Y247-A278 HydrophobicContact CD1-CB 3.96Å; Y247-A278 HydrophobicContact CE1-CB 3.92Å
279S82.9Confident83.5Confident62 Ų6255.4 Ų55.443%0.43429%0.293SS..SBendtrans-70-42.4174.5-165.30000111.3T281S279-T281 PolarHBondContact O-N 3.33Å
280E75.4Confident84Confident103 Ų10350.2 Ų50.248%0.48126%0.264SS..SBendtrans-65.2115.6170.6-176.268.7-130.300110L277 S282 S283L277-E280 HydrophobicContact CB-CB 4.03Å; E280-S282 PolarHBondContact O-N 3.4Å; E280-S283 WeakPolarHBondContact OE1-CB 2.92Å; E280-S283 PolarHBondContact OE1-OG 3Å
281T66.8Low84.6Confident113 Ų11349.1 Ų49.169%0.69325%0.252SS*.  trans-77.841.1-170.748.10000114.3S279 S283S279-T281 PolarHBondContact O-N 3.33Å; T281-S283 PolarHBondContact O-N 2.82Å
282S62.3Low85Confident48 Ų4847.1 Ų47.134%0.33624%0.244SC..  trans56.142.9-17968.80000113.9E280 R284E280-S282 PolarHBondContact O-N 3.4Å; S282-R284 PolarHBondContact O-N 2.74Å
283S64.1Low85.2Confident64 Ų6449.3 Ų49.345%0.44826%0.259SS..  trans-41.8104.2171-74.70000111.4E280 T281 D285E280-S283 WeakPolarHBondContact OE1-CB 2.92Å; E280-S283 PolarHBondContact OE1-OG 3Å; T281-S283 PolarHBondContact O-N 2.82Å; S283-D285 PolarHBondContact O-N 2.84Å; S283-D285 VanDerWaalsContact O-N 3.13Å
284R70.3Confident85.4Confident77 Ų7749.4 Ų49.429%0.29126%0.259SS..  trans-63.8117.5-170-63.6-179.5-179.6-156.5-11.2111.2S282 Y332 V363 N364S282-R284 PolarHBondContact O-N 2.74Å; R284-Y332 VanDerWaalsContact NH1-CZ 3.31Å; R284-Y332 PolarHBondContact NH1-OH 3.46Å; R284-Y332 VanDerWaalsContact NH1-OH 3.11Å; R284-Y332 PolarHBondContact NH2-OH 2.56Å; R284-Y332 VanDerWaalsContact NH2-OH 3.1Å; R284-V363 PolarHBondContact NH1-O 3.28Å; R284-N364 HydrophobicContact CB-CB 4.5Å; R284-N364 VanDerWaalsContact CD-OD1 3.26Å; R284-N364 WeakPolarHBondContact CD-OD1 2.97Å; R284-N364 VanDerWaalsContact CG-OD1 3.31Å; R284-N364 WeakPolarHBondContact CG-OD1 3.28Å
285D79.4Confident85.5Confident47 Ų4748.9 Ų48.925%0.25126%0.259SS..  trans-51.9144.4176.4-64.9-104.9000112.5S283 R287 S288 L334S283-D285 PolarHBondContact O-N 2.84Å; S283-D285 VanDerWaalsContact O-N 3.13Å; D285-R287 HydrophobicContact CB-CB 4.06Å; D285-R287 PolarHBondContact O-N 3.08Å; D285-R287 VanDerWaalsContact O-N 3.09Å; D285-R287 IonicContact OD1-CZ 3.02Å; D285-R287 IonicContact OD1-NE 2.68Å; D285-R287 IonicContact OD1-NH2 2.81Å; D285-R287 PolarHBondContact OD1-NH2 3.25Å; D285-R287 VanDerWaalsContact OD1-NH2 3.15Å; D285-S288 WeakPolarHBondContact O-CB 3.33Å; D285-S288 PolarHBondContact O-N 3Å; D285-L334 HydrophobicContact CB-CD1 3.64Å; D285-L334 VanDerWaalsContact CG-CD1 3.5Å
286K85.8Confident85.4Confident175 Ų17555 Ų5576%0.76128%0.283SS*.THydrogen-bonded Turntrans-60-16.8164.6-58.4177.7-175.9172.70112.7
287R90.7Very high85.3Confident82 Ų8261.4 Ų61.431%0.30931%0.31SS..THydrogen-bonded Turntrans-86.8-4174.1-60.4-179.9-70.5175.31.9114.4D285 L334 F335 E336 T338 V341D285-R287 HydrophobicContact CB-CB 4.06Å; D285-R287 PolarHBondContact O-N 3.08Å; D285-R287 VanDerWaalsContact O-N 3.09Å; D285-R287 IonicContact OD1-CZ 3.02Å; D285-R287 IonicContact OD1-NE 2.68Å; D285-R287 IonicContact OD1-NH2 2.81Å; D285-R287 PolarHBondContact OD1-NH2 3.25Å; D285-R287 VanDerWaalsContact OD1-NH2 3.15Å; R287-L334 HydrophobicContact CB-CD1 3.93Å; R287-F335 WeakPolarHBondContact CB-O 3.45Å; R287-F335 PolarHBondContact O-N 3.15Å; R287-E336 WeakPolarHBondContact CD-O 3.25Å; R287-E336 PolarHBondContact NH1-O 3.36Å; R287-T338 HydrophobicContact CG-CG2 3.86Å; R287-V341 WeakPolarHBondContact O-CG2 3.32Å
288S91.5Very high85.2Confident5 Ų559.5 Ų59.54%0.03530%0.3CS..EExtended strand (participates in β ladder)trans-83.1141.2175.8-72.60000112D285 V333 S362D285-S288 WeakPolarHBondContact O-CB 3.33Å; D285-S288 PolarHBondContact O-N 3Å; S288-V333 CarbonylContact C-O 3.58Å; S288-V333 WeakPolarHBondContact CA-O 3.42Å; S288-S362 VanDerWaalsContact C-CB 3.47Å; S288-S362 WeakPolarHBondContact O-CB 3.28Å; S288-S362 PolarHBondContact O-N 3.02Å; S288-S362 VanDerWaalsContact O-N 3.1Å
289V94.3Very high85.3Confident0 Ų059.9 Ų59.90%030%0.303CS..EExtended strand (participates in β ladder)trans-115.7139.9173.1179.90000109.2V291 Y332 V333 F335 V341 A344 V359 M360V289-V291 HydrophobicContact CG1-CG2 4.33Å; V289-Y332 CarbonylContact O-C 3.55Å; V289-Y332 VanDerWaalsContact O-CA 3.22Å; V289-Y332 WeakPolarHBondContact O-CA 3.47Å; V289-V333 PolarHBondContact N-O 3.11Å; V289-V333 PolarHBondContact O-N 3.1Å; V289-F335 HydrophobicContact CB-CE2 4.07Å; V289-F335 HydrophobicContact CG2-CD2 3.81Å; V289-F335 HydrophobicContact CG2-CE2 3.57Å; V289-V341 HydrophobicContact CG2-CB 4.11Å; V289-V341 HydrophobicContact CG2-CG1 3.87Å; V289-V341 HydrophobicContact CG2-CG2 3.89Å; V289-A344 HydrophobicContact CG2-CB 4.3Å; V289-V359 HydrophobicContact CG1-CG1 3.31Å; V289-M360 WeakPolarHBondContact CG1-O 3.27Å
290F94.9Very high85.6Confident43 Ų4357.3 Ų57.319%0.18928%0.284CS..EExtended strand (participates in β ladder)trans-89.2130.4168.4169-93.9000109.5F330 Y332 V359 M360F290-F330 HydrophobicContact CD2-CD2 4.46Å; F290-F330 HydrophobicContact CE2-CB 3.76Å; F290-F330 AromaticContact CE2-CD2 3.7Å; F290-F330 HydrophobicContact CE2-CD2 3.7Å; F290-F330 AromaticContact CE2-CG 3.96Å; F290-F330 HydrophobicContact CE2-CG 3.96Å; F290-F330 HydrophobicContact CZ-CB 3.92Å; F290-F330 HydrophobicContact CZ-CG 4.42Å; F290-Y332 HydrophobicContact CB-CD1 4.27Å; F290-Y332 HydrophobicContact CB-CE1 4.02Å; F290-Y332 HydrophobicContact CD2-CD1 4.42Å; F290-Y332 AromaticContact CD2-CE1 3.7Å; F290-Y332 HydrophobicContact CD2-CE1 3.7Å; F290-Y332 AromaticContact CD2-CZ 3.86Å; F290-Y332 HydrophobicContact CG-CE1 4.36Å; F290-V359 WeakPolarHBondContact O-CA 3.42Å; F290-M360 HydrophobicContact CD1-CB 4.13Å; F290-M360 HydrophobicContact CD1-CG 4.39Å; F290-M360 PolarHBondContact N-O 2.9Å; F290-M360 PolarHBondContact O-N 3.17Å
291V95.3Very high86.4Confident1 Ų154 Ų541%0.00627%0.273CS..EExtended strand (participates in β ladder)trans-122.1116.9175.2-172.30000108.3V289 L294 F307 F330 G331 V333 L357V289-V291 HydrophobicContact CG1-CG2 4.33Å; V291-L294 HydrophobicContact CB-CD1 4.39Å; V291-L294 HydrophobicContact CG1-CD1 4.26Å; V291-L294 HydrophobicContact CG1-CD2 3.93Å; V291-L294 HydrophobicContact CG1-CG 4.01Å; V291-F307 HydrophobicContact CG1-CE2 4.16Å; V291-F307 HydrophobicContact CG1-CZ 4.23Å; V291-F307 HydrophobicContact CG2-CE2 3.72Å; V291-F307 HydrophobicContact CG2-CZ 3.79Å; V291-F330 CarbonylContact O-C 3.56Å; V291-F330 WeakPolarHBondContact O-CA 3.31Å; V291-F330 WeakPolarHBondContact O-CB 3.15Å; V291-G331 PolarHBondContact N-O 3.1Å; V291-G331 PolarHBondContact O-N 2.92Å; V291-V333 HydrophobicContact CG2-CG2 3.93Å; V291-L357 HydrophobicContact CG1-CB 4.4Å; V291-L357 HydrophobicContact CG1-CD1 4.16Å; V291-L357 HydrophobicContact CG1-CD2 4.32Å
292G95.1Very high87.6Confident3 Ų350.3 Ų50.33%0.03125%0.253CS..EExtended strand (participates in β ladder)trans-113.6171.8178.100000112.9L294 G329 R358G292-L294 PolarHBondContact O-N 3.14Å; G292-G329 CarbonylContact C-O 3.54Å; G292-R358 PolarHBondContact N-O 3.48Å; G292-R358 PolarHBondContact O-N 3.07Å
