A0A093HGN6_STRCA Loading...

Protein sprouty homolog 2

AlphaFold DB , UniProt , Accession A0A093HGN6, Species STRCA (Struthio camelus australis), Gene n/a, Length 313 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.2Very low33.4Very low226 Ų226144.3 Ų144.3100%1.11384%0.84SS**  0123.40-67.7152.2165.900106.1
2E33.8Very low33.6Very low154 Ų154147.9 Ų147.972%0.7284%0.843SS**  cis-166.3152.4-1-121154.5118.600109.2
3T36Very low33.5Very low122 Ų122145.2 Ų145.275%0.74884%0.839SS**  trans29.3152.2144.957.30000122.8
4R34Very low33.5Very low228 Ų228145.9 Ų145.986%0.8684%0.837SS**  cis-176.4150.8-7.3164.9174.1177.2145.8-1.9109.1
5A36Very low33.7Very low91 Ų91146.3 Ų146.375%0.75283%0.834SS**  trans-8.4145.1169.700000122.4
6Q39.3Very low33.6Very low196 Ų196149.6 Ų149.692%0.91684%0.84SS**  trans-121.6168160.7-76.8-170.4-100112.6
7N32Very low33.6Very low174 Ų174148.7 Ų148.793%0.9384%0.839SS**  trans-71.3169.2-165.8-70.8-38000118.5
8G29.3Very low33.6Very low71 Ų71152.6 Ų152.673%0.73284%0.838SS**  trans132.795.8150.400000113.6
9S30.6Very low33.6Very low133 Ų133156.9 Ų156.993%0.9384%0.84SS**  85.9128.572.3-1690000114.6
10G29.7Very low33.5Very low59 Ų59155.6 Ų155.661%0.60883%0.833SS**  trans117.188.215000000121.3
11S34Very low33.8Very low133 Ų133154.7 Ų154.793%0.9383%0.833SS**  trans63.8163.8136.827.30000123.3
12Q36.8Very low33.7Very low188 Ų188147.8 Ų147.888%0.87982%0.82SS**  trans-105.1163.1-161.3-51.5174-4.700114.9
13S31.6Very low33.9Very low112 Ų112150.3 Ų150.378%0.78382%0.823SS**  -178.2134.7126.845.10000116.9
14L33.8Very low34.4Very low155 Ų155149.5 Ų149.581%0.81282%0.82SS**  trans50.8117.2141.8-68.2167.3000125.3
15L35.9Very low34.3Very low152 Ų152145.6 Ų145.680%0.79681%0.811SS**  trans28.5126.3130.1-65.8174.5000122.2
16Q33Very low34Very low199 Ų199143.6 Ų143.693%0.9380%0.8SS**  -156.1129.2125.7-137.4162.61.900113.6
17V33.3Very low34.2Very low135 Ų135141.3 Ų141.382%0.81879%0.789SS**PPolyproline II helixtrans-99.8131.9171171.40000109.3
18R32.6Very low34.6Very low218 Ų218138.7 Ų138.782%0.82378%0.782SS**PPolyproline II helixtrans-79.1126.1-172.7-175.3172.2178.2149.1-2.1111.8
19R33.7Very low35Very low235 Ų235141.5 Ų141.589%0.88778%0.78SS**PPolyproline II helixtrans-86.7151.8158.5-79.7-175.3169.397.8-3.5109.4
20D32Very low35.8Very low131 Ų131142.1 Ų142.170%0.70177%0.772SS**  trans-141.1160.3157.9-140.1-35.9000109.8
21T39.7Very low36.3Very low136 Ų136150.6 Ų150.683%0.83479%0.785SS**  trans-137.1136-154.7-16.50000112.3
22G31.2Very low36.8Very low81 Ų81151.3 Ų151.384%0.83578%0.779SS**  trans-179.2118.7173.600000116.3
23R36.8Very low37.2Very low207 Ų207148.7 Ų148.778%0.78178%0.775SS**  trans-139.5174.5162.6-126.4-149.1171.9-166.7-2.2105.2
24P46.1Very low37.7Very low105 Ų105149.8 Ų149.868%0.68277%0.772SS**  cis-124.4-157.67.546.2-29.5000111.3
25H33Very low37.9Very low147 Ų147148.8 Ų148.868%0.68177%0.772SS**  cis-145.8166.9-4.9-150.1-82.9000109.7
26G30.2Very low38.1Very low49 Ų49149.4 Ų149.451%0.50577%0.771SS.*  trans-174.8127.2167.700000109.9
27E43.6Very low38.5Very low147 Ų147147.8 Ų147.869%0.68776%0.764SS**  trans-56.4149.8179.8-99.4-70.7107.200113D29E27-D29 PolarHBondContact OE2-N 2.81Å
28P38.7Very low39.1Very low120 Ų120147.4 Ų147.478%0.77976%0.761SS**  -147.4140.8100.437-20.7000117.1
29D39.7Very low39.9Very low129 Ų129144 Ų14469%0.6975%0.754SS**  trans-75.4155.9169.2-168.724.2000114.9E27E27-D29 PolarHBondContact OE2-N 2.81Å
30L47.4Very low41Very low146 Ų146138.7 Ų138.776%0.76475%0.748SS**  trans47.274.2152.6-155.473.4000120.4
31R39.9Very low42.5Very low237 Ų237135.9 Ų135.989%0.89473%0.732SS**  trans-151.634.6147.8-91.7-130.2145.8-145.5-11.1115.9
32D43.5Very low43.8Very low149 Ų149132.7 Ų132.780%0.79772%0.715SS**  trans-61.1165.4154.7-104.1-53.7000111.1
33V46Very low45.1Very low133 Ų133134.6 Ų134.681%0.80671%0.706SS**SBendtrans83.925.1176.3-157.80000117
34L40.7Very low46.1Very low134 Ų134129.7 Ų129.770%0.70270%0.695SS**  trans-154.835.6156.9-118.4153.9000116.9Q36L34-Q36 HydrophobicContact CD2-CB 4.36Å; L34-Q36 PolarHBondContact O-N 3.46Å
35T38.2Very low46.8Very low135 Ų135129.2 Ų129.283%0.82868%0.684SS**  trans-69.584.7160.20.70000109Q37T35-Q37 PolarHBondContact O-N 3.14Å
36Q40.7Very low48.2Very low164 Ų164126.1 Ų126.177%0.76667%0.671SS**  trans-69.883.3-180-170.1165.65.100111.1L34 V38L34-Q36 HydrophobicContact CD2-CB 4.36Å; L34-Q36 PolarHBondContact O-N 3.46Å; Q36-V38 PolarHBondContact O-N 2.95Å
37Q41.2Very low49.6Very low166 Ų166131.2 Ų131.278%0.77668%0.675SS**  trans084156.2-162.3172.669.900115.2T35 H39T35-Q37 PolarHBondContact O-N 3.14Å; Q37-H39 PolarHBondContact O-N 3.45Å
38V45.3Very low50.4Low127 Ų127127 Ų12777%0.7767%0.666SS**  trans-70.699.4165.9178.10000107.2Q36 V40Q36-V38 PolarHBondContact O-N 2.95Å; V38-V40 HydrophobicContact CG1-CG2 4.35Å; V38-V40 PolarHBondContact O-N 3.4Å
39H50.8Low51.3Low146 Ų146126.4 Ų126.468%0.67666%0.655SS**  trans-7590.9-176.6-160.689.6000110Q37 L41Q37-H39 PolarHBondContact O-N 3.45Å; H39-L41 PolarHBondContact O-N 3.12Å
40V56.1Low52.3Low124 Ų124130.2 Ų130.275%0.75266%0.66SS**  trans-73.6106.7177.7-178.30000109.3V38V38-V40 HydrophobicContact CG1-CG2 4.35Å; V38-V40 PolarHBondContact O-N 3.4Å
41L63.1Low52.6Low71 Ų71130 Ų13037%0.37266%0.66SS.*  trans-65.7142.2173.9-57.3175.8000110.4H39H39-L41 PolarHBondContact O-N 3.12Å
42S67.9Low53.2Low69 Ų69123.8 Ų123.848%0.48365%0.648SS.*  trans-71.3156.9-176.667.70000112.4D44 Q45 I46S42-D44 PolarHBondContact O-N 3.17Å; S42-D44 VanDerWaalsContact O-N 3.14Å; S42-Q45 WeakPolarHBondContact O-CB 3.28Å; S42-Q45 PolarHBondContact O-N 3.15Å; S42-I46 PolarHBondContact O-N 3.25Å
43L58.5Low53.7Low122 Ų122123.3 Ų123.364%0.63965%0.645SS**Hα-helixtrans-56.7-32.1-176.1-105167.4000113.7I46 R47L43-I46 PolarHBondContact O-N 3.49Å; L43-R47 PolarHBondContact O-N 3.03Å; L43-R47 VanDerWaalsContact O-N 3.17Å
44D58.2Low54Low104 Ų104124.4 Ų124.456%0.55664%0.642SS**Hα-helixtrans-73.2-31.9178.6-61.2-52.7000112.5S42 I46 R47 A48S42-D44 PolarHBondContact O-N 3.17Å; S42-D44 VanDerWaalsContact O-N 3.14Å; D44-I46 VanDerWaalsContact C-N 3.34Å; D44-R47 PolarHBondContact O-N 3.11Å; D44-R47 IonicContact OD1-CZ 2.68Å; D44-R47 IonicContact OD1-NH1 3.91Å; D44-R47 PolarHBondContact OD1-NH1 2.99Å; D44-A48 PolarHBondContact O-N 3.49Å
45Q61.2Low54.3Low94 Ų94128.3 Ų128.344%0.43965%0.649SS.*Hα-helixtrans-69-34.3173.9-164.8169-0.900111.5S42 A48 I49S42-Q45 WeakPolarHBondContact O-CB 3.28Å; S42-Q45 PolarHBondContact O-N 3.15Å; Q45-A48 PolarHBondContact O-N 3.11Å; Q45-I49 HydrophobicContact CG-CD1 4.47Å; Q45-I49 WeakPolarHBondContact O-CD1 3.03Å; Q45-I49 WeakPolarHBondContact O-CG1 3.17Å; Q45-I49 PolarHBondContact O-N 2.94Å
46I61.5Low55Low82 Ų82128.5 Ų128.542%0.42165%0.65SS.*Hα-helixtrans-68.6-35.4174.1-59.5171.3000111.2S42 L43 D44 R50S42-I46 PolarHBondContact O-N 3.25Å; L43-I46 PolarHBondContact O-N 3.49Å; D44-I46 VanDerWaalsContact C-N 3.34Å; I46-R50 PolarHBondContact O-N 3.42Å
47R60Low55.4Low156 Ų156127.6 Ų127.659%0.58965%0.646SS**Hα-helixtrans-67.3-40.8173.3-70-175.7-165.3136.8-2112.3L43 D44 I49 R50 N51L43-R47 PolarHBondContact O-N 3.03Å; L43-R47 VanDerWaalsContact O-N 3.17Å; D44-R47 PolarHBondContact O-N 3.11Å; D44-R47 IonicContact OD1-CZ 2.68Å; D44-R47 IonicContact OD1-NH1 3.91Å; D44-R47 PolarHBondContact OD1-NH1 2.99Å; R47-I49 VanDerWaalsContact C-N 3.34Å; R47-I49 PolarHBondContact O-N 3.41Å; R47-R50 PolarHBondContact O-N 2.96Å; R47-N51 WeakPolarHBondContact O-CB 3.36Å; R47-N51 PolarHBondContact O-N 2.92Å; R47-N51 VanDerWaalsContact O-N 3.13Å
48A59.3Low56.2Low60 Ų60122.5 Ų122.550%0.49664%0.637SS.*Hα-helixtrans-58.6-45.8176.500000111.7D44 Q45 R50 N51D44-A48 PolarHBondContact O-N 3.49Å; Q45-A48 PolarHBondContact O-N 3.11Å; A48-R50 PolarHBondContact O-N 2.96Å; A48-N51 PolarHBondContact O-N 2.04Å
49I59.1Low55.9Low107 Ų107122.7 Ų122.755%0.54964%0.642SS.*Hα-helixtrans-67.8-31.7-178.9-63.7164000112.6Q45 R47 T52Q45-I49 HydrophobicContact CG-CD1 4.47Å; Q45-I49 WeakPolarHBondContact O-CD1 3.03Å; Q45-I49 WeakPolarHBondContact O-CG1 3.17Å; Q45-I49 PolarHBondContact O-N 2.94Å; R47-I49 VanDerWaalsContact C-N 3.34Å; R47-I49 PolarHBondContact O-N 3.41Å; I49-T52 PolarHBondContact O-OG1 3.31Å
50R59.1Low55.5Low209 Ų209121.7 Ų121.779%0.78965%0.646SS**Hα-helixtrans-83.2-9.5174.5-74.7-172.277.5174.14.4114.5I46 R47 A48I46-R50 PolarHBondContact O-N 3.42Å; R47-R50 PolarHBondContact O-N 2.96Å; A48-R50 PolarHBondContact O-N 2.96Å
51N54.1Low54.9Low142 Ų142122.3 Ų122.376%0.75965%0.649SS**Hα-helixtrans-93.8-12.1178.9-160.834.4000113.1R47 A48 N53R47-N51 WeakPolarHBondContact O-CB 3.36Å; R47-N51 PolarHBondContact O-N 2.92Å; R47-N51 VanDerWaalsContact O-N 3.13Å; A48-N51 PolarHBondContact O-N 2.04Å; N51-N53 VanDerWaalsContact C-N 3.31Å; N51-N53 PolarHBondContact O-N 2.95Å
52T53.3Low54Low106 Ų106122.8 Ų122.865%0.6566%0.664SS**  trans-89.563.1171.654.90000111.2I49 E54I49-T52 PolarHBondContact O-OG1 3.31Å; T52-E54 PolarHBondContact O-N 2.83Å; T52-E54 VanDerWaalsContact O-N 3.12Å
53N53Low52.5Low138 Ų138125.5 Ų125.574%0.73868%0.68SS**  trans-80.774.4163.2-89.4-14.8000109.1N51 Y55N51-N53 VanDerWaalsContact C-N 3.31Å; N51-N53 PolarHBondContact O-N 2.95Å; N53-Y55 PolarHBondContact O-N 2.89Å
54E53.7Low51.5Low157 Ų157131.1 Ų131.173%0.73469%0.693SS**  trans-7775.4171.2-164.4141.8101.800109.1T52T52-E54 PolarHBondContact O-N 2.83Å; T52-E54 VanDerWaalsContact O-N 3.12Å
55Y46.4Very low50.2Low216 Ų216132.5 Ų132.585%0.84771%0.707SS**  trans-122.350.4-179.8-105.4-84.9000111.3N53N53-Y55 PolarHBondContact O-N 2.89Å
56T51.6Low49Very low139 Ų139131.4 Ų131.485%0.85372%0.721SS**  trans-140.35616940.20000111.7
57E50.2Low47.7Very low145 Ų145134.7 Ų134.768%0.67875%0.745SS**  trans-122.986.3165.548-167.6162.500110.4
58G57Low46.7Very low58 Ų58136.5 Ų136.560%0.59876%0.757SS**  trans-65.5160.2159.500000110.3T60G58-T60 PolarHBondContact O-N 2.87Å
59P40.1Very low45.3Very low132 Ų132138.8 Ų138.886%0.85777%0.769SS**  trans-57.3114.6-166.921.9-33.6000112.8V61P59-V61 PolarHBondContact O-N 2.88Å
60T42.3Very low44.2Very low125 Ų125140 Ų14077%0.76778%0.782SS**  trans-62112-176-54.50000112.1G58G58-T60 PolarHBondContact O-N 2.87Å
61V43.1Very low43.4Very low136 Ų136136 Ų13682%0.82478%0.783SS**PPolyproline II helixtrans-88.4132.9162.4179.50000108.6P59P59-V61 PolarHBondContact O-N 2.88Å
62A44.6Very low42.2Very low82 Ų82140.5 Ų140.568%0.67879%0.789SS**PPolyproline II helixtrans-64.2152.4-167.900000114.5
63P36.3Very low41.3Very low126 Ų126141.8 Ų141.882%0.81880%0.796SS**PPolyproline II helixtrans-70.5149.4-178.4-14.829.7000113.3
64R36.5Very low40.5Very low240 Ų240139.5 Ų139.591%0.90680%0.797SS**  trans-119.1148.2156.9-73.6-166.7177.4-166.10.9110.6
65P32.9Very low39.5Very low132 Ų132139 Ų13986%0.85781%0.805SS**  trans-90.9132.6-162.1-5.225.3000113.9
66G34.7Very low39.1Very low71 Ų71137.4 Ų137.473%0.73281%0.805SS**  trans81.1121146.800000118.8
67V34.9Very low38.2Very low152 Ų152139.2 Ų139.292%0.92180%0.803SS**  -150.9148111.3174.50000107.4
