A0A087YPW6_POEFO Loading...

Neurogenic differentiation factor

AlphaFold DB , UniProt , Accession A0A087YPW6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 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
1M37.6Very low43.6Very low232 Ų232151.5 Ų151.5100%1.14380%0.803SS**  0121.60-87.4178175.900108.1
2L39.7Very low43.8Very low144 Ų144152.8 Ų152.875%0.75481%0.808SS**  trans60.2100.8158.6-74.979.4000117.1
3T48.1Very low43.8Very low130 Ų130150.5 Ų150.580%0.79881%0.808SS**  32.791.569.159.50000114.7
4R47.4Very low43.1Very low231 Ų231150.2 Ų150.287%0.87281%0.806SS**  trans178.7152.8141.7-103.1173177.1-172.5-1.2111.4
5L46Very low43.1Very low152 Ų152148.9 Ų148.980%0.79681%0.805SS**SBendtrans86.1101.7-178.9-49.4168.7000111.4
6F38.1Very low42.7Very low177 Ų177149.3 Ų149.378%0.77680%0.8SS**  cis-150.2110.635.2-85-99.1000110.2
7S43.9Very low42.6Very low129 Ų129150.9 Ų150.990%0.90280%0.798SS**  trans-110.693151.1-60.30000104.8
8D39.3Very low42Very low105 Ų105154.9 Ų154.956%0.56180%0.802SS**  trans-126.6106.9173.9-148.2-30.6000107.6S10D8-S10 PolarHBondContact O-N 3.26Å; D8-S10 PolarHBondContact OD1-OG 2.8Å
9P49Very low41.6Very low126 Ų126151.5 Ų151.582%0.81879%0.794SS**  trans-84.220.3-174.716.2-2.7000113.5
10S43.9Very low41.1Very low85 Ų85148.7 Ų148.759%0.59479%0.793SS**  trans-101.97.4-168.957.30000115.7D8D8-S10 PolarHBondContact O-N 3.26Å; D8-S10 PolarHBondContact OD1-OG 2.8Å
11L46.4Very low40.8Very low156 Ų156154.4 Ų154.482%0.81780%0.804SS**  trans-120.349.3-178.1-69176.6000114.4
12L46.7Very low40.7Very low166 Ų166147.4 Ų147.487%0.86978%0.783SS**  trans-109.1112.4163.3-70.3177.5000110.1
13P43.8Very low40.7Very low123 Ų123149.4 Ų149.480%0.79979%0.788SS**  trans-85.2144.3151.625.7-14.2000110.6
14D34Very low40.1Very low147 Ų147150.6 Ų150.679%0.78679%0.79SS**  trans-48.5146.1-165.2-152.11.5000117.9
15V42.1Very low39.6Very low131 Ų131143.4 Ų143.479%0.79478%0.775SS**  trans-87.9106.9176171.90000108.9
16Q37Very low39Very low154 Ų154143.7 Ų143.772%0.7278%0.777SS**  trans-105.990.4164.5-87.9178.5-17.900111.6Y18Q16-Y18 WeakPolarHBondContact O-CD2 3.37Å; Q16-Y18 PolarHBondContact O-N 3.43Å
17K41.6Very low39Very low178 Ų178138.3 Ų138.377%0.77477%0.772SS**  trans5.9102.6134.7-154.7179-170.6-176.50115.7
18Y31.7Very low38.7Very low222 Ų222141.8 Ų141.887%0.87177%0.774SS**  trans-103.7104.6159.4-77.2-80.5000110Q16Q16-Y18 WeakPolarHBondContact O-CD2 3.37Å; Q16-Y18 PolarHBondContact O-N 3.43Å
19S33.8Very low38.7Very low91 Ų91143.8 Ų143.864%0.63679%0.785SS**  trans-93.7156.8159.8-60.90000108.8
20A31.6Very low38.2Very low95 Ų95146.8 Ų146.879%0.78579%0.788SS**  trans7897.415900000117.4
21W35.3Very low37.8Very low268 Ų268152.1 Ų152.1100%1.01580%0.8SS**  trans-88.1104.5148.5-73.670.9000107.2
22A35.8Very low37.3Very low86 Ų86151.2 Ų151.271%0.71180%0.795SS**  trans-159.7113.1163.200000110.2
23E40.2Very low36.9Very low185 Ų185153.1 Ų153.186%0.86480%0.796SS**  trans58.7150.6142.9-63.6-162.9144.700124.4
24D33.7Very low36.6Very low156 Ų156154.1 Ų154.183%0.83480%0.795SS**  trans76.7142.7169.8-75.2-33.6000118.7
25S37.3Very low37.1Very low80 Ų80156.6 Ų156.656%0.55980%0.801SS**  cis-176.2152.1-13.3-174.50000105.5
26D34.8Very low37Very low157 Ų157157.4 Ų157.484%0.8480%0.801SS**  trans64.2136.7162.7-56.6-48.4000118
27G36.6Very low37.2Very low65 Ų65159.6 Ų159.667%0.6781%0.811SS**  cis133.2121.320.900000106.6
28E37.4Very low37.1Very low202 Ų202158.4 Ų158.494%0.94481%0.814SS**  trans174.3131.8141.2-95.2178.2-169.400113.1
29D40.6Very low37.4Very low146 Ų146152.7 Ų152.778%0.78181%0.812SS**  trans-70.4149.5-179.7-93.1-50.3000114.7
30H38.1Very low37.9Very low189 Ų189156.2 Ų156.288%0.87582%0.819SS**  trans-145.292.6146.7-83-44.1000113.7
31K36Very low38.1Very low198 Ų198159.5 Ų159.586%0.86182%0.823SS**  48.9107124.6-157.4165.4-177.1176.20119.9
32I35.9Very low38.4Very low136 Ų136153.1 Ų153.170%0.69781%0.809SS**  trans-70.9148164.5-63164.7000110.9D34I32-D34 WeakPolarHBondContact CG2-OD2 3.47Å
33K37.2Very low38.7Very low207 Ų207157.7 Ų157.790%0.982%0.818SS**  trans-121.6108.1164.7-122.1-172.8178.3-169.40107.1
34D37Very low38.6Very low144 Ų144157.9 Ų157.977%0.7782%0.818SS**  trans-97.9141.9168-74.3-47.1000108.9I32I32-D34 WeakPolarHBondContact CG2-OD2 3.47Å
35E44.6Very low38.9Very low199 Ų199154.8 Ų154.893%0.9382%0.815SS**  trans-104.2137.3169-74.1-173.2159.700109.5
36D41.6Very low39.1Very low147 Ų147156.8 Ų156.879%0.78683%0.829SS**  trans-66.7148.8-173.9-63.1-57.1000114.7
37Q40.5Very low39.4Very low200 Ų200156.5 Ų156.594%0.93583%0.827SS**  trans-153123.5139.7-124.9151.672.900112.3
38D38.8Very low39.7Very low154 Ų154161.4 Ų161.482%0.82484%0.837SS**  trans-62.3145-175.6-63-69.9000115.4
39A39.8Very low40Very low102 Ų102163.5 Ų163.584%0.84384%0.836SS**  trans-163.5112.7131.900000109.9
40Q42.6Very low39.5Very low164 Ų164160.3 Ų160.377%0.76684%0.838SS**  trans-63.2145.4166.3-72.7168.2-78.600111.1
41D36Very low39.3Very low165 Ų165155.1 Ų155.188%0.88284%0.836SS**  -163.8134.4121-94.7-23.1000111.2
42D41.7Very low39.6Very low133 Ų133151 Ų15171%0.71183%0.832SS**  trans-70.7148.6-172.5-68-59.1000114.6
43M42.4Very low39.9Very low183 Ų183155.9 Ų155.990%0.90184%0.842SS**  -177108.8119.3-104.5-178.7-86.100114.1
44E37.6Very low40.3Very low188 Ų188152.8 Ų152.888%0.87984%0.84SS**  trans42.5110.6143.4-62.1-154151.100123.9
45A41Very low40.3Very low92 Ų92153 Ų15376%0.7684%0.837SS**  18.2129.1122.700000121.4
46S40.5Very low40.3Very low121 Ų121148.6 Ų148.685%0.84683%0.828SS**  -168.7138.4107.739.80000112.7
47D42.5Very low40.3Very low151 Ų151148.8 Ų148.881%0.80782%0.824SS**  trans-49.5153173.9-79.6-70.6000115
48L42.3Very low40.7Very low168 Ų168147.7 Ų147.788%0.8882%0.818SS**  178.6100.3116.2-88.1172.4000112
49R42.5Very low41.1Very low246 Ų246144.4 Ų144.493%0.92881%0.813SS**  trans11118.7137.2-159.2172.6-160.2-105.52.7119.4
50G32Very low41.5Very low80 Ų80142.6 Ų142.683%0.82580%0.803SS**  107.3135.2127.700000118.3
51G33.3Very low41.8Very low80 Ų80138.7 Ų138.783%0.82579%0.788SS**  trans135.3101.915200000116.1
52S42.9Very low42.7Very low112 Ų112138.5 Ų138.578%0.78379%0.787SS**  trans-39.8137.3160.2-174.80000113.5
53R40.3Very low43.5Very low238 Ų238136.2 Ų136.290%0.89877%0.774SS**  trans-171.8109.3145.6-101.3151.3-170-161.33.3111.1H55R53-H55 PolarHBondContact O-N 2.96Å
54T46.1Very low44.1Very low141 Ų141135.5 Ų135.587%0.86577%0.769SS**  trans-53.1110.4160.449.80000109.7
55H36.9Very low45Very low150 Ų150134.2 Ų134.269%0.69477%0.768SS**  trans-102.598.2166.9-160.3-118.9000108R53 E57R53-H55 PolarHBondContact O-N 2.96Å; H55-E57 WeakPolarHBondContact CE1-CG 3.35Å; H55-E57 IonicContact CE1-OE1 3.15Å; H55-E57 PolarHBondContact CE1-OE1 3.48Å; H55-E57 WeakPolarHBondContact ND1-CG 3.36Å; H55-E57 IonicContact ND1-OE1 2.81Å; H55-E57 PolarHBondContact ND1-OE1 3.37Å; H55-E57 PolarHBondContact O-N 2.91Å
56S45.8Very low45.8Very low106 Ų106136.1 Ų136.174%0.74177%0.765SS**  trans-72.9106.3165.3172.30000107.2
57E40.1Very low46.6Very low150 Ų150138 Ų13870%0.70177%0.766SS**  trans-96.588165.5-63-171-177.700108.1H55 A59H55-E57 WeakPolarHBondContact CE1-CG 3.35Å; H55-E57 IonicContact CE1-OE1 3.15Å; H55-E57 PolarHBondContact CE1-OE1 3.48Å; H55-E57 WeakPolarHBondContact ND1-CG 3.36Å; H55-E57 IonicContact ND1-OE1 2.81Å; H55-E57 PolarHBondContact ND1-OE1 3.37Å; H55-E57 PolarHBondContact O-N 2.91Å; E57-A59 PolarHBondContact O-N 2.95Å
58H49.4Very low47.4Very low178 Ų178135.3 Ų135.382%0.82476%0.755SS**  trans-68.482.1157.4-178.574.5000107.9
59A48Very low47.8Very low85 Ų85135.4 Ų135.470%0.70275%0.751SS**  trans-88101.3167.800000107.9E57 D61E57-A59 PolarHBondContact O-N 2.95Å; A59-D61 PolarHBondContact O-N 3.46Å
60G47.7Very low48.2Very low63 Ų63131.4 Ų131.465%0.64974%0.743SS**  trans-63.499.7165.800000109.4D62G60-D62 PolarHBondContact O-N 2.99Å
61D47.9Very low48.7Very low83 Ų83134.5 Ų134.544%0.44474%0.741SS.*  trans-85.464.7167.9-158.454000106.9A59 D63 R99 R103A59-D61 PolarHBondContact O-N 3.46Å; D61-D63 PolarHBondContact O-N 3.45Å; D61-R99 IonicContact OD1-NH1 3.68Å; D61-R103 IonicContact OD2-CZ 3.64Å; D61-R103 IonicContact OD2-NH1 3.81Å; D61-R103 IonicContact OD2-NH2 2.81Å; D61-R103 PolarHBondContact OD2-NH2 3.05Å
62D56.4Low49.6Very low160 Ų160139.8 Ų139.886%0.85674%0.744SS**  trans-7576.4161.8-81.2-34.1000106.8G60G60-D62 PolarHBondContact O-N 2.99Å