293N95.1Very high89.1Confident86 Ų8648 Ų4846%0.4624%0.237SC..SBendtrans59.226.3-172.5-15935000114.6G329 K356N293-G329 PolarHBondContact N-O 2.8Å; N293-K356 WeakPolarHBondContact CB-O 3.29Å; N293-K356 PolarHBondContact ND2-O 3.19Å
294L94.6Very high90.4Very high3 Ų346.1 Ų46.12%0.01622%0.222CC..  trans-63.4147.1174.2-74.8168.9000111V291 G292 Y296 V298 V303 G329 L352 L357V291-L294 HydrophobicContact CB-CD1 4.39Å; V291-L294 HydrophobicContact CG1-CD1 4.26Å; V291-L294 HydrophobicContact CG1-CD2 3.93Å; V291-L294 HydrophobicContact CG1-CG 4.01Å; G292-L294 PolarHBondContact O-N 3.14Å; L294-Y296 PolarHBondContact O-N 3.49Å; L294-V298 HydrophobicContact CB-CG1 4.18Å; L294-V298 HydrophobicContact CD2-CG1 4.32Å; L294-V303 HydrophobicContact CD1-CG2 4.46Å; L294-V303 HydrophobicContact CD2-CG1 4.5Å; L294-V303 HydrophobicContact CD2-CG2 3.73Å; L294-G329 PolarHBondContact N-O 3.17Å; L294-G329 WeakPolarHBondContact O-CA 3.45Å; L294-L352 HydrophobicContact CD2-CD2 3.93Å; L294-L357 HydrophobicContact CD2-CD2 3.66Å; L294-L357 HydrophobicContact CG-CD2 4.32Å
295P93Very high91.4Very high15 Ų1549.8 Ų49.810%0.09724%0.239CC..  trans-60135.7169.4-1727.5000111.2K297 V298 M353P295-K297 PolarHBondContact O-N 2.97Å; P295-K297 VanDerWaalsContact O-N 3.1Å; P295-V298 HydrophobicContact CB-CB 4.09Å; P295-V298 HydrophobicContact CG-CB 4.22Å; P295-V298 HydrophobicContact CG-CG2 4.49Å; P295-V298 WeakPolarHBondContact O-CB 3.47Å; P295-V298 VanDerWaalsContact O-CG1 3.26Å; P295-V298 WeakPolarHBondContact O-CG1 3.4Å; P295-V298 PolarHBondContact O-N 2.91Å; P295-M353 HydrophobicContact CB-SD 4.33Å; P295-M353 HydrophobicContact CG-CB 3.86Å; P295-M353 HydrophobicContact CG-CG 4.27Å; P295-M353 HydrophobicContact CG-SD 4.07Å
296Y90.9Very high92.1Very high130 Ų13049.4 Ų49.451%0.5124%0.236SC..THydrogen-bonded Turntrans-63.6-20.8-173-57.9-53.1000114.9L294 G327L294-Y296 PolarHBondContact O-N 3.49Å; Y296-G327 VanDerWaalsContact CD1-O 3.24Å; Y296-G327 WeakPolarHBondContact CD1-O 3.34Å; Y296-G327 PolarHBondContact O-N 3.3Å; Y296-G327 VanDerWaalsContact O-N 3.09Å
297K88.1Confident92.4Very high159 Ų15941.1 Ų41.169%0.69120%0.2SC*.THydrogen-bonded Turntrans-107.712.5176.1-61.8-160.9177.4-136.10113.8D240 P295D240-K297 IonicContact OD1-NZ 3.82Å; D240-K297 PolarHBondContact OD1-NZ 3.03Å; P295-K297 PolarHBondContact O-N 2.97Å; P295-K297 VanDerWaalsContact O-N 3.1Å
298V90.5Very high92.5Very high7 Ų741.2 Ų41.24%0.04221%0.206CC..  trans-64.2143179.778.50000111.2L294 P295 A302 V303 I318 L352 M353L294-V298 HydrophobicContact CB-CG1 4.18Å; L294-V298 HydrophobicContact CD2-CG1 4.32Å; P295-V298 HydrophobicContact CB-CB 4.09Å; P295-V298 HydrophobicContact CG-CB 4.22Å; P295-V298 HydrophobicContact CG-CG2 4.49Å; P295-V298 WeakPolarHBondContact O-CB 3.47Å; P295-V298 VanDerWaalsContact O-CG1 3.26Å; P295-V298 WeakPolarHBondContact O-CG1 3.4Å; P295-V298 PolarHBondContact O-N 2.91Å; V298-A302 HydrophobicContact CG2-CB 4.12Å; V298-V303 HydrophobicContact CG1-CG2 3.95Å; V298-V303 HydrophobicContact CG2-CG2 3.94Å; V298-I318 HydrophobicContact CG1-CD1 3.65Å; V298-L352 HydrophobicContact CG2-CD2 4.06Å; V298-M353 HydrophobicContact CB-SD 4.45Å; V298-M353 HydrophobicContact CG2-SD 4Å
299A89.8Confident92.5Very high34 Ų3447.9 Ų47.928%0.28124%0.242SC..  trans-88.3146.3173.400000110.9S301 A302 V303A299-S301 PolarHBondContact O-N 2.92Å; A299-A302 WeakPolarHBondContact O-CB 3.19Å; A299-A302 PolarHBondContact O-N 2.93Å; A299-V303 PolarHBondContact O-N 3.19Å
300E90.9Very high92.4Very high8 Ų848.3 Ų48.34%0.03724%0.244CC..Hα-helixtrans-53.7-40.6177.2-72.173.4-17300111.7N243 A302 V303 E304 V316 I318 R320N243-E300 PolarHBondContact ND2-OE1 3.45Å; E300-A302 VanDerWaalsContact C-N 3.32Å; E300-A302 PolarHBondContact O-N 3.07Å; E300-V303 PolarHBondContact O-N 3.44Å; E300-E304 PolarHBondContact O-N 3.13Å; E300-V316 HydrophobicContact CB-CB 4.38Å; E300-V316 HydrophobicContact CB-CG1 4.15Å; E300-V316 HydrophobicContact CG-CG1 4.3Å; E300-I318 HydrophobicContact CB-CD1 4.44Å; E300-I318 HydrophobicContact CG-CB 4.43Å; E300-I318 HydrophobicContact CG-CD1 3.83Å; E300-I318 HydrophobicContact CG-CG1 4.01Å; E300-R320 VanDerWaalsContact CD-NH2 3.29Å; E300-R320 IonicContact OE1-CZ 2.71Å; E300-R320 IonicContact OE1-NE 2.64Å; E300-R320 PolarHBondContact OE1-NE 3.39Å; E300-R320 IonicContact OE1-NH2 2.84Å; E300-R320 PolarHBondContact OE1-NH2 2.9Å; E300-R320 IonicContact OE2-CZ 3.6Å; E300-R320 IonicContact OE2-NH2 2.74Å; E300-R320 PolarHBondContact OE2-NH2 3.34Å
301S90.8Very high92.2Very high35 Ų3547.5 Ų47.525%0.24525%0.249CC..Hα-helixtrans-69.9-21.4178.1-6.20000114.3G270 A299 K305G270-S301 WeakPolarHBondContact O-CB 3.49Å; G270-S301 PolarHBondContact O-OG 3.31Å; A299-S301 PolarHBondContact O-N 2.92Å; S301-K305 WeakPolarHBondContact O-CG 3.2Å; S301-K305 PolarHBondContact O-N 2.83Å
302A92.1Very high92.1Very high34 Ų3449.8 Ų49.828%0.28126%0.264SS..Hα-helixtrans-80-36.917400000111.1V298 A299 E300 E304 H306V298-A302 HydrophobicContact CG2-CB 4.12Å; A299-A302 WeakPolarHBondContact O-CB 3.19Å; A299-A302 PolarHBondContact O-N 2.93Å; E300-A302 VanDerWaalsContact C-N 3.32Å; E300-A302 PolarHBondContact O-N 3.07Å; A302-E304 VanDerWaalsContact C-N 3.34Å; A302-H306 PolarHBondContact O-N 2.92Å
303V93.1Very high92Very high1 Ų149.7 Ų49.71%0.00626%0.263CS..Hα-helixtrans-65.1-41.3169.8-178.10000110.3L294 V298 A299 E300 H306 F307 V316 I318 V333 L352L294-V303 HydrophobicContact CD1-CG2 4.46Å; L294-V303 HydrophobicContact CD2-CG1 4.5Å; L294-V303 HydrophobicContact CD2-CG2 3.73Å; V298-V303 HydrophobicContact CG1-CG2 3.95Å; V298-V303 HydrophobicContact CG2-CG2 3.94Å; A299-V303 PolarHBondContact O-N 3.19Å; E300-V303 PolarHBondContact O-N 3.44Å; V303-H306 PolarHBondContact O-N 2.73Å; V303-F307 HydrophobicContact CG1-CD2 3.99Å; V303-F307 HydrophobicContact CG1-CE2 4.01Å; V303-F307 VanDerWaalsContact O-CD2 3.28Å; V303-F307 WeakPolarHBondContact O-CD2 3.41Å; V303-F307 PolarHBondContact O-N 2.98Å; V303-V316 HydrophobicContact CB-CG1 4.27Å; V303-V316 HydrophobicContact CG1-CG1 4.25Å; V303-I318 HydrophobicContact CG2-CD1 4.18Å; V303-V333 HydrophobicContact CG1-CG2 3.99Å; V303-L352 HydrophobicContact CG2-CD2 4.25Å
304E92Very high91.8Very high24 Ų2447.5 Ų47.511%0.11225%0.251CS..Hα-helixtrans-56.3-54175.8-172-178.4162.600112R272 E300 A302 H306 F307 L308 V313 V316R272-E304 WeakPolarHBondContact CD-OE1 3.37Å; R272-E304 VanDerWaalsContact CD-OE2 3.26Å; R272-E304 WeakPolarHBondContact CD-OE2 3.46Å; R272-E304 IonicContact CZ-OE1 2.73Å; R272-E304 IonicContact NE-OE1 3.32Å; R272-E304 IonicContact NH1-OE1 2.8Å; R272-E304 PolarHBondContact NH1-OE1 2.84Å; E300-E304 PolarHBondContact O-N 3.13Å; A302-E304 VanDerWaalsContact C-N 3.34Å; E304-H306 VanDerWaalsContact C-N 3.28Å; E304-H306 PolarHBondContact O-N 2.8Å; E304-F307 PolarHBondContact O-N 3.36Å; E304-L308 HydrophobicContact CG-CD2 4.41Å; E304-L308 PolarHBondContact O-N 2.83Å; E304-L308 VanDerWaalsContact O-N 3.14Å; E304-V313 HydrophobicContact CG-CB 4.31Å; E304-V313 HydrophobicContact CG-CG1 4.27Å; E304-V316 HydrophobicContact CB-CG2 4.06Å