68K37.7Very low37.2Very low194 Ų194140.9 Ų140.984%0.84381%0.808SS**  trans-109.7146.9-179.4-54.4169.8-176.9174.90110.8
69S30.8Very low35.9Very low107 Ų107144.4 Ų144.475%0.74881%0.814SS**  trans170.198.8145-79.60000110.6
70T36.9Very low35.5Very low134 Ų134146.1 Ų146.182%0.82281%0.81SS**  84.7139.310151.30000116.3
71P41.1Very low35Very low124 Ų124149.2 Ų149.281%0.80581%0.808SS**  trans-102.8160.1-169.139.4-35.4000114.7
72R30.1Very low34.8Very low237 Ų237148.5 Ų148.589%0.89481%0.806SS**  trans-153113.3162.7-140.5177.3-165-154.92.8116.3
73V33Very low34.3Very low132 Ų132153.3 Ų153.380%0.881%0.814SS**  trans34.8134.2135.2-169.10000120.6
74A37.5Very low33.9Very low91 Ų91150.9 Ų150.975%0.75281%0.812SS**  trans-76.7154.517300000114.8
75T32Very low33.7Very low146 Ų146147.9 Ų147.990%0.89681%0.813SS**  trans-153.4145.815790000111.6
76Q37.4Very low34.2Very low182 Ų182146.2 Ų146.285%0.8580%0.802SS**  trans-77.6156.8173-61.7179.5-700111.9
77H32.3Very low33.9Very low178 Ų178150.6 Ų150.682%0.82480%0.803SS**  trans-173.3112.4135.8-114.8-118.5000107.8
78K28.9Very low33.7Very low179 Ų179150 Ų15078%0.77879%0.79SS**  67.199.389.8-170.4-173.4176.3-175.10114.6
79N30.6Very low33.5Very low133 Ų133150.5 Ų150.571%0.71179%0.787SS**  trans-176.2155.2151.2-114.124.7000108.1
80E32.7Very low33.4Very low168 Ų168152.7 Ų152.779%0.78579%0.785SS**  cis-159.2148.9-23.9-131.3175.5158.500106.4
81R30.6Very low33.2Very low190 Ų190156 Ų15672%0.71779%0.788SS**  trans-142.1116.9-178.5-177179.7-176.8162.55.4110.8H83R81-H83 PolarHBondContact NE-NE2 3.12Å; R81-H83 PolarHBondContact NH2-NE2 2.69Å
82P38.7Very low32.7Very low120 Ų120155.3 Ų155.378%0.77979%0.786SS**  trans-89.2130.1174.133.3-30.2000110.9
83H33.6Very low32.7Very low183 Ų183155.1 Ų155.185%0.84779%0.785SS**  trans-134.4129.8160.4-82.3-32.3000107.6R81R81-H83 PolarHBondContact NE-NE2 3.12Å; R81-H83 PolarHBondContact NH2-NE2 2.69Å
84G28Very low32.8Very low75 Ų75156 Ų15677%0.77378%0.784SS**  trans-90.9176.4-175.300000114.2
85L32.8Very low32.5Very low178 Ų178160.5 Ų160.593%0.93279%0.79SS**  trans-139.3160.1166.5-12796.1000109.4
86P42.7Very low32.4Very low96 Ų96161.3 Ų161.362%0.62378%0.783SS**  trans-111.1-163.5-156.144.3-40.1000115.9
87E29.7Very low32.1Very low164 Ų164157.8 Ų157.877%0.76677%0.774SS**  trans79.2143.9168.2-66167.8101.300115.6
88H31.5Very low32.1Very low138 Ų138157.4 Ų157.464%0.63977%0.773SS**  cis-157.5157.220.9-147.9-41000112.9
89R32.6Very low32.2Very low206 Ų206156.9 Ų156.978%0.77778%0.775SS**  trans92.3101.4143-108.7163.4-166-178.55.4122.5
90H28.4Very low32.3Very low153 Ų153158.5 Ų158.571%0.70878%0.778SS**  44.9125127.3-70.2-93.2000122.2
91F32.2Very low32.4Very low203 Ų203156.4 Ų156.489%0.8978%0.777SS**  -160.6139.3103.4-111.2-76.7000111.6
92S31.1Very low32.5Very low110 Ų110152.7 Ų152.777%0.76978%0.78SS**  trans-129.8135.5175.7-60.50000110.9
93R30.8Very low33Very low232 Ų232152 Ų15288%0.87578%0.776SS**  trans-156.186.9165.1-169.9166.7-75-163.7-3.1114.7
94I35.1Very low33.1Very low151 Ų151154.9 Ų154.977%0.77478%0.779SS**  trans18.6124.1131.3-49.9169.2000119.9
95Q30.5Very low33.6Very low186 Ų186155.7 Ų155.787%0.86978%0.778SS**  165.6124.5121.3-114.61607.100107.9
96H30.1Very low34.2Very low162 Ų162152.6 Ų152.675%0.7577%0.769SS**  cis107149.743.9-167.5-91.1000112.2
97T31.5Very low34Very low108 Ų108155.5 Ų155.566%0.66378%0.778SS**  trans70.3143.917615.90000116.7
98Q31.2Very low34.1Very low171 Ų171153.7 Ų153.780%0.79978%0.784SS**  cis-153.7167.33.5-160.7168.10.100112.2
99M32Very low34.2Very low168 Ų168157.7 Ų157.783%0.82879%0.794SS**  trans-64.6160.3173.8-58.4169.482.300113.8
100H33Very low34.2Very low166 Ų166154 Ų15477%0.76980%0.799SS**  trans-165.8111.5134.6-97.2-64.8000114.1
101T33.2Very low34.6Very low125 Ų125153.8 Ų153.877%0.76780%0.802SS**  trans46.8121131.353.50000124.6
102S34.3Very low34.6Very low112 Ų112149.9 Ų149.978%0.78380%0.799SS**  trans-60.7169.7152.2-145.50000111.8
103P49.2Very low34.8Very low106 Ų106150.1 Ų150.169%0.68880%0.797SS**  cis-157.5-175.336.945.2-22.1000121.7
104R36Very low34.9Very low242 Ų242145.1 Ų145.191%0.91379%0.792SS**  trans90.1139.7152.8-86.1-179.9175.8142-0121.9
105A37.1Very low34.6Very low92 Ų92144 Ų14476%0.7680%0.797SS**  trans-104.1179.917300000110.7
106P45.4Very low34.9Very low114 Ų114142.3 Ų142.374%0.7480%0.8SS**  -154.2164.271.840.5-19.6000119.1
107L39.1Very low35Very low156 Ų156138.1 Ų138.182%0.81780%0.801SS**  trans26.7136143.8-63.8167.7000123.2
108S31.8Very low35.2Very low127 Ų127138.8 Ų138.889%0.88881%0.809SS**  trans-152.8148132-84.60000112.8
109R34.4Very low35.5Very low222 Ų222142.6 Ų142.684%0.83882%0.816SS**  trans-92.1159.5176.2-64.5176.9176.290.6-1.2110.6
110S32.6Very low35.6Very low127 Ų127140.3 Ų140.389%0.88882%0.817SS**  trans-146.4140.8143.4-87.50000111.5
111I36Very low35.6Very low150 Ų150137.9 Ų137.977%0.76982%0.819SS**  trans-118.8138.5172.5-67.8167.4000106.2
112S32.4Very low35.6Very low120 Ų120137.9 Ų137.984%0.83982%0.819SS**  trans-150.8127.316250.40000110.9
113T34.5Very low35.8Very low116 Ų116143.6 Ų143.671%0.71282%0.823SS**  trans-106.8172.617946.30000110.9
114V33.4Very low35.2Very low127 Ų127144.9 Ų144.977%0.7783%0.829SS**  trans60.6125.7165-610000119.8
115S29.7Very low35.1Very low128 Ų128138.8 Ų138.890%0.89582%0.823SS**  trans-161.2104.8136.3-82.80000110.4
116T35.8Very low35.2Very low149 Ų149141.1 Ų141.191%0.91483%0.829SS**  trans-86.8135.3168.3-35.70000108.3
117G32.2Very low34.6Very low75 Ų75141.2 Ų141.277%0.77383%0.832SS**  trans-172.464.9-174.200000116.9
118S35Very low34.4Very low121 Ų121139.5 Ų139.585%0.84683%0.833SS**  trans-79118.8169.1-53.50000111.4
119R39.3Very low34.4Very low251 Ų251141 Ų14195%0.94783%0.831SS**  trans-145.3122.7156.9-63.4-167.484.6163.34111.7
120S32.4Very low34.4Very low120 Ų120135.4 Ų135.484%0.83983%0.826SS**  trans-81.9148.6171.8-37.40000111.2
121S33.6Very low34.6Very low115 Ų115134.6 Ų134.680%0.80482%0.82SS**  trans177.5104.7139.7-98.60000114.4
122T32.9Very low34.8Very low125 Ų125136.1 Ų136.177%0.76782%0.824SS**  trans19.3157.4133.650.10000124.7
123R38.8Very low35.2Very low233 Ų233140 Ų14088%0.87983%0.829SS**  trans92.2141.1167.4-51177.475.5-177.82.7113.7
124T36Very low35.5Very low132 Ų132145.6 Ų145.681%0.8184%0.837SS**  cis-136168.615.943.30000113.9
125S34.5Very low35.6Very low114 Ų114147.7 Ų147.780%0.79784%0.843SS**  trans-118.9152.6-178.444.40000114.3
126T38.4Very low36Very low142 Ų142149.9 Ų149.987%0.87184%0.844SS**  trans-161.5141.416539.30000106.8
127S34.3Very low35.7Very low116 Ų116146.5 Ų146.581%0.81184%0.838SS**  cis-161.8150.1-4.244.20000108.7
128S35.3Very low36Very low119 Ų119149 Ų14983%0.83284%0.844SS**  trans-89162.3-170.9-47.70000114.9
129N31.5Very low36Very low160 Ų160148.7 Ų148.786%0.85684%0.842SS**  trans-155.7126.6143.6-128.21.7000112.5
130S34.6Very low35.8Very low104 Ų104142 Ų14273%0.72783%0.834SS**  trans54.2138.4135.2-146.10000120.5
131S35.6Very low35.8Very low110 Ų110139.9 Ų139.977%0.76983%0.831SS**  cis-152.616813.2-157.50000112
132E40.7Very low36.3Very low181 Ų181140.3 Ų140.385%0.84683%0.831SS**  trans-116.1136.5-178.32.4174.192.800111.1
133Q40.2Very low36.4Very low201 Ų201140.8 Ų140.894%0.93983%0.833SS**  trans-138.7137.7155.6-75.6-159.6-21.500111.9
134R41.3Very low36.7Very low235 Ų235134.2 Ų134.289%0.88783%0.829SS**  trans-74.5160.5-173.8-64.6164.8139.2153.8-6.5112.1
135L35.7Very low37Very low171 Ų171135.6 Ų135.690%0.89583%0.831SS**  -166.7167.8109.6-98.3166.1000111.8
136L38.9Very low37.6Very low173 Ų173132.7 Ų132.791%0.90682%0.82SS**  trans-90.9154.5-159-62161.4000113.7
137G28.1Very low37.8Very low78 Ų78133.8 Ų133.880%0.80482%0.819SS**  trans166.999.9164.100000114.2
138S39.4Very low38.3Very low127 Ų127135.6 Ų135.689%0.88882%0.817SS**  trans-122.6116.6170.2-59.10000110.4
139S35.5Very low38.8Very low115 Ų115139.4 Ų139.480%0.80481%0.813SS**  trans-171.3144.9147.1-1350000112.9
140S35.2Very low39.6Very low112 Ų112140.2 Ų140.278%0.78381%0.814SS**  trans41.4120153.355.40000121
141G30.9Very low40Very low75 Ų75141.9 Ų141.977%0.77381%0.811SS**  trans-77.8-146.8172.700000114.7
142P44.4Very low40.3Very low124 Ų124141.4 Ų141.481%0.80581%0.805SS**  cis-122.7-154.96.738.6-19.5000112.8
143V34.5Very low40.1Very low134 Ų134141 Ų14181%0.81280%0.8SS**  trans91.9111.4169.5-168.70000116.8
144A46.2Very low40Very low96 Ų96135.1 Ų135.179%0.79378%0.782SS**  trans10.1123.8155.300000120.4
145D42.9Very low39.7Very low160 Ų160131.4 Ų131.486%0.85677%0.774SS**  trans-131.9137.9130.2-16715.4000110.5
146G45.2Very low39.9Very low54 Ų54129 Ų12956%0.55776%0.762SS**  trans-107.495.2-170.600000111.3I148G146-I148 PolarHBondContact O-N 3.24Å
147I42.9Very low39.4Very low165 Ų165129.6 Ų129.685%0.84676%0.757SS**  trans-57115.5169.8-68.5172.1000108.7R149I147-R149 VanDerWaalsContact C-N 3.29Å; I147-R149 PolarHBondContact O-N 3.11Å
148I45.5Very low39.7Very low153 Ų153129.5 Ų129.579%0.78574%0.744SS**  trans-69.184.5-174.4-56.7175.2000109.8G146G146-I148 PolarHBondContact O-N 3.24Å
149R45.2Very low39.3Very low199 Ų199128.4 Ų128.475%0.75174%0.736SS**  trans-80.5115.4161.9-171.6178.6-179.5122.5-0.7107.4I147 Q151I147-R149 VanDerWaalsContact C-N 3.29Å; I147-R149 PolarHBondContact O-N 3.11Å; R149-Q151 HydrophobicContact CB-CG 4.46Å; R149-Q151 HydrophobicContact CG-CG 3.91Å; R149-Q151 PolarHBondContact O-N 2.81Å
150M48Very low39.4Very low178 Ų178130.4 Ų130.488%0.87773%0.733SS**  trans-65.471.5169.8-67.8-75.7-81.500110.3
151Q44.1Very low40Very low138 Ų138133 Ų13365%0.64574%0.737SS**  trans-80.1127.3166.6-68.7-168.7-4.500108.2R149 K153R149-Q151 HydrophobicContact CB-CG 4.46Å; R149-Q151 HydrophobicContact CG-CG 3.91Å; R149-Q151 PolarHBondContact O-N 2.81Å; Q151-K153 PolarHBondContact O-N 3.5Å
152P42.1Very low40Very low100 Ų100138.2 Ų138.265%0.64974%0.738SS**  trans-62.9110.9162.926.8-31.2000107.4S154P152-S154 PolarHBondContact O-N 3.11Å
153K35.1Very low39.7Very low172 Ų172138 Ų13875%0.74874%0.737SS**  trans-69.384.6-179.6-171.2171.9178.7-175.80109.5Q151 E155Q151-K153 PolarHBondContact O-N 3.5Å; K153-E155 VanDerWaalsContact CE-OE1 3.24Å; K153-E155 WeakPolarHBondContact CE-OE1 3.11Å; K153-E155 IonicContact NZ-OE1 2.76Å; K153-E155 PolarHBondContact O-N 3.46Å
154S39Very low40.3Very low79 Ų79136.5 Ų136.555%0.55272%0.724SS**  trans-66.2102.4164.259.40000107.8P152 L156P152-S154 PolarHBondContact O-N 3.11Å; S154-L156 PolarHBondContact O-N 3.38Å
155E35.2Very low39.8Very low156 Ų156135.8 Ų135.873%0.72971%0.713SS**  trans-66.375.4161.8-71.3-97.1137.200107.1K153 K157K153-E155 VanDerWaalsContact CE-OE1 3.24Å; K153-E155 WeakPolarHBondContact CE-OE1 3.11Å; K153-E155 IonicContact NZ-OE1 2.76Å; K153-E155 PolarHBondContact O-N 3.46Å; E155-K157 PolarHBondContact O-N 2.83Å
156L39.7Very low39.9Very low120 Ų120136.9 Ų136.963%0.62871%0.71SS**  trans-73.675176.2-146.5175.9000106.6S154 S158S154-L156 PolarHBondContact O-N 3.38Å; L156-S158 PolarHBondContact O-N 2.9Å