63D57.7Low49.6Very low85 Ų85141.9 Ų141.946%0.45575%0.746SS.*  trans-107.4101.3169.2-97-30.2000107.6D61 D65D61-D63 PolarHBondContact O-N 3.45Å; D63-D65 PolarHBondContact O-N 2.88Å
64E56Low49.8Very low169 Ų169133.3 Ų133.379%0.7973%0.732SS**  trans-41.7120.9173-62.7173.8158.400110.8D66E64-D66 VanDerWaalsContact C-N 3.32Å; E64-D66 PolarHBondContact O-N 3.34Å
65D55.7Low49.8Very low161 Ų161135.5 Ų135.586%0.86173%0.733SS**  trans-63.788.8171-79.6-46.5000109.1D63D63-D65 PolarHBondContact O-N 2.88Å
66D57.8Low50Low131 Ų131136 Ų13670%0.70174%0.74SS**  trans-90.5105.3160.4-104.6-17.8000107.6E64 V68E64-D66 VanDerWaalsContact C-N 3.32Å; E64-D66 PolarHBondContact O-N 3.34Å; D66-V68 WeakPolarHBondContact O-CG2 3.31Å; D66-V68 PolarHBondContact O-N 3.2Å
67D58.2Low50.2Low161 Ų161137.1 Ų137.186%0.86174%0.743SS**  trans-55.4119.2168.7-77.8-52.8000109.5
68V59Low50.6Low94 Ų94139.7 Ų139.757%0.5776%0.755SS**  trans-98.9106.8-178.9-172.90000109.5D66 M92D66-V68 WeakPolarHBondContact O-CG2 3.31Å; D66-V68 PolarHBondContact O-N 3.2Å; V68-M92 HydrophobicContact CG2-CE 3.92Å; V68-M92 HydrophobicContact CG2-SD 4.41Å
69E49.9Very low50.3Low170 Ų170134.2 Ų134.279%0.79475%0.746SS**  trans-72.9125.8157.4-67.1-70.2178.500108.6D71E69-D71 PolarHBondContact O-N 2.85Å
70E51.6Low50.6Low163 Ų163138.3 Ų138.376%0.76276%0.756SS**  trans-78.493.5174.8-72.5179.3166.500108.9E72E70-E72 PolarHBondContact O-N 2.68Å
71D43Very low51.2Low145 Ų145145.5 Ų145.578%0.77576%0.764SS**  trans-77.8110.4164.8-71.8-47.2000108.7E69E69-D71 PolarHBondContact O-N 2.85Å
72E50.8Low51.6Low191 Ų191147.6 Ų147.689%0.89378%0.782SS**  trans-60.3133.1168.8-76.7-177.3150.500110.4E70 G74E70-E72 PolarHBondContact O-N 2.68Å; E72-G74 PolarHBondContact O-N 3.26Å
73D44Very low51.8Low155 Ų155149.6 Ų149.683%0.82978%0.783SS**  trans-65.1109.9-171.9-154.4-43.3000111.2
74G42.9Very low51.7Low59 Ų59155.4 Ų155.461%0.60880%0.804SS**  trans-88.6113.316500000109.8E72 D76E72-G74 PolarHBondContact O-N 3.26Å; G74-D76 PolarHBondContact O-N 3Å
75E47.3Very low52Low187 Ų187159.7 Ų159.787%0.87481%0.813SS**  trans-6497.8175.2-170.5178.6-157.200110.4
76D41.3Very low52.8Low159 Ų159154.5 Ų154.585%0.8580%0.798SS**PPolyproline II helixtrans-103.4121.7176.1-99.3-30.7000112.1G74G74-D76 PolarHBondContact O-N 3Å
77T48.6Very low53.4Low130 Ų130154.7 Ų154.780%0.79881%0.806SS**PPolyproline II helixtrans-70154.1175.937.80000112.1
78E48.9Very low53.8Low205 Ų205156.4 Ų156.496%0.95881%0.806SS**PPolyproline II helixtrans-51.2134.5-170.9-68.3-160.4142.600115.5
79G44.4Very low54.1Low62 Ų62161 Ų16164%0.63982%0.818SS**  trans-163.2106.6166.500000111.8R81G79-R81 PolarHBondContact O-N 3.37Å; G79-R81 VanDerWaalsContact O-N 3.11Å
80D54.2Low55.2Low171 Ų171163.8 Ų163.891%0.91482%0.821SS**  trans-51.3108177.2-172.828.8000112.2
81R59.4Low56.5Low214 Ų214165.3 Ų165.381%0.80883%0.826SS**  trans-135137.7170.4-66-172.6-176-172.13.7109.9G79 K83G79-R81 PolarHBondContact O-N 3.37Å; G79-R81 VanDerWaalsContact O-N 3.11Å; R81-K83 PolarHBondContact O-N 2.67Å
82P55.8Low58.3Low128 Ų128161.1 Ų161.183%0.83180%0.802SS**  trans-65.6119.7-17424.5-32.2000111.3K84P82-K84 PolarHBondContact O-N 2.72Å; P82-K84 VanDerWaalsContact O-N 3.07Å
83K60.5Low60.2Low201 Ų201156.8 Ų156.887%0.87479%0.789SS**  trans-64.1103.9-178.3-68.7168.4-179.9166.30110.7R81 R85R81-K83 PolarHBondContact O-N 2.67Å; K83-R85 PolarHBondContact O-N 3.25Å
84K57.3Low62.4Low208 Ų208154.6 Ų154.690%0.90477%0.774SS**  trans-58124.1165.4-82.1179.3175.6176.70109P82 G86P82-K84 PolarHBondContact O-N 2.72Å; P82-K84 VanDerWaalsContact O-N 3.07Å; K84-G86 VanDerWaalsContact C-N 3.34Å; K84-G86 PolarHBondContact O-N 2.91Å
85R61.6Low64.7Low259 Ų259155 Ų15598%0.97777%0.771SS**  trans-69.384.3176.4-70.1175.5160.3-175.6-6.1110.2K83K83-R85 PolarHBondContact O-N 3.25Å
86G71.9Confident66.8Low52 Ų52151.3 Ų151.354%0.53675%0.749SS.*  trans-103.4160.6158.200000110.3K84 K88K84-G86 VanDerWaalsContact C-N 3.34Å; K84-G86 PolarHBondContact O-N 2.91Å; G86-K88 PolarHBondContact O-N 3.26Å
87P70.7Confident69.3Low135 Ų135146.1 Ų146.188%0.87772%0.72SS**  trans-50.9118.1170.5-22.732.7000109.2K89P87-K89 PolarHBondContact O-N 3.48Å; P87-K89 VanDerWaalsContact O-N 3.09Å
88K65.7Low71.5Confident196 Ų196145 Ų14585%0.85271%0.706SS**  trans-66112-176.7-162.9177.2-175.6-176.60107.2G86 R90G86-K88 PolarHBondContact O-N 3.26Å; K88-R90 PolarHBondContact O-N 3.48Å
89K66Low73.7Confident190 Ų190141.7 Ų141.783%0.82669%0.685SS**  trans-50.2106172-72.7-172.1176.8-172.40107.6P87 K91P87-K89 PolarHBondContact O-N 3.48Å; P87-K89 VanDerWaalsContact O-N 3.09Å; K89-K91 PolarHBondContact O-N 2.9Å
90R73.8Confident76.1Confident229 Ų229141.8 Ų141.886%0.86468%0.676SS**PPolyproline II helixtrans-72.2117.5178.9-72.7175.764.9-167.4-0.6106.2K88 M92K88-R90 PolarHBondContact O-N 3.48Å; R90-M92 PolarHBondContact O-N 3.48Å
91K77.4Confident78.1Confident196 Ų196139 Ų13985%0.85266%0.656SS**PPolyproline II helixtrans-53.4127.8171.2-62.8-170.7177.1-164.50107.9K89 T93K89-K91 PolarHBondContact O-N 2.9Å; K91-T93 PolarHBondContact O-N 3.08Å
92M81Confident79.9Confident57 Ų57134.6 Ų134.628%0.28165%0.647SS.*PPolyproline II helixtrans-61.5137.9178.2-70-139.9-66.400109.9V68 R90 R96 I97V68-M92 HydrophobicContact CG2-CE 3.92Å; V68-M92 HydrophobicContact CG2-SD 4.41Å; R90-M92 PolarHBondContact O-N 3.48Å; M92-R96 VanDerWaalsContact SD-CD 3.52Å; M92-R96 HydrophobicContact SD-CG 3.83Å; M92-I97 HydrophobicContact CB-CD1 4.23Å; M92-I97 HydrophobicContact CB-CG1 3.84Å; M92-I97 HydrophobicContact CE-CG1 4.01Å
93T90.8Very high82Confident99 Ų99134.6 Ų134.661%0.60763%0.631SS**PPolyproline II helixtrans-64.6145.2173-49.80000109.7K91 A95 R96 I97K91-T93 PolarHBondContact O-N 3.08Å; T93-A95 HydrophobicContact CG2-CB 4.43Å; T93-A95 PolarHBondContact O-N 2.92Å; T93-A95 VanDerWaalsContact O-N 3.16Å; T93-R96 WeakPolarHBondContact O-CA 3.18Å; T93-R96 WeakPolarHBondContact O-CB 3.45Å; T93-R96 PolarHBondContact O-N 3.11Å; T93-I97 PolarHBondContact O-N 3.46Å; T93-I97 VanDerWaalsContact O-N 3.07Å
94Q90.8Very high83.8Confident110 Ų110132.9 Ų132.951%0.51462%0.619SS.*Hα-helixtrans-50-42.2177.4-176.760.820.500112.7R96 I97 E98Q94-R96 VanDerWaalsContact C-N 3.32Å; Q94-R96 PolarHBondContact O-N 2.95Å; Q94-I97 WeakPolarHBondContact O-CB 3.33Å; Q94-I97 PolarHBondContact O-N 3.44Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.36Å; Q94-E98 PolarHBondContact NE2-OE1 2.88Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.26Å
95A91Very high85.7Confident66 Ų66128.1 Ų128.155%0.54560%0.602SS.*Hα-helixtrans-61.2-35.4175.500000113.7T93 R99T93-A95 HydrophobicContact CG2-CB 4.43Å; T93-A95 PolarHBondContact O-N 2.92Å; T93-A95 VanDerWaalsContact O-N 3.16Å; A95-R99 WeakPolarHBondContact O-CB 3.26Å; A95-R99 PolarHBondContact O-N 3.44Å
96R91.7Very high87.5Confident111 Ų111121.9 Ų121.942%0.41958%0.582SS.*Hα-helixtrans-70.7-40.5176.1-170.5175-176.3-161.42.8110.7M92 T93 Q94 R99 S100M92-R96 VanDerWaalsContact SD-CD 3.52Å; M92-R96 HydrophobicContact SD-CG 3.83Å; T93-R96 WeakPolarHBondContact O-CA 3.18Å; T93-R96 WeakPolarHBondContact O-CB 3.45Å; T93-R96 PolarHBondContact O-N 3.11Å; Q94-R96 VanDerWaalsContact C-N 3.32Å; Q94-R96 PolarHBondContact O-N 2.95Å; R96-R99 PolarHBondContact O-N 3.39Å; R96-S100 WeakPolarHBondContact O-CB 3.3Å; R96-S100 PolarHBondContact O-N 2.84Å
97I93.3Very high88.7Confident49 Ų49121.7 Ų121.725%0.25158%0.575SS.*Hα-helixtrans-61.2-46.8174.7-63.6169.6000110.2M92 T93 Q94 S100 K101M92-I97 HydrophobicContact CB-CD1 4.23Å; M92-I97 HydrophobicContact CB-CG1 3.84Å; M92-I97 HydrophobicContact CE-CG1 4.01Å; T93-I97 PolarHBondContact O-N 3.46Å; T93-I97 VanDerWaalsContact O-N 3.07Å; Q94-I97 WeakPolarHBondContact O-CB 3.33Å; Q94-I97 PolarHBondContact O-N 3.44Å; I97-S100 PolarHBondContact O-N 2.92Å; I97-K101 HydrophobicContact CG2-CD 4.11Å; I97-K101 HydrophobicContact CG2-CG 4.49Å; I97-K101 WeakPolarHBondContact O-CG 3.35Å; I97-K101 PolarHBondContact O-N 3.46Å
98E95.3Very high90Very high106 Ų106119.1 Ų119.150%0.49555%0.554SS.*Hα-helixtrans-63.8-42.6178.5-74.4170.5-168.400112.5Q94 S100 K101 L102Q94-E98 WeakPolarHBondContact CG-OE1 3.36Å; Q94-E98 PolarHBondContact NE2-OE1 2.88Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 3.26Å; E98-S100 VanDerWaalsContact C-N 3.34Å; E98-S100 PolarHBondContact O-N 3.24Å; E98-K101 PolarHBondContact O-N 3.22Å; E98-L102 WeakPolarHBondContact O-CB 3.18Å; E98-L102 PolarHBondContact O-N 2.84Å