305K92.3Very high91.5Very high153 Ų15347.6 Ų47.667%0.66525%0.252SS*.Hα-helixtrans-52.8-43.7178.6-76.8-179.8178-1670112.8S301 F307 L308S301-K305 WeakPolarHBondContact O-CG 3.2Å; S301-K305 PolarHBondContact O-N 2.83Å; K305-F307 PolarHBondContact O-N 2.93Å; K305-L308 HydrophobicContact CG-CD1 4.45Å; K305-L308 PolarHBondContact O-N 3.41Å
306H92.9Very high91.5Very high39 Ų3947.1 Ų47.118%0.18125%0.249CC..Hα-helixtrans-63.6-17.8178.6-165.193.8000114.3A302 V303 E304 S350 E351 L352A302-H306 PolarHBondContact O-N 2.92Å; V303-H306 PolarHBondContact O-N 2.73Å; E304-H306 VanDerWaalsContact C-N 3.28Å; E304-H306 PolarHBondContact O-N 2.8Å; H306-S350 PolarHBondContact NE2-OG 3.19Å; H306-E351 PolarHBondContact CE1-O 2.79Å; H306-L352 HydrophobicContact CB-CD1 4.2Å
307F93.4Very high91.5Very high1 Ų145.9 Ų45.90%0.00424%0.243CC..Hα-helixtrans-112.3-1179.6-74.2-66.6000114.1V291 V303 E304 K305 D309 C310 V313 V333 F335 A344 L347 L357 V359V291-F307 HydrophobicContact CG1-CE2 4.16Å; V291-F307 HydrophobicContact CG1-CZ 4.23Å; V291-F307 HydrophobicContact CG2-CE2 3.72Å; V291-F307 HydrophobicContact CG2-CZ 3.79Å; V303-F307 HydrophobicContact CG1-CD2 3.99Å; V303-F307 HydrophobicContact CG1-CE2 4.01Å; V303-F307 VanDerWaalsContact O-CD2 3.28Å; V303-F307 WeakPolarHBondContact O-CD2 3.41Å; V303-F307 PolarHBondContact O-N 2.98Å; E304-F307 PolarHBondContact O-N 3.36Å; K305-F307 PolarHBondContact O-N 2.93Å; F307-D309 PolarHBondContact O-N 2.77Å; F307-C310 WeakPolarHBondContact O-CB 3.48Å; F307-C310 PolarHBondContact O-N 3.25Å; F307-C310 VanDerWaalsContact O-N 3.1Å; F307-V313 HydrophobicContact CB-CG2 4.07Å; F307-V333 HydrophobicContact CD2-CG2 4.04Å; F307-V333 HydrophobicContact CE2-CG2 4.32Å; F307-F335 HydrophobicContact CB-CE1 4.1Å; F307-F335 HydrophobicContact CB-CZ 3.86Å; F307-F335 HydrophobicContact CD1-CZ 4.07Å; F307-F335 HydrophobicContact CG-CZ 4.11Å; F307-A344 HydrophobicContact CD1-CB 4.04Å; F307-A344 HydrophobicContact CE1-CB 4.1Å; F307-L347 HydrophobicContact CD1-CD1 4.43Å; F307-L357 HydrophobicContact CE2-CD1 4.41Å; F307-L357 HydrophobicContact CZ-CD1 4.3Å; F307-V359 HydrophobicContact CE1-CG2 4.27Å; F307-V359 HydrophobicContact CZ-CG2 3.97Å
308L92Very high91.7Very high85 Ų8539.1 Ų39.145%0.44521%0.214SC..Hα-helixtrans-60-35.6173.8-68.6178.5000111.9E304 K305 C310 G311E304-L308 HydrophobicContact CG-CD2 4.41Å; E304-L308 PolarHBondContact O-N 2.83Å; E304-L308 VanDerWaalsContact O-N 3.14Å; K305-L308 HydrophobicContact CG-CD1 4.45Å; K305-L308 PolarHBondContact O-N 3.41Å; L308-C310 PolarHBondContact O-N 3.29Å; L308-C310 VanDerWaalsContact O-N 3.15Å; L308-G311 WeakPolarHBondContact O-CA 3.29Å; L308-G311 PolarHBondContact O-N 2.92Å
309D91.1Very high91.7Very high145 Ų14540.2 Ų40.278%0.77522%0.221SC*.THydrogen-bonded Turntrans-64.3-17.6178.1-53.5-17.2000112.9F307F307-D309 PolarHBondContact O-N 2.77Å
310C91.7Very high91.7Very high8 Ų841 Ų415%0.05422%0.217CC..THydrogen-bonded Turntrans-91.1-4.4171.9-680000113.2F307 L308 F335 S340 L343 A344 L347F307-C310 WeakPolarHBondContact O-CB 3.48Å; F307-C310 PolarHBondContact O-N 3.25Å; F307-C310 VanDerWaalsContact O-N 3.1Å; L308-C310 PolarHBondContact O-N 3.29Å; L308-C310 VanDerWaalsContact O-N 3.15Å; C310-F335 HydrophobicContact CB-CE1 4.19Å; C310-F335 HydrophobicContact CB-CZ 4.46Å; C310-S340 VanDerWaalsContact O-CA 3.25Å; C310-S340 WeakPolarHBondContact O-CA 3.28Å; C310-S340 WeakPolarHBondContact O-CB 3.17Å; C310-S340 PolarHBondContact O-OG 2.89Å; C310-L343 HydrophobicContact CB-CB 3.95Å; C310-L343 VanDerWaalsContact SG-C 3.57Å; C310-A344 HydrophobicContact CB-CB 4.34Å; C310-A344 VanDerWaalsContact SG-CA 3.57Å; C310-A344 PolarHBondContact SG-N 3.14Å; C310-L347 WeakPolarHBondContact SG-CD1 3.35Å
311G92.4Very high91.6Very high27 Ų2742.7 Ų42.728%0.27823%0.226SC..SBendtrans111.4-175-179.400000114.2L308 V313L308-G311 WeakPolarHBondContact O-CA 3.29Å; L308-G311 PolarHBondContact O-N 2.92Å; G311-V313 PolarHBondContact O-N 3.18Å
312S92.9Very high91.2Very high48 Ų4847.9 Ų47.934%0.33625%0.246SC..  trans-58.7110.2-171.4-177.30000113.1F335 E336S312-F335 WeakPolarHBondContact O-CA 3.41Å; S312-E336 WeakPolarHBondContact CB-OE2 3.38Å; S312-E336 PolarHBondContact O-N 3.1Å; S312-E336 PolarHBondContact OG-OE2 2.84Å
313V92.5Very high90.7Very high1 Ų150.6 Ų50.61%0.00626%0.259CS..EExtended strand (participates in β ladder)trans-76.4133163.1177.10000107.8R272 E304 F307 G311 V316 V333 F335R272-V313 PolarHBondContact NH1-O 2.95Å; R272-V313 PolarHBondContact NH2-O 3.43Å; E304-V313 HydrophobicContact CG-CB 4.31Å; E304-V313 HydrophobicContact CG-CG1 4.27Å; F307-V313 HydrophobicContact CB-CG2 4.07Å; G311-V313 PolarHBondContact O-N 3.18Å; V313-V316 HydrophobicContact CG1-CG2 3.87Å; V313-V333 HydrophobicContact CB-CG1 4.48Å; V313-V333 HydrophobicContact CG1-CG1 3.81Å; V313-V333 HydrophobicContact CG2-CG1 3.9Å; V313-F335 HydrophobicContact CG2-CD1 4.02Å; V313-F335 HydrophobicContact CG2-CE1 3.69Å; V313-F335 HydrophobicContact CG2-CZ 4.39Å
314M90.6Very high90.2Very high41 Ų4153.5 Ų53.520%0.20228%0.277CS..EExtended strand (participates in β ladder)trans-88-53.9166.2-59.1-161.785.300110.9G264 R272 L334 E336G264-M314 WeakPolarHBondContact CA-O 3.47Å; R272-M314 PolarHBondContact NH2-O 3.37Å; M314-L334 HydrophobicContact CB-CD2 4.34Å; M314-L334 HydrophobicContact CB-CG 4.3Å; M314-L334 PolarHBondContact N-O 3.26Å; M314-E336 HydrophobicContact CG-CB 3.84Å; M314-E336 HydrophobicContact CG-CG 4.42Å; M314-E336 HydrophobicContact SD-CB 4.32Å; M314-E336 HydrophobicContact SD-CG 4.39Å
315A89.2Confident89.6Confident4 Ų452.4 Ų52.43%0.03327%0.272CS..EExtended strand (participates in β ladder)trans-147.1141.2-172.800000113.6R274 L334R274-A315 HydrophobicContact CB-CB 4.12Å; R274-A315 HydrophobicContact CG-CB 4.37Å; A315-L334 HydrophobicContact CB-CB 4.45Å; A315-L334 PolarHBondContact N-O 2.58Å; A315-L334 PolarHBondContact O-N 3.18Å
316V91.9Very high89.3Confident6 Ų648.6 Ų48.64%0.03626%0.258CS..EExtended strand (participates in β ladder)trans-110.9135174.9-179.40000110.1E300 V303 E304 V313 I318 V333E300-V316 HydrophobicContact CB-CB 4.38Å; E300-V316 HydrophobicContact CB-CG1 4.15Å; E300-V316 HydrophobicContact CG-CG1 4.3Å; V303-V316 HydrophobicContact CB-CG1 4.27Å; V303-V316 HydrophobicContact CG1-CG1 4.25Å; E304-V316 HydrophobicContact CB-CG2 4.06Å; V313-V316 HydrophobicContact CG1-CG2 3.87Å; V316-I318 HydrophobicContact CG1-CG1 4.41Å; V316-V333 HydrophobicContact CG2-CG2 4.45Å
317R90.9Very high89.1Confident104 Ų10447 Ų4739%0.39225%0.253SS..EExtended strand (participates in β ladder)trans-131.893.3177.2178.5-175.2152.5162.9-5.2110.2G331 Y332R317-G331 CarbonylContact O-C 3.58Å; R317-G331 WeakPolarHBondContact O-CA 2.74Å; R317-Y332 PolarHBondContact N-O 3.47Å; R317-Y332 PolarHBondContact O-N 2.8Å
318I92.2Very high89Confident17 Ų1751.9 Ų51.99%0.08727%0.274CS..EExtended strand (participates in β ladder)trans-71.7136167.4-62.9174.2000108.7V298 E300 V303 V316 R320V298-I318 HydrophobicContact CG1-CD1 3.65Å; E300-I318 HydrophobicContact CB-CD1 4.44Å; E300-I318 HydrophobicContact CG-CB 4.43Å; E300-I318 HydrophobicContact CG-CD1 3.83Å; E300-I318 HydrophobicContact CG-CG1 4.01Å; V303-I318 HydrophobicContact CG2-CD1 4.18Å; V316-I318 HydrophobicContact CG1-CG1 4.41Å; I318-R320 HydrophobicContact CG2-CG 4.23Å; I318-R320 PolarHBondContact O-N 2.81Å