157K27.9Very low39.9Very low187 Ų187142.4 Ų142.481%0.81372%0.722SS**  trans-63.691.1161.7-170.6167.4-172.41680106.2E155 S159E155-K157 PolarHBondContact O-N 2.83Å; K157-S159 PolarHBondContact O-N 3.38Å
158S34.4Very low40.2Very low76 Ų76137 Ų13753%0.53169%0.694SS.*  trans-49.1101.6154.5-175.80000105.6L156 E160L156-S158 PolarHBondContact O-N 2.9Å; S158-E160 PolarHBondContact O-N 3.42Å; S158-E160 PolarHBondContact OG-N 3.29Å
159S31.3Very low40.5Very low103 Ų103134.9 Ų134.972%0.7268%0.684SS**  trans-77.959.5161-166.10000107.3K157K157-S159 PolarHBondContact O-N 3.38Å
160E37.8Very low41Very low158 Ų158127.4 Ų127.474%0.73867%0.669SS**  trans-46137.6155-161.9162.2127.400107.6S158 K162S158-E160 PolarHBondContact O-N 3.42Å; S158-E160 PolarHBondContact OG-N 3.29Å; E160-K162 PolarHBondContact O-N 3.21Å
161L47.3Very low41.6Very low165 Ų165120.9 Ų120.986%0.86464%0.643SS**  trans-49.397.9-164.6-67.8154.3000111.2P163L161-P163 WeakPolarHBondContact O-CD 3.43Å
162K30.6Very low42.9Very low185 Ų185118.2 Ų118.280%0.80463%0.631SS**  trans-64.4126.7175.8-166.8177.1-175.7-172.70107.2E160 L164E160-K162 PolarHBondContact O-N 3.21Å; K162-L164 PolarHBondContact O-N 3.09Å
163P39.7Very low44.6Very low120 Ų120114.6 Ų114.678%0.77961%0.607SS**  trans-63.1105.6-179.5-22.733.6000110.7L161 S165L161-P163 WeakPolarHBondContact O-CD 3.43Å; P163-S165 PolarHBondContact O-N 3.38Å; P163-S165 VanDerWaalsContact O-N 3.16Å
164L45.4Very low46.6Very low102 Ų102112.3 Ų112.353%0.53459%0.594SS.*  trans17.484.8148.4-164.468.7000115.5K162 L169K162-L164 PolarHBondContact O-N 3.09Å; L164-L169 HydrophobicContact CD1-CD2 4.22Å; L164-L169 HydrophobicContact CD1-CG 4.08Å; L164-L169 HydrophobicContact CD2-CD1 4.06Å; L164-L169 HydrophobicContact CD2-CD2 3.8Å; L164-L169 HydrophobicContact CD2-CG 3.87Å; L164-L169 HydrophobicContact CG-CD1 4.5Å; L164-L169 HydrophobicContact CG-CD2 4.41Å; L164-L169 HydrophobicContact CG-CG 4.1Å
165S36.6Very low48.8Very low81 Ų81114.7 Ų114.757%0.56659%0.591SS**  trans-63.5137.1161.842.30000109.4P163 E167 D168P163-S165 PolarHBondContact O-N 3.38Å; P163-S165 VanDerWaalsContact O-N 3.16Å; S165-E167 PolarHBondContact O-N 2.87Å; S165-D168 PolarHBondContact O-N 2.68Å; S165-D168 VanDerWaalsContact O-N 3.08Å
166K45.5Very low51.1Low184 Ų184107.4 Ų107.480%0.856%0.558SS**THydrogen-bonded Turntrans-64.5-18.9-162.4-72.8178176.3175.80114.7D168K166-D168 VanDerWaalsContact C-N 3.33Å; K166-D168 PolarHBondContact O-N 2.78Å
167E44.6Very low53.2Low170 Ų170106.9 Ų106.979%0.79455%0.552SS**THydrogen-bonded Turntrans-67.8-24.7175-75.374.4-174.600114S165S165-E167 PolarHBondContact O-N 2.87Å
168D49.3Very low55.7Low51 Ų51103.4 Ų103.427%0.27354%0.542SS..G310 helixtrans-84.5-19.5-172.8-172.247.5000114.1S165 K166 G170 A171S165-D168 PolarHBondContact O-N 2.68Å; S165-D168 VanDerWaalsContact O-N 3.08Å; K166-D168 VanDerWaalsContact C-N 3.33Å; K166-D168 PolarHBondContact O-N 2.78Å; D168-G170 PolarHBondContact O-N 3.5Å; D168-A171 WeakPolarHBondContact O-CB 3.37Å; D168-A171 PolarHBondContact O-N 2.88Å
169L52.5Low57.9Low108 Ų108102 Ų10257%0.56553%0.532SS*.G310 helixtrans-57-23.3177.2-85.2169.8000113.7L164L164-L169 HydrophobicContact CD1-CD2 4.22Å; L164-L169 HydrophobicContact CD1-CG 4.08Å; L164-L169 HydrophobicContact CD2-CD1 4.06Å; L164-L169 HydrophobicContact CD2-CD2 3.8Å; L164-L169 HydrophobicContact CD2-CG 3.87Å; L164-L169 HydrophobicContact CG-CD1 4.5Å; L164-L169 HydrophobicContact CG-CD2 4.41Å; L164-L169 HydrophobicContact CG-CG 4.1Å
170G54.1Low60.1Low42 Ų4299 Ų9943%0.43352%0.517SS..G310 helixtrans-78.4-2417600000114.8D168 H172 T173D168-G170 PolarHBondContact O-N 3.5Å; G170-H172 PolarHBondContact O-N 2.97Å; G170-T173 VanDerWaalsContact C-OG1 3.28Å; G170-T173 WeakPolarHBondContact CA-OG1 3.5Å; G170-T173 WeakPolarHBondContact O-CB 3.3Å; G170-T173 PolarHBondContact O-OG1 2.68Å
171A61Low62.3Low41 Ų4195.9 Ų95.934%0.33950%0.501SS..G310 helixtrans-72.7-31.6-17200000113.1D168 C184D168-A171 WeakPolarHBondContact O-CB 3.37Å; D168-A171 PolarHBondContact O-N 2.88Å; A171-C184 VanDerWaalsContact O-CB 3.25Å; A171-C184 WeakPolarHBondContact O-CB 3.38Å
172H72.3Confident64.2Low82 Ų8288.9 Ų88.938%0.3847%0.466SS..G310 helixtrans-85.5-4.9-178-70.8-69.6000115.1G170 Y174 C182 C184 C187G170-H172 PolarHBondContact O-N 2.97Å; H172-Y174 VanDerWaalsContact C-N 3.27Å; H172-Y174 PolarHBondContact O-N 3.4Å; H172-C182 VanDerWaalsContact CA-SG 3.53Å; H172-C182 PolarHBondContact O-SG 2.94Å; H172-C184 PolarHBondContact CE1-SG 3.43Å; H172-C187 PolarHBondContact CE1-SG 3.36Å; H172-C187 PolarHBondContact ND1-SG 2.06Å
173T76.8Confident66.7Low25 Ų2582.9 Ų82.915%0.15344%0.44CS..G310 helixtrans-62.1-30.3-175.9-40.10000113.7G170 R175 C298 C299G170-T173 VanDerWaalsContact C-OG1 3.28Å; G170-T173 WeakPolarHBondContact CA-OG1 3.5Å; G170-T173 WeakPolarHBondContact O-CB 3.3Å; G170-T173 PolarHBondContact O-OG1 2.68Å; T173-R175 PolarHBondContact O-N 3.25Å; T173-C298 WeakPolarHBondContact CG2-SG 3.48Å; T173-C299 VanDerWaalsContact CG2-O 3.23Å; T173-C299 WeakPolarHBondContact CG2-O 3.34Å; T173-C299 PolarHBondContact O-N 3.29Å
174Y78.4Confident68.7Low124 Ų12477.8 Ų77.849%0.48641%0.407SS..EExtended strand (participates in β ladder)trans-84.6106.9-174.3-63.4-74.9000111.6H172 C182 K183 T296 C298H172-Y174 VanDerWaalsContact C-N 3.27Å; H172-Y174 PolarHBondContact O-N 3.4Å; Y174-C182 CarbonylContact O-C 3.57Å; Y174-C182 WeakPolarHBondContact O-CA 3.44Å; Y174-C182 PolarHBondContact O-SG 3.43Å; Y174-C182 VanDerWaalsContact O-SG 3.36Å; Y174-K183 PolarHBondContact O-N 2.96Å; Y174-T296 HydrophobicContact CD1-CG2 4.22Å; Y174-T296 HydrophobicContact CG-CG2 4.45Å; Y174-C298 HydrophobicContact CD1-CB 4.43Å; Y174-C298 HydrophobicContact CE1-CB 4.24Å
175R84Confident70.2Confident128 Ų12882.2 Ų82.248%0.48342%0.422SS..EExtended strand (participates in β ladder)trans-113.6151.1179.9-61.2-171.1-178.7-149.34111.6T173 G180 T296 V297T173-R175 PolarHBondContact O-N 3.25Å; R175-G180 WeakPolarHBondContact CD-O 3.47Å; R175-T296 CarbonylContact O-C 3.51Å; R175-T296 WeakPolarHBondContact O-CA 3.44Å; R175-V297 PolarHBondContact N-O 2.78Å; R175-V297 PolarHBondContact O-N 3.35Å
176C84.2Confident72.2Confident4 Ų483.9 Ų83.93%0.02742%0.42CS..EExtended strand (participates in β ladder)trans-75.4138.7172.1176.80000111.1D178 C179 G180 K181 K183 C289 S294C176-D178 PolarHBondContact SG-N 3.47Å; C176-C179 HydrophobicContact CB-CB 4.24Å; C176-C179 WeakPolarHBondContact CB-SG 3.39Å; C176-C179 PolarHBondContact SG-N 3.47Å; C176-G180 VanDerWaalsContact O-CA 3.28Å; C176-G180 WeakPolarHBondContact O-CA 3.34Å; C176-G180 PolarHBondContact O-N 3.23Å; C176-K181 PolarHBondContact N-O 2.84Å; C176-K183 HydrophobicContact CB-CG 4.43Å; C176-C289 HydrophobicContact CB-CB 3.73Å; C176-C289 WeakPolarHBondContact CB-SG 3.49Å; C176-C289 PolarHBondContact SG-SG 3.46Å; C176-S294 WeakPolarHBondContact SG-CB 3.23Å; C176-S294 PolarHBondContact SG-OG 2.83Å
177E83.8Confident73.7Confident108 Ų10875.4 Ų75.451%0.50539%0.385SS..THydrogen-bonded Turntrans-64-57.4172.2-66.4-176.1158.100111.7C179 N295 V297E177-C179 PolarHBondContact O-N 2.88Å; E177-C179 VanDerWaalsContact O-N 3.14Å; E177-N295 HydrophobicContact CG-CB 4.48Å; E177-N295 WeakPolarHBondContact OE2-CB 3.25Å; E177-V297 HydrophobicContact CG-CB 4.48Å; E177-V297 HydrophobicContact CG-CG2 3.47Å; E177-V297 VanDerWaalsContact CG-CG2 3.47Å; E177-V297 WeakPolarHBondContact OE1-CG2 3.47Å
178D79.5Confident75.4Confident115 Ų11569.5 Ų69.562%0.61536%0.36SS*.THydrogen-bonded Turntrans-61.1-29-175.7-35.8-22.4000114.5C176 S294C176-D178 PolarHBondContact SG-N 3.47Å; D178-S294 WeakPolarHBondContact OD2-CB 3.02Å
179C82.3Confident76.6Confident46 Ų4674.4 Ų74.431%0.31138%0.376SS..THydrogen-bonded Turntrans-124-9.7-163.6102.10000114.1C176 E177 K181 C289C176-C179 HydrophobicContact CB-CB 4.24Å; C176-C179 WeakPolarHBondContact CB-SG 3.39Å; C176-C179 PolarHBondContact SG-N 3.47Å; E177-C179 PolarHBondContact O-N 2.88Å; E177-C179 VanDerWaalsContact O-N 3.14Å; C179-K181 PolarHBondContact O-N 2.78Å; C179-K181 VanDerWaalsContact SG-CB 3.5Å; C179-K181 PolarHBondContact SG-N 3.45Å; C179-K181 VanDerWaalsContact SG-N 3.41Å; C179-C289 WeakPolarHBondContact CB-SG 3.44Å; C179-C289 WeakPolarHBondContact SG-CB 3.24Å; C179-C289 CovalentContact SG-SG 2.04Å; C179-C289 PolarHBondContact SG-SG 3.22Å
180G77.1Confident77.5Confident40 Ų4072.4 Ų72.441%0.41237%0.369SS..  trans63.8-15.8-177.400000116.5R175 C176R175-G180 WeakPolarHBondContact CD-O 3.47Å; C176-G180 VanDerWaalsContact O-CA 3.28Å; C176-G180 WeakPolarHBondContact O-CA 3.34Å; C176-G180 PolarHBondContact O-N 3.23Å
181K84.1Confident78.4Confident93 Ų9375.5 Ų75.540%0.40437%0.368SS..  trans-74151-178.7-57.2-174.9171.8-161.80111.9C176 C179 R286 P287 G288 C289C176-K181 PolarHBondContact N-O 2.84Å; C179-K181 PolarHBondContact O-N 2.78Å; C179-K181 VanDerWaalsContact SG-CB 3.5Å; C179-K181 PolarHBondContact SG-N 3.45Å; C179-K181 VanDerWaalsContact SG-N 3.41Å; K181-R286 PolarHBondContact NZ-O 3.44Å; K181-P287 WeakPolarHBondContact CB-O 3.19Å; K181-P287 WeakPolarHBondContact CD-O 3.32Å; K181-G288 VanDerWaalsContact CD-O 3.3Å; K181-G288 WeakPolarHBondContact CD-O 3.24Å; K181-C289 HydrophobicContact CB-CB 3.96Å
182C85.7Confident78.7Confident17 Ų1778.2 Ų78.212%0.11538%0.38CS..BIsolated β-bridgetrans-67.6143.9178.5-170.60000112.1H172 Y174 C184 C187 G288 C289H172-C182 VanDerWaalsContact CA-SG 3.53Å; H172-C182 PolarHBondContact O-SG 2.94Å; Y174-C182 CarbonylContact O-C 3.57Å; Y174-C182 WeakPolarHBondContact O-CA 3.44Å; Y174-C182 PolarHBondContact O-SG 3.43Å; Y174-C182 VanDerWaalsContact O-SG 3.36Å; C182-C184 PolarHBondContact SG-N 3.39Å; C182-C184 VanDerWaalsContact SG-N 3.43Å; C182-C187 HydrophobicContact CB-CB 4.21Å; C182-C187 VanDerWaalsContact CB-SG 3.59Å; C182-C187 PolarHBondContact SG-SG 3.15Å; C182-G288 CarbonylContact O-C 3.48Å; C182-G288 WeakPolarHBondContact O-CA 3.5Å; C182-C289 PolarHBondContact O-N 3.3Å
183K83.6Confident78.3Confident59 Ų5975.9 Ų75.926%0.25737%0.37SS..  trans-100.19.1175.8-67.1-165.2-175.8175.20113.9Y174 C176 T188 C289 S294 N295 T296Y174-K183 PolarHBondContact O-N 2.96Å; C176-K183 HydrophobicContact CB-CG 4.43Å; K183-T188 PolarHBondContact O-OG1 2.85Å; K183-C289 HydrophobicContact CG-CB 4.13Å; K183-S294 WeakPolarHBondContact CE-OG 3.22Å; K183-S294 PolarHBondContact NZ-O 3.42Å; K183-S294 PolarHBondContact NZ-OG 3.21Å; K183-N295 PolarHBondContact NZ-O 3.02Å; K183-N295 VanDerWaalsContact NZ-O 3.12Å; K183-T296 HydrophobicContact CB-CG2 4.5Å; K183-T296 HydrophobicContact CD-CG2 3.87Å; K183-T296 WeakPolarHBondContact CD-OG1 3.48Å; K183-T296 HydrophobicContact CG-CG2 4.41Å; K183-T296 PolarHBondContact NZ-OG1 2.97Å