99R95.1Very high91.6Very high136 Ų136112.3 Ų112.351%0.51354%0.535SS..Hα-helixtrans-59-45.2173.3-178-174.1-75.7-147.1-1.5111.4D61 A95 R96 L102 R103D61-R99 IonicContact OD1-NH1 3.68Å; A95-R99 WeakPolarHBondContact O-CB 3.26Å; A95-R99 PolarHBondContact O-N 3.44Å; R96-R99 PolarHBondContact O-N 3.39Å; R99-L102 PolarHBondContact O-N 3.35Å; R99-R103 WeakPolarHBondContact O-CG 3.4Å; R99-R103 PolarHBondContact O-N 3.08Å
100S95.1Very high93.2Very high65 Ų65110.6 Ų110.646%0.45552%0.523SS..Hα-helixtrans-62-47.1177.1178.90000111.6R96 I97 E98 L102 R103 R104R96-S100 WeakPolarHBondContact O-CB 3.3Å; R96-S100 PolarHBondContact O-N 2.84Å; I97-S100 PolarHBondContact O-N 2.92Å; E98-S100 VanDerWaalsContact C-N 3.34Å; E98-S100 PolarHBondContact O-N 3.24Å; S100-L102 VanDerWaalsContact C-N 3.31Å; S100-L102 PolarHBondContact O-N 3.26Å; S100-R103 WeakPolarHBondContact O-CB 3.29Å; S100-R103 PolarHBondContact O-N 3.02Å; S100-R103 VanDerWaalsContact O-N 3.15Å; S100-R104 PolarHBondContact O-N 3.41Å
101K96.8Very high94.3Very high113 Ų113103.9 Ų103.949%0.49150%0.501SS..Hα-helixtrans-56.1-44.5174.9-74.2176.2179179.30111.7I97 E98 R104 I105I97-K101 HydrophobicContact CG2-CD 4.11Å; I97-K101 HydrophobicContact CG2-CG 4.49Å; I97-K101 WeakPolarHBondContact O-CG 3.35Å; I97-K101 PolarHBondContact O-N 3.46Å; E98-K101 PolarHBondContact O-N 3.22Å; K101-R104 PolarHBondContact O-N 3.35Å; K101-I105 VanDerWaalsContact O-CG1 3.28Å; K101-I105 WeakPolarHBondContact O-CG1 3.42Å; K101-I105 PolarHBondContact O-N 3.03Å
102L97.4Very high95.4Very high120 Ų120102.9 Ų102.963%0.62849%0.492SS*.Hα-helixtrans-63.8-42.7177.9-175.263.4000112.1E98 R99 S100 R104 I105 K106E98-L102 WeakPolarHBondContact O-CB 3.18Å; E98-L102 PolarHBondContact O-N 2.84Å; R99-L102 PolarHBondContact O-N 3.35Å; S100-L102 VanDerWaalsContact C-N 3.31Å; S100-L102 PolarHBondContact O-N 3.26Å; L102-R104 VanDerWaalsContact C-N 3.34Å; L102-R104 PolarHBondContact O-N 3.4Å; L102-I105 PolarHBondContact O-N 3.49Å; L102-K106 WeakPolarHBondContact O-CB 3.43Å; L102-K106 PolarHBondContact O-N 3.09Å
103R97.9Very high96.2Very high128 Ų128104.1 Ų104.148%0.48350%0.503SS..Hα-helixtrans-58.9-45.5174.1-72177.1-179.8-170.6-1.3110.7D61 R99 S100 K106 A107D61-R103 IonicContact OD2-CZ 3.64Å; D61-R103 IonicContact OD2-NH1 3.81Å; D61-R103 IonicContact OD2-NH2 2.81Å; D61-R103 PolarHBondContact OD2-NH2 3.05Å; R99-R103 WeakPolarHBondContact O-CG 3.4Å; R99-R103 PolarHBondContact O-N 3.08Å; S100-R103 WeakPolarHBondContact O-CB 3.29Å; S100-R103 PolarHBondContact O-N 3.02Å; S100-R103 VanDerWaalsContact O-N 3.15Å; R103-K106 PolarHBondContact O-N 3.19Å; R103-A107 PolarHBondContact O-N 3.16Å
104R98.3Very high96.6Very high165 Ų165106.3 Ų106.362%0.62350%0.5SS*.Hα-helixtrans-62.7-44.6177.5-164.2172.887.8153.7-0.4112.3S100 K101 L102 K106 A107 N108S100-R104 PolarHBondContact O-N 3.41Å; K101-R104 PolarHBondContact O-N 3.35Å; L102-R104 VanDerWaalsContact C-N 3.34Å; L102-R104 PolarHBondContact O-N 3.4Å; R104-K106 PolarHBondContact O-N 2.91Å; R104-A107 PolarHBondContact O-N 2.93Å; R104-N108 WeakPolarHBondContact O-CB 3.36Å; R104-N108 VanDerWaalsContact O-CG 3.23Å; R104-N108 PolarHBondContact O-N 2.94Å
105I98.3Very high97Very high108 Ų108104 Ų10455%0.55449%0.49SS*.Hα-helixtrans-60.1-46.2176.4-69.6164.6000110.6K101 L102 A107 N108 A109K101-I105 VanDerWaalsContact O-CG1 3.28Å; K101-I105 WeakPolarHBondContact O-CG1 3.42Å; K101-I105 PolarHBondContact O-N 3.03Å; L102-I105 PolarHBondContact O-N 3.49Å; I105-A107 VanDerWaalsContact C-N 3.34Å; I105-A107 PolarHBondContact O-N 3.41Å; I105-N108 PolarHBondContact O-N 3.2Å; I105-A109 WeakPolarHBondContact O-CB 3.36Å; I105-A109 PolarHBondContact O-N 3.44Å
106K98.3Very high97.3Very high129 Ų129106.6 Ų106.656%0.56149%0.491SS*.Hα-helixtrans-64-36.6177.8-172.6179.5179174.40112.5L102 R103 R104 R110L102-K106 WeakPolarHBondContact O-CB 3.43Å; L102-K106 PolarHBondContact O-N 3.09Å; R103-K106 PolarHBondContact O-N 3.19Å; R104-K106 PolarHBondContact O-N 2.91Å; K106-R110 WeakPolarHBondContact O-CG 3.49Å; K106-R110 PolarHBondContact O-N 3.2Å; K106-R110 PolarHBondContact O-NE 2.96Å
107A98.4Very high97.6Very high47 Ų47106.2 Ų106.239%0.38850%0.497SS..Hα-helixtrans-66.9-46.6174.200000111.4R103 R104 I105 A109 R110 E111R103-A107 PolarHBondContact O-N 3.16Å; R104-A107 PolarHBondContact O-N 2.93Å; I105-A107 VanDerWaalsContact C-N 3.34Å; I105-A107 PolarHBondContact O-N 3.41Å; A107-A109 VanDerWaalsContact C-N 3.33Å; A107-A109 PolarHBondContact O-N 3.38Å; A107-R110 WeakPolarHBondContact O-CB 3.39Å; A107-R110 PolarHBondContact O-N 3.43Å; A107-R110 VanDerWaalsContact O-N 3.14Å; A107-E111 PolarHBondContact O-N 3.28Å
108N98.6Very high97.9Very high81 Ų81108.2 Ų108.243%0.43351%0.508SS..Hα-helixtrans-61.3-40.3177.8-72-11.7000112.5R104 I105 R110 E111 R112R104-N108 WeakPolarHBondContact O-CB 3.36Å; R104-N108 VanDerWaalsContact O-CG 3.23Å; R104-N108 PolarHBondContact O-N 2.94Å; I105-N108 PolarHBondContact O-N 3.2Å; N108-R110 VanDerWaalsContact C-N 3.33Å; N108-R110 PolarHBondContact O-N 3.09Å; N108-E111 PolarHBondContact O-N 3.43Å; N108-R112 WeakPolarHBondContact O-CG 3.39Å; N108-R112 PolarHBondContact O-N 3.31Å
109A98.6Very high98Very high54 Ų54105.9 Ų105.945%0.44650%0.499SS..Hα-helixtrans-60.3-44.3174.900000111.4I105 A107 R112 T113I105-A109 WeakPolarHBondContact O-CB 3.36Å; I105-A109 PolarHBondContact O-N 3.44Å; A107-A109 VanDerWaalsContact C-N 3.33Å; A107-A109 PolarHBondContact O-N 3.38Å; A109-R112 PolarHBondContact O-N 3.35Å; A109-T113 PolarHBondContact O-N 3.18Å; A109-T113 VanDerWaalsContact O-N 3.11Å; A109-T113 PolarHBondContact O-OG1 3.5Å
110R98.7Very high98.2Very high153 Ų153102.4 Ų102.458%0.57750%0.496SS*.Hα-helixtrans-63-42.8177-74.8-176.1-89.8-168.42.4112.5K106 A107 N108 R112 T113 R114K106-R110 WeakPolarHBondContact O-CG 3.49Å; K106-R110 PolarHBondContact O-N 3.2Å; K106-R110 PolarHBondContact O-NE 2.96Å; A107-R110 WeakPolarHBondContact O-CB 3.39Å; A107-R110 PolarHBondContact O-N 3.43Å; A107-R110 VanDerWaalsContact O-N 3.14Å; N108-R110 VanDerWaalsContact C-N 3.33Å; N108-R110 PolarHBondContact O-N 3.09Å; R110-R112 VanDerWaalsContact C-N 3.34Å; R110-R112 PolarHBondContact O-N 3.21Å; R110-T113 PolarHBondContact O-N 3.21Å; R110-R114 PolarHBondContact O-N 3.07Å
111E98.6Very high98.3Very high88 Ų88102 Ų10241%0.41150%0.496SS..Hα-helixtrans-66.7-36.3178.2-175.155-153.800112.1A107 N108 R114 M115A107-E111 PolarHBondContact O-N 3.28Å; N108-E111 PolarHBondContact O-N 3.43Å; E111-R114 PolarHBondContact O-N 3.36Å; E111-R114 IonicContact OE1-CZ 2.96Å; E111-R114 IonicContact OE1-NH1 3.98Å; E111-R114 PolarHBondContact OE1-NH1 3.42Å; E111-R114 WeakPolarHBondContact OE2-CD 3.47Å; E111-R114 IonicContact OE2-NH1 2.73Å; E111-M115 HydrophobicContact CG-CG 4.5Å; E111-M115 WeakPolarHBondContact O-CB 3.28Å; E111-M115 WeakPolarHBondContact O-CG 3.16Å; E111-M115 PolarHBondContact O-N 3.41Å
112R98.7Very high98.4Very high176 Ų17697.7 Ų97.766%0.66448%0.478SS*.Hα-helixtrans-59.8-47.5172.4-72.7-179.4-170.1-173.23.4111.4N108 A109 R110 R114 M115 H116N108-R112 WeakPolarHBondContact O-CG 3.39Å; N108-R112 PolarHBondContact O-N 3.31Å; A109-R112 PolarHBondContact O-N 3.35Å; R110-R112 VanDerWaalsContact C-N 3.34Å; R110-R112 PolarHBondContact O-N 3.21Å; R112-R114 PolarHBondContact O-N 3.15Å; R112-M115 PolarHBondContact O-N 3.35Å; R112-H116 PolarHBondContact O-CD2 3.37Å; R112-H116 PolarHBondContact O-N 2.89Å
113T98.6Very high98.4Very high82 Ų8294.1 Ų94.150%0.50346%0.46SS..Hα-helixtrans-58-49.1176.3-57.20000111.3A109 R110 M115 H116 D117A109-T113 PolarHBondContact O-N 3.18Å; A109-T113 VanDerWaalsContact O-N 3.11Å; A109-T113 PolarHBondContact O-OG1 3.5Å; R110-T113 PolarHBondContact O-N 3.21Å; T113-M115 VanDerWaalsContact C-N 3.27Å; T113-M115 PolarHBondContact O-N 2.88Å; T113-H116 WeakPolarHBondContact O-CB 3.47Å; T113-H116 PolarHBondContact O-N 3.04Å; T113-D117 PolarHBondContact O-N 3.48Å
114R98.8Very high98.4Very high145 Ų14592.2 Ų92.255%0.54746%0.459SS..Hα-helixtrans-55.9-41.6176.3-179.3-178.9167.1-83.6-5.1112.3R110 E111 R112 D117 L118R110-R114 PolarHBondContact O-N 3.07Å; E111-R114 PolarHBondContact O-N 3.36Å; E111-R114 IonicContact OE1-CZ 2.96Å; E111-R114 IonicContact OE1-NH1 3.98Å; E111-R114 PolarHBondContact OE1-NH1 3.42Å; E111-R114 WeakPolarHBondContact OE2-CD 3.47Å; E111-R114 IonicContact OE2-NH1 2.73Å; R112-R114 PolarHBondContact O-N 3.15Å; R114-D117 PolarHBondContact O-N 3.44Å; R114-L118 PolarHBondContact O-N 3.45Å