319V91Very high89Confident29 Ų2948.3 Ų48.318%0.17626%0.258CS..EExtended strand (participates in β ladder)trans-87.9108174178.70000108.6K328 F330 Y332V319-K328 HydrophobicContact CG1-CD 4.3Å; V319-K328 HydrophobicContact CG1-CG 4.47Å; V319-K328 WeakPolarHBondContact O-CB 3.49Å; V319-K328 PolarHBondContact O-N 2.83Å; V319-F330 HydrophobicContact CB-CD2 4.05Å; V319-F330 HydrophobicContact CB-CE2 3.63Å; V319-F330 HydrophobicContact CB-CZ 3.89Å; V319-F330 HydrophobicContact CG1-CE1 4.46Å; V319-F330 HydrophobicContact CG1-CE2 3.95Å; V319-F330 HydrophobicContact CG1-CZ 3.75Å; V319-F330 HydrophobicContact CG2-CD2 4.01Å; V319-F330 HydrophobicContact CG2-CE2 3.55Å; V319-F330 HydrophobicContact CG2-CZ 4.24Å; V319-F330 PolarHBondContact N-O 2.8Å; V319-Y332 HydrophobicContact CG2-CD2 4.26Å; V319-Y332 HydrophobicContact CG2-CE2 3.97Å
320R89.8Confident89.2Confident52 Ų5244.4 Ų44.420%0.19623%0.234CC..EExtended strand (participates in β ladder)trans-95.8161.9175.9-63.5170.7-179.9-114.39.3111D240 N243 E300 I318 I326D240-R320 PolarHBondContact O-NH1 3.25Å; N243-R320 WeakPolarHBondContact OD1-CD 3.46Å; N243-R320 PolarHBondContact OD1-NE 2.9Å; N243-R320 VanDerWaalsContact OD1-NE 3.13Å; E300-R320 VanDerWaalsContact CD-NH2 3.29Å; E300-R320 IonicContact OE1-CZ 2.71Å; E300-R320 IonicContact OE1-NE 2.64Å; E300-R320 PolarHBondContact OE1-NE 3.39Å; E300-R320 IonicContact OE1-NH2 2.84Å; E300-R320 PolarHBondContact OE1-NH2 2.9Å; E300-R320 IonicContact OE2-CZ 3.6Å; E300-R320 IonicContact OE2-NH2 2.74Å; E300-R320 PolarHBondContact OE2-NH2 3.34Å; I318-R320 HydrophobicContact CG2-CG 4.23Å; I318-R320 PolarHBondContact O-N 2.81Å; R320-I326 CarbonylContact C-O 3.53Å; R320-I326 WeakPolarHBondContact CA-O 3.26Å
321D88.5Confident89.3Confident42 Ų4244.1 Ų44.123%0.22523%0.232CC..  trans-77.5150.5169.3-170.860.6000112.7V323 T324 G325 I326 K328D321-V323 PolarHBondContact OD2-N 2.84Å; D321-T324 WeakPolarHBondContact CB-OG1 3.22Å; D321-T324 PolarHBondContact OD2-N 3.34Å; D321-G325 WeakPolarHBondContact O-CA 3.47Å; D321-G325 PolarHBondContact O-N 2.82Å; D321-I326 PolarHBondContact N-O 2.97Å; D321-K328 VanDerWaalsContact CA-CE 3.44Å; D321-K328 VanDerWaalsContact OD1-CE 3.27Å; D321-K328 WeakPolarHBondContact OD1-CE 3.38Å; D321-K328 IonicContact OD1-NZ 3.74Å; D321-K328 PolarHBondContact OD1-NZ 3.28Å
322Q82.9Confident89.4Confident144 Ų14444.4 Ų44.467%0.67323%0.225SC*.THydrogen-bonded Turntrans-88.8-11-175.7-69-171.669.100114.3
323V81.9Confident89.4Confident92 Ų9242.1 Ų42.156%0.55821%0.209SC*.THydrogen-bonded Turntrans-104.5-55.9175.5-174.90000109.2I220 D321I220-V323 WeakPolarHBondContact CG2-O 3.24Å; D321-V323 PolarHBondContact OD2-N 2.84Å
324T81.9Confident89.4Confident61 Ų6142.3 Ų42.337%0.37421%0.21SC..THydrogen-bonded Turntrans-85.9-16.7-17562.60000114.5D321 I326D321-T324 WeakPolarHBondContact CB-OG1 3.22Å; D321-T324 PolarHBondContact OD2-N 3.34Å; T324-I326 PolarHBondContact O-N 2.78Å; T324-I326 VanDerWaalsContact O-N 3.07Å
325G79.9Confident89.5Confident2 Ų240.4 Ų40.42%0.02120%0.201CC..  trans71.5-6.8-176.100000115.5D321D321-G325 WeakPolarHBondContact O-CA 3.47Å; D321-G325 PolarHBondContact O-N 2.82Å
326I85.9Confident89.6Confident72 Ų7244.4 Ų44.437%0.36922%0.219SC..  trans-69.3144-179.7-60172.5000109.9R320 D321 T324R320-I326 CarbonylContact C-O 3.53Å; R320-I326 WeakPolarHBondContact CA-O 3.26Å; D321-I326 PolarHBondContact N-O 2.97Å; T324-I326 PolarHBondContact O-N 2.78Å; T324-I326 VanDerWaalsContact O-N 3.07Å
327G87.9Confident89.7Confident7 Ų748.4 Ų48.47%0.07224%0.24CC..EExtended strand (participates in β ladder)trans-64.2137.5175.100000111.9Y296 G329Y296-G327 VanDerWaalsContact CD1-O 3.24Å; Y296-G327 WeakPolarHBondContact CD1-O 3.34Å; Y296-G327 PolarHBondContact O-N 3.3Å; Y296-G327 VanDerWaalsContact O-N 3.09Å; G327-G329 PolarHBondContact O-N 2.89Å; G327-G329 VanDerWaalsContact O-N 3.14Å
328K92Very high89.8Confident102 Ų10246.4 Ų46.444%0.44324%0.239SC..EExtended strand (participates in β ladder)trans-78.814.1176.8-57.3-159.8-178.2-133.70113.8V319 D321 F330V319-K328 HydrophobicContact CG1-CD 4.3Å; V319-K328 HydrophobicContact CG1-CG 4.47Å; V319-K328 WeakPolarHBondContact O-CB 3.49Å; V319-K328 PolarHBondContact O-N 2.83Å; D321-K328 VanDerWaalsContact CA-CE 3.44Å; D321-K328 VanDerWaalsContact OD1-CE 3.27Å; D321-K328 WeakPolarHBondContact OD1-CE 3.38Å; D321-K328 IonicContact OD1-NZ 3.74Å; D321-K328 PolarHBondContact OD1-NZ 3.28Å; K328-F330 VanDerWaalsContact C-N 3.28Å; K328-F330 HydrophobicContact CB-CD1 3.97Å; K328-F330 HydrophobicContact CB-CE1 3.69Å; K328-F330 WeakPolarHBondContact O-CD1 3.08Å; K328-F330 PolarHBondContact O-N 3Å
329G92.8Very high89.8Confident10 Ų1050.4 Ų50.410%0.10326%0.261CS..EExtended strand (participates in β ladder)trans71.816-177.600000114.8G292 N293 L294 G327G292-G329 CarbonylContact C-O 3.54Å; N293-G329 PolarHBondContact N-O 2.8Å; L294-G329 PolarHBondContact N-O 3.17Å; L294-G329 WeakPolarHBondContact O-CA 3.45Å; G327-G329 PolarHBondContact O-N 2.89Å; G327-G329 VanDerWaalsContact O-N 3.14Å
330F94.6Very high90Very high63 Ų6349.4 Ų49.428%0.27626%0.256SS..EExtended strand (participates in β ladder)trans-149.2160.4172.971.2-89.6000112.9F290 V291 V319 K328 Y332F290-F330 HydrophobicContact CD2-CD2 4.46Å; F290-F330 HydrophobicContact CE2-CB 3.76Å; F290-F330 AromaticContact CE2-CD2 3.7Å; F290-F330 HydrophobicContact CE2-CD2 3.7Å; F290-F330 AromaticContact CE2-CG 3.96Å; F290-F330 HydrophobicContact CE2-CG 3.96Å; F290-F330 HydrophobicContact CZ-CB 3.92Å; F290-F330 HydrophobicContact CZ-CG 4.42Å; V291-F330 CarbonylContact O-C 3.56Å; V291-F330 WeakPolarHBondContact O-CA 3.31Å; V291-F330 WeakPolarHBondContact O-CB 3.15Å; V319-F330 HydrophobicContact CB-CD2 4.05Å; V319-F330 HydrophobicContact CB-CE2 3.63Å; V319-F330 HydrophobicContact CB-CZ 3.89Å; V319-F330 HydrophobicContact CG1-CE1 4.46Å; V319-F330 HydrophobicContact CG1-CE2 3.95Å; V319-F330 HydrophobicContact CG1-CZ 3.75Å; V319-F330 HydrophobicContact CG2-CD2 4.01Å; V319-F330 HydrophobicContact CG2-CE2 3.55Å; V319-F330 HydrophobicContact CG2-CZ 4.24Å; V319-F330 PolarHBondContact N-O 2.8Å; K328-F330 VanDerWaalsContact C-N 3.28Å; K328-F330 HydrophobicContact CB-CD1 3.97Å; K328-F330 HydrophobicContact CB-CE1 3.69Å; K328-F330 WeakPolarHBondContact O-CD1 3.08Å; K328-F330 PolarHBondContact O-N 3Å; F330-Y332 HydrophobicContact CD2-CE2 4.33Å; F330-Y332 HydrophobicContact CE2-CE2 4.27Å
331G93.7Very high90.2Very high2 Ų247 Ų472%0.02125%0.246CC..EExtended strand (participates in β ladder)trans-158.4-174.4-18000000112.6V291 R317V291-G331 PolarHBondContact N-O 3.1Å; V291-G331 PolarHBondContact O-N 2.92Å; R317-G331 CarbonylContact O-C 3.58Å; R317-G331 WeakPolarHBondContact O-CA 2.74Å