184C81.7Confident77.7Confident13 Ų1377.4 Ų77.49%0.08838%0.381CS..  trans-56.7151.7179.192.40000111.8A171 H172 C182 E186 C187 T188A171-C184 VanDerWaalsContact O-CB 3.25Å; A171-C184 WeakPolarHBondContact O-CB 3.38Å; H172-C184 PolarHBondContact CE1-SG 3.43Å; C182-C184 PolarHBondContact SG-N 3.39Å; C182-C184 VanDerWaalsContact SG-N 3.43Å; C184-E186 PolarHBondContact O-N 3.48Å; C184-C187 HydrophobicContact CB-CB 4.15Å; C184-C187 WeakPolarHBondContact CB-SG 3.39Å; C184-C187 WeakPolarHBondContact O-CB 3.15Å; C184-C187 PolarHBondContact O-N 3.28Å; C184-C187 WeakPolarHBondContact SG-CB 2.97Å; C184-C187 PolarHBondContact SG-N 2.78Å; C184-C187 CovalentContact SG-SG 2.06Å; C184-C187 PolarHBondContact SG-SG 3.43Å; C184-T188 VanDerWaalsContact O-CB 3.29Å; C184-T188 WeakPolarHBondContact O-CB 3.39Å; C184-T188 PolarHBondContact O-N 3.46Å; C184-T188 PolarHBondContact O-OG1 3.01Å
185K77.1Confident76.8Confident196 Ų19674.5 Ų74.585%0.85238%0.379SS*.THydrogen-bonded Turntrans-58.8-35.5-177.6-74.5-175.6178.4177.70112.4T188 Y189K185-T188 CarbonylContact O-C 3.32Å; K185-T188 PolarHBondContact O-N 3.49Å; K185-Y189 WeakPolarHBondContact O-CB 3.44Å; K185-Y189 PolarHBondContact O-N 3.22Å
186E78.7Confident75.5Confident115 Ų11571.1 Ų71.154%0.53737%0.374SS..THydrogen-bonded Turntrans-76.2-37-179.4-46.8-168.316700113.3C184 T188 Y189 R191C184-E186 PolarHBondContact O-N 3.48Å; E186-T188 VanDerWaalsContact C-N 3.26Å; E186-Y189 PolarHBondContact O-N 3Å; E186-R191 PolarHBondContact O-NH2 2.83Å
187C78.2Confident74.1Confident7 Ų778.8 Ų78.85%0.04740%0.403CS..THydrogen-bonded Turntrans-62.2-41.2172.5-49.70000110.2H172 C182 C184 R286 G288H172-C187 PolarHBondContact CE1-SG 3.36Å; H172-C187 PolarHBondContact ND1-SG 2.06Å; C182-C187 HydrophobicContact CB-CB 4.21Å; C182-C187 VanDerWaalsContact CB-SG 3.59Å; C182-C187 PolarHBondContact SG-SG 3.15Å; C184-C187 HydrophobicContact CB-CB 4.15Å; C184-C187 WeakPolarHBondContact CB-SG 3.39Å; C184-C187 WeakPolarHBondContact O-CB 3.15Å; C184-C187 PolarHBondContact O-N 3.28Å; C184-C187 WeakPolarHBondContact SG-CB 2.97Å; C184-C187 PolarHBondContact SG-N 2.78Å; C184-C187 CovalentContact SG-SG 2.06Å; C184-C187 PolarHBondContact SG-SG 3.43Å; C187-R286 WeakPolarHBondContact O-CG 3.36Å; C187-G288 VanDerWaalsContact O-CA 3.24Å; C187-G288 WeakPolarHBondContact O-CA 3.4Å; C187-G288 PolarHBondContact O-N 3.17Å
188T78.8Confident72.6Confident46 Ų4680 Ų8028%0.28241%0.411SS..THydrogen-bonded Turntrans-96.311.6-176.8-37.80000111.2K183 C184 K185 E186 R286K183-T188 PolarHBondContact O-OG1 2.85Å; C184-T188 VanDerWaalsContact O-CB 3.29Å; C184-T188 WeakPolarHBondContact O-CB 3.39Å; C184-T188 PolarHBondContact O-N 3.46Å; C184-T188 PolarHBondContact O-OG1 3.01Å; K185-T188 CarbonylContact O-C 3.32Å; K185-T188 PolarHBondContact O-N 3.49Å; E186-T188 VanDerWaalsContact C-N 3.26Å; T188-R286 PolarHBondContact O-NE 3.24Å; T188-R286 PolarHBondContact O-NH2 3.3Å
189Y74.9Confident71.2Confident153 Ų15375.5 Ų75.560%0.639%0.389SS*.SBendtrans-80.3132.2173.3-165.2-96.3000110K185 E186 R191K185-Y189 WeakPolarHBondContact O-CB 3.44Å; K185-Y189 PolarHBondContact O-N 3.22Å; E186-Y189 PolarHBondContact O-N 3Å; Y189-R191 PolarHBondContact O-N 2.9Å
190P71Confident69.9Low66 Ų6680.5 Ų80.543%0.42941%0.412SS..PPolyproline II helixtrans-61.5126.5177.1-20.932.6000111.3D282P190-D282 WeakPolarHBondContact CA-OD1 3.49Å
191R73Confident68.9Low108 Ų10886.8 Ų86.841%0.40843%0.428SS..PPolyproline II helixtrans-82.6125-179.2-63.5-69164.5154.4-6.4110.1E186 Y189 Y281 D282E186-R191 PolarHBondContact O-NH2 2.83Å; Y189-R191 PolarHBondContact O-N 2.9Å; R191-Y281 HydrophobicContact CB-CE1 4.3Å; R191-D282 PolarHBondContact N-OD1 3.19Å
192T68.2Low67.6Low97 Ų9790.9 Ų90.960%0.59545%0.449SS*.PPolyproline II helixtrans-72.2155.7171.7490000110.5P194T192-P194 WeakPolarHBondContact O-CD 3.48Å
193L63.7Low66.3Low33 Ų3392.6 Ų92.617%0.17346%0.46CS..PPolyproline II helixtrans-62.7129170.4-74.3169.3000108.9W197 Q278 Y281L193-W197 HydrophobicContact CD2-CZ2 4.04Å; L193-Q278 HydrophobicContact CD1-CB 3.76Å; L193-Q278 HydrophobicContact CD1-CG 4.42Å; L193-Q278 HydrophobicContact CD2-CB 4.48Å; L193-Q278 HydrophobicContact CG-CB 3.72Å; L193-Q278 HydrophobicContact CG-CG 3.93Å; L193-Y281 HydrophobicContact CD2-CD1 4.19Å; L193-Y281 HydrophobicContact CD2-CG 3.98Å
194P64.5Low65Low58 Ų5895.6 Ų95.638%0.37748%0.479SS..PPolyproline II helixtrans-52.5139.9170.7-25.128.4000111.7T192 C196 W197 Y281T192-P194 WeakPolarHBondContact O-CD 3.48Å; P194-C196 PolarHBondContact O-N 3.33Å; P194-W197 VanDerWaalsContact CD-NE1 3.32Å; P194-Y281 HydrophobicContact CG-CE1 4.43Å
195S59.6Low63.8Low62 Ų6297.2 Ų97.243%0.43449%0.489SS..SBendtrans-76.53.4-177.650.20000114.9C205S195-C205 CarbonylContact O-C 3.45Å
196C55.5Low63.5Low58 Ų5889.7 Ų89.739%0.39246%0.462SS..  trans-130.744-167.2-530000113.3P194P194-C196 PolarHBondContact O-N 3.33Å
197W54.3Low63.4Low165 Ų16585.9 Ų85.963%0.62545%0.449SS*.SBendtrans-78.6-21.8-178.7-82.151.9000114.9L193 P194 Y281L193-W197 HydrophobicContact CD2-CZ2 4.04Å; P194-W197 VanDerWaalsContact CD-NE1 3.32Å; W197-Y281 HydrophobicContact CH2-CD2 4.31Å; W197-Y281 AromaticContact CZ2-CD2 3.9Å; W197-Y281 HydrophobicContact CZ2-CD2 3.9Å; W197-Y281 AromaticContact CZ2-CE2 3.96Å; W197-Y281 HydrophobicContact CZ2-CE2 3.96Å
198I52.9Low63.3Low132 Ų13288.5 Ų88.568%0.67746%0.461SS*.SBendtrans-118.8-14.8-163.8-78.2162.6000113
199C51Low63.2Low22 Ų2289.5 Ų89.515%0.14947%0.465CS..SBendtrans-146.5119.4-178.6177.50000107.8K201 C203C199-K201 VanDerWaalsContact C-N 3.28Å; C199-K201 PolarHBondContact O-N 2.9Å; C199-C203 HydrophobicContact CB-CB 3.51Å; C199-C203 WeakPolarHBondContact CB-SG 3.24Å; C199-C203 WeakPolarHBondContact SG-CB 3.13Å; C199-C203 PolarHBondContact SG-N 3.48Å; C199-C203 CovalentContact SG-SG 2.05Å; C199-C203 PolarHBondContact SG-SG 2.9Å
200D55.2Low63.5Low150 Ų15085.6 Ų85.680%0.80246%0.457SS*.SBendtrans-64.482.1-174.5-87.2-56.3000111.9Q202D200-Q202 PolarHBondContact O-N 3.36Å
201K56.1Low64.1Low173 Ų17383.3 Ų83.375%0.75244%0.442SS*.SBendtrans60.10.3178.3-53.1177.1-175.8174.80116C199C199-K201 VanDerWaalsContact C-N 3.28Å; C199-K201 PolarHBondContact O-N 2.9Å
202Q56.6Low64.5Low179 Ų17978.9 Ų78.984%0.83643%0.426SS*.SBendtrans-91.4-14.1-177-69.8178.27.100114.7D200D200-Q202 PolarHBondContact O-N 3.36Å
203C58.5Low65.1Low52 Ų5282 Ų8235%0.35143%0.428SS..SBendtrans-132.3134.2-177.2-36.80000110.7C199 C205C199-C203 HydrophobicContact CB-CB 3.51Å; C199-C203 WeakPolarHBondContact CB-SG 3.24Å; C199-C203 WeakPolarHBondContact SG-CB 3.13Å; C199-C203 PolarHBondContact SG-N 3.48Å; C199-C203 CovalentContact SG-SG 2.05Å; C199-C203 PolarHBondContact SG-SG 2.9Å; C203-C205 HydrophobicContact CB-CB 4.22Å; C203-C205 WeakPolarHBondContact CB-SG 3.37Å; C203-C205 PolarHBondContact O-N 3.24Å
204L55.1Low65.9Low123 Ų12383.2 Ų83.264%0.64445%0.448SS*.  trans-75.747.2169-68.8172.1000111.7S206 N209L204-S206 PolarHBondContact O-N 3.26Å; L204-N209 PolarHBondContact O-ND2 3.06Å
205C57.6Low66.9Low47 Ų4780.8 Ų80.832%0.31843%0.432SS..  trans-80.662178.2-69.60000110.9S195 C203 A207 V210S195-C205 CarbonylContact O-C 3.45Å; C203-C205 HydrophobicContact CB-CB 4.22Å; C203-C205 WeakPolarHBondContact CB-SG 3.37Å; C203-C205 PolarHBondContact O-N 3.24Å; C205-A207 PolarHBondContact O-N 2.77Å; C205-V210 HydrophobicContact CB-CG2 4.44Å
206S71Confident68.1Low38 Ų3879 Ų7927%0.26642%0.419SS..  trans-53.1134.7164.1176.90000109.2L204 Q208 N209 V210L204-S206 PolarHBondContact O-N 3.26Å; S206-Q208 PolarHBondContact O-N 3.49Å; S206-Q208 VanDerWaalsContact O-N 3.09Å; S206-N209 WeakPolarHBondContact O-CB 3.19Å; S206-N209 PolarHBondContact O-N 2.92Å; S206-V210 PolarHBondContact O-N 3.18Å
207A75.3Confident69.5Low34 Ų3476.4 Ų76.428%0.28140%0.402SS..Hα-helixtrans-56.5-29.9179.700000112.3C205 V210 V211 L274C205-A207 PolarHBondContact O-N 2.77Å; A207-V210 PolarHBondContact O-N 2.68Å; A207-V211 PolarHBondContact O-N 2.75Å; A207-L274 HydrophobicContact CB-CD1 4.42Å; A207-L274 HydrophobicContact CB-CD2 3.81Å
208Q77.3Confident70.7Confident62 Ų6270.8 Ų70.829%0.2939%0.387SS..Hα-helixtrans-64.7-40.3173.4-170.460.858.300112.3S206 V211 D212S206-Q208 PolarHBondContact O-N 3.49Å; S206-Q208 VanDerWaalsContact O-N 3.09Å; Q208-V211 PolarHBondContact O-N 2.91Å; Q208-D212 PolarHBondContact NE2-OD1 3.49Å; Q208-D212 WeakPolarHBondContact O-CB 3.15Å; Q208-D212 PolarHBondContact O-N 3.18Å
209N75.4Confident72.1Confident67 Ų6767.4 Ų67.436%0.35837%0.374SS..Hα-helixtrans-67.4-42.3178.4-65.32.9000110.6L204 S206 V211 D212 Y213L204-N209 PolarHBondContact O-ND2 3.06Å; S206-N209 WeakPolarHBondContact O-CB 3.19Å; S206-N209 PolarHBondContact O-N 2.92Å; N209-V211 VanDerWaalsContact C-N 3.27Å; N209-V211 PolarHBondContact O-N 2.79Å; N209-D212 PolarHBondContact O-N 3.41Å; N209-Y213 HydrophobicContact CB-CD2 4.26Å; N209-Y213 HydrophobicContact CB-CE2 4.15Å; N209-Y213 WeakPolarHBondContact O-CD2 3.39Å; N209-Y213 PolarHBondContact O-N 3.16Å
210V81.4Confident73.6Confident72 Ų7266.6 Ų66.644%0.43637%0.369SS..Hα-helixtrans-58.4-41.4176.9178.90000111C205 S206 A207 G214C205-V210 HydrophobicContact CB-CG2 4.44Å; S206-V210 PolarHBondContact O-N 3.18Å; A207-V210 PolarHBondContact O-N 2.68Å; V210-G214 WeakPolarHBondContact O-CA 3.49Å; V210-G214 PolarHBondContact O-N 3.29Å
211V83.6Confident74.9Confident18 Ų1862.6 Ų62.611%0.10934%0.344CS..Hα-helixtrans-69.5-46.7174.1167.80000111.8A207 Q208 N209 Y213 G214 T215 Y267 A270 L274A207-V211 PolarHBondContact O-N 2.75Å; Q208-V211 PolarHBondContact O-N 2.91Å; N209-V211 VanDerWaalsContact C-N 3.27Å; N209-V211 PolarHBondContact O-N 2.79Å; V211-Y213 VanDerWaalsContact C-N 3.33Å; V211-Y213 PolarHBondContact O-N 3.32Å; V211-G214 PolarHBondContact O-N 2.96Å; V211-T215 HydrophobicContact CG1-CG2 4.19Å; V211-T215 WeakPolarHBondContact O-CB 3.46Å; V211-T215 WeakPolarHBondContact O-CG2 3.38Å; V211-T215 PolarHBondContact O-N 3.4Å; V211-T215 PolarHBondContact O-OG1 2.96Å; V211-Y267 HydrophobicContact CG1-CD2 3.74Å; V211-Y267 HydrophobicContact CG1-CE2 4Å; V211-A270 HydrophobicContact CG1-CB 3.91Å; V211-A270 HydrophobicContact CG2-CB 4.01Å; V211-L274 HydrophobicContact CB-CD1 4.02Å; V211-L274 HydrophobicContact CG2-CD1 3.53Å; V211-L274 HydrophobicContact CG2-CG 3.98Å
212D82.4Confident76.1Confident14 Ų1455.7 Ų55.78%0.07532%0.322CS..Hα-helixtrans-61-38.4-178-80.419.9000112.8Q208 N209 V217 C218 K221Q208-D212 PolarHBondContact NE2-OD1 3.49Å; Q208-D212 WeakPolarHBondContact O-CB 3.15Å; Q208-D212 PolarHBondContact O-N 3.18Å; N209-D212 PolarHBondContact O-N 3.41Å; D212-V217 PolarHBondContact O-N 2.05Å; D212-C218 PolarHBondContact O-N 2.94Å; D212-K221 IonicContact OD2-NZ 3.78Å; D212-K221 PolarHBondContact OD2-NZ 2.89Å
213Y80Confident77.1Confident164 Ų16450.2 Ų50.264%0.64330%0.298SS*.Hα-helixtrans-78.7-45.2174-67.7-62.6000112.4N209 V211 T215 C216 C218N209-Y213 HydrophobicContact CB-CD2 4.26Å; N209-Y213 HydrophobicContact CB-CE2 4.15Å; N209-Y213 WeakPolarHBondContact O-CD2 3.39Å; N209-Y213 PolarHBondContact O-N 3.16Å; V211-Y213 VanDerWaalsContact C-N 3.33Å; V211-Y213 PolarHBondContact O-N 3.32Å; Y213-T215 VanDerWaalsContact C-N 3.27Å; Y213-T215 PolarHBondContact O-N 3.08Å; Y213-C216 PolarHBondContact O-N 3.06Å; Y213-C218 HydrophobicContact CD1-CB 4.02Å; Y213-C218 HydrophobicContact CE1-CB 4.14Å