115M98.7Very high98.4Very high61 Ų6186.9 Ų86.930%0.344%0.443SS..Hα-helixtrans-69.6-34.5177-74.1-57.5-57.600113E111 R112 T113 L118 N119E111-M115 HydrophobicContact CG-CG 4.5Å; E111-M115 WeakPolarHBondContact O-CB 3.28Å; E111-M115 WeakPolarHBondContact O-CG 3.16Å; E111-M115 PolarHBondContact O-N 3.41Å; R112-M115 PolarHBondContact O-N 3.35Å; T113-M115 VanDerWaalsContact C-N 3.27Å; T113-M115 PolarHBondContact O-N 2.88Å; M115-L118 HydrophobicContact CE-CD2 4.18Å; M115-L118 HydrophobicContact SD-CD2 4.12Å; M115-N119 WeakPolarHBondContact O-CB 3.48Å; M115-N119 VanDerWaalsContact O-CG 3.25Å; M115-N119 PolarHBondContact O-N 3.2Å; M115-N119 PolarHBondContact O-ND2 3.34Å
116H98.6Very high98.3Very high121 Ų12183 Ų8356%0.5642%0.421SS*.Hα-helixtrans-63.6-42.2172.4-73.8-61.1000111.7R112 T113 N119 S120R112-H116 PolarHBondContact O-CD2 3.37Å; R112-H116 PolarHBondContact O-N 2.89Å; T113-H116 WeakPolarHBondContact O-CB 3.47Å; T113-H116 PolarHBondContact O-N 3.04Å; H116-N119 PolarHBondContact O-N 3Å; H116-S120 WeakPolarHBondContact O-CB 3.44Å; H116-S120 PolarHBondContact O-N 3.34Å; H116-S120 PolarHBondContact O-OG 3.46Å
117D98.5Very high98.2Very high103 Ų10382.3 Ų82.355%0.55142%0.418SS*.Hα-helixtrans-63.7-45.2176.8-63.9-24.3000111.2T113 R114 N119 S120 A121T113-D117 PolarHBondContact O-N 3.48Å; R114-D117 PolarHBondContact O-N 3.44Å; D117-N119 PolarHBondContact O-N 3.33Å; D117-S120 WeakPolarHBondContact O-CB 3.46Å; D117-S120 PolarHBondContact O-N 2.99Å; D117-A121 PolarHBondContact O-N 3.25Å
118L98.5Very high98.1Very high92 Ų9284.9 Ų84.948%0.48243%0.429SS..Hα-helixtrans-60.8-44.9176.7178.962.5000112.3R114 M115 S120 A121 L122R114-L118 PolarHBondContact O-N 3.45Å; M115-L118 HydrophobicContact CE-CD2 4.18Å; M115-L118 HydrophobicContact SD-CD2 4.12Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 3.06Å; L118-A121 PolarHBondContact O-N 3.33Å; L118-L122 PolarHBondContact O-N 3.44Å
119N98.3Very high97.9Very high56 Ų5681.5 Ų81.530%0.29941%0.411SS..Hα-helixtrans-67-35.8178.7-71.8-38.4000111.4M115 H116 D117 L122 D123 K140M115-N119 WeakPolarHBondContact O-CB 3.48Å; M115-N119 VanDerWaalsContact O-CG 3.25Å; M115-N119 PolarHBondContact O-N 3.2Å; M115-N119 PolarHBondContact O-ND2 3.34Å; H116-N119 PolarHBondContact O-N 3Å; D117-N119 PolarHBondContact O-N 3.33Å; N119-L122 PolarHBondContact O-N 3.48Å; N119-D123 PolarHBondContact O-N 3.35Å; N119-K140 PolarHBondContact OD1-NZ 2.92Å
120S98.3Very high97.6Very high64 Ų6479.9 Ų79.945%0.44840%0.396SS..Hα-helixtrans-63.4-43.4173.9-61.10000111.7H116 D117 L118 L122 D123 N124H116-S120 WeakPolarHBondContact O-CB 3.44Å; H116-S120 PolarHBondContact O-N 3.34Å; H116-S120 PolarHBondContact O-OG 3.46Å; D117-S120 WeakPolarHBondContact O-CB 3.46Å; D117-S120 PolarHBondContact O-N 2.99Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 3.06Å; S120-L122 PolarHBondContact O-N 2.93Å; S120-D123 PolarHBondContact O-N 3.5Å; S120-N124 PolarHBondContact O-N 2.99Å; S120-N124 PolarHBondContact O-ND2 2.89Å
121A98.6Very high97Very high57 Ų5773.6 Ų73.647%0.47138%0.375SS..Hα-helixtrans-61.8-42.2174.300000112.1D117 L118 N124 L125D117-A121 PolarHBondContact O-N 3.25Å; L118-A121 PolarHBondContact O-N 3.33Å; A121-N124 PolarHBondContact O-N 3.49Å; A121-L125 PolarHBondContact O-N 3.13Å
122L98.4Very high96.5Very high22 Ų2274.3 Ų74.312%0.11538%0.375CS..Hα-helixtrans-64.3-39.6175.5-176.168.1000112.1L118 N119 S120 N124 L125 R126 K140 T143L118-L122 PolarHBondContact O-N 3.44Å; N119-L122 PolarHBondContact O-N 3.48Å; S120-L122 PolarHBondContact O-N 2.93Å; L122-N124 VanDerWaalsContact C-N 3.32Å; L122-L125 HydrophobicContact CD1-CD2 4.37Å; L122-L125 WeakPolarHBondContact O-CB 3.45Å; L122-L125 PolarHBondContact O-N 3.42Å; L122-R126 WeakPolarHBondContact O-CG 3.36Å; L122-R126 PolarHBondContact O-N 3.29Å; L122-K140 HydrophobicContact CD2-CB 4.07Å; L122-K140 HydrophobicContact CD2-CD 4.11Å; L122-K140 HydrophobicContact CD2-CG 3.62Å; L122-T143 HydrophobicContact CD1-CG2 3.91Å
123D97.1Very high95.9Very high44 Ų4467.3 Ų67.324%0.23535%0.353CS..Hα-helixtrans-65.7-35.4174.7-87.1-18000112.2N119 S120 R126 K127 K137N119-D123 PolarHBondContact O-N 3.35Å; S120-D123 PolarHBondContact O-N 3.5Å; D123-R126 WeakPolarHBondContact O-CB 3.44Å; D123-R126 PolarHBondContact O-N 2.85Å; D123-R126 IonicContact OD1-CZ 3.71Å; D123-R126 IonicContact OD1-NH1 2.67Å; D123-R126 PolarHBondContact OD1-NH1 2.86Å; D123-K127 WeakPolarHBondContact O-CG 3.24Å; D123-K127 PolarHBondContact O-N 2.9Å; D123-K137 VanDerWaalsContact CG-NZ 3.33Å; D123-K137 IonicContact OD1-NZ 3.8Å; D123-K137 PolarHBondContact OD1-NZ 3.4Å; D123-K137 VanDerWaalsContact OD1-NZ 3.15Å; D123-K137 IonicContact OD2-NZ 3.88Å; D123-K137 PolarHBondContact OD2-NZ 2.87Å
124N97.7Very high95.3Very high88 Ų8872 Ų7247%0.47137%0.367SS..Hα-helixtrans-66.6-39.2171.3-72.4-28.6000111.9S120 A121 L122 R126 K127S120-N124 PolarHBondContact O-N 2.99Å; S120-N124 PolarHBondContact O-ND2 2.89Å; A121-N124 PolarHBondContact O-N 3.49Å; L122-N124 VanDerWaalsContact C-N 3.32Å; N124-R126 VanDerWaalsContact C-N 3.32Å; N124-R126 PolarHBondContact O-N 3.4Å; N124-K127 WeakPolarHBondContact O-CB 3.28Å; N124-K127 PolarHBondContact O-N 3.43Å; N124-K127 PolarHBondContact OD1-NZ 2.91Å
125L98.3Very high94.7Very high53 Ų5371.8 Ų71.828%0.27738%0.381SS..Hα-helixtrans-59.7-42.6172.4-179.661.6000111.5A121 L122 K127 V128 V129 T143 L144 A147A121-L125 PolarHBondContact O-N 3.13Å; L122-L125 HydrophobicContact CD1-CD2 4.37Å; L122-L125 WeakPolarHBondContact O-CB 3.45Å; L122-L125 PolarHBondContact O-N 3.42Å; L125-K127 PolarHBondContact O-N 2.93Å; L125-V128 HydrophobicContact CD1-CG2 4.07Å; L125-V128 WeakPolarHBondContact O-CG2 3.37Å; L125-V128 PolarHBondContact O-N 2.67Å; L125-V128 VanDerWaalsContact O-N 3.09Å; L125-V129 WeakPolarHBondContact O-CG2 3.47Å; L125-V129 PolarHBondContact O-N 3.43Å; L125-T143 HydrophobicContact CD2-CG2 4.04Å; L125-T143 HydrophobicContact CG-CG2 4.09Å; L125-L144 HydrophobicContact CD2-CD2 4.16Å; L125-A147 HydrophobicContact CD1-CB 4.06Å; L125-A147 HydrophobicContact CD2-CB 4.11Å; L125-A147 HydrophobicContact CG-CB 4.37Å
126R97.1Very high94.2Very high28 Ų2874.5 Ų74.511%0.10639%0.393CS..Hα-helixtrans-56-34.7177.1-73.5-179.7179.7106.92.1113.1L122 D123 N124 V128 V129 Y132 L138 T143L122-R126 WeakPolarHBondContact O-CG 3.36Å; L122-R126 PolarHBondContact O-N 3.29Å; D123-R126 WeakPolarHBondContact O-CB 3.44Å; D123-R126 PolarHBondContact O-N 2.85Å; D123-R126 IonicContact OD1-CZ 3.71Å; D123-R126 IonicContact OD1-NH1 2.67Å; D123-R126 PolarHBondContact OD1-NH1 2.86Å; N124-R126 VanDerWaalsContact C-N 3.32Å; N124-R126 PolarHBondContact O-N 3.4Å; R126-V128 VanDerWaalsContact C-N 3.28Å; R126-V128 PolarHBondContact O-N 3.15Å; R126-V129 VanDerWaalsContact O-CG2 3.28Å; R126-V129 WeakPolarHBondContact O-CG2 3.39Å; R126-Y132 HydrophobicContact CB-CD2 4.18Å; R126-Y132 HydrophobicContact CB-CE2 4.32Å; R126-Y132 WeakPolarHBondContact O-CB 3.49Å; R126-Y132 WeakPolarHBondContact O-CD2 3.45Å; R126-L138 PolarHBondContact NE-O 3.26Å; R126-L138 PolarHBondContact NH2-O 2.82Å; R126-T143 HydrophobicContact CG-CG2 3.62Å; R126-T143 PolarHBondContact NE-OG1 3.41Å
127K95.8Very high94Very high114 Ų11474.4 Ų74.450%0.49639%0.391SS..Hα-helixtrans-69-25.4-179.3-65.2169.3-170.7166.20113.2D123 N124 L125 Y132D123-K127 WeakPolarHBondContact O-CG 3.24Å; D123-K127 PolarHBondContact O-N 2.9Å; N124-K127 WeakPolarHBondContact O-CB 3.28Å; N124-K127 PolarHBondContact O-N 3.43Å; N124-K127 PolarHBondContact OD1-NZ 2.91Å; L125-K127 PolarHBondContact O-N 2.93Å; K127-Y132 HydrophobicContact CG-CD2 4.41Å; K127-Y132 HydrophobicContact CG-CE1 4.32Å; K127-Y132 HydrophobicContact CG-CE2 3.93Å
128V96Very high93.8Very high100 Ų10070.5 Ų70.561%0.60637%0.37SS*.Hα-helixtrans-104.6-11.8-174.5-59.30000113.6L125 R126L125-V128 HydrophobicContact CD1-CG2 4.07Å; L125-V128 WeakPolarHBondContact O-CG2 3.37Å; L125-V128 PolarHBondContact O-N 2.67Å; L125-V128 VanDerWaalsContact O-N 3.09Å; R126-V128 VanDerWaalsContact C-N 3.28Å; R126-V128 PolarHBondContact O-N 3.15Å