332Y93.6Very high90.5Very high33 Ų3349.1 Ų49.113%0.12926%0.255CS..EExtended strand (participates in β ladder)trans-130.6137.8175.9-59.5-85.3000109.9R284 V289 F290 R317 V319 F330R284-Y332 VanDerWaalsContact NH1-CZ 3.31Å; R284-Y332 PolarHBondContact NH1-OH 3.46Å; R284-Y332 VanDerWaalsContact NH1-OH 3.11Å; R284-Y332 PolarHBondContact NH2-OH 2.56Å; R284-Y332 VanDerWaalsContact NH2-OH 3.1Å; V289-Y332 CarbonylContact O-C 3.55Å; V289-Y332 VanDerWaalsContact O-CA 3.22Å; V289-Y332 WeakPolarHBondContact O-CA 3.47Å; F290-Y332 HydrophobicContact CB-CD1 4.27Å; F290-Y332 HydrophobicContact CB-CE1 4.02Å; F290-Y332 HydrophobicContact CD2-CD1 4.42Å; F290-Y332 AromaticContact CD2-CE1 3.7Å; F290-Y332 HydrophobicContact CD2-CE1 3.7Å; F290-Y332 AromaticContact CD2-CZ 3.86Å; F290-Y332 HydrophobicContact CG-CE1 4.36Å; R317-Y332 PolarHBondContact N-O 3.47Å; R317-Y332 PolarHBondContact O-N 2.8Å; V319-Y332 HydrophobicContact CG2-CD2 4.26Å; V319-Y332 HydrophobicContact CG2-CE2 3.97Å; F330-Y332 HydrophobicContact CD2-CE2 4.33Å; F330-Y332 HydrophobicContact CE2-CE2 4.27Å
333V93.3Very high91Very high1 Ų145.8 Ų45.81%0.00624%0.241CC..EExtended strand (participates in β ladder)trans-114.5124.6173.4-178.60000107.3S288 V289 V291 V303 F307 V313 V316 F335S288-V333 CarbonylContact C-O 3.58Å; S288-V333 WeakPolarHBondContact CA-O 3.42Å; V289-V333 PolarHBondContact N-O 3.11Å; V289-V333 PolarHBondContact O-N 3.1Å; V291-V333 HydrophobicContact CG2-CG2 3.93Å; V303-V333 HydrophobicContact CG1-CG2 3.99Å; F307-V333 HydrophobicContact CD2-CG2 4.04Å; F307-V333 HydrophobicContact CE2-CG2 4.32Å; V313-V333 HydrophobicContact CB-CG1 4.48Å; V313-V333 HydrophobicContact CG1-CG1 3.81Å; V313-V333 HydrophobicContact CG2-CG1 3.9Å; V316-V333 HydrophobicContact CG2-CG2 4.45Å; V333-F335 HydrophobicContact CB-CE2 4.17Å; V333-F335 HydrophobicContact CG1-CD2 4.19Å; V333-F335 HydrophobicContact CG1-CE1 4.33Å; V333-F335 HydrophobicContact CG1-CE2 3.7Å; V333-F335 HydrophobicContact CG1-CZ 3.8Å
334L92.1Very high91.6Very high5 Ų541.4 Ų41.43%0.02622%0.215CC..EExtended strand (participates in β ladder)trans-97.4117.1172.9174.263.2000108.4D285 R287 M314 A315D285-L334 HydrophobicContact CB-CD1 3.64Å; D285-L334 VanDerWaalsContact CG-CD1 3.5Å; R287-L334 HydrophobicContact CB-CD1 3.93Å; M314-L334 HydrophobicContact CB-CD2 4.34Å; M314-L334 HydrophobicContact CB-CG 4.3Å; M314-L334 PolarHBondContact N-O 3.26Å; A315-L334 HydrophobicContact CB-CB 4.45Å; A315-L334 PolarHBondContact N-O 2.58Å; A315-L334 PolarHBondContact O-N 3.18Å
335F93.6Very high92.2Very high0 Ų041.2 Ų41.20%021%0.211CC..EExtended strand (participates in β ladder)trans-89.4157.9171.4-66.9-86.2000111.4R287 V289 F307 C310 S312 V313 V333 S340 V341 A344R287-F335 WeakPolarHBondContact CB-O 3.45Å; R287-F335 PolarHBondContact O-N 3.15Å; V289-F335 HydrophobicContact CB-CE2 4.07Å; V289-F335 HydrophobicContact CG2-CD2 3.81Å; V289-F335 HydrophobicContact CG2-CE2 3.57Å; F307-F335 HydrophobicContact CB-CE1 4.1Å; F307-F335 HydrophobicContact CB-CZ 3.86Å; F307-F335 HydrophobicContact CD1-CZ 4.07Å; F307-F335 HydrophobicContact CG-CZ 4.11Å; C310-F335 HydrophobicContact CB-CE1 4.19Å; C310-F335 HydrophobicContact CB-CZ 4.46Å; S312-F335 WeakPolarHBondContact O-CA 3.41Å; V313-F335 HydrophobicContact CG2-CD1 4.02Å; V313-F335 HydrophobicContact CG2-CE1 3.69Å; V313-F335 HydrophobicContact CG2-CZ 4.39Å; V333-F335 HydrophobicContact CB-CE2 4.17Å; V333-F335 HydrophobicContact CG1-CD2 4.19Å; V333-F335 HydrophobicContact CG1-CE1 4.33Å; V333-F335 HydrophobicContact CG1-CE2 3.7Å; V333-F335 HydrophobicContact CG1-CZ 3.8Å; F335-S340 VanDerWaalsContact CD1-CB 3.48Å; F335-V341 HydrophobicContact CD2-CG2 4.26Å; F335-A344 HydrophobicContact CE2-CB 3.83Å; F335-A344 HydrophobicContact CZ-CB 3.76Å
336E91.9Very high92.9Very high89 Ų8949 Ų4942%0.41624%0.244SC..SBendtrans-70.1-42173.4-172165-166.700111.4R287 S312 M314R287-E336 WeakPolarHBondContact CD-O 3.25Å; R287-E336 PolarHBondContact NH1-O 3.36Å; S312-E336 WeakPolarHBondContact CB-OE2 3.38Å; S312-E336 PolarHBondContact O-N 3.1Å; S312-E336 PolarHBondContact OG-OE2 2.84Å; M314-E336 HydrophobicContact CG-CB 3.84Å; M314-E336 HydrophobicContact CG-CG 4.42Å; M314-E336 HydrophobicContact SD-CB 4.32Å; M314-E336 HydrophobicContact SD-CG 4.39Å
337N93.2Very high93.1Very high90 Ų9048.2 Ų48.248%0.48124%0.241SC..SBendtrans-108.5155.9-177.1-67.9-25000113D339N337-D339 VanDerWaalsContact C-N 3.3Å
338T92.3Very high93.3Very high61 Ų6150.8 Ų50.837%0.37425%0.253SS..SBendtrans-74.5-18174.138.40000113.9R287 V341 H342R287-T338 HydrophobicContact CG-CG2 3.86Å; T338-V341 WeakPolarHBondContact O-CB 3.24Å; T338-V341 PolarHBondContact O-N 2.64Å; T338-H342 PolarHBondContact O-ND1 3.06Å
339D93.7Very high93.4Very high101 Ų10150.8 Ų50.854%0.5426%0.257SS..Hα-helixtrans-88.7-32.6-171.9-45.5-59.7000110.5N337 V341 H342 L343N337-D339 VanDerWaalsContact C-N 3.3Å; D339-V341 PolarHBondContact O-N 3.47Å; D339-H342 WeakPolarHBondContact O-CA 3.32Å; D339-H342 WeakPolarHBondContact O-CB 3.41Å; D339-H342 PolarHBondContact O-N 3.17Å; D339-L343 PolarHBondContact O-N 3.15Å
340S94.7Very high93.4Very high9 Ų951.6 Ų51.66%0.06326%0.262CS..Hα-helixtrans-55.1-29.7164-60.50000113.4C310 F335 L343 A344C310-S340 VanDerWaalsContact O-CA 3.25Å; C310-S340 WeakPolarHBondContact O-CA 3.28Å; C310-S340 WeakPolarHBondContact O-CB 3.17Å; C310-S340 PolarHBondContact O-OG 2.89Å; F335-S340 VanDerWaalsContact CD1-CB 3.48Å; S340-L343 PolarHBondContact O-N 3.45Å; S340-A344 VanDerWaalsContact O-CB 3.24Å; S340-A344 WeakPolarHBondContact O-CB 3.49Å; S340-A344 PolarHBondContact O-N 3.16Å
341V94Very high93.3Very high0 Ų054.2 Ų54.20%028%0.275CS..Hα-helixtrans-64.5-41.9170.31720000111.4R287 V289 F335 T338 D339 A344 L345 R361R287-V341 WeakPolarHBondContact O-CG2 3.32Å; V289-V341 HydrophobicContact CG2-CB 4.11Å; V289-V341 HydrophobicContact CG2-CG1 3.87Å; V289-V341 HydrophobicContact CG2-CG2 3.89Å; F335-V341 HydrophobicContact CD2-CG2 4.26Å; T338-V341 WeakPolarHBondContact O-CB 3.24Å; T338-V341 PolarHBondContact O-N 2.64Å; D339-V341 PolarHBondContact O-N 3.47Å; V341-A344 PolarHBondContact O-N 3.44Å; V341-L345 HydrophobicContact CG1-CD1 4.33Å; V341-L345 VanDerWaalsContact O-CG 3.26Å; V341-L345 WeakPolarHBondContact O-CG 3.45Å; V341-L345 PolarHBondContact O-N 3.1Å; V341-R361 HydrophobicContact CG1-CG 4.21Å
342H93.6Very high93.1Very high87 Ų8755 Ų5540%0.40328%0.278SS..Hα-helixtrans-73.1-31.1179.9-62.491.5000111.8T338 D339T338-H342 PolarHBondContact O-ND1 3.06Å; D339-H342 WeakPolarHBondContact O-CA 3.32Å; D339-H342 WeakPolarHBondContact O-CB 3.41Å; D339-H342 PolarHBondContact O-N 3.17Å
343L94.8Very high92.9Very high74 Ų7460 Ų6039%0.38730%0.304SS..Hα-helixtrans-69.3-46.6169.4-62.2-179.6000111.8C310 D339 S340 L345 K346 L347C310-L343 HydrophobicContact CB-CB 3.95Å; C310-L343 VanDerWaalsContact SG-C 3.57Å; D339-L343 PolarHBondContact O-N 3.15Å; S340-L343 PolarHBondContact O-N 3.45Å; L343-L345 PolarHBondContact O-N 3.18Å; L343-K346 HydrophobicContact CD2-CD 4.4Å; L343-K346 WeakPolarHBondContact O-CA 3Å; L343-K346 VanDerWaalsContact O-CB 3.29Å; L343-K346 WeakPolarHBondContact O-CB 3.32Å; L343-K346 PolarHBondContact O-N 2.78Å; L343-L347 PolarHBondContact O-N 2.92Å