214G80.1Confident78.1Confident57 Ų5748.1 Ų48.159%0.58828%0.283SS*.Hα-helixtrans-68.4-22.5-177.600000114.5V210 V211V210-G214 WeakPolarHBondContact O-CA 3.49Å; V210-G214 PolarHBondContact O-N 3.29Å; V211-G214 PolarHBondContact O-N 2.96Å
215T85.2Confident79.1Confident8 Ų849.5 Ų49.55%0.04928%0.281CS..THydrogen-bonded Turntrans-104.710.317765.90000112.9V211 Y213 V217 C263 L264 C266 Y267 A270V211-T215 HydrophobicContact CG1-CG2 4.19Å; V211-T215 WeakPolarHBondContact O-CB 3.46Å; V211-T215 WeakPolarHBondContact O-CG2 3.38Å; V211-T215 PolarHBondContact O-N 3.4Å; V211-T215 PolarHBondContact O-OG1 2.96Å; Y213-T215 VanDerWaalsContact C-N 3.27Å; Y213-T215 PolarHBondContact O-N 3.08Å; T215-V217 PolarHBondContact O-N 3.02Å; T215-V217 VanDerWaalsContact O-N 3.13Å; T215-C263 WeakPolarHBondContact CB-O 3.36Å; T215-C263 CarbonylContact O-C 3.36Å; T215-L264 WeakPolarHBondContact O-CA 3.42Å; T215-L264 WeakPolarHBondContact O-CD2 3.45Å; T215-L264 PolarHBondContact O-N 3.41Å; T215-C266 HydrophobicContact CG2-CB 4.26Å; T215-Y267 VanDerWaalsContact OG1-CD2 3.29Å; T215-Y267 WeakPolarHBondContact OG1-CD2 3.5Å; T215-A270 HydrophobicContact CG2-CB 4.27Å
216C85.2Confident80Confident24 Ų2454.7 Ų54.716%0.16230%0.3CS..THydrogen-bonded Turntrans61.317176.9-42.10000114.9Y213 C218 C219 L261 C263Y213-C216 PolarHBondContact O-N 3.06Å; C216-C218 PolarHBondContact O-N 3.48Å; C216-C219 VanDerWaalsContact O-CB 3.29Å; C216-C219 WeakPolarHBondContact O-CB 3.34Å; C216-C219 PolarHBondContact O-N 2.82Å; C216-L261 HydrophobicContact CB-CB 4.35Å; C216-L261 HydrophobicContact CB-CD1 4.04Å; C216-L261 HydrophobicContact CB-CD2 4.28Å; C216-L261 HydrophobicContact CB-CG 4.47Å; C216-C263 HydrophobicContact CB-CB 4.16Å; C216-C263 WeakPolarHBondContact CB-SG 3.29Å; C216-C263 WeakPolarHBondContact SG-CB 3.1Å; C216-C263 CovalentContact SG-SG 2.04Å; C216-C263 PolarHBondContact SG-SG 3Å
217V84.6Confident79.8Confident4 Ų457.3 Ų57.32%0.02432%0.317CS..Hα-helixtrans-66.7-22.9177.2165.30000112.2D212 T215 C219 V220 K221 L264 Y267D212-V217 PolarHBondContact O-N 2.05Å; T215-V217 PolarHBondContact O-N 3.02Å; T215-V217 VanDerWaalsContact O-N 3.13Å; V217-C219 PolarHBondContact O-N 3.19Å; V217-V220 WeakPolarHBondContact O-CB 3.48Å; V217-V220 PolarHBondContact O-N 3.4Å; V217-K221 HydrophobicContact CG1-CD 4.32Å; V217-K221 HydrophobicContact CG1-CG 4.29Å; V217-K221 WeakPolarHBondContact O-CG 3.4Å; V217-K221 PolarHBondContact O-N 2.86Å; V217-L264 HydrophobicContact CB-CD2 4.4Å; V217-L264 HydrophobicContact CG2-CD2 3.56Å; V217-Y267 HydrophobicContact CB-CD2 4.31Å; V217-Y267 HydrophobicContact CB-CE2 4.23Å; V217-Y267 HydrophobicContact CG1-CE2 4.22Å; V217-Y267 HydrophobicContact CG2-CD1 3.74Å; V217-Y267 HydrophobicContact CG2-CD2 3.48Å; V217-Y267 VanDerWaalsContact CG2-CD2 3.48Å; V217-Y267 HydrophobicContact CG2-CE1 4.04Å; V217-Y267 HydrophobicContact CG2-CE2 3.77Å; V217-Y267 HydrophobicContact CG2-CG 3.42Å; V217-Y267 VanDerWaalsContact CG2-CG 3.42Å
218C81.1Confident79.3Confident46 Ų4657.3 Ų57.331%0.31132%0.316SS..Hα-helixtrans-54.2-36.6166.354.90000113.1D212 Y213 C216 K221 G222D212-C218 PolarHBondContact O-N 2.94Å; Y213-C218 HydrophobicContact CD1-CB 4.02Å; Y213-C218 HydrophobicContact CE1-CB 4.14Å; C216-C218 PolarHBondContact O-N 3.48Å; C218-K221 PolarHBondContact O-N 2.84Å; C218-G222 PolarHBondContact O-N 3.36Å
219C81.6Confident78.4Confident62 Ų6261.7 Ų61.742%0.41934%0.341SS..Hα-helixtrans-70.2-38.6177.8-55.50000111.6C216 V217 G222 L223 L261C216-C219 VanDerWaalsContact O-CB 3.29Å; C216-C219 WeakPolarHBondContact O-CB 3.34Å; C216-C219 PolarHBondContact O-N 2.82Å; V217-C219 PolarHBondContact O-N 3.19Å; C219-G222 PolarHBondContact O-N 3.35Å; C219-L223 WeakPolarHBondContact O-CB 3.45Å; C219-L223 PolarHBondContact O-N 3.37Å; C219-L261 HydrophobicContact CB-CD1 3.79Å
220V83.1Confident77.6Confident4 Ų465 Ų652%0.02436%0.359CS..Hα-helixtrans-61.4-46.8172.3152.50000111.5V217 L223 F224 P239 M254 V257 L264V217-V220 WeakPolarHBondContact O-CB 3.48Å; V217-V220 PolarHBondContact O-N 3.4Å; V220-L223 PolarHBondContact O-N 2.9Å; V220-F224 HydrophobicContact CG1-CD2 4.22Å; V220-F224 HydrophobicContact CG1-CE2 4.22Å; V220-F224 PolarHBondContact O-N 3.21Å; V220-P239 HydrophobicContact CG1-CB 3.64Å; V220-P239 HydrophobicContact CG1-CG 4.26Å; V220-M254 HydrophobicContact CB-CE 4.06Å; V220-M254 HydrophobicContact CB-SD 4.06Å; V220-M254 HydrophobicContact CG1-CE 3.68Å; V220-M254 HydrophobicContact CG1-SD 3.34Å; V220-M254 WeakPolarHBondContact CG1-SD 3.29Å; V220-M254 HydrophobicContact CG2-CE 3.61Å; V220-M254 HydrophobicContact CG2-SD 3.6Å; V220-M254 VanDerWaalsContact CG2-SD 3.6Å; V220-V257 HydrophobicContact CG2-CG1 4.19Å; V220-L264 HydrophobicContact CB-CD2 4.49Å; V220-L264 HydrophobicContact CG2-CD1 3.78Å; V220-L264 HydrophobicContact CG2-CD2 3.64Å; V220-L264 HydrophobicContact CG2-CG 4.41Å
221K82.3Confident76.4Confident66 Ų6668.8 Ų68.829%0.28738%0.376SS..Hα-helixtrans-61.8-43.8176.4-71.1177.3168.2-178.10111.5D212 V217 C218 F224 Y225D212-K221 IonicContact OD2-NZ 3.78Å; D212-K221 PolarHBondContact OD2-NZ 2.89Å; V217-K221 HydrophobicContact CG1-CD 4.32Å; V217-K221 HydrophobicContact CG1-CG 4.29Å; V217-K221 WeakPolarHBondContact O-CG 3.4Å; V217-K221 PolarHBondContact O-N 2.86Å; C218-K221 PolarHBondContact O-N 2.84Å; K221-F224 PolarHBondContact O-N 3.31Å; K221-Y225 WeakPolarHBondContact O-CB 3.36Å; K221-Y225 PolarHBondContact O-N 2.92Å
222G80.2Confident74.9Confident29 Ų2976.4 Ų76.430%0.29941%0.411SS..Hα-helixtrans-65.2-41176.600000113.5C218 C219 Y225 H226C218-G222 PolarHBondContact O-N 3.36Å; C219-G222 PolarHBondContact O-N 3.35Å; G222-Y225 PolarHBondContact O-N 3.38Å; G222-H226 PolarHBondContact O-CD2 2.95Å; G222-H226 VanDerWaalsContact O-CD2 3.29Å; G222-H226 PolarHBondContact O-N 3.09Å
223L78.6Confident73.7Confident63 Ų6377.9 Ų77.933%0.3342%0.419SS..Hα-helixtrans-62.1-46.3174.2-179.265.9000111C219 V220 Y225 H226 C227 V257C219-L223 WeakPolarHBondContact O-CB 3.45Å; C219-L223 PolarHBondContact O-N 3.37Å; V220-L223 PolarHBondContact O-N 2.9Å; L223-Y225 VanDerWaalsContact C-N 3.32Å; L223-Y225 PolarHBondContact O-N 3.18Å; L223-H226 PolarHBondContact O-N 3.18Å; L223-C227 VanDerWaalsContact O-CB 3.24Å; L223-C227 WeakPolarHBondContact O-CB 3.19Å; L223-C227 PolarHBondContact O-N 3.21Å; L223-C227 PolarHBondContact O-SG 3.35Å; L223-C227 VanDerWaalsContact O-SG 3.34Å; L223-V257 HydrophobicContact CD2-CG2 3.51Å
224F78.6Confident72.9Confident9 Ų975 Ų754%0.03941%0.414CS..Hα-helixtrans-68-29.5176.6-75.1-22000113.6V220 K221 S228 C235 P239 R250 A253 M254V220-F224 HydrophobicContact CG1-CD2 4.22Å; V220-F224 HydrophobicContact CG1-CE2 4.22Å; V220-F224 PolarHBondContact O-N 3.21Å; K221-F224 PolarHBondContact O-N 3.31Å; F224-S228 VanDerWaalsContact O-CB 3.22Å; F224-S228 WeakPolarHBondContact O-CB 3.29Å; F224-S228 PolarHBondContact O-N 2.87Å; F224-C235 HydrophobicContact CB-CB 4.5Å; F224-C235 VanDerWaalsContact CB-SG 3.57Å; F224-C235 WeakPolarHBondContact CG-SG 3.45Å; F224-P239 HydrophobicContact CD2-CB 3.84Å; F224-P239 HydrophobicContact CE2-CB 3.64Å; F224-R250 HydrophobicContact CE1-CB 4.23Å; F224-R250 HydrophobicContact CE1-CG 4.08Å; F224-R250 HydrophobicContact CZ-CB 3.89Å; F224-R250 HydrophobicContact CZ-CG 4.13Å; F224-A253 HydrophobicContact CE1-CB 4.26Å; F224-M254 HydrophobicContact CD1-CE 4.48Å; F224-M254 HydrophobicContact CD2-CE 4.32Å; F224-M254 HydrophobicContact CE1-CE 3.75Å; F224-M254 HydrophobicContact CE2-CE 3.55Å; F224-M254 HydrophobicContact CE2-CG 4.32Å; F224-M254 HydrophobicContact CE2-SD 3.73Å; F224-M254 HydrophobicContact CZ-CE 3.23Å; F224-M254 HydrophobicContact CZ-CG 3.98Å; F224-M254 HydrophobicContact CZ-SD 3.81Å
225Y76.9Confident71.9Confident151 Ų15172.7 Ų72.759%0.59239%0.389SS*.Hα-helixtrans-66.4-41.6171.2-178.7-108.6000112.2K221 G222 L223K221-Y225 WeakPolarHBondContact O-CB 3.36Å; K221-Y225 PolarHBondContact O-N 2.92Å; G222-Y225 PolarHBondContact O-N 3.38Å; L223-Y225 VanDerWaalsContact C-N 3.32Å; L223-Y225 PolarHBondContact O-N 3.18Å
226H76Confident70.6Confident157 Ų15773.5 Ų73.573%0.72740%0.397SS*.Hα-helixtrans-82.4-20.6177.9-73.9-61.6000114.8G222 L223G222-H226 PolarHBondContact O-CD2 2.95Å; G222-H226 VanDerWaalsContact O-CD2 3.29Å; G222-H226 PolarHBondContact O-N 3.09Å; L223-H226 PolarHBondContact O-N 3.18Å
227C66.6Low69.5Low92 Ų9277.4 Ų77.462%0.62242%0.416SS*.Hα-helixtrans-97.6-11.7177.8-66.90000114L223L223-C227 VanDerWaalsContact O-CB 3.24Å; L223-C227 WeakPolarHBondContact O-CB 3.19Å; L223-C227 PolarHBondContact O-N 3.21Å; L223-C227 PolarHBondContact O-SG 3.35Å; L223-C227 VanDerWaalsContact O-SG 3.34Å
228S65.6Low68.4Low35 Ų3582.1 Ų82.125%0.24544%0.441CS..SBendtrans-80.8125.9166.6-163.80000108.6F224 D233F224-S228 VanDerWaalsContact O-CB 3.22Å; F224-S228 WeakPolarHBondContact O-CB 3.29Å; F224-S228 PolarHBondContact O-N 2.87Å; S228-D233 PolarHBondContact OG-O 3.42Å
229N57Low67.4Low154 Ų15480.5 Ų80.582%0.82443%0.43SS*.  trans-69.4142.9163.4-145.833.2000107.5D231N229-D231 VanDerWaalsContact C-N 3.27Å; N229-D231 PolarHBondContact O-N 2.04Å
230D59.4Low66.4Low136 Ų13680.6 Ų80.673%0.72743%0.43SS*.THydrogen-bonded Turntrans-60.2-19.1-148-152.831.1000117.1
231D55.6Low65.4Low151 Ų15182.4 Ų82.481%0.80744%0.444SS*.THydrogen-bonded Turntrans-114.4-21-161.7-68.3-70.2000118.1N229N229-D231 VanDerWaalsContact C-N 3.27Å; N229-D231 PolarHBondContact O-N 2.04Å
232E53.4Low64.2Low179 Ų17983.2 Ų83.284%0.83646%0.457SS*.THydrogen-bonded Turntrans-105.9-27.6-164.5-80.9-87.4103.400116.3
233D57.1Low63.2Low45 Ų4586.7 Ų86.724%0.24148%0.476CS..  trans-131.2112.7-173.7-83.1-40.8000112.4S228 C235 Q244S228-D233 PolarHBondContact OG-O 3.42Å; D233-C235 HydrophobicContact CB-CB 4.22Å; D233-C235 WeakPolarHBondContact O-CB 3.25Å; D233-C235 PolarHBondContact O-N 3.06Å; D233-Q244 PolarHBondContact OD1-NE2 3.07Å
234N62.7Low62.3Low102 Ų10286.5 Ų86.555%0.54547%0.474SS..  trans-73.967.2167.2-167.9-13.1000111.1D237N234-D237 PolarHBondContact ND2-OD2 2.63Å; N234-D237 WeakPolarHBondContact OD1-CB 3.05Å; N234-D237 PolarHBondContact OD1-OD2 3.13Å; N234-D237 VanDerWaalsContact OD1-OD2 3.14Å
235C58.3Low61.5Low10 Ų1091 Ų917%0.06851%0.506CS..THydrogen-bonded Turntrans-79.3-32.7-169.91780000112.3F224 D233 N238 R250F224-C235 HydrophobicContact CB-CB 4.5Å; F224-C235 VanDerWaalsContact CB-SG 3.57Å; F224-C235 WeakPolarHBondContact CG-SG 3.45Å; D233-C235 HydrophobicContact CB-CB 4.22Å; D233-C235 WeakPolarHBondContact O-CB 3.25Å; D233-C235 PolarHBondContact O-N 3.06Å; C235-N238 CarbonylContact O-C 3.54Å; C235-R250 PolarHBondContact O-NH2 2.99Å; C235-R250 PolarHBondContact SG-NE 3.16Å; C235-R250 PolarHBondContact SG-NH2 2.99Å
236A59.5Low60.9Low24 Ų2488.8 Ų88.820%0.19850%0.501CS..THydrogen-bonded Turntrans-74-34.4-176.500000113.3