129V95.1Very high93.8Very high10 Ų1068.4 Ų68.46%0.06136%0.363CS..SBendtrans-77.7152.7168.6-79.40000111.3L125 R126 L146 A147L125-V129 WeakPolarHBondContact O-CG2 3.47Å; L125-V129 PolarHBondContact O-N 3.43Å; R126-V129 VanDerWaalsContact O-CG2 3.28Å; R126-V129 WeakPolarHBondContact O-CG2 3.39Å; V129-L146 HydrophobicContact CB-CD2 4.18Å; V129-L146 HydrophobicContact CB-CG 4.33Å; V129-L146 HydrophobicContact CG2-CD2 4.45Å; V129-A147 HydrophobicContact CG1-CB 3.68Å
130P92Very high93.7Very high21 Ų2170.9 Ų70.914%0.13637%0.371CS..THydrogen-bonded Turntrans-56151.8176-24.234.8000111.5Y132 L146 Y150 L173P130-Y132 VanDerWaalsContact C-N 3.32Å; P130-Y132 PolarHBondContact O-N 2.78Å; P130-L146 WeakPolarHBondContact O-CD2 3.46Å; P130-Y150 HydrophobicContact CG-CD1 4.05Å; P130-Y150 HydrophobicContact CG-CD2 3.7Å; P130-Y150 HydrophobicContact CG-CE1 4.17Å; P130-Y150 HydrophobicContact CG-CE2 3.87Å; P130-Y150 HydrophobicContact CG-CG 3.79Å; P130-L173 HydrophobicContact CB-CD1 4.38Å; P130-L173 HydrophobicContact CG-CD1 4.23Å; P130-L173 HydrophobicContact CG-CD2 4.25Å
131C85.5Confident93.7Very high21 Ų2172 Ų7214%0.14237%0.371CS..THydrogen-bonded Turntrans66.330.5173.6-39.80000113.8S133 V185 C188C131-S133 PolarHBondContact O-N 3.45Å; C131-V185 HydrophobicContact CB-CG2 4.46Å; C131-C188 HydrophobicContact CB-CB 3.84Å; C131-C188 VanDerWaalsContact CB-SG 3.58Å; C131-C188 WeakPolarHBondContact SG-CB 3.38Å
132Y88.4Confident93.7Very high103 Ų10370.6 Ų70.640%0.40436%0.355SS..  trans-57126.9171175.1-113.3000111R126 K127 P130 K134R126-Y132 HydrophobicContact CB-CD2 4.18Å; R126-Y132 HydrophobicContact CB-CE2 4.32Å; R126-Y132 WeakPolarHBondContact O-CB 3.49Å; R126-Y132 WeakPolarHBondContact O-CD2 3.45Å; K127-Y132 HydrophobicContact CG-CD2 4.41Å; K127-Y132 HydrophobicContact CG-CE1 4.32Å; K127-Y132 HydrophobicContact CG-CE2 3.93Å; P130-Y132 VanDerWaalsContact C-N 3.32Å; P130-Y132 PolarHBondContact O-N 2.78Å; Y132-K134 HydrophobicContact CE1-CG 3.9Å
133S86.3Confident93.7Very high29 Ų2969.5 Ų69.520%0.20335%0.349CS..  trans-120.2134.7172.4172.20000110.3C131 T135 Q136C131-S133 PolarHBondContact O-N 3.45Å; S133-T135 VanDerWaalsContact C-N 3.34Å; S133-T135 PolarHBondContact OG-N 3.3Å; S133-T135 PolarHBondContact OG-OG1 2.99Å; S133-Q136 WeakPolarHBondContact CB-O 3.44Å; S133-Q136 PolarHBondContact OG-N 2.81Å; S133-Q136 VanDerWaalsContact OG-N 3.09Å
134K84.9Confident93.7Very high181 Ų18172 Ų7279%0.78736%0.362SS*.SBendtrans-71.7-30.9176-66.1-177.2-178.6179.50111.9Y132Y132-K134 HydrophobicContact CE1-CG 3.9Å
135T86.7Confident93.8Very high139 Ų13973.5 Ų73.585%0.85336%0.361SS*.SBendtrans-95.3-28.5-174.654.10000112.6S133S133-T135 VanDerWaalsContact C-N 3.34Å; S133-T135 PolarHBondContact OG-N 3.3Å; S133-T135 PolarHBondContact OG-OG1 2.99Å
136Q89.1Confident93.7Very high119 Ų11971 Ų7156%0.55635%0.348SS*.SBendtrans-124.6105-178.6-169.4-179.415.700110.8S133S133-Q136 WeakPolarHBondContact CB-O 3.44Å; S133-Q136 PolarHBondContact OG-N 2.81Å; S133-Q136 VanDerWaalsContact OG-N 3.09Å
137K93.5Very high93.8Very high119 Ų11970.1 Ų70.152%0.51735%0.347SS..PPolyproline II helixtrans-83.5132.5176.3-64.5-173.8178.4-170.80110.5D123D123-K137 VanDerWaalsContact CG-NZ 3.33Å; D123-K137 IonicContact OD1-NZ 3.8Å; D123-K137 PolarHBondContact OD1-NZ 3.4Å; D123-K137 VanDerWaalsContact OD1-NZ 3.15Å; D123-K137 IonicContact OD2-NZ 3.88Å; D123-K137 PolarHBondContact OD2-NZ 2.87Å
138L95.1Very high93.9Very high20 Ų2072.1 Ų72.111%0.10536%0.356CS..PPolyproline II helixtrans-62.5148.6167.7-65179.7000111R126 E142 T143 L146 T181 L184R126-L138 PolarHBondContact NE-O 3.26Å; R126-L138 PolarHBondContact NH2-O 2.82Å; L138-E142 HydrophobicContact CB-CB 4.23Å; L138-T143 PolarHBondContact O-OG1 2.93Å; L138-L146 HydrophobicContact CD1-CD2 3.69Å; L138-T181 HydrophobicContact CD1-CG2 4.44Å; L138-T181 HydrophobicContact CD2-CG2 3.74Å; L138-L184 HydrophobicContact CD2-CD2 4.04Å
139S96.9Very high94Very high48 Ų4868.3 Ų68.334%0.33633%0.332SS..PPolyproline II helixtrans-60.8164.1174.169.60000111.5I141 E142 T143S139-I141 VanDerWaalsContact C-N 3.3Å; S139-I141 PolarHBondContact O-N 3.24Å; S139-I141 WeakPolarHBondContact OG-CG2 3.38Å; S139-E142 VanDerWaalsContact CB-OE2 3.28Å; S139-E142 WeakPolarHBondContact CB-OE2 3.43Å; S139-E142 PolarHBondContact N-OE2 2.94Å; S139-E142 PolarHBondContact O-N 3.34Å; S139-E142 WeakPolarHBondContact OG-CB 3.38Å; S139-E142 VanDerWaalsContact OG-CG 3.22Å; S139-E142 WeakPolarHBondContact OG-CG 3.39Å; S139-E142 PolarHBondContact OG-N 3.49Å; S139-E142 PolarHBondContact OG-OE2 3.37Å; S139-T143 WeakPolarHBondContact O-CB 3.33Å; S139-T143 PolarHBondContact O-N 2.93Å; S139-T143 PolarHBondContact O-OG1 2.8Å
140K98Very high94.2Very high108 Ų10870.9 Ų70.947%0.4734%0.341SS..Hα-helixtrans-56.4-46.3179.6-59.4-165.1169.5-177.60111.1N119 L122 L144N119-K140 PolarHBondContact OD1-NZ 2.92Å; L122-K140 HydrophobicContact CD2-CB 4.07Å; L122-K140 HydrophobicContact CD2-CD 4.11Å; L122-K140 HydrophobicContact CD2-CG 3.62Å; K140-L144 VanDerWaalsContact O-CG 3.3Å; K140-L144 WeakPolarHBondContact O-CG 3.08Å; K140-L144 PolarHBondContact O-N 3.03Å
141I98.1Very high94.5Very high87 Ų8775.3 Ų75.345%0.44636%0.362SS..Hα-helixtrans-68.5-41.4-178.3-174.858.9000112.5S139 L144 R145S139-I141 VanDerWaalsContact C-N 3.3Å; S139-I141 PolarHBondContact O-N 3.24Å; S139-I141 WeakPolarHBondContact OG-CG2 3.38Å; I141-L144 PolarHBondContact O-N 3.49Å; I141-R145 HydrophobicContact CD1-CG 4.23Å; I141-R145 HydrophobicContact CG1-CG 4.4Å; I141-R145 WeakPolarHBondContact O-CB 3.39Å; I141-R145 WeakPolarHBondContact O-CG 3.47Å; I141-R145 PolarHBondContact O-N 3.24Å
142E97.6Very high95.1Very high28 Ų2881.3 Ų81.313%0.13138%0.382CS..Hα-helixtrans-66.7-40.5178.7-72.6166.3139.400111.8L138 S139 L144 R145 L146 S178 T181L138-E142 HydrophobicContact CB-CB 4.23Å; S139-E142 VanDerWaalsContact CB-OE2 3.28Å; S139-E142 WeakPolarHBondContact CB-OE2 3.43Å; S139-E142 PolarHBondContact N-OE2 2.94Å; S139-E142 PolarHBondContact O-N 3.34Å; S139-E142 WeakPolarHBondContact OG-CB 3.38Å; S139-E142 VanDerWaalsContact OG-CG 3.22Å; S139-E142 WeakPolarHBondContact OG-CG 3.39Å; S139-E142 PolarHBondContact OG-N 3.49Å; S139-E142 PolarHBondContact OG-OE2 3.37Å; E142-L144 VanDerWaalsContact C-N 3.32Å; E142-L144 PolarHBondContact O-N 3.09Å; E142-R145 PolarHBondContact O-N 3.33Å; E142-L146 VanDerWaalsContact O-CB 3.24Å; E142-L146 WeakPolarHBondContact O-CB 3.42Å; E142-L146 PolarHBondContact O-N 3.49Å; E142-S178 VanDerWaalsContact OE1-CB 3.25Å; E142-S178 WeakPolarHBondContact OE1-CB 3.42Å; E142-S178 PolarHBondContact OE1-OG 3.15Å; E142-T181 PolarHBondContact OE1-OG1 3.03Å
143T97.9Very high95.4Very high0 Ų076.6 Ų76.60%036%0.364CS..Hα-helixtrans-57.9-46.8175.1-53.90000110.5L122 L125 R126 L138 S139 A147L122-T143 HydrophobicContact CD1-CG2 3.91Å; L125-T143 HydrophobicContact CD2-CG2 4.04Å; L125-T143 HydrophobicContact CG-CG2 4.09Å; R126-T143 HydrophobicContact CG-CG2 3.62Å; R126-T143 PolarHBondContact NE-OG1 3.41Å; L138-T143 PolarHBondContact O-OG1 2.93Å; S139-T143 WeakPolarHBondContact O-CB 3.33Å; S139-T143 PolarHBondContact O-N 2.93Å; S139-T143 PolarHBondContact O-OG1 2.8Å; T143-A147 VanDerWaalsContact O-CB 3.28Å; T143-A147 WeakPolarHBondContact O-CB 3.44Å; T143-A147 PolarHBondContact O-N 3.42Å
144L98.6Very high95.9Very high97 Ų9778.3 Ų78.351%0.50837%0.371SS..Hα-helixtrans-67.1-42.4179.7-67.1174.8000112.5L125 K140 I141 E142 A147 K148L125-L144 HydrophobicContact CD2-CD2 4.16Å; K140-L144 VanDerWaalsContact O-CG 3.3Å; K140-L144 WeakPolarHBondContact O-CG 3.08Å; K140-L144 PolarHBondContact O-N 3.03Å; I141-L144 PolarHBondContact O-N 3.49Å; E142-L144 VanDerWaalsContact C-N 3.32Å; E142-L144 PolarHBondContact O-N 3.09Å; L144-A147 PolarHBondContact O-N 3.34Å; L144-K148 PolarHBondContact O-N 3.49Å
145R98.3Very high96.6Very high118 Ų11872.7 Ų72.745%0.44536%0.355SS..Hα-helixtrans-63.1-47.3176.6-73.6178.9-179.3171.94.6111.3I141 E142 A147 K148 N149 G176 L177I141-R145 HydrophobicContact CD1-CG 4.23Å; I141-R145 HydrophobicContact CG1-CG 4.4Å; I141-R145 WeakPolarHBondContact O-CB 3.39Å; I141-R145 WeakPolarHBondContact O-CG 3.47Å; I141-R145 PolarHBondContact O-N 3.24Å; E142-R145 PolarHBondContact O-N 3.33Å; R145-A147 PolarHBondContact O-N 2.96Å; R145-K148 PolarHBondContact O-N 2.98Å; R145-N149 VanDerWaalsContact O-CG 3.23Å; R145-N149 PolarHBondContact O-N 3.26Å; R145-N149 PolarHBondContact O-OD1 2.89Å; R145-G176 VanDerWaalsContact CD-O 3.26Å; R145-G176 WeakPolarHBondContact CD-O 3.46Å; R145-G176 PolarHBondContact NH1-O 2.98Å; R145-L177 HydrophobicContact CB-CD2 3.65Å