344A94.1Very high92.7Very high0 Ų063.1 Ų63.10%034%0.337CS..Hα-helixtrans-59.9-32.9177.500000112.7V289 F307 C310 F335 S340 V341 K346 L347 V359V289-A344 HydrophobicContact CG2-CB 4.3Å; F307-A344 HydrophobicContact CD1-CB 4.04Å; F307-A344 HydrophobicContact CE1-CB 4.1Å; C310-A344 HydrophobicContact CB-CB 4.34Å; C310-A344 VanDerWaalsContact SG-CA 3.57Å; C310-A344 PolarHBondContact SG-N 3.14Å; F335-A344 HydrophobicContact CE2-CB 3.83Å; F335-A344 HydrophobicContact CZ-CB 3.76Å; S340-A344 VanDerWaalsContact O-CB 3.24Å; S340-A344 WeakPolarHBondContact O-CB 3.49Å; S340-A344 PolarHBondContact O-N 3.16Å; V341-A344 PolarHBondContact O-N 3.44Å; A344-K346 VanDerWaalsContact C-N 3.27Å; A344-K346 PolarHBondContact O-N 3.39Å; A344-L347 PolarHBondContact O-N 3.09Å; A344-L347 VanDerWaalsContact O-N 3.14Å; A344-V359 VanDerWaalsContact O-CG1 3.32Å; A344-V359 WeakPolarHBondContact O-CG1 3.46Å
345L94.2Very high92.8Very high57 Ų5767 Ų6730%0.29835%0.351SS..Hα-helixtrans-64-27.1172.3-75.1169.7000113.6V341 L343 N348 R361V341-L345 HydrophobicContact CG1-CD1 4.33Å; V341-L345 VanDerWaalsContact O-CG 3.26Å; V341-L345 WeakPolarHBondContact O-CG 3.45Å; V341-L345 PolarHBondContact O-N 3.1Å; L343-L345 PolarHBondContact O-N 3.18Å; L345-N348 WeakPolarHBondContact O-CB 3.46Å; L345-N348 PolarHBondContact O-N 3.13Å; L345-R361 HydrophobicContact CD1-CB 4.49Å
346K94.3Very high92.8Very high166 Ų16672.7 Ų72.772%0.72238%0.376SS*.Hα-helixtrans-72.5-29.3172.5-60176.9-178-179.60111.9L343 A344 N348L343-K346 HydrophobicContact CD2-CD 4.4Å; L343-K346 WeakPolarHBondContact O-CA 3Å; L343-K346 VanDerWaalsContact O-CB 3.29Å; L343-K346 WeakPolarHBondContact O-CB 3.32Å; L343-K346 PolarHBondContact O-N 2.78Å; A344-K346 VanDerWaalsContact C-N 3.27Å; A344-K346 PolarHBondContact O-N 3.39Å; K346-N348 PolarHBondContact O-N 2.85Å; K346-N348 VanDerWaalsContact O-N 3.16Å
347L90.6Very high93Very high56 Ų5668.4 Ų68.429%0.29336%0.356SS..THydrogen-bonded Turntrans-76.615.7173-61.1-169.6000113.9F307 C310 L343 A344 S350F307-L347 HydrophobicContact CD1-CD1 4.43Å; C310-L347 WeakPolarHBondContact SG-CD1 3.35Å; L343-L347 PolarHBondContact O-N 2.92Å; A344-L347 PolarHBondContact O-N 3.09Å; A344-L347 VanDerWaalsContact O-N 3.14Å; L347-S350 VanDerWaalsContact O-CB 3.25Å; L347-S350 WeakPolarHBondContact O-CB 3.37Å; L347-S350 PolarHBondContact O-N 2.92Å; L347-S350 PolarHBondContact O-OG 3.01Å
348N92.9Very high93.1Very high61 Ų6170.9 Ų70.933%0.32636%0.359SS..THydrogen-bonded Turntrans-63.3137.3170.7-174.141.1000110.9L345 K346 S350 R358 V359L345-N348 WeakPolarHBondContact O-CB 3.46Å; L345-N348 PolarHBondContact O-N 3.13Å; K346-N348 PolarHBondContact O-N 2.85Å; K346-N348 VanDerWaalsContact O-N 3.16Å; N348-S350 VanDerWaalsContact C-N 3.26Å; N348-S350 PolarHBondContact O-N 3.48Å; N348-R358 WeakPolarHBondContact OD1-CA 3.46Å; N348-V359 HydrophobicContact CB-CB 4.18Å; N348-V359 PolarHBondContact OD1-N 3Å; N348-V359 PolarHBondContact OD1-O 3.46Å
349N92.6Very high93.2Very high101 Ų10168.1 Ų68.154%0.5434%0.342SS..THydrogen-bonded Turntrans68.75.7-170.1-44.8-63.8000116.4L357N349-L357 WeakPolarHBondContact CA-O 3.44Å; N349-L357 PolarHBondContact N-O 3.5Å
350S92.9Very high93.2Very high27 Ų2767.5 Ų67.519%0.18934%0.337CS..  trans-59.6147.9170.2580000111.9H306 L347 N348 K356 L357H306-S350 PolarHBondContact NE2-OG 3.19Å; L347-S350 VanDerWaalsContact O-CB 3.25Å; L347-S350 WeakPolarHBondContact O-CB 3.37Å; L347-S350 PolarHBondContact O-N 2.92Å; L347-S350 PolarHBondContact O-OG 3.01Å; N348-S350 VanDerWaalsContact C-N 3.26Å; N348-S350 PolarHBondContact O-N 3.48Å; S350-K356 CarbonylContact O-C 3.58Å; S350-K356 WeakPolarHBondContact O-CA 3.05Å; S350-L357 WeakPolarHBondContact O-CB 3.49Å; S350-L357 PolarHBondContact O-N 3.24Å
351E92.8Very high93.1Very high119 Ų11972.7 Ų72.756%0.55636%0.355SS*.EExtended strand (participates in β ladder)trans-94.5131.4-174.4-71.3-172-165.100113H306 R355 K356H306-E351 PolarHBondContact CE1-O 2.79Å; E351-R355 WeakPolarHBondContact CA-O 3.05Å; E351-K356 HydrophobicContact CG-CG 3.58Å; E351-K356 WeakPolarHBondContact OE1-CE 3.25Å; E351-K356 IonicContact OE1-NZ 3.62Å
352L90.7Very high92.8Very high18 Ų1873.5 Ų73.59%0.09436%0.361CS..EExtended strand (participates in β ladder)trans-130.7116.7174.2-176.669.8000109.3L294 V298 V303 H306 G354 R355 L357L294-L352 HydrophobicContact CD2-CD2 3.93Å; V298-L352 HydrophobicContact CG2-CD2 4.06Å; V303-L352 HydrophobicContact CG2-CD2 4.25Å; H306-L352 HydrophobicContact CB-CD1 4.2Å; L352-G354 VanDerWaalsContact C-N 3.31Å; L352-G354 PolarHBondContact O-N 3.28Å; L352-R355 PolarHBondContact N-O 3.33Å; L352-R355 PolarHBondContact O-N 3.38Å; L352-R355 VanDerWaalsContact O-N 3.13Å; L352-L357 HydrophobicContact CB-CD1 3.9Å; L352-L357 HydrophobicContact CB-CD2 3.91Å; L352-L357 HydrophobicContact CB-CG 3.9Å; L352-L357 HydrophobicContact CD2-CD1 4.14Å; L352-L357 HydrophobicContact CD2-CD2 4.2Å
353M88.1Confident92.2Very high137 Ų13773 Ų7368%0.67536%0.364SS*.THydrogen-bonded Turntrans5145.5-176.7-49.6178.273.800113.2P295 V298 R355P295-M353 HydrophobicContact CB-SD 4.33Å; P295-M353 HydrophobicContact CG-CB 3.86Å; P295-M353 HydrophobicContact CG-CG 4.27Å; P295-M353 HydrophobicContact CG-SD 4.07Å; V298-M353 HydrophobicContact CB-SD 4.45Å; V298-M353 HydrophobicContact CG2-SD 4Å; M353-R355 VanDerWaalsContact C-N 3.33Å; M353-R355 PolarHBondContact O-N 3.33Å
354G89.6Confident91Very high68 Ų6871 Ų7170%0.70135%0.354SS*.THydrogen-bonded Turntrans7219.7-179.800000115L352L352-G354 VanDerWaalsContact C-N 3.31Å; L352-G354 PolarHBondContact O-N 3.28Å
355R93.4Very high89.6Confident85 Ų8577.9 Ų77.932%0.32138%0.383SS..EExtended strand (participates in β ladder)trans-128.4127.9173.9-65.9-172.6176.1-165.5-5.5111.5E351 L352 M353 L357E351-R355 WeakPolarHBondContact CA-O 3.05Å; L352-R355 PolarHBondContact N-O 3.33Å; L352-R355 PolarHBondContact O-N 3.38Å; L352-R355 VanDerWaalsContact O-N 3.13Å; M353-R355 VanDerWaalsContact C-N 3.33Å; M353-R355 PolarHBondContact O-N 3.33Å; R355-L357 PolarHBondContact O-N 2.95Å
356K94.9Very high88.1Confident120 Ų12080.7 Ų80.752%0.52240%0.395SS..EExtended strand (participates in β ladder)trans-69.3116173.2-68.7-179178.9-178.20110.3N293 S350 E351N293-K356 WeakPolarHBondContact CB-O 3.29Å; N293-K356 PolarHBondContact ND2-O 3.19Å; S350-K356 CarbonylContact O-C 3.58Å; S350-K356 WeakPolarHBondContact O-CA 3.05Å; E351-K356 HydrophobicContact CG-CG 3.58Å; E351-K356 WeakPolarHBondContact OE1-CE 3.25Å; E351-K356 IonicContact OE1-NZ 3.62Å
357L95.6Very high86.3Confident0 Ų079.1 Ų79.10%039%0.388CS..  trans-73.7138.3-179.6-63-173.5000111.4V291 L294 F307 N349 S350 L352 R355 V359V291-L357 HydrophobicContact CG1-CB 4.4Å; V291-L357 HydrophobicContact CG1-CD1 4.16Å; V291-L357 HydrophobicContact CG1-CD2 4.32Å; L294-L357 HydrophobicContact CD2-CD2 3.66Å; L294-L357 HydrophobicContact CG-CD2 4.32Å; F307-L357 HydrophobicContact CE2-CD1 4.41Å; F307-L357 HydrophobicContact CZ-CD1 4.3Å; N349-L357 WeakPolarHBondContact CA-O 3.44Å; N349-L357 PolarHBondContact N-O 3.5Å; S350-L357 WeakPolarHBondContact O-CB 3.49Å; S350-L357 PolarHBondContact O-N 3.24Å; L352-L357 HydrophobicContact CB-CD1 3.9Å; L352-L357 HydrophobicContact CB-CD2 3.91Å; L352-L357 HydrophobicContact CB-CG 3.9Å; L352-L357 HydrophobicContact CD2-CD1 4.14Å; L352-L357 HydrophobicContact CD2-CD2 4.2Å; R355-L357 PolarHBondContact O-N 2.95Å; L357-V359 HydrophobicContact CB-CG2 4.34Å