237D61.7Low60.6Low107 Ų10782.9 Ų82.957%0.57248%0.477SS*.THydrogen-bonded Turntrans-70.5-34179-77.9-23.5000112.4N234 P239N234-D237 PolarHBondContact ND2-OD2 2.63Å; N234-D237 WeakPolarHBondContact OD1-CB 3.05Å; N234-D237 PolarHBondContact OD1-OD2 3.13Å; N234-D237 VanDerWaalsContact OD1-OD2 3.14Å; D237-P239 WeakPolarHBondContact O-CD 3.4Å
238N61.8Low60.9Low102 Ų10283.3 Ų83.355%0.54548%0.48SS..  trans-127.970.8-176.1-69.4-77.7000112.1C235 C240 S241 R250C235-N238 CarbonylContact O-C 3.54Å; N238-C240 PolarHBondContact O-N 2.87Å; N238-C240 VanDerWaalsContact O-N 3.07Å; N238-S241 PolarHBondContact O-N 2.89Å; N238-R250 PolarHBondContact O-NH2 2.78Å
239P59.8Low61.4Low13 Ų1386.2 Ų86.28%0.08450%0.496CS..THydrogen-bonded Turntrans-65.7-12.1-176.826.6-35.8000114.5V220 F224 D237V220-P239 HydrophobicContact CG1-CB 3.64Å; V220-P239 HydrophobicContact CG1-CG 4.26Å; F224-P239 HydrophobicContact CD2-CB 3.84Å; F224-P239 HydrophobicContact CE2-CB 3.64Å; D237-P239 WeakPolarHBondContact O-CD 3.4Å
240C60.6Low62.4Low63 Ų6379.8 Ų79.843%0.42646%0.461SS..THydrogen-bonded Turntrans-11313.4-176.5-490000113.9N238N238-C240 PolarHBondContact O-N 2.87Å; N238-C240 VanDerWaalsContact O-N 3.07Å
241S61.3Low63.5Low43 Ų4379.2 Ų79.230%0.30145%0.448SS..  trans-82.9131.8179.4-167.70000112.2N238 S243N238-S241 PolarHBondContact O-N 2.89Å; S241-S243 PolarHBondContact OG-OG 2.87Å
242C57.9Low64.6Low83 Ų8375.6 Ų75.656%0.56144%0.435SS*.  trans-87.92.5176.2-63.40000114.3Q244 W251C242-Q244 PolarHBondContact O-N 2.75Å; C242-W251 VanDerWaalsContact SG-CZ2 3.56Å; C242-W251 PolarHBondContact SG-NE1 3.16Å; C242-W251 VanDerWaalsContact SG-NE1 3.44Å
243S58.2Low66Low102 Ų10268.4 Ų68.471%0.71341%0.406SS*.  trans-88.26.8-165.2650000116.3S241S241-S243 PolarHBondContact OG-OG 2.87Å
244Q61.2Low67.1Low58 Ų5867.3 Ų67.327%0.27140%0.4SS..SBendtrans-116.9153.6-176.5-86.2167.8-28.700112.3D233 C242 H246 C247D233-Q244 PolarHBondContact OD1-NE2 3.07Å; C242-Q244 PolarHBondContact O-N 2.75Å; Q244-H246 PolarHBondContact O-N 2.77Å; Q244-C247 WeakPolarHBondContact O-CB 3.31Å; Q244-C247 PolarHBondContact O-N 2.85Å; Q244-C247 VanDerWaalsContact O-N 3.09Å
245S60.1Low68Low103 Ų10364.2 Ų64.272%0.7239%0.392SS*.THydrogen-bonded Turntrans-50.3-30.1-178.846.20000114.5
246H65.4Low69.3Low105 Ų10567.5 Ų67.549%0.48641%0.411SS..THydrogen-bonded Turntrans-98.322.1-177.5-60.8-63.4000114.8Q244 C248 T249 R250Q244-H246 PolarHBondContact O-N 2.77Å; H246-C248 PolarHBondContact O-N 2.8Å; H246-T249 PolarHBondContact O-N 3.3Å; H246-R250 WeakPolarHBondContact O-CG 3.48Å; H246-R250 PolarHBondContact O-N 3.3Å; H246-R250 VanDerWaalsContact O-N 3.1Å
247C69.2Low70.4Confident33 Ų3367.4 Ų67.422%0.22341%0.408CS..Hα-helixtrans-42.6-57.9178.7-175.60000113.4Q244 T249 R250 W251Q244-C247 WeakPolarHBondContact O-CB 3.31Å; Q244-C247 PolarHBondContact O-N 2.85Å; Q244-C247 VanDerWaalsContact O-N 3.09Å; C247-T249 PolarHBondContact O-N 3.21Å; C247-R250 PolarHBondContact O-N 2.91Å; C247-W251 PolarHBondContact O-N 2.68Å
248C73.1Confident71.5Confident101 Ų10163.2 Ų63.268%0.68239%0.387SS*.Hα-helixtrans-60.4-39.7-176-60.80000113.6H246 S252H246-C248 PolarHBondContact O-N 2.8Å; C248-S252 WeakPolarHBondContact O-CB 3.08Å; C248-S252 PolarHBondContact O-N 3.35Å; C248-S252 PolarHBondContact O-OG 3.19Å
249T76.6Confident72.4Confident96 Ų9664.8 Ų64.859%0.58940%0.395SS*.Hα-helixtrans-67.3-40.8178.6-510000110.8H246 C247 S252 A253H246-T249 PolarHBondContact O-N 3.3Å; C247-T249 PolarHBondContact O-N 3.21Å; T249-S252 PolarHBondContact O-N 3.11Å; T249-A253 WeakPolarHBondContact O-CB 3.1Å; T249-A253 PolarHBondContact O-N 2.92Å
250R78.3Confident73.4Confident20 Ų2072 Ų728%0.07543%0.425CS..Hα-helixtrans-68.1-44.4178.7-68176.767.9-172.52111.9F224 C235 N238 H246 C247 S252 A253 M254F224-R250 HydrophobicContact CE1-CB 4.23Å; F224-R250 HydrophobicContact CE1-CG 4.08Å; F224-R250 HydrophobicContact CZ-CB 3.89Å; F224-R250 HydrophobicContact CZ-CG 4.13Å; C235-R250 PolarHBondContact O-NH2 2.99Å; C235-R250 PolarHBondContact SG-NE 3.16Å; C235-R250 PolarHBondContact SG-NH2 2.99Å; N238-R250 PolarHBondContact O-NH2 2.78Å; H246-R250 WeakPolarHBondContact O-CG 3.48Å; H246-R250 PolarHBondContact O-N 3.3Å; H246-R250 VanDerWaalsContact O-N 3.1Å; C247-R250 PolarHBondContact O-N 2.91Å; R250-S252 VanDerWaalsContact C-N 3.33Å; R250-S252 PolarHBondContact O-N 3.18Å; R250-A253 PolarHBondContact O-N 3.33Å; R250-M254 VanDerWaalsContact O-CG 3.31Å; R250-M254 WeakPolarHBondContact O-CG 3.39Å; R250-M254 PolarHBondContact O-N 2.67Å
251W81.2Confident74.5Confident124 Ų12471.4 Ų71.447%0.4742%0.417SS..Hα-helixtrans-63.1-37.9173.1-74.2107.2000112.6C242 C247 M254 G255C242-W251 VanDerWaalsContact SG-CZ2 3.56Å; C242-W251 PolarHBondContact SG-NE1 3.16Å; C242-W251 VanDerWaalsContact SG-NE1 3.44Å; C247-W251 PolarHBondContact O-N 2.68Å; W251-M254 PolarHBondContact O-N 2.94Å; W251-G255 PolarHBondContact O-N 3.2Å
252S79.8Confident75.4Confident74 Ų7473.6 Ų73.652%0.51743%0.431SS..Hα-helixtrans-63.2-45.7173.8-58.60000111.8C248 T249 R250 G255 V256C248-S252 WeakPolarHBondContact O-CB 3.08Å; C248-S252 PolarHBondContact O-N 3.35Å; C248-S252 PolarHBondContact O-OG 3.19Å; T249-S252 PolarHBondContact O-N 3.11Å; R250-S252 VanDerWaalsContact C-N 3.33Å; R250-S252 PolarHBondContact O-N 3.18Å; S252-G255 PolarHBondContact O-N 2.91Å; S252-V256 WeakPolarHBondContact O-CG2 3.41Å; S252-V256 PolarHBondContact O-N 3.44Å
253A81.4Confident76.5Confident29 Ų2971.1 Ų71.124%0.2441%0.414CS..Hα-helixtrans-61.4-43.817500000111.9F224 T249 R250 G255 V256 V257F224-A253 HydrophobicContact CE1-CB 4.26Å; T249-A253 WeakPolarHBondContact O-CB 3.1Å; T249-A253 PolarHBondContact O-N 2.92Å; R250-A253 PolarHBondContact O-N 3.33Å; A253-G255 VanDerWaalsContact C-N 3.33Å; A253-G255 PolarHBondContact O-N 3.38Å; A253-V256 PolarHBondContact O-N 2.87Å; A253-V257 WeakPolarHBondContact O-CB 3.45Å; A253-V257 VanDerWaalsContact O-CG2 3.24Å; A253-V257 WeakPolarHBondContact O-CG2 3.08Å; A253-V257 PolarHBondContact O-N 3.07Å
254M80.8Confident77.6Confident22 Ų2267 Ų6711%0.10838%0.384CS..Hα-helixtrans-60.2-41.2173.2-67.4-57.483.300112.4V220 F224 R250 W251 S258V220-M254 HydrophobicContact CB-CE 4.06Å; V220-M254 HydrophobicContact CB-SD 4.06Å; V220-M254 HydrophobicContact CG1-CE 3.68Å; V220-M254 HydrophobicContact CG1-SD 3.34Å; V220-M254 WeakPolarHBondContact CG1-SD 3.29Å; V220-M254 HydrophobicContact CG2-CE 3.61Å; V220-M254 HydrophobicContact CG2-SD 3.6Å; V220-M254 VanDerWaalsContact CG2-SD 3.6Å; F224-M254 HydrophobicContact CD1-CE 4.48Å; F224-M254 HydrophobicContact CD2-CE 4.32Å; F224-M254 HydrophobicContact CE1-CE 3.75Å; F224-M254 HydrophobicContact CE2-CE 3.55Å; F224-M254 HydrophobicContact CE2-CG 4.32Å; F224-M254 HydrophobicContact CE2-SD 3.73Å; F224-M254 HydrophobicContact CZ-CE 3.23Å; F224-M254 HydrophobicContact CZ-CG 3.98Å; F224-M254 HydrophobicContact CZ-SD 3.81Å; R250-M254 VanDerWaalsContact O-CG 3.31Å; R250-M254 WeakPolarHBondContact O-CG 3.39Å; R250-M254 PolarHBondContact O-N 2.67Å; W251-M254 PolarHBondContact O-N 2.94Å; M254-S258 VanDerWaalsContact O-CB 3.28Å; M254-S258 WeakPolarHBondContact O-CB 3.46Å; M254-S258 PolarHBondContact O-N 3Å; M254-S258 PolarHBondContact O-OG 3.44Å
255G82.6Confident78.5Confident36 Ų3672.7 Ų72.737%0.37140%0.403SS..Hα-helixtrans-60.4-52175.400000111.9W251 S252 A253 S258 L259W251-G255 PolarHBondContact O-N 3.2Å; S252-G255 PolarHBondContact O-N 2.91Å; A253-G255 VanDerWaalsContact C-N 3.33Å; A253-G255 PolarHBondContact O-N 3.38Å; G255-S258 WeakPolarHBondContact O-CB 3.09Å; G255-S258 PolarHBondContact O-N 3.34Å; G255-L259 PolarHBondContact O-N 2.99Å
256V84.8Confident79.6Confident80 Ų8071.2 Ų71.249%0.48539%0.392SS..Hα-helixtrans-59.4-49.5178.4172.60000111.3S252 A253 S258 L259 F260S252-V256 WeakPolarHBondContact O-CG2 3.41Å; S252-V256 PolarHBondContact O-N 3.44Å; A253-V256 PolarHBondContact O-N 2.87Å; V256-S258 VanDerWaalsContact C-N 3.27Å; V256-S258 PolarHBondContact O-N 3.2Å; V256-L259 WeakPolarHBondContact O-CB 3.41Å; V256-L259 PolarHBondContact O-N 3.44Å; V256-L259 VanDerWaalsContact O-N 3.11Å; V256-F260 HydrophobicContact CG1-CD2 4.28Å; V256-F260 HydrophobicContact CG1-CE2 3.8Å; V256-F260 WeakPolarHBondContact O-CD2 3.14Å
257V83.1Confident80.5Confident22 Ų2266.9 Ų66.913%0.13337%0.371CS..Hα-helixtrans-62.6-35.6178.6-179.10000111.1V220 L223 A253 L259 F260 L261 L264V220-V257 HydrophobicContact CG2-CG1 4.19Å; L223-V257 HydrophobicContact CD2-CG2 3.51Å; A253-V257 WeakPolarHBondContact O-CB 3.45Å; A253-V257 VanDerWaalsContact O-CG2 3.24Å; A253-V257 WeakPolarHBondContact O-CG2 3.08Å; A253-V257 PolarHBondContact O-N 3.07Å; V257-L259 VanDerWaalsContact C-N 3.28Å; V257-L259 PolarHBondContact O-N 2.78Å; V257-F260 PolarHBondContact O-N 3.01Å; V257-F260 VanDerWaalsContact O-N 3.16Å; V257-L261 HydrophobicContact CG1-CD1 3.85Å; V257-L261 WeakPolarHBondContact O-CB 3.04Å; V257-L261 PolarHBondContact O-N 3.04Å; V257-L264 HydrophobicContact CB-CD1 4.25Å; V257-L264 HydrophobicContact CG1-CD1 3.61Å
258S84Confident81.1Confident19 Ų1971.4 Ų71.413%0.13339%0.392CS..Hα-helixtrans-66.7-23.8176.4-58.80000114.2M254 G255 V256 L261M254-S258 VanDerWaalsContact O-CB 3.28Å; M254-S258 WeakPolarHBondContact O-CB 3.46Å; M254-S258 PolarHBondContact O-N 3Å; M254-S258 PolarHBondContact O-OG 3.44Å; G255-S258 WeakPolarHBondContact O-CB 3.09Å; G255-S258 PolarHBondContact O-N 3.34Å; V256-S258 VanDerWaalsContact C-N 3.27Å; V256-S258 PolarHBondContact O-N 3.2Å; S258-L261 CarbonylContact O-C 3.42Å
259L82Confident81.7Confident135 Ų13570.2 Ų70.271%0.70738%0.384SS*.Hα-helixtrans-70.3-35.2172.4-64.4172.1000111.7G255 V256 V257G255-L259 PolarHBondContact O-N 2.99Å; V256-L259 WeakPolarHBondContact O-CB 3.41Å; V256-L259 PolarHBondContact O-N 3.44Å; V256-L259 VanDerWaalsContact O-N 3.11Å; V257-L259 VanDerWaalsContact C-N 3.28Å; V257-L259 PolarHBondContact O-N 2.78Å
260F80.6Confident82Confident164 Ų16467 Ų6772%0.71937%0.366SS*.Hα-helixtrans-84.8-26.9176.6-62.5-70.7000113V256 V257V256-F260 HydrophobicContact CG1-CD2 4.28Å; V256-F260 HydrophobicContact CG1-CE2 3.8Å; V256-F260 WeakPolarHBondContact O-CD2 3.14Å; V257-F260 PolarHBondContact O-N 3.01Å; V257-F260 VanDerWaalsContact O-N 3.16Å
261L82.4Confident82.3Confident50 Ų5069.5 Ų69.526%0.26238%0.378SS..  trans-126.378.4-176.4-69.7173.5000110.3C216 C219 V257 S258 C263 L264C216-L261 HydrophobicContact CB-CB 4.35Å; C216-L261 HydrophobicContact CB-CD1 4.04Å; C216-L261 HydrophobicContact CB-CD2 4.28Å; C216-L261 HydrophobicContact CB-CG 4.47Å; C219-L261 HydrophobicContact CB-CD1 3.79Å; V257-L261 HydrophobicContact CG1-CD1 3.85Å; V257-L261 WeakPolarHBondContact O-CB 3.04Å; V257-L261 PolarHBondContact O-N 3.04Å; S258-L261 CarbonylContact O-C 3.42Å; L261-C263 PolarHBondContact O-N 2.92Å; L261-L264 HydrophobicContact CB-CD1 3.9Å; L261-L264 HydrophobicContact CB-CG 4.24Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 2.85Å