146L97.6Very high97Very high0 Ų069 Ų690%033%0.327CS..Hα-helixtrans-64.1-40.7178.9-177.860.8000111.4V129 P130 L138 E142 N149 Y150 L173 L177V129-L146 HydrophobicContact CB-CD2 4.18Å; V129-L146 HydrophobicContact CB-CG 4.33Å; V129-L146 HydrophobicContact CG2-CD2 4.45Å; P130-L146 WeakPolarHBondContact O-CD2 3.46Å; L138-L146 HydrophobicContact CD1-CD2 3.69Å; E142-L146 VanDerWaalsContact O-CB 3.24Å; E142-L146 WeakPolarHBondContact O-CB 3.42Å; E142-L146 PolarHBondContact O-N 3.49Å; L146-N149 PolarHBondContact O-N 3.29Å; L146-Y150 VanDerWaalsContact O-CB 3.29Å; L146-Y150 WeakPolarHBondContact O-CB 3.3Å; L146-Y150 PolarHBondContact O-N 3.19Å; L146-L173 HydrophobicContact CD1-CB 4.18Å; L146-L173 HydrophobicContact CD1-CD2 4.2Å; L146-L177 HydrophobicContact CB-CD1 4.34Å; L146-L177 HydrophobicContact CB-CD2 4.28Å; L146-L177 HydrophobicContact CD1-CD1 3.94Å
147A98.6Very high97.3Very high10 Ų1065.4 Ų65.48%0.08331%0.312CS..Hα-helixtrans-60.4-47.4175.300000112.2L125 V129 T143 L144 R145 N149 Y150 I151L125-A147 HydrophobicContact CD1-CB 4.06Å; L125-A147 HydrophobicContact CD2-CB 4.11Å; L125-A147 HydrophobicContact CG-CB 4.37Å; V129-A147 HydrophobicContact CG1-CB 3.68Å; T143-A147 VanDerWaalsContact O-CB 3.28Å; T143-A147 WeakPolarHBondContact O-CB 3.44Å; T143-A147 PolarHBondContact O-N 3.42Å; L144-A147 PolarHBondContact O-N 3.34Å; R145-A147 PolarHBondContact O-N 2.96Å; A147-N149 PolarHBondContact O-N 2.73Å; A147-Y150 PolarHBondContact O-N 3.01Å; A147-I151 WeakPolarHBondContact O-CG1 3.26Å; A147-I151 PolarHBondContact O-N 3.49Å
148K98.5Very high97.5Very high156 Ų15666.9 Ų66.968%0.67832%0.324SS*.Hα-helixtrans-57.1-48.8175.1176.6-174173.5-178.90111.4L144 R145 Y150 I151 W152L144-K148 PolarHBondContact O-N 3.49Å; R145-K148 PolarHBondContact O-N 2.98Å; K148-Y150 VanDerWaalsContact C-N 3.3Å; K148-Y150 PolarHBondContact O-N 3.37Å; K148-I151 PolarHBondContact O-N 3.34Å; K148-W152 PolarHBondContact O-N 3.04Å; K148-W152 VanDerWaalsContact O-N 3.08Å
149N98.2Very high97.5Very high20 Ų2074.9 Ų74.911%0.10735%0.353CS..Hα-helixtrans-63.6-38.8-179.6-67.2-9.2000111.4R145 L146 A147 W152 A153 T172 L173 K175R145-N149 VanDerWaalsContact O-CG 3.23Å; R145-N149 PolarHBondContact O-N 3.26Å; R145-N149 PolarHBondContact O-OD1 2.89Å; L146-N149 PolarHBondContact O-N 3.29Å; A147-N149 PolarHBondContact O-N 2.73Å; N149-W152 PolarHBondContact O-N 3.03Å; N149-A153 WeakPolarHBondContact O-CB 3.33Å; N149-A153 PolarHBondContact O-N 3.26Å; N149-T172 WeakPolarHBondContact CB-O 3.44Å; N149-T172 PolarHBondContact ND2-O 3.11Å; N149-L173 PolarHBondContact ND2-O 3.27Å; N149-K175 PolarHBondContact ND2-O 3.02Å
150Y97.9Very high97.4Very high65 Ų6575.1 Ų75.126%0.25536%0.355SS..Hα-helixtrans-67-44.6178.8-175-141.2000112.2P130 L146 A147 K148 W152 A153 L154 Y169 L173P130-Y150 HydrophobicContact CG-CD1 4.05Å; P130-Y150 HydrophobicContact CG-CD2 3.7Å; P130-Y150 HydrophobicContact CG-CE1 4.17Å; P130-Y150 HydrophobicContact CG-CE2 3.87Å; P130-Y150 HydrophobicContact CG-CG 3.79Å; L146-Y150 VanDerWaalsContact O-CB 3.29Å; L146-Y150 WeakPolarHBondContact O-CB 3.3Å; L146-Y150 PolarHBondContact O-N 3.19Å; A147-Y150 PolarHBondContact O-N 3.01Å; K148-Y150 VanDerWaalsContact C-N 3.3Å; K148-Y150 PolarHBondContact O-N 3.37Å; Y150-W152 VanDerWaalsContact C-N 3.29Å; Y150-W152 PolarHBondContact O-N 2.98Å; Y150-A153 PolarHBondContact O-N 2.91Å; Y150-L154 HydrophobicContact CD1-CD1 4.27Å; Y150-L154 HydrophobicContact CD2-CD1 4.11Å; Y150-L154 HydrophobicContact CD2-CD2 4.33Å; Y150-L154 HydrophobicContact CD2-CG 3.85Å; Y150-L154 HydrophobicContact CE1-CD1 3.89Å; Y150-L154 HydrophobicContact CE2-CD1 3.67Å; Y150-L154 HydrophobicContact CE2-CD2 3.62Å; Y150-L154 HydrophobicContact CE2-CG 3.54Å; Y150-L154 HydrophobicContact CG-CD1 4.39Å; Y150-L154 WeakPolarHBondContact O-CG 3.48Å; Y150-L154 PolarHBondContact O-N 3.39Å; Y150-Y169 WeakPolarHBondContact CE2-OH 3.34Å; Y150-L173 HydrophobicContact CD2-CD2 4.04Å; Y150-L173 HydrophobicContact CG-CD2 4.42Å
151I98.4Very high97.2Very high114 Ų11473.4 Ų73.459%0.58537%0.368SS*.Hα-helixtrans-56.9-46.1173.4-68.2166000110.2A147 K148 L154 S155A147-I151 WeakPolarHBondContact O-CG1 3.26Å; A147-I151 PolarHBondContact O-N 3.49Å; K148-I151 PolarHBondContact O-N 3.34Å; I151-L154 PolarHBondContact O-N 3.18Å; I151-S155 WeakPolarHBondContact O-CB 3.45Å; I151-S155 PolarHBondContact O-N 3.36Å; I151-S155 PolarHBondContact O-OG 3.41Å
152W97.9Very high96.8Very high147 Ų14776.7 Ų76.756%0.55738%0.379SS*.Hα-helixtrans-61.7-45.8177.8-17788.3000111.9K148 N149 Y150 L154 S155 E156 T172K148-W152 PolarHBondContact O-N 3.04Å; K148-W152 VanDerWaalsContact O-N 3.08Å; N149-W152 PolarHBondContact O-N 3.03Å; Y150-W152 VanDerWaalsContact C-N 3.29Å; Y150-W152 PolarHBondContact O-N 2.98Å; W152-L154 PolarHBondContact O-N 3.43Å; W152-S155 WeakPolarHBondContact O-CB 3.28Å; W152-S155 PolarHBondContact O-N 3.36Å; W152-E156 PolarHBondContact O-N 3.02Å; W152-T172 HydrophobicContact CD2-CG2 4.4Å; W152-T172 HydrophobicContact CE3-CG2 3.15Å; W152-T172 HydrophobicContact CH2-CG2 4.48Å; W152-T172 HydrophobicContact CZ3-CG2 3.21Å; W152-T172 WeakPolarHBondContact CZ3-OG1 3.49Å
153A96.5Very high96.4Very high4 Ų485.8 Ų85.83%0.03341%0.412CS..Hα-helixtrans-61-47.2179.400000111.6N149 Y150 S155 E156 I157 Y169 T172N149-A153 WeakPolarHBondContact O-CB 3.33Å; N149-A153 PolarHBondContact O-N 3.26Å; Y150-A153 PolarHBondContact O-N 2.91Å; A153-S155 VanDerWaalsContact C-N 3.34Å; A153-S155 PolarHBondContact O-N 2.92Å; A153-E156 PolarHBondContact O-N 3.08Å; A153-I157 VanDerWaalsContact O-CG1 3.26Å; A153-I157 WeakPolarHBondContact O-CG1 3.22Å; A153-I157 PolarHBondContact O-N 3.29Å; A153-I157 VanDerWaalsContact O-N 3.08Å; A153-Y169 HydrophobicContact CB-CD2 4Å; A153-Y169 HydrophobicContact CB-CE2 3.66Å; A153-T172 HydrophobicContact CB-CG2 3.77Å
154L96.8Very high95.9Very high64 Ų6487.8 Ų87.834%0.33543%0.425SS..Hα-helixtrans-63.4-40.2176.6-68-178.3000112.1Y150 I151 W152 E156 I157 L158Y150-L154 HydrophobicContact CD1-CD1 4.27Å; Y150-L154 HydrophobicContact CD2-CD1 4.11Å; Y150-L154 HydrophobicContact CD2-CD2 4.33Å; Y150-L154 HydrophobicContact CD2-CG 3.85Å; Y150-L154 HydrophobicContact CE1-CD1 3.89Å; Y150-L154 HydrophobicContact CE2-CD1 3.67Å; Y150-L154 HydrophobicContact CE2-CD2 3.62Å; Y150-L154 HydrophobicContact CE2-CG 3.54Å; Y150-L154 HydrophobicContact CG-CD1 4.39Å; Y150-L154 WeakPolarHBondContact O-CG 3.48Å; Y150-L154 PolarHBondContact O-N 3.39Å; I151-L154 PolarHBondContact O-N 3.18Å; W152-L154 PolarHBondContact O-N 3.43Å; L154-E156 VanDerWaalsContact C-N 3.26Å; L154-E156 PolarHBondContact O-N 3.16Å; L154-I157 HydrophobicContact CD2-CD1 4.27Å; L154-I157 PolarHBondContact O-N 3.34Å; L154-L158 WeakPolarHBondContact O-CG 3.39Å; L154-L158 PolarHBondContact O-N 3.17Å
155S97.8Very high95.6Very high64 Ų6488 Ų8845%0.44843%0.427SS..Hα-helixtrans-59.7-40176.4-58.70000111.3I151 W152 A153 L158 R159I151-S155 WeakPolarHBondContact O-CB 3.45Å; I151-S155 PolarHBondContact O-N 3.36Å; I151-S155 PolarHBondContact O-OG 3.41Å; W152-S155 WeakPolarHBondContact O-CB 3.28Å; W152-S155 PolarHBondContact O-N 3.36Å; A153-S155 VanDerWaalsContact C-N 3.34Å; A153-S155 PolarHBondContact O-N 2.92Å; S155-L158 PolarHBondContact O-N 2.87Å; S155-R159 VanDerWaalsContact O-CB 3.31Å; S155-R159 WeakPolarHBondContact O-CB 3.25Å; S155-R159 PolarHBondContact O-N 2.97Å
156E95.9Very high95.2Very high60 Ų6085.9 Ų85.928%0.2842%0.424SS..Hα-helixtrans-69.6-37.8178.4-172.855.1-153.400113W152 A153 L154 R159 S160W152-E156 PolarHBondContact O-N 3.02Å; A153-E156 PolarHBondContact O-N 3.08Å; L154-E156 VanDerWaalsContact C-N 3.26Å; L154-E156 PolarHBondContact O-N 3.16Å; E156-R159 PolarHBondContact O-N 3.36Å; E156-R159 IonicContact OE1-CZ 3.38Å; E156-R159 IonicContact OE1-NE 3.64Å; E156-R159 IonicContact OE1-NH2 2.67Å; E156-R159 PolarHBondContact OE1-NH2 2.6Å; E156-R159 IonicContact OE2-CZ 3.18Å; E156-R159 IonicContact OE2-NE 2.85Å; E156-R159 PolarHBondContact OE2-NE 2.63Å; E156-R159 IonicContact OE2-NH2 2.72Å; E156-R159 PolarHBondContact OE2-NH2 2.5Å; E156-S160 WeakPolarHBondContact O-CB 3.5Å; E156-S160 PolarHBondContact O-N 3.29Å; E156-S160 PolarHBondContact O-OG 3.11Å