358R95Very high84.7Confident142 Ų14279.8 Ų79.854%0.53639%0.391SS..EExtended strand (participates in β ladder)trans-100.2104.3172.3175.6178.1158.2-172.4-2.5109.6G292 N348 M360G292-R358 PolarHBondContact N-O 3.48Å; G292-R358 PolarHBondContact O-N 3.07Å; N348-R358 WeakPolarHBondContact OD1-CA 3.46Å; R358-M360 HydrophobicContact CG-CG 4.34Å; R358-M360 HydrophobicContact CG-SD 4.48Å; R358-M360 PolarHBondContact NE-SD 3.4Å; R358-M360 PolarHBondContact NH2-SD 3.41Å
359V95.4Very high83.1Confident3 Ų384.7 Ų84.72%0.01841%0.41CS..EExtended strand (participates in β ladder)trans-101.1128.2-177.5-167.30000110.2V289 F290 F307 A344 N348 L357V289-V359 HydrophobicContact CG1-CG1 3.31Å; F290-V359 WeakPolarHBondContact O-CA 3.42Å; F307-V359 HydrophobicContact CE1-CG2 4.27Å; F307-V359 HydrophobicContact CZ-CG2 3.97Å; A344-V359 VanDerWaalsContact O-CG1 3.32Å; A344-V359 WeakPolarHBondContact O-CG1 3.46Å; N348-V359 HydrophobicContact CB-CB 4.18Å; N348-V359 PolarHBondContact OD1-N 3Å; N348-V359 PolarHBondContact OD1-O 3.46Å; L357-V359 HydrophobicContact CB-CG2 4.34Å
360M93.6Very high81.4Confident87 Ų8786 Ų8643%0.42941%0.413SS..EExtended strand (participates in β ladder)trans-143.4154.8179.8-58.8-175.573.600111.1V289 F290 R358 S362V289-M360 WeakPolarHBondContact CG1-O 3.27Å; F290-M360 HydrophobicContact CD1-CB 4.13Å; F290-M360 HydrophobicContact CD1-CG 4.39Å; F290-M360 PolarHBondContact N-O 2.9Å; F290-M360 PolarHBondContact O-N 3.17Å; R358-M360 HydrophobicContact CG-CG 4.34Å; R358-M360 HydrophobicContact CG-SD 4.48Å; R358-M360 PolarHBondContact NE-SD 3.4Å; R358-M360 PolarHBondContact NH2-SD 3.41Å; M360-S362 PolarHBondContact O-N 3.13Å
361R91.8Very high79.7Confident119 Ų11991.3 Ų91.345%0.44944%0.435SS..EExtended strand (participates in β ladder)trans-64.4136.8175.4-161172.1-169.5158.66.6109.5V341 L345 V363V341-R361 HydrophobicContact CG1-CG 4.21Å; L345-R361 HydrophobicContact CD1-CB 4.49Å; R361-V363 PolarHBondContact O-N 2.92Å
362S87.4Confident78Confident16 Ų1690.9 Ų90.911%0.11244%0.436CS..  trans-69.3105.8-177.4-171.20000110.8S288 M360S288-S362 VanDerWaalsContact C-CB 3.47Å; S288-S362 WeakPolarHBondContact O-CB 3.28Å; S288-S362 PolarHBondContact O-N 3.02Å; S288-S362 VanDerWaalsContact O-N 3.1Å; M360-S362 PolarHBondContact O-N 3.13Å
363V81.4Confident76.4Confident78 Ų7894 Ų9447%0.47346%0.459SS..  trans-82.6136.4172.8-65.70000110.7R284 R361 K365 L368R284-V363 PolarHBondContact NH1-O 3.28Å; R361-V363 PolarHBondContact O-N 2.92Å; V363-K365 PolarHBondContact O-N 3.44Å; V363-L368 HydrophobicContact CB-CD1 3.82Å; V363-L368 HydrophobicContact CG1-CD1 4.4Å; V363-L368 HydrophobicContact CG2-CD1 3.99Å
364N70.4Confident74.8Confident32 Ų3293.3 Ų93.317%0.17146%0.459CS..  trans-88.6100.1176.7-143.711.2000109.3R284 E366 K367 L368R284-N364 HydrophobicContact CB-CB 4.5Å; R284-N364 VanDerWaalsContact CD-OD1 3.26Å; R284-N364 WeakPolarHBondContact CD-OD1 2.97Å; R284-N364 VanDerWaalsContact CG-OD1 3.31Å; R284-N364 WeakPolarHBondContact CG-OD1 3.28Å; N364-E366 VanDerWaalsContact C-N 3.26Å; N364-E366 PolarHBondContact O-N 2.76Å; N364-K367 PolarHBondContact O-N 2.89Å; N364-L368 PolarHBondContact O-N 3.14Å
365K64Low73.1Confident143 Ų14395.3 Ų95.362%0.62246%0.459SS*.Hα-helixtrans-65.2-23.8-167.9-77.6-167.1174.3-171.90114V363 L368 K369V363-K365 PolarHBondContact O-N 3.44Å; K365-L368 PolarHBondContact O-N 3.48Å; K365-K369 PolarHBondContact O-N 2.96Å
366E62.7Low71Confident116 Ų116102.4 Ų102.454%0.54249%0.486SS..Hα-helixtrans-63.7-46.7172.9-70.4108.8-132.300111.9N364 L368 K369 Q370N364-E366 VanDerWaalsContact C-N 3.26Å; N364-E366 PolarHBondContact O-N 2.76Å; E366-L368 VanDerWaalsContact C-N 3.32Å; E366-L368 PolarHBondContact O-N 3.5Å; E366-K369 WeakPolarHBondContact O-CB 3.35Å; E366-K369 PolarHBondContact O-N 2.88Å; E366-Q370 PolarHBondContact O-N 2.85Å
367K56Low69Low133 Ų133104.1 Ų104.158%0.57850%0.5SS*.Hα-helixtrans-64.1-37.4177.2-60.3-163.7176.1-1670111.8N364 K369 Q370 Q371N364-K367 PolarHBondContact O-N 2.89Å; K367-K369 PolarHBondContact O-N 3.21Å; K367-Q370 PolarHBondContact O-N 2.88Å; K367-Q371 WeakPolarHBondContact O-CG 3.26Å; K367-Q371 PolarHBondContact O-N 3.22Å
368L57.9Low66.8Low70 Ų70112.1 Ų112.137%0.36654%0.535SS..Hα-helixtrans-65.8-33172.2-77.6169.7000113.3V363 N364 K365 E366 N372V363-L368 HydrophobicContact CB-CD1 3.82Å; V363-L368 HydrophobicContact CG1-CD1 4.4Å; V363-L368 HydrophobicContact CG2-CD1 3.99Å; N364-L368 PolarHBondContact O-N 3.14Å; K365-L368 PolarHBondContact O-N 3.48Å; E366-L368 VanDerWaalsContact C-N 3.32Å; E366-L368 PolarHBondContact O-N 3.5Å; L368-N372 WeakPolarHBondContact O-CB 3.41Å; L368-N372 PolarHBondContact O-N 2.97Å; L368-N372 VanDerWaalsContact O-N 3.15Å; L368-N372 PolarHBondContact O-ND2 3.36Å
369K58.4Low64.5Low165 Ų165113.2 Ų113.272%0.71755%0.551SS**Hα-helixtrans-66.7-47.5172.1-81.7-173.6170.8-169.60110.9K365 E366 K367 Q371 N372 S373K365-K369 PolarHBondContact O-N 2.96Å; E366-K369 WeakPolarHBondContact O-CB 3.35Å; E366-K369 PolarHBondContact O-N 2.88Å; K367-K369 PolarHBondContact O-N 3.21Å; K369-Q371 VanDerWaalsContact C-N 3.33Å; K369-Q371 PolarHBondContact O-N 3.46Å; K369-N372 CarbonylContact O-C 3.55Å; K369-N372 PolarHBondContact O-N 2.89Å; K369-N372 VanDerWaalsContact O-N 3.13Å; K369-S373 WeakPolarHBondContact O-CB 3.4Å; K369-S373 PolarHBondContact O-N 3.06Å; K369-S373 PolarHBondContact O-OG 2.79Å
370Q57.6Low62.3Low129 Ų129120.4 Ų120.460%0.60359%0.588SS**Hα-helixtrans-59.5-40.4178.6-70.4167.9-24.800112.6E366 K367 S373E366-Q370 PolarHBondContact O-N 2.85Å; K367-Q370 PolarHBondContact O-N 2.88Å; Q370-S373 WeakPolarHBondContact CA-OG 3.24Å; Q370-S373 PolarHBondContact O-OG 3.15Å
371Q55.9Low60Low138 Ų138119.3 Ų119.365%0.64560%0.599SS**Hα-helixtrans-68.2-36174.9-73.4176.4-31.200112.9K367 K369K367-Q371 WeakPolarHBondContact O-CG 3.26Å; K367-Q371 PolarHBondContact O-N 3.22Å; K369-Q371 VanDerWaalsContact C-N 3.33Å; K369-Q371 PolarHBondContact O-N 3.46Å
372N57Low57.6Low109 Ų109123 Ų12358%0.58362%0.618SS**Hα-helixtrans-84-8.7179-77.8-71.9000114.3L368 K369L368-N372 WeakPolarHBondContact O-CB 3.41Å; L368-N372 PolarHBondContact O-N 2.97Å; L368-N372 VanDerWaalsContact O-N 3.15Å; L368-N372 PolarHBondContact O-ND2 3.36Å; K369-N372 CarbonylContact O-C 3.55Å; K369-N372 PolarHBondContact O-N 2.89Å; K369-N372 VanDerWaalsContact O-N 3.13Å
373S58.3Low55.3Low83 Ų83127.5 Ų127.558%0.5865%0.647SS**THydrogen-bonded Turntrans-86.5-1176.852.70000114.4K369 Q370 P375K369-S373 WeakPolarHBondContact O-CB 3.4Å; K369-S373 PolarHBondContact O-N 3.06Å; K369-S373 PolarHBondContact O-OG 2.79Å; Q370-S373 WeakPolarHBondContact CA-OG 3.24Å; Q370-S373 PolarHBondContact O-OG 3.15Å; S373-P375 VanDerWaalsContact O-CD 3.24Å; S373-P375 WeakPolarHBondContact O-CD 3.38Å
374N54.1Low53.5Low124 Ų124133.7 Ų133.766%0.66367%0.667SS**  trans-75111.2170.3-77.4-12000110.1R376N374-R376 VanDerWaalsContact C-N 3.34Å; N374-R376 PolarHBondContact O-N 3.43Å