262P79.9Confident82.4Confident89 Ų8965.5 Ų65.558%0.57838%0.375SS*.G310 helixtrans-62.2-17.5-179.625.2-35000113.4L264 W265P262-L264 PolarHBondContact O-N 3.42Å; P262-W265 PolarHBondContact O-N 3.43Å; P262-W265 VanDerWaalsContact O-N 3.16Å
263C82.4Confident82.6Confident31 Ų3165.5 Ų65.521%0.20937%0.374CS..G310 helixtrans-52.7-28.1167.340.90000113.6T215 C216 L261 W265 C266T215-C263 WeakPolarHBondContact CB-O 3.36Å; T215-C263 CarbonylContact O-C 3.36Å; C216-C263 HydrophobicContact CB-CB 4.16Å; C216-C263 WeakPolarHBondContact CB-SG 3.29Å; C216-C263 WeakPolarHBondContact SG-CB 3.1Å; C216-C263 CovalentContact SG-SG 2.04Å; C216-C263 PolarHBondContact SG-SG 3Å; L261-C263 PolarHBondContact O-N 2.92Å; C263-W265 VanDerWaalsContact C-N 3.33Å; C263-W265 PolarHBondContact O-N 2.88Å; C263-C266 VanDerWaalsContact O-CB 3.31Å; C263-C266 WeakPolarHBondContact O-CB 3.36Å; C263-C266 PolarHBondContact O-N 3.44Å
264L80.7Confident82.7Confident16 Ų1665.7 Ų65.78%0.08437%0.371CS..G310 helixtrans-65.8-32178.2-75.1166.7000113.2T215 V217 V220 V257 L261 P262 C266 Y267T215-L264 WeakPolarHBondContact O-CA 3.42Å; T215-L264 WeakPolarHBondContact O-CD2 3.45Å; T215-L264 PolarHBondContact O-N 3.41Å; V217-L264 HydrophobicContact CB-CD2 4.4Å; V217-L264 HydrophobicContact CG2-CD2 3.56Å; V220-L264 HydrophobicContact CB-CD2 4.49Å; V220-L264 HydrophobicContact CG2-CD1 3.78Å; V220-L264 HydrophobicContact CG2-CD2 3.64Å; V220-L264 HydrophobicContact CG2-CG 4.41Å; V257-L264 HydrophobicContact CB-CD1 4.25Å; V257-L264 HydrophobicContact CG1-CD1 3.61Å; L261-L264 HydrophobicContact CB-CD1 3.9Å; L261-L264 HydrophobicContact CB-CG 4.24Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 2.85Å; P262-L264 PolarHBondContact O-N 3.42Å; L264-C266 PolarHBondContact O-N 2.85Å; L264-Y267 WeakPolarHBondContact O-CB 3.4Å; L264-Y267 PolarHBondContact O-N 3.14Å
265W79.5Confident82.9Confident178 Ų17871.2 Ų71.267%0.67439%0.394SS*.G310 helixtrans-66-24.8174.1-68.73000112P262 C263 Y267 P269P262-W265 PolarHBondContact O-N 3.43Å; P262-W265 VanDerWaalsContact O-N 3.16Å; C263-W265 VanDerWaalsContact C-N 3.33Å; C263-W265 PolarHBondContact O-N 2.88Å; W265-Y267 VanDerWaalsContact C-N 3.31Å; W265-P269 WeakPolarHBondContact O-CD 3.4Å
266C83.1Confident83Confident71 Ų7175 Ų7548%0.4841%0.406SS..G310 helixtrans-77.9-12.6173.9-59.20000113T215 C263 L264 P269 A270T215-C266 HydrophobicContact CG2-CB 4.26Å; C263-C266 VanDerWaalsContact O-CB 3.31Å; C263-C266 WeakPolarHBondContact O-CB 3.36Å; C263-C266 PolarHBondContact O-N 3.44Å; L264-C266 PolarHBondContact O-N 2.85Å; C266-P269 WeakPolarHBondContact O-CD 3.41Å; C266-P269 WeakPolarHBondContact O-CG 3.34Å; C266-A270 WeakPolarHBondContact O-CB 3.28Å; C266-A270 PolarHBondContact O-N 2.87Å
267Y84.6Confident82.9Confident15 Ų1574.7 Ų74.76%0.05941%0.406CS..Hα-helixtrans-63-48177.2180-122.7000113.2V211 T215 V217 L264 W265 A270 K271V211-Y267 HydrophobicContact CG1-CD2 3.74Å; V211-Y267 HydrophobicContact CG1-CE2 4Å; T215-Y267 VanDerWaalsContact OG1-CD2 3.29Å; T215-Y267 WeakPolarHBondContact OG1-CD2 3.5Å; V217-Y267 HydrophobicContact CB-CD2 4.31Å; V217-Y267 HydrophobicContact CB-CE2 4.23Å; V217-Y267 HydrophobicContact CG1-CE2 4.22Å; V217-Y267 HydrophobicContact CG2-CD1 3.74Å; V217-Y267 HydrophobicContact CG2-CD2 3.48Å; V217-Y267 VanDerWaalsContact CG2-CD2 3.48Å; V217-Y267 HydrophobicContact CG2-CE1 4.04Å; V217-Y267 HydrophobicContact CG2-CE2 3.77Å; V217-Y267 HydrophobicContact CG2-CG 3.42Å; V217-Y267 VanDerWaalsContact CG2-CG 3.42Å; L264-Y267 WeakPolarHBondContact O-CB 3.4Å; L264-Y267 PolarHBondContact O-N 3.14Å; W265-Y267 VanDerWaalsContact C-N 3.31Å; Y267-A270 PolarHBondContact O-N 3.46Å; Y267-K271 HydrophobicContact CE1-CD 3.9Å; Y267-K271 HydrophobicContact CE2-CD 4.12Å; Y267-K271 WeakPolarHBondContact O-CB 3.19Å; Y267-K271 PolarHBondContact O-N 3.29Å; Y267-K271 PolarHBondContact OH-NZ 2.88Å
268L82.9Confident83Confident127 Ų12776.7 Ų76.767%0.66541%0.414SS*.Hα-helixtrans-59.4-52.5-179.5-67.1172.5000112.4G272L268-G272 PolarHBondContact O-N 2.71Å
269P84.6Confident82.9Confident77 Ų7777.3 Ų77.350%0.542%0.423SS..Hα-helixtrans-66.2-41.2175.325.5-32.7000112.1W265 C266 K271 G272 C273W265-P269 WeakPolarHBondContact O-CD 3.4Å; C266-P269 WeakPolarHBondContact O-CD 3.41Å; C266-P269 WeakPolarHBondContact O-CG 3.34Å; P269-K271 PolarHBondContact O-N 3.39Å; P269-G272 CarbonylContact O-C 3.56Å; P269-G272 WeakPolarHBondContact O-CA 3.42Å; P269-G272 PolarHBondContact O-N 3.3Å; P269-G272 VanDerWaalsContact O-N 3.15Å; P269-C273 WeakPolarHBondContact O-CB 3.39Å; P269-C273 PolarHBondContact O-N 3.37Å; P269-C273 PolarHBondContact O-SG 3.2Å
270A83.3Confident82.9Confident27 Ų2774.2 Ų74.222%0.22341%0.412CS..Hα-helixtrans-62.2-43178.900000112.6V211 T215 C266 Y267 G272 C273 L274V211-A270 HydrophobicContact CG1-CB 3.91Å; V211-A270 HydrophobicContact CG2-CB 4.01Å; T215-A270 HydrophobicContact CG2-CB 4.27Å; C266-A270 WeakPolarHBondContact O-CB 3.28Å; C266-A270 PolarHBondContact O-N 2.87Å; Y267-A270 PolarHBondContact O-N 3.46Å; A270-G272 VanDerWaalsContact C-N 3.34Å; A270-C273 PolarHBondContact O-N 2.92Å; A270-L274 WeakPolarHBondContact O-CG 3.49Å; A270-L274 PolarHBondContact O-N 3.18Å
271K84.1Confident83Confident74 Ų7469 Ų6932%0.32239%0.388SS..Hα-helixtrans-66-36.6174.3-168.6174.8-168.4170.30111.6Y267 P269 L274 K275Y267-K271 HydrophobicContact CE1-CD 3.9Å; Y267-K271 HydrophobicContact CE2-CD 4.12Å; Y267-K271 WeakPolarHBondContact O-CB 3.19Å; Y267-K271 PolarHBondContact O-N 3.29Å; Y267-K271 PolarHBondContact OH-NZ 2.88Å; P269-K271 PolarHBondContact O-N 3.39Å; K271-L274 PolarHBondContact O-N 3.1Å; K271-K275 WeakPolarHBondContact O-CG 3.29Å; K271-K275 PolarHBondContact O-N 3.09Å
272G84.2Confident83.1Confident39 Ų3967.3 Ų67.340%0.40238%0.379SS..Hα-helixtrans-60.1-50.1170.300000112.2L268 P269 A270 L274 K275 L276L268-G272 PolarHBondContact O-N 2.71Å; P269-G272 CarbonylContact O-C 3.56Å; P269-G272 WeakPolarHBondContact O-CA 3.42Å; P269-G272 PolarHBondContact O-N 3.3Å; P269-G272 VanDerWaalsContact O-N 3.15Å; A270-G272 VanDerWaalsContact C-N 3.34Å; G272-L274 PolarHBondContact O-N 3.31Å; G272-K275 PolarHBondContact O-N 3.06Å; G272-L276 WeakPolarHBondContact O-CB 3.42Å; G272-L276 PolarHBondContact O-N 2.78Å
273C84.1Confident83Confident75 Ų7570.6 Ų70.651%0.50738%0.38SS..Hα-helixtrans-58.1-45.5174.6-68.50000111.6P269 A270 K275 L276 C277P269-C273 WeakPolarHBondContact O-CB 3.39Å; P269-C273 PolarHBondContact O-N 3.37Å; P269-C273 PolarHBondContact O-SG 3.2Å; A270-C273 PolarHBondContact O-N 2.92Å; C273-K275 PolarHBondContact O-N 2.95Å; C273-L276 PolarHBondContact O-N 2.97Å; C273-C277 WeakPolarHBondContact O-CB 3.34Å; C273-C277 PolarHBondContact O-N 3.32Å; C273-C277 PolarHBondContact O-SG 3.3Å
274L83.3Confident82.9Confident32 Ų3274.6 Ų74.617%0.16840%0.403CS..Hα-helixtrans-59.6-44.9174.9-73.4-173.1000112.5A207 V211 A270 K271 G272 L276 C277 Q278A207-L274 HydrophobicContact CB-CD1 4.42Å; A207-L274 HydrophobicContact CB-CD2 3.81Å; V211-L274 HydrophobicContact CB-CD1 4.02Å; V211-L274 HydrophobicContact CG2-CD1 3.53Å; V211-L274 HydrophobicContact CG2-CG 3.98Å; A270-L274 WeakPolarHBondContact O-CG 3.49Å; A270-L274 PolarHBondContact O-N 3.18Å; K271-L274 PolarHBondContact O-N 3.1Å; G272-L274 PolarHBondContact O-N 3.31Å; L274-L276 VanDerWaalsContact C-N 3.33Å; L274-L276 PolarHBondContact O-N 2.72Å; L274-C277 PolarHBondContact O-N 2.85Å; L274-Q278 VanDerWaalsContact O-CB 3.29Å; L274-Q278 WeakPolarHBondContact O-CB 3.41Å; L274-Q278 PolarHBondContact O-N 3.17Å
275K84.8Confident82.6Confident138 Ų13878.1 Ų78.160%0.642%0.422SS*.Hα-helixtrans-66.1-35.3176.9-69.9-56.5-174.581.20112.2K271 G272 C273 G279K271-K275 WeakPolarHBondContact O-CG 3.29Å; K271-K275 PolarHBondContact O-N 3.09Å; G272-K275 PolarHBondContact O-N 3.06Å; C273-K275 PolarHBondContact O-N 2.95Å; K275-G279 PolarHBondContact O-N 2.73Å
276L85.5Confident82.6Confident117 Ų11771.5 Ų71.561%0.61340%0.397SS*.Hα-helixtrans-67.9-48.9174.3-175.464.5000111.2G272 C273 L274 Q278 G279 C280G272-L276 WeakPolarHBondContact O-CB 3.42Å; G272-L276 PolarHBondContact O-N 2.78Å; C273-L276 PolarHBondContact O-N 2.97Å; L274-L276 VanDerWaalsContact C-N 3.33Å; L274-L276 PolarHBondContact O-N 2.72Å; L276-Q278 VanDerWaalsContact C-N 3.35Å; L276-Q278 PolarHBondContact O-N 2.98Å; L276-G279 CarbonylContact O-C 3.52Å; L276-G279 WeakPolarHBondContact O-CA 3.21Å; L276-G279 PolarHBondContact O-N 3.34Å; L276-G279 VanDerWaalsContact O-N 3.09Å; L276-C280 PolarHBondContact O-N 3.3Å; L276-C280 PolarHBondContact O-SG 2.99Å; L276-C280 VanDerWaalsContact O-SG 3.38Å
277C82.3Confident82.2Confident72 Ų7271.7 Ų71.749%0.48640%0.398SS..Hα-helixtrans-60-42176-69.80000111.8C273 L274 G279 C280 Y281C273-C277 WeakPolarHBondContact O-CB 3.34Å; C273-C277 PolarHBondContact O-N 3.32Å; C273-C277 PolarHBondContact O-SG 3.3Å; L274-C277 PolarHBondContact O-N 2.85Å; C277-G279 VanDerWaalsContact C-N 3.34Å; C277-C280 PolarHBondContact O-N 3.47Å; C277-Y281 VanDerWaalsContact O-CB 3.24Å; C277-Y281 WeakPolarHBondContact O-CB 3.42Å; C277-Y281 PolarHBondContact O-N 3.03Å
278Q84.6Confident82.1Confident64 Ų6471 Ų7130%0.29940%0.395SS..Hα-helixtrans-65.4-38.6173.3-172.8159.4-32.900111.9L193 L274 L276 Y281 D282L193-Q278 HydrophobicContact CD1-CB 3.76Å; L193-Q278 HydrophobicContact CD1-CG 4.42Å; L193-Q278 HydrophobicContact CD2-CB 4.48Å; L193-Q278 HydrophobicContact CG-CB 3.72Å; L193-Q278 HydrophobicContact CG-CG 3.93Å; L274-Q278 VanDerWaalsContact O-CB 3.29Å; L274-Q278 WeakPolarHBondContact O-CB 3.41Å; L274-Q278 PolarHBondContact O-N 3.17Å; L276-Q278 VanDerWaalsContact C-N 3.35Å; L276-Q278 PolarHBondContact O-N 2.98Å; Q278-Y281 PolarHBondContact O-N 3.29Å; Q278-D282 WeakPolarHBondContact O-CB 3.31Å; Q278-D282 PolarHBondContact O-N 3.36Å
279G81.8Confident82.2Confident32 Ų3265.4 Ų65.433%0.3337%0.366SS..Hα-helixtrans-58.7-53.3170.900000111.7K275 L276 C277 Y281 D282 R283K275-G279 PolarHBondContact O-N 2.73Å; L276-G279 CarbonylContact O-C 3.52Å; L276-G279 WeakPolarHBondContact O-CA 3.21Å; L276-G279 PolarHBondContact O-N 3.34Å; L276-G279 VanDerWaalsContact O-N 3.09Å; C277-G279 VanDerWaalsContact C-N 3.34Å; G279-Y281 PolarHBondContact O-N 2.94Å; G279-D282 PolarHBondContact O-N 3.05Å; G279-R283 WeakPolarHBondContact O-CG 3.47Å; G279-R283 PolarHBondContact O-N 3.27Å
280C82.9Confident82Confident70 Ų7067.3 Ų67.347%0.47336%0.364SS..Hα-helixtrans-60.1-42.8177.2-68.60000112.2L276 C277 R283 V284L276-C280 PolarHBondContact O-N 3.3Å; L276-C280 PolarHBondContact O-SG 2.99Å; L276-C280 VanDerWaalsContact O-SG 3.38Å; C277-C280 PolarHBondContact O-N 3.47Å; C280-R283 WeakPolarHBondContact O-CB 3.24Å; C280-R283 PolarHBondContact O-N 2.68Å; C280-R283 VanDerWaalsContact O-N 3.11Å; C280-V284 WeakPolarHBondContact O-CG2 3.34Å; C280-V284 PolarHBondContact O-N 3.12Å