157I95.8Very high94.8Very high45 Ų4588.4 Ų88.423%0.23144%0.439CS..Hα-helixtrans-62.8-46.2174.5-64.2165.6000110.2A153 L154 R159 S160 G161 P164 Y169A153-I157 VanDerWaalsContact O-CG1 3.26Å; A153-I157 WeakPolarHBondContact O-CG1 3.22Å; A153-I157 PolarHBondContact O-N 3.29Å; A153-I157 VanDerWaalsContact O-N 3.08Å; L154-I157 HydrophobicContact CD2-CD1 4.27Å; L154-I157 PolarHBondContact O-N 3.34Å; I157-R159 VanDerWaalsContact C-N 3.34Å; I157-R159 PolarHBondContact O-N 3.17Å; I157-S160 PolarHBondContact O-OG 3.17Å; I157-G161 PolarHBondContact O-N 3.42Å; I157-P164 HydrophobicContact CD1-CB 4.38Å; I157-P164 HydrophobicContact CD1-CG 3.62Å; I157-P164 HydrophobicContact CG1-CB 4.08Å; I157-P164 HydrophobicContact CG1-CG 3.75Å; I157-Y169 HydrophobicContact CD1-CD2 4.3Å; I157-Y169 HydrophobicContact CD1-CE2 4.06Å
158L96.6Very high94.5Very high149 Ų14990.8 Ų90.878%0.7846%0.455SS*.Hα-helixtrans-63.7-39.9177.6-68.9173.8000111.9L154 S155L154-L158 WeakPolarHBondContact O-CG 3.39Å; L154-L158 PolarHBondContact O-N 3.17Å; S155-L158 PolarHBondContact O-N 2.87Å
159R96.6Very high94.2Very high188 Ų18885.1 Ų85.171%0.70943%0.43SS*.Hα-helixtrans-69.5-41.2179.7-173178.271.492-8113.1S155 E156 I157S155-R159 VanDerWaalsContact O-CB 3.31Å; S155-R159 WeakPolarHBondContact O-CB 3.25Å; S155-R159 PolarHBondContact O-N 2.97Å; E156-R159 PolarHBondContact O-N 3.36Å; E156-R159 IonicContact OE1-CZ 3.38Å; E156-R159 IonicContact OE1-NE 3.64Å; E156-R159 IonicContact OE1-NH2 2.67Å; E156-R159 PolarHBondContact OE1-NH2 2.6Å; E156-R159 IonicContact OE2-CZ 3.18Å; E156-R159 IonicContact OE2-NE 2.85Å; E156-R159 PolarHBondContact OE2-NE 2.63Å; E156-R159 IonicContact OE2-NH2 2.72Å; E156-R159 PolarHBondContact OE2-NH2 2.5Å; I157-R159 VanDerWaalsContact C-N 3.34Å; I157-R159 PolarHBondContact O-N 3.17Å
160S94.4Very high94Very high54 Ų5484.1 Ų84.138%0.37842%0.424SS..Hα-helixtrans-80.9-23.2-178.9640000113.2E156 I157 K162E156-S160 WeakPolarHBondContact O-CB 3.5Å; E156-S160 PolarHBondContact O-N 3.29Å; E156-S160 PolarHBondContact O-OG 3.11Å; I157-S160 PolarHBondContact O-OG 3.17Å; S160-K162 PolarHBondContact O-N 2.89Å; S160-K162 PolarHBondContact OG-N 3.46Å
161G93.3Very high93.7Very high71 Ų7183.4 Ų83.473%0.73242%0.423SS*.  trans64.214.2-174.600000113.6I157I157-G161 PolarHBondContact O-N 3.42Å
162K90.6Very high93.6Very high156 Ų15679.1 Ų79.168%0.67840%0.402SS*.SBendtrans-118.3148.7-175.2-68.9176.6-174.3178.50110.3S160S160-K162 PolarHBondContact O-N 2.89Å; S160-K162 PolarHBondContact OG-N 3.46Å
163R88.3Confident93.5Very high219 Ų21972.1 Ų72.183%0.82638%0.376SS*.PPolyproline II helixtrans-64127.2170.2-167.1171.773.581.2-4.4108.4
164P88.4Confident93.5Very high43 Ų4372 Ų7228%0.27938%0.375SS..PPolyproline II helixtrans-69.2149-179.431.8-37000110I157 Y169I157-P164 HydrophobicContact CD1-CB 4.38Å; I157-P164 HydrophobicContact CD1-CG 3.62Å; I157-P164 HydrophobicContact CG1-CB 4.08Å; I157-P164 HydrophobicContact CG1-CG 3.75Å; P164-Y169 HydrophobicContact CB-CD2 4.5Å; P164-Y169 HydrophobicContact CG-CD2 4.17Å; P164-Y169 HydrophobicContact CG-CG 4.44Å
165D90.9Very high93.4Very high101 Ų10176.1 Ų76.154%0.5439%0.39SS..PPolyproline II helixtrans-62.4138.1164.917256.1000109.7V167 S168 Y169D165-V167 VanDerWaalsContact C-N 3.34Å; D165-V167 PolarHBondContact O-N 3.21Å; D165-V167 WeakPolarHBondContact OD2-CB 3.47Å; D165-V167 PolarHBondContact OD2-N 3.35Å; D165-V167 VanDerWaalsContact OD2-N 3.16Å; D165-S168 PolarHBondContact O-N 3.34Å; D165-S168 PolarHBondContact OD2-N 2.92Å; D165-S168 VanDerWaalsContact OD2-N 3.09Å; D165-Y169 VanDerWaalsContact O-CB 3.3Å; D165-Y169 WeakPolarHBondContact O-CB 3.47Å; D165-Y169 PolarHBondContact O-N 3.35Å
166L89.6Confident93.3Very high74 Ų7475.3 Ų75.339%0.38739%0.392SS..Hα-helixtrans-65.9-39.8-172.5-17663.9000111.1Y169 V170 L191L166-Y169 PolarHBondContact O-N 3.5Å; L166-V170 WeakPolarHBondContact O-CG2 3.44Å; L166-V170 PolarHBondContact O-N 3.26Å; L166-L191 HydrophobicContact CD2-CD2 3.48Å; L166-L191 VanDerWaalsContact CD2-CD2 3.48Å; L166-L191 HydrophobicContact CG-CD2 3.74Å
167V90.1Very high93.4Very high53 Ų5373.4 Ų73.432%0.32138%0.384SS..Hα-helixtrans-66.6-49-179.4-179.70000109.8D165 Y169 V170 Q171D165-V167 VanDerWaalsContact C-N 3.34Å; D165-V167 PolarHBondContact O-N 3.21Å; D165-V167 WeakPolarHBondContact OD2-CB 3.47Å; D165-V167 PolarHBondContact OD2-N 3.35Å; D165-V167 VanDerWaalsContact OD2-N 3.16Å; V167-Y169 VanDerWaalsContact C-N 3.29Å; V167-Y169 PolarHBondContact O-N 3.22Å; V167-V170 PolarHBondContact O-N 3.44Å; V167-Q171 HydrophobicContact CG1-CG 4.42Å; V167-Q171 WeakPolarHBondContact O-CG 3.39Å; V167-Q171 PolarHBondContact O-N 3.38Å
168S91.3Very high93.4Very high59 Ų5973.2 Ų73.241%0.41339%0.387SS..Hα-helixtrans-58.7-39.6176.2-176.70000112.7D165 Q171 T172D165-S168 PolarHBondContact O-N 3.34Å; D165-S168 PolarHBondContact OD2-N 2.92Å; D165-S168 VanDerWaalsContact OD2-N 3.09Å; S168-Q171 PolarHBondContact O-N 3.44Å; S168-T172 WeakPolarHBondContact O-CB 3.44Å; S168-T172 PolarHBondContact O-N 2.99Å; S168-T172 PolarHBondContact O-OG1 3.47Å
169Y93.3Very high93.3Very high37 Ų3770.7 Ų70.715%0.14537%0.371CS..Hα-helixtrans-63.6-44176.5-177.3-107.8000112.1Y150 A153 I157 P164 D165 L166 V167 T172 L173 L189Y150-Y169 WeakPolarHBondContact CE2-OH 3.34Å; A153-Y169 HydrophobicContact CB-CD2 4Å; A153-Y169 HydrophobicContact CB-CE2 3.66Å; I157-Y169 HydrophobicContact CD1-CD2 4.3Å; I157-Y169 HydrophobicContact CD1-CE2 4.06Å; P164-Y169 HydrophobicContact CB-CD2 4.5Å; P164-Y169 HydrophobicContact CG-CD2 4.17Å; P164-Y169 HydrophobicContact CG-CG 4.44Å; D165-Y169 VanDerWaalsContact O-CB 3.3Å; D165-Y169 WeakPolarHBondContact O-CB 3.47Å; D165-Y169 PolarHBondContact O-N 3.35Å; L166-Y169 PolarHBondContact O-N 3.5Å; V167-Y169 VanDerWaalsContact C-N 3.29Å; V167-Y169 PolarHBondContact O-N 3.22Å; Y169-T172 WeakPolarHBondContact O-CB 3.39Å; Y169-T172 PolarHBondContact O-N 3.03Å; Y169-L173 HydrophobicContact CD1-CD1 4Å; Y169-L173 HydrophobicContact CE1-CD1 3.46Å; Y169-L173 VanDerWaalsContact CE1-CD1 3.46Å; Y169-L173 HydrophobicContact CE1-CG 4.26Å; Y169-L173 WeakPolarHBondContact O-CG 3.28Å; Y169-L173 PolarHBondContact O-N 3.25Å; Y169-L189 HydrophobicContact CE1-CD1 4.45Å
170V93.3Very high93.1Very high0 Ų066.1 Ų66.10%037%0.365CS..Hα-helixtrans-70.8-39.5177.7-177.80000112.2L166 V167 T172 L173 C174 V185 L189 L191 F196L166-V170 WeakPolarHBondContact O-CG2 3.44Å; L166-V170 PolarHBondContact O-N 3.26Å; V167-V170 PolarHBondContact O-N 3.44Å; V170-T172 PolarHBondContact O-N 2.81Å; V170-L173 PolarHBondContact O-N 3.14Å; V170-L173 VanDerWaalsContact O-N 3.13Å; V170-C174 WeakPolarHBondContact O-CB 3.42Å; V170-C174 PolarHBondContact O-N 3.39Å; V170-C174 PolarHBondContact O-SG 3.31Å; V170-V185 HydrophobicContact CG1-CG1 4.15Å; V170-L189 HydrophobicContact CG2-CB 4.27Å; V170-L189 HydrophobicContact CG2-CD1 3.43Å; V170-L189 VanDerWaalsContact CG2-CD1 3.43Å; V170-L189 HydrophobicContact CG2-CG 4.48Å; V170-L191 HydrophobicContact CB-CD1 3.63Å; V170-L191 HydrophobicContact CG1-CD1 3.74Å; V170-L191 HydrophobicContact CG2-CD1 3.47Å; V170-L191 VanDerWaalsContact CG2-CD1 3.47Å; V170-L191 HydrophobicContact CG2-CG 4.17Å; V170-F196 HydrophobicContact CB-CD2 4.43Å; V170-F196 HydrophobicContact CB-CE2 3.76Å; V170-F196 HydrophobicContact CB-CZ 4.33Å; V170-F196 HydrophobicContact CG1-CD2 4.18Å; V170-F196 HydrophobicContact CG1-CE1 4.46Å; V170-F196 HydrophobicContact CG1-CE2 3.54Å; V170-F196 HydrophobicContact CG1-CZ 3.7Å
171Q93.1Very high93.1Very high50 Ų5063.8 Ų63.823%0.23435%0.349CS..Hα-helixtrans-55.7-42.5174.2-75.4177.4-1500111.2V167 S168 K175 F196 E199V167-Q171 HydrophobicContact CG1-CG 4.42Å; V167-Q171 WeakPolarHBondContact O-CG 3.39Å; V167-Q171 PolarHBondContact O-N 3.38Å; S168-Q171 PolarHBondContact O-N 3.44Å; Q171-K175 PolarHBondContact O-N 2.94Å; Q171-F196 HydrophobicContact CB-CE2 4.3Å; Q171-F196 HydrophobicContact CB-CZ 4.46Å; Q171-F196 HydrophobicContact CG-CD2 4.44Å; Q171-F196 HydrophobicContact CG-CE2 3.54Å; Q171-F196 HydrophobicContact CG-CZ 3.96Å; Q171-E199 PolarHBondContact NE2-OE2 3.07Å