375P52.9Low52Low109 Ų109140.3 Ų140.371%0.70870%0.697SS**G310 helixtrans-81.6-11.8-172.933.2-35.1000113.7S373 L377S373-P375 VanDerWaalsContact O-CD 3.24Å; S373-P375 WeakPolarHBondContact O-CD 3.38Å; P375-L377 VanDerWaalsContact C-N 3.33Å; P375-L377 PolarHBondContact O-N 3.22Å
376R49.8Very low50.7Low235 Ų235136.6 Ų136.689%0.88770%0.7SS**G310 helixtrans-76.7-0.3-165.4-73.5-167.8172.5-145.9-1.1117N374N374-R376 VanDerWaalsContact C-N 3.34Å; N374-R376 PolarHBondContact O-N 3.43Å
377L52.5Low49.4Very low156 Ų156138.5 Ų138.582%0.81771%0.713SS**G310 helixtrans-13029.1178.8-71.5174.4000114.4P375P375-L377 VanDerWaalsContact C-N 3.33Å; P375-L377 PolarHBondContact O-N 3.22Å
378K50.6Low48.3Very low167 Ų167139.3 Ų139.373%0.72672%0.724SS**SBendtrans-111.342168.3-76.3-173.9177.4172.20113
379N47Very low47.2Very low165 Ų165145.6 Ų145.688%0.88275%0.748SS**  trans-143.654.1169.4-96.4-19.7000111.4
380I49.4Very low45.9Very low154 Ų154144.4 Ų144.479%0.7976%0.755SS**  trans-104111.9153.4-62.9177.4000105.4
381G43.7Very low44.9Very low64 Ų64143.6 Ų143.666%0.6676%0.764SS**PPolyproline II helixtrans-64.3134.6-17600000111.3P383G381-P383 WeakPolarHBondContact O-CD 3.34Å
382K43.5Very low43.9Very low198 Ų198146.5 Ų146.586%0.86177%0.774SS**PPolyproline II helixtrans-63.4121.1164.4-66.6-177.8178.8-176.30107.8K384K382-K384 PolarHBondContact O-N 3.49Å
383P37.9Very low42.8Very low110 Ų110145.7 Ų145.771%0.71478%0.783SS**PPolyproline II helixtrans-61.8125.9167.326.1-31.9000108.4G381 Q385G381-P383 WeakPolarHBondContact O-CD 3.34Å; P383-Q385 PolarHBondContact O-N 3.24Å
384K43.5Very low41.6Very low207 Ų207146.5 Ų146.590%0.979%0.794SS**  trans-76.671.3176.1-72.1-176.3178.21780110.3K382 G386K382-K384 PolarHBondContact O-N 3.49Å; K384-G386 PolarHBondContact O-N 3.18Å
385Q39.2Very low40.6Very low171 Ų171150.1 Ų150.180%0.79981%0.807SS**  trans-75.4100.5163.1-75.9-175-19.900108.6P383 L387P383-Q385 PolarHBondContact O-N 3.24Å; Q385-L387 PolarHBondContact O-N 3.19Å
386G36.9Very low39.7Very low66 Ų66148.4 Ų148.468%0.6881%0.809SS**  trans-75.795.2173.400000110.6K384 N388K384-G386 PolarHBondContact O-N 3.18Å; G386-N388 PolarHBondContact O-N 2.91Å
387L36.1Very low38.9Very low155 Ų155146 Ų14681%0.81281%0.808SS**  trans-80.894.5168.3-90.9160.2000109.3Q385 F389Q385-L387 PolarHBondContact O-N 3.19Å; L387-F389 PolarHBondContact O-N 3.26Å
388N32.7Very low38.3Very low151 Ų151143.8 Ų143.881%0.80781%0.806SS**  trans-71.2124.1174.4-66-24.5000110G386G386-N388 PolarHBondContact O-N 2.91Å
389F34Very low37.9Very low201 Ų201145.5 Ų145.588%0.88281%0.813SS**  trans-91.7115.9162.4-93.1-93.6000109.5L387L387-F389 PolarHBondContact O-N 3.26Å
390T31.3Very low37.4Very low141 Ų141143 Ų14387%0.86581%0.809SS**  trans-155.7160.6147.316.60000110.1
391S37.3Very low36.7Very low111 Ų111143.4 Ų143.478%0.77681%0.812SS**  trans-87174.1-170.2510000114.7
392K34.9Very low36.2Very low199 Ų199149.6 Ų149.687%0.86582%0.82SS**  trans-34.1146.8158.9-53175.5176.4-178.40111.3
393A32.6Very low35.7Very low92 Ų92148.2 Ų148.276%0.7682%0.821SS**  cis-173.5172.649.400000113.3
394A34.8Very low35.5Very low100 Ų100145.8 Ų145.883%0.82682%0.816SS**  trans67.7163.6155.300000119.7
395E32.5Very low35.3Very low200 Ų200143.2 Ų143.294%0.93581%0.807SS**  trans-99179-173.7-59.1148.4109.100111.8
396G33.3Very low35.3Very low73 Ų73142.8 Ų142.875%0.75380%0.803SS**  trans117.969.8147.300000120.1
397H33.5Very low35.1Very low186 Ų186144.6 Ų144.686%0.86181%0.811SS**  70146.6127.2-139.874.8000123.2
398S38.8Very low35.1Very low109 Ų109143.7 Ų143.776%0.76281%0.812SS**  trans77.5171.6160.682.70000120.2
399K42.3Very low35.5Very low202 Ų202144.3 Ų144.388%0.87881%0.814SS**  trans-135.4139.9-162.3-50.9164.6-177.4169.30110.8
400S36.9Very low35.5Very low114 Ų114144.8 Ų144.880%0.79782%0.816SS**  trans-171.7139.3149.636.20000115.8
401L34.5Very low35.6Very low162 Ų162144.8 Ų144.885%0.84882%0.816SS**  trans46.596.6136.5-54.8174.2000121.9
402F34.4Very low35.5Very low193 Ų193149.8 Ų149.885%0.84682%0.824SS**  34.6127.5106.6-143.7-88.4000120.9
403I31.5Very low35.5Very low169 Ų169149.9 Ų149.987%0.86782%0.824SS**  trans-164.6153.8139.4-99.5151.7000108.9
404G34.9Very low35.5Very low60 Ų60155.5 Ų155.562%0.61983%0.832SS**  trans-93.4-150.3-170.500000116.2
405E38.4Very low35.4Very low152 Ų152154.3 Ų154.371%0.7183%0.828SS**  cis-159.71580.1-130.3-161.3176.500112.9
406K39.9Very low35.6Very low163 Ų163154 Ų15471%0.70983%0.827SS**  trans37.2127.9154-66.6167.3-172141.30121.7
407A32.7Very low35.8Very low103 Ų103160.2 Ų160.285%0.85183%0.834SS**  trans-137.7136.6147.100000110.5
408V36.2Very low35.8Very low137 Ų137160.9 Ų160.983%0.8383%0.834SS**  trans-131.7142.7-174.5176.60000111.8
409L41.4Very low35.5Very low164 Ų164161.4 Ų161.486%0.85984%0.837SS**  trans-65.9139.8-179.4-68154.7000113.7
410K33.1Very low35Very low210 Ų210155.4 Ų155.491%0.91383%0.833SS**  trans-141.5158.6150.1-77.2-159.9175.9178.30112.3
411T34.6Very low34.8Very low142 Ų142155.4 Ų155.487%0.87183%0.832SS**  trans-94.1169.5-166.650.90000113.6
412K34.2Very low35.3Very low216 Ų216153.6 Ų153.694%0.93983%0.83SS**  trans-122.4146.6173.5-81.7-172173.5-179.20112.3
413K34.8Very low35.7Very low201 Ų201153.7 Ų153.787%0.87483%0.83SS**  trans-148.1133.7-179.9-162.1176.2-174.5179.10110.8
414K33.2Very low36.1Very low210 Ų210154.5 Ų154.591%0.91383%0.827SS**  trans30.1137.6164.9-76.9-170.8172.9-176.30122.3
415G32.8Very low36.6Very low74 Ų74160.2 Ų160.276%0.76384%0.838SS**  trans110.6147.8154.100000114.6
416Q36Very low36.6Very low194 Ų194164.9 Ų164.991%0.90785%0.849SS**  cis-147.4165-14.6-86.7-171.9-9.800108.8
417K38.1Very low37Very low204 Ų204166.3 Ų166.389%0.88786%0.855SS**  trans-91.5138.8171.2-72.1-178.2176.7179.90111.4
418K33.5Very low37.8Very low199 Ų199170 Ų17087%0.86586%0.855SS**  trans-147.1170147.9-80.5-155.5177.6-179.60111.8
419S31.6Very low38.4Very low120 Ų120176.3 Ų176.384%0.83987%0.871SS**  trans-44.3162.3178.244.80000117
420G31.6Very low38.3Very low77 Ų77177 Ų17779%0.79487%0.872SS**  cis178.4-171.94.600000113.2
421C33.3Very low38.6Very low113 Ų113175.2 Ų175.276%0.76487%0.87SS**  trans-105.8151.7-177.3-177.40000111.7
422P45.7Very low38.8Very low125 Ų125177.1 Ų177.181%0.81287%0.87SS**  -137.8169.9123.438-27.3000114.9
423K42.7Very low39.1Very low194 Ų194174.8 Ų174.884%0.84387%0.865SS**  trans-98.2148.1-178.9-54.1169-177.9172.50112.2
424K40.1Very low39.3Very low187 Ų187173.1 Ų173.181%0.81387%0.865SS**  trans-173.4119.5138.2-101.6163-179.61800107.9
425Q43.5Very low39.7Very low179 Ų179170.7 Ų170.784%0.83686%0.862SS**  60111.683.1-72.3-173.9-20.700115.2
426R39.2Very low40.2Very low250 Ų250177.6 Ų177.694%0.94387%0.869SS**  -158.4154.5118.5-121.7174.3172.6167.4-4.3112.1
427K48.3Very low40.5Very low194 Ų194176.3 Ų176.384%0.84387%0.866SS**  trans-90.7172.5167-78.3-174.4174.6-175.90109.7
428Q49.5Very low40.7Very low181 Ų181174 Ų17485%0.84686%0.864SS**  trans118.1138.8160.2-66.4176.98.600112
429K49.9Very low41.4Very low269 Ų269171.7 Ų171.7100%1.1786%0.864SS**  cis-134.800.7-150177-176.7-177.30110.8

Retrieved 429 of 429 residues in 860.4 ms (Link to these results)