281Y82.6Confident81.9Confident55 Ų5568.5 Ų68.522%0.21637%0.37CS..Hα-helixtrans-61-46.4175.5-178.4-102.7000111.6R191 L193 P194 W197 C277 Q278 G279 R283 V284 N285R191-Y281 HydrophobicContact CB-CE1 4.3Å; L193-Y281 HydrophobicContact CD2-CD1 4.19Å; L193-Y281 HydrophobicContact CD2-CG 3.98Å; P194-Y281 HydrophobicContact CG-CE1 4.43Å; W197-Y281 HydrophobicContact CH2-CD2 4.31Å; W197-Y281 AromaticContact CZ2-CD2 3.9Å; W197-Y281 HydrophobicContact CZ2-CD2 3.9Å; W197-Y281 AromaticContact CZ2-CE2 3.96Å; W197-Y281 HydrophobicContact CZ2-CE2 3.96Å; C277-Y281 VanDerWaalsContact O-CB 3.24Å; C277-Y281 WeakPolarHBondContact O-CB 3.42Å; C277-Y281 PolarHBondContact O-N 3.03Å; Q278-Y281 PolarHBondContact O-N 3.29Å; G279-Y281 PolarHBondContact O-N 2.94Å; Y281-R283 VanDerWaalsContact C-N 3.28Å; Y281-R283 PolarHBondContact O-N 2.63Å; Y281-V284 PolarHBondContact O-N 3.23Å; Y281-N285 HydrophobicContact CE1-CB 4.38Å; Y281-N285 HydrophobicContact CE2-CB 4.12Å; Y281-N285 VanDerWaalsContact CE2-ND2 3.32Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.44Å; Y281-N285 WeakPolarHBondContact O-CB 3.39Å; Y281-N285 PolarHBondContact O-N 3.13Å; Y281-N285 PolarHBondContact OH-ND2 3.44Å; Y281-N285 VanDerWaalsContact OH-ND2 3.11Å
282D83.4Confident81.6Confident15 Ų1574 Ų748%0.0839%0.394CS..Hα-helixtrans-62.6-33.1172.4-178.366.7000112.6P190 R191 Q278 G279 V284 R286P190-D282 WeakPolarHBondContact CA-OD1 3.49Å; R191-D282 PolarHBondContact N-OD1 3.19Å; Q278-D282 WeakPolarHBondContact O-CB 3.31Å; Q278-D282 PolarHBondContact O-N 3.36Å; G279-D282 PolarHBondContact O-N 3.05Å; D282-V284 VanDerWaalsContact C-N 3.34Å; D282-V284 PolarHBondContact O-N 3.2Å; D282-R286 WeakPolarHBondContact O-CB 3.24Å; D282-R286 PolarHBondContact O-N 3.35Å; D282-R286 WeakPolarHBondContact OD1-CD 3.32Å; D282-R286 IonicContact OD1-NE 3.74Å; D282-R286 IonicContact OD1-NH1 3.59Å; D282-R286 IonicContact OD2-CZ 3.58Å; D282-R286 IonicContact OD2-NH1 2.68Å; D282-R286 PolarHBondContact OD2-NH1 2.94Å
283R79.3Confident81.2Confident157 Ų15780.9 Ų80.959%0.59242%0.415SS*.Hα-helixtrans-68.4-32.8176.7-67.9-71.8169.3113.8-1.8112.8G279 C280 Y281 R290G279-R283 WeakPolarHBondContact O-CG 3.47Å; G279-R283 PolarHBondContact O-N 3.27Å; C280-R283 WeakPolarHBondContact O-CB 3.24Å; C280-R283 PolarHBondContact O-N 2.68Å; C280-R283 VanDerWaalsContact O-N 3.11Å; Y281-R283 VanDerWaalsContact C-N 3.28Å; Y281-R283 PolarHBondContact O-N 2.63Å; R283-R290 VanDerWaalsContact CD-NH1 3.34Å; R283-R290 VanDerWaalsContact CZ-NH2 3.28Å
284V79.8Confident80.8Confident115 Ų11577.9 Ų77.970%0.69740%0.395SS*.Hα-helixtrans-90.5-51.9-177.8176.40000111.9C280 Y281 D282C280-V284 WeakPolarHBondContact O-CG2 3.34Å; C280-V284 PolarHBondContact O-N 3.12Å; Y281-V284 PolarHBondContact O-N 3.23Å; D282-V284 VanDerWaalsContact C-N 3.34Å; D282-V284 PolarHBondContact O-N 3.2Å
285N75Confident80.4Confident90 Ų9081.9 Ų81.948%0.48142%0.416SS..Hα-helixtrans-86.8-2.8-171-96.124.1000115.3Y281 P287Y281-N285 HydrophobicContact CE1-CB 4.38Å; Y281-N285 HydrophobicContact CE2-CB 4.12Å; Y281-N285 VanDerWaalsContact CE2-ND2 3.32Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.44Å; Y281-N285 WeakPolarHBondContact O-CB 3.39Å; Y281-N285 PolarHBondContact O-N 3.13Å; Y281-N285 PolarHBondContact OH-ND2 3.44Å; Y281-N285 VanDerWaalsContact OH-ND2 3.11Å; N285-P287 WeakPolarHBondContact O-CD 3.42Å
286R79.1Confident80.3Confident39 Ų3978.5 Ų78.515%0.14741%0.407CS..  trans-79.5120.1-178.9-171.2-179.7-167.7165.3-8.9111.5K181 C187 T188 D282K181-R286 PolarHBondContact NZ-O 3.44Å; C187-R286 WeakPolarHBondContact O-CG 3.36Å; T188-R286 PolarHBondContact O-NE 3.24Å; T188-R286 PolarHBondContact O-NH2 3.3Å; D282-R286 WeakPolarHBondContact O-CB 3.24Å; D282-R286 PolarHBondContact O-N 3.35Å; D282-R286 WeakPolarHBondContact OD1-CD 3.32Å; D282-R286 IonicContact OD1-NE 3.74Å; D282-R286 IonicContact OD1-NH1 3.59Å; D282-R286 IonicContact OD2-CZ 3.58Å; D282-R286 IonicContact OD2-NH1 2.68Å; D282-R286 PolarHBondContact OD2-NH1 2.94Å
287P74.7Confident79.9Confident76 Ų7675.8 Ų75.849%0.49440%0.395SS..  trans-78.7-19.3-175.631.5-35.5000113.4K181 N285K181-P287 WeakPolarHBondContact CB-O 3.19Å; K181-P287 WeakPolarHBondContact CD-O 3.32Å; N285-P287 WeakPolarHBondContact O-CD 3.42Å
288G82.4Confident79.7Confident0 Ų075.7 Ų75.70%040%0.395CS..SBendtrans-80.9168.3-178.700000115.3K181 C182 C187K181-G288 VanDerWaalsContact CD-O 3.3Å; K181-G288 WeakPolarHBondContact CD-O 3.24Å; C182-G288 CarbonylContact O-C 3.48Å; C182-G288 WeakPolarHBondContact O-CA 3.5Å; C187-G288 VanDerWaalsContact O-CA 3.24Å; C187-G288 WeakPolarHBondContact O-CA 3.4Å; C187-G288 PolarHBondContact O-N 3.17Å
289C83.8Confident78.9Confident9 Ų975.2 Ų75.26%0.06140%0.398CS..  trans-74.8158.4178.4-156.70000113C176 C179 K181 C182 K183 C291C176-C289 HydrophobicContact CB-CB 3.73Å; C176-C289 WeakPolarHBondContact CB-SG 3.49Å; C176-C289 PolarHBondContact SG-SG 3.46Å; C179-C289 WeakPolarHBondContact CB-SG 3.44Å; C179-C289 WeakPolarHBondContact SG-CB 3.24Å; C179-C289 CovalentContact SG-SG 2.04Å; C179-C289 PolarHBondContact SG-SG 3.22Å; K181-C289 HydrophobicContact CB-CB 3.96Å; C182-C289 PolarHBondContact O-N 3.3Å; K183-C289 HydrophobicContact CG-CB 4.13Å; C289-C291 VanDerWaalsContact SG-SG 3.66Å
290R80.5Confident77.8Confident118 Ų11882.8 Ų82.845%0.44542%0.422SS..  trans-132.85.8-176.1-60.7-177.953.9-104.8-32113.8R283R283-R290 VanDerWaalsContact CD-NH1 3.34Å; R283-R290 VanDerWaalsContact CZ-NH2 3.28Å
291C82.4Confident76.7Confident52 Ų5284.9 Ų84.935%0.35143%0.432SS..  trans-68.4135.7175.1-60.20000110.5C289 S294C289-C291 VanDerWaalsContact SG-SG 3.66Å; C291-S294 WeakPolarHBondContact CB-OG 3.44Å
292K78.1Confident75Confident190 Ų19087.5 Ų87.583%0.82646%0.456SS*.SBendtrans-81.1-31.3-177.8-73.4-173.6173.8-174.90114.2
293H74.4Confident73.3Confident182 Ų18292.1 Ų92.184%0.84349%0.489SS*.SBendtrans-129.722.8-169.9-54129000113.4
294S75.4Confident71.8Confident13 Ų1390.6 Ų90.69%0.09150%0.497CS..  trans-83.4145-178.270.80000111.9C176 D178 K183 C291C176-S294 WeakPolarHBondContact SG-CB 3.23Å; C176-S294 PolarHBondContact SG-OG 2.83Å; D178-S294 WeakPolarHBondContact OD2-CB 3.02Å; K183-S294 WeakPolarHBondContact CE-OG 3.22Å; K183-S294 PolarHBondContact NZ-O 3.42Å; K183-S294 PolarHBondContact NZ-OG 3.21Å; C291-S294 WeakPolarHBondContact CB-OG 3.44Å
295N76.5Confident70.5Confident115 Ų11589.9 Ų89.962%0.61550%0.495SS*.  trans-69.5169.8167.5-69.3-49.6000110.9E177 K183E177-N295 HydrophobicContact CG-CB 4.48Å; E177-N295 WeakPolarHBondContact OE2-CB 3.25Å; K183-N295 PolarHBondContact NZ-O 3.02Å; K183-N295 VanDerWaalsContact NZ-O 3.12Å
296T81Confident69.2Low67 Ų6791.2 Ų91.241%0.41151%0.509SS..EExtended strand (participates in β ladder)trans-130.2113.8-172.5-44.80000109.7Y174 R175 K183Y174-T296 HydrophobicContact CD1-CG2 4.22Å; Y174-T296 HydrophobicContact CG-CG2 4.45Å; R175-T296 CarbonylContact O-C 3.51Å; R175-T296 WeakPolarHBondContact O-CA 3.44Å; K183-T296 HydrophobicContact CB-CG2 4.5Å; K183-T296 HydrophobicContact CD-CG2 3.87Å; K183-T296 WeakPolarHBondContact CD-OG1 3.48Å; K183-T296 HydrophobicContact CG-CG2 4.41Å; K183-T296 PolarHBondContact NZ-OG1 2.97Å
297V78.8Confident67.7Low60 Ų60100.1 Ų100.136%0.36454%0.542SS..EExtended strand (participates in β ladder)trans-89.6135.2177.2170.20000109.9R175 E177R175-V297 PolarHBondContact N-O 2.78Å; R175-V297 PolarHBondContact O-N 3.35Å; E177-V297 HydrophobicContact CG-CB 4.48Å; E177-V297 HydrophobicContact CG-CG2 3.47Å; E177-V297 VanDerWaalsContact CG-CG2 3.47Å; E177-V297 WeakPolarHBondContact OE1-CG2 3.47Å
298C76.9Confident66.1Low71 Ų71103.6 Ų103.648%0.4856%0.557SS.*EExtended strand (participates in β ladder)trans-87.3102.2169.7-172.50000108.7T173 Y174 K300T173-C298 WeakPolarHBondContact CG2-SG 3.48Å; Y174-C298 HydrophobicContact CD1-CB 4.43Å; Y174-C298 HydrophobicContact CE1-CB 4.24Å; C298-K300 VanDerWaalsContact C-N 3.33Å; C298-K300 PolarHBondContact O-N 2.9Å
299C67.8Low64.5Low54 Ų54113.3 Ų113.337%0.36560%0.599SS.*  trans-73.285.2175.7-670000110.3T173 V301T173-C299 VanDerWaalsContact CG2-O 3.23Å; T173-C299 WeakPolarHBondContact CG2-O 3.34Å; T173-C299 PolarHBondContact O-N 3.29Å; C299-V301 PolarHBondContact O-N 3.05Å
300K60Low62.7Low190 Ų190121.7 Ų121.783%0.82664%0.637SS**  trans-61.5105.4177.3-168.4162.8-174.4171.80109.9C298C298-K300 VanDerWaalsContact C-N 3.33Å; C298-K300 PolarHBondContact O-N 2.9Å
301V58.3Low60.8Low114 Ų114125.2 Ų125.269%0.69166%0.656SS**  trans-59.9127.2177.8-177.10000108.3C299 S303C299-V301 PolarHBondContact O-N 3.05Å; V301-S303 PolarHBondContact O-N 3.26Å; V301-S303 VanDerWaalsContact O-N 3.11Å
302P47.8Very low59.4Low111 Ų111128.5 Ų128.572%0.72168%0.677SS**  trans-60.9117.1175.5-23.134000109.9V304P302-V304 PolarHBondContact O-N 3.42Å
303S46.9Very low58.3Low111 Ų111129.6 Ų129.678%0.77670%0.7SS**  trans-68.198.2170.751.50000108.5V301 P305V301-S303 PolarHBondContact O-N 3.26Å; V301-S303 VanDerWaalsContact O-N 3.11Å; S303-P305 WeakPolarHBondContact O-CD 3.42Å
304V49.1Very low57.5Low125 Ų125127 Ų12776%0.75869%0.693SS**PPolyproline II helixtrans-60.4118.5171.4179.70000107.5P302P302-V304 PolarHBondContact O-N 3.42Å
305P50.7Low56.5Low100 Ų100133 Ų13365%0.64972%0.724SS**PPolyproline II helixtrans-65145.4178.327-33.4000109.6S303 R307S303-P305 WeakPolarHBondContact O-CD 3.42Å; P305-R307 PolarHBondContact O-N 3.01Å; P305-R307 VanDerWaalsContact O-N 3.15Å
306P47.9Very low55.4Low118 Ų118134 Ų13477%0.76673%0.73SS**PPolyproline II helixtrans-60.8122178.525.7-33.3000109.3N308P306-N308 PolarHBondContact O-N 2.99Å; P306-N308 VanDerWaalsContact O-N 3.11Å
307R47.2Very low53.9Low227 Ų227137.9 Ų137.986%0.85775%0.749SS**  trans-64.6112.8167.8-76.1-175.5172.4-174.8-3.5107.4P305 F309P305-R307 PolarHBondContact O-N 3.01Å; P305-R307 VanDerWaalsContact O-N 3.15Å; R307-F309 PolarHBondContact O-N 3.14Å; R307-F309 VanDerWaalsContact O-N 3.17Å
308N42.8Very low52.3Low149 Ų149142.8 Ų142.880%0.79777%0.773SS**  trans-58119.2168-71.3-61.5000108P306 E310P306-N308 PolarHBondContact O-N 2.99Å; P306-N308 VanDerWaalsContact O-N 3.11Å; N308-E310 PolarHBondContact O-N 3.02Å; N308-E310 VanDerWaalsContact O-N 3.12Å
309F48.4Very low50.7Low204 Ų204147.6 Ų147.690%0.89579%0.793SS**  trans-75.495164.9-86.1-94.2000107.1R307 K311R307-F309 PolarHBondContact O-N 3.14Å; R307-F309 VanDerWaalsContact O-N 3.17Å; F309-K311 PolarHBondContact O-N 2.76Å
310E45.8Very low49.5Very low184 Ų184154.3 Ų154.386%0.8682%0.823SS**PPolyproline II helixtrans-59.7131163.7-73.7-175.198.900108.8N308N308-E310 PolarHBondContact O-N 3.02Å; N308-E310 VanDerWaalsContact O-N 3.12Å
311K41.1Very low48.7Very low193 Ų193151.5 Ų151.584%0.83982%0.823SS**PPolyproline II helixtrans-84.4126.1-175.4-169.2179.7-176.6-174.70108.2F309F309-K311 PolarHBondContact O-N 2.76Å
312P51.9Low47.9Very low121 Ų121154.7 Ų154.779%0.78683%0.834SS**PPolyproline II helixtrans-61.7140.3173.7-20.332.4000110.7
313T54.7Low47.9Very low213 Ų213158.6 Ų158.6100%1.30784%0.844SS**  trans-820172.5-510000110.6

Retrieved 313 of 313 residues in 1266 ms (Link to these results)