172T95.3Very high93.1Very high23 Ų2360.9 Ų60.914%0.14132%0.317CS..Hα-helixtrans-61.2-50.9174.8-64.50000112.2N149 W152 A153 S168 Y169 V170 C174 K175N149-T172 WeakPolarHBondContact CB-O 3.44Å; N149-T172 PolarHBondContact ND2-O 3.11Å; W152-T172 HydrophobicContact CD2-CG2 4.4Å; W152-T172 HydrophobicContact CE3-CG2 3.15Å; W152-T172 HydrophobicContact CH2-CG2 4.48Å; W152-T172 HydrophobicContact CZ3-CG2 3.21Å; W152-T172 WeakPolarHBondContact CZ3-OG1 3.49Å; A153-T172 HydrophobicContact CB-CG2 3.77Å; S168-T172 WeakPolarHBondContact O-CB 3.44Å; S168-T172 PolarHBondContact O-N 2.99Å; S168-T172 PolarHBondContact O-OG1 3.47Å; Y169-T172 WeakPolarHBondContact O-CB 3.39Å; Y169-T172 PolarHBondContact O-N 3.03Å; V170-T172 PolarHBondContact O-N 2.81Å; T172-C174 VanDerWaalsContact C-N 3.33Å; T172-C174 PolarHBondContact O-N 2.91Å; T172-K175 PolarHBondContact O-N 2.97Å
173L95.9Very high93.2Very high0 Ų057.4 Ų57.40%031%0.306CS..Hα-helixtrans-61.2-42.3-179.2-72.1-179.7000111.9P130 L146 N149 Y150 Y169 V170 K175 L177 V185 L189P130-L173 HydrophobicContact CB-CD1 4.38Å; P130-L173 HydrophobicContact CG-CD1 4.23Å; P130-L173 HydrophobicContact CG-CD2 4.25Å; L146-L173 HydrophobicContact CD1-CB 4.18Å; L146-L173 HydrophobicContact CD1-CD2 4.2Å; N149-L173 PolarHBondContact ND2-O 3.27Å; Y150-L173 HydrophobicContact CD2-CD2 4.04Å; Y150-L173 HydrophobicContact CG-CD2 4.42Å; Y169-L173 HydrophobicContact CD1-CD1 4Å; Y169-L173 HydrophobicContact CE1-CD1 3.46Å; Y169-L173 VanDerWaalsContact CE1-CD1 3.46Å; Y169-L173 HydrophobicContact CE1-CG 4.26Å; Y169-L173 WeakPolarHBondContact O-CG 3.28Å; Y169-L173 PolarHBondContact O-N 3.25Å; V170-L173 PolarHBondContact O-N 3.14Å; V170-L173 VanDerWaalsContact O-N 3.13Å; L173-K175 VanDerWaalsContact C-N 3.31Å; L173-K175 PolarHBondContact O-N 3.5Å; L173-L177 WeakPolarHBondContact O-CD1 3.47Å; L173-V185 HydrophobicContact CB-CG1 4.35Å; L173-V185 HydrophobicContact CD1-CG1 4.39Å; L173-L189 HydrophobicContact CD1-CD1 3.97Å
174C96.1Very high93.3Very high2 Ų249 Ų491%0.01428%0.277CS..Hα-helixtrans-78.7-8.7-174.3-64.80000114.5V170 T172 G176 L177 T182 F196V170-C174 WeakPolarHBondContact O-CB 3.42Å; V170-C174 PolarHBondContact O-N 3.39Å; V170-C174 PolarHBondContact O-SG 3.31Å; T172-C174 VanDerWaalsContact C-N 3.33Å; T172-C174 PolarHBondContact O-N 2.91Å; C174-G176 PolarHBondContact O-N 2.88Å; C174-G176 VanDerWaalsContact O-N 3.08Å; C174-L177 WeakPolarHBondContact O-CB 3.41Å; C174-L177 PolarHBondContact O-N 3.02Å; C174-T182 HydrophobicContact CB-CG2 3.91Å; C174-F196 HydrophobicContact CB-CE1 4.34Å; C174-F196 HydrophobicContact CB-CZ 4.13Å
175K95.8Very high93.4Very high150 Ų15047 Ų4765%0.65226%0.264SS*.THydrogen-bonded Turntrans-56.3116.3-176.1-174175.3-179.2172.70112.2N149 Q171 T172 L173 L177N149-K175 PolarHBondContact ND2-O 3.02Å; Q171-K175 PolarHBondContact O-N 2.94Å; T172-K175 PolarHBondContact O-N 2.97Å; L173-K175 VanDerWaalsContact C-N 3.31Å; L173-K175 PolarHBondContact O-N 3.5Å; K175-L177 VanDerWaalsContact C-N 3.26Å; K175-L177 PolarHBondContact O-N 3.39Å
176G95.9Very high93.3Very high48 Ų4842.7 Ų42.750%0.49524%0.243SC..THydrogen-bonded Turntrans73.412.1178.100000114.9R145 C174R145-G176 VanDerWaalsContact CD-O 3.26Å; R145-G176 WeakPolarHBondContact CD-O 3.46Å; R145-G176 PolarHBondContact NH1-O 2.98Å; C174-G176 PolarHBondContact O-N 2.88Å; C174-G176 VanDerWaalsContact O-N 3.08Å
177L96.6Very high93.1Very high19 Ų1941.7 Ų41.710%0.09925%0.25CC..  trans-80.8159.4169.1-59.1-174.8000110.7R145 L146 L173 C174 K175 T181 V185R145-L177 HydrophobicContact CB-CD2 3.65Å; L146-L177 HydrophobicContact CB-CD1 4.34Å; L146-L177 HydrophobicContact CB-CD2 4.28Å; L146-L177 HydrophobicContact CD1-CD1 3.94Å; L173-L177 WeakPolarHBondContact O-CD1 3.47Å; C174-L177 WeakPolarHBondContact O-CB 3.41Å; C174-L177 PolarHBondContact O-N 3.02Å; K175-L177 VanDerWaalsContact C-N 3.26Å; K175-L177 PolarHBondContact O-N 3.39Å; L177-T181 HydrophobicContact CB-CG2 4.11Å; L177-T181 HydrophobicContact CD1-CG2 3.7Å; L177-T181 HydrophobicContact CG-CG2 4.32Å; L177-V185 HydrophobicContact CD1-CG2 4.39Å
178S96.1Very high92.8Very high42 Ų4242.2 Ų42.229%0.29426%0.255SS..  trans-68157.1172.374.50000110.6E142 P180 T181 T182E142-S178 VanDerWaalsContact OE1-CB 3.25Å; E142-S178 WeakPolarHBondContact OE1-CB 3.42Å; E142-S178 PolarHBondContact OE1-OG 3.15Å; S178-P180 WeakPolarHBondContact OG-CD 3.47Å; S178-T181 PolarHBondContact O-N 2.82Å; S178-T181 VanDerWaalsContact O-N 3.11Å; S178-T181 WeakPolarHBondContact OG-CB 3.44Å; S178-T181 PolarHBondContact OG-N 3.23Å; S178-T181 PolarHBondContact OG-OG1 3.33Å; S178-T182 PolarHBondContact O-N 3.49Å; S178-T182 PolarHBondContact O-OG1 3.14Å
179Q94.1Very high92.4Very high95 Ų9541.9 Ų41.944%0.44425%0.248SC..Hα-helixtrans-55.7-45177-172.163.44900113.4T181 T182 N183Q179-T181 VanDerWaalsContact C-N 3.28Å; Q179-T181 PolarHBondContact O-N 3.03Å; Q179-T182 PolarHBondContact O-N 2.98Å; Q179-N183 PolarHBondContact NE2-OD1 3.28Å; Q179-N183 VanDerWaalsContact O-CG 3.22Å; Q179-N183 PolarHBondContact O-N 2.91Å; Q179-N183 PolarHBondContact O-ND2 3.18Å; Q179-N183 PolarHBondContact O-OD1 3.48Å
180P93.4Very high91.5Very high92 Ų9248.4 Ų48.460%0.59728%0.28SS*.Hα-helixtrans-58.7-39.3175.5-25.935.7000113.2S178 N183 L184S178-P180 WeakPolarHBondContact OG-CD 3.47Å; P180-N183 PolarHBondContact O-N 3.43Å; P180-L184 PolarHBondContact O-N 3.33Å
181T94.1Very high90.1Very high6 Ų649.6 Ų49.64%0.03729%0.286CS..Hα-helixtrans-71.9-41179.9-65.20000111.5L138 E142 L177 S178 Q179 N183 L184 V185L138-T181 HydrophobicContact CD1-CG2 4.44Å; L138-T181 HydrophobicContact CD2-CG2 3.74Å; E142-T181 PolarHBondContact OE1-OG1 3.03Å; L177-T181 HydrophobicContact CB-CG2 4.11Å; L177-T181 HydrophobicContact CD1-CG2 3.7Å; L177-T181 HydrophobicContact CG-CG2 4.32Å; S178-T181 PolarHBondContact O-N 2.82Å; S178-T181 VanDerWaalsContact O-N 3.11Å; S178-T181 WeakPolarHBondContact OG-CB 3.44Å; S178-T181 PolarHBondContact OG-N 3.23Å; S178-T181 PolarHBondContact OG-OG1 3.33Å; Q179-T181 VanDerWaalsContact C-N 3.28Å; Q179-T181 PolarHBondContact O-N 3.03Å; T181-N183 VanDerWaalsContact C-N 3.26Å; T181-N183 PolarHBondContact O-N 2.76Å; T181-L184 WeakPolarHBondContact O-CB 3.45Å; T181-L184 PolarHBondContact O-N 3.15Å; T181-L184 VanDerWaalsContact O-N 3.15Å; T181-V185 WeakPolarHBondContact O-CG2 3.36Å; T181-V185 PolarHBondContact O-N 2.91Å
182T94.2Very high88.1Confident10 Ų1053.4 Ų53.46%0.06131%0.308CS..Hα-helixtrans-57.4-41.6172.4-640000111.3C174 S178 Q179 V185 A186 F196C174-T182 HydrophobicContact CB-CG2 3.91Å; S178-T182 PolarHBondContact O-N 3.49Å; S178-T182 PolarHBondContact O-OG1 3.14Å; Q179-T182 PolarHBondContact O-N 2.98Å; T182-V185 PolarHBondContact O-N 3.21Å; T182-A186 WeakPolarHBondContact O-CB 3.43Å; T182-A186 PolarHBondContact O-N 3.27Å; T182-F196 HydrophobicContact CG2-CD1 4.4Å; T182-F196 HydrophobicContact CG2-CE1 3.83Å
183N91.1Very high86.1Confident82 Ų8256.5 Ų56.544%0.43933%0.331SS..Hα-helixtrans-64.6-41.1176-67.3-13.1000112.1Q179 P180 T181 A186 G187Q179-N183 PolarHBondContact NE2-OD1 3.28Å; Q179-N183 VanDerWaalsContact O-CG 3.22Å; Q179-N183 PolarHBondContact O-N 2.91Å; Q179-N183 PolarHBondContact O-ND2 3.18Å; Q179-N183 PolarHBondContact O-OD1 3.48Å; P180-N183 PolarHBondContact O-N 3.43Å; T181-N183 VanDerWaalsContact C-N 3.26Å; T181-N183 PolarHBondContact O-N 2.76Å; N183-A186 PolarHBondContact O-N 3.3Å; N183-G187 PolarHBondContact O-N 3.26Å
184L90.8Very high84Confident43 Ų4367.4 Ų67.423%0.22537%0.372CS..Hα-helixtrans-59.9-46.8174.7179.566.5000111L138 P180 T181 A186 G187 C188L138-L184 HydrophobicContact CD2-CD2 4.04Å; P180-L184 PolarHBondContact O-N 3.33Å; T181-L184 WeakPolarHBondContact O-CB 3.45Å; T181-L184 PolarHBondContact O-N 3.15Å; T181-L184 VanDerWaalsContact O-N 3.15Å; L184-A186 PolarHBondContact O-N 3.37Å; L184-G187 PolarHBondContact O-N 2.9Å; L184-C188 PolarHBondContact O-N 2.86Å; L184-C188 PolarHBondContact O-SG 3Å; L184-C188 VanDerWaalsContact O-SG 3.35Å
185V91Very high81.8Confident1 Ų173.1 Ų73.11%0.00640%0.403CS..Hα-helixtrans-62-45.2178.81760000111.3C131 V170 L173 L177 T181 T182 G187 C188 L189C131-V185 HydrophobicContact CB-CG2 4.46Å; V170-V185 HydrophobicContact CG1-CG1 4.15Å; L173-V185 HydrophobicContact CB-CG1 4.35Å; L173-V185 HydrophobicContact CD1-CG1 4.39Å; L177-V185 HydrophobicContact CD1-CG2 4.39Å; T181-V185 WeakPolarHBondContact O-CG2 3.36Å; T181-V185 PolarHBondContact O-N 2.91Å; T182-V185 PolarHBondContact O-N 3.21Å; V185-G187 VanDerWaalsContact C-N 3.31Å; V185-G187 PolarHBondContact O-N 3.42Å; V185-C188 PolarHBondContact O-N 3.35Å; V185-L189 HydrophobicContact CG1-CD1 3.87Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 WeakPolarHBondContact O-CG 3.47Å; V185-L189 PolarHBondContact O-N 2.95Å
186A87.6Confident79.7Confident11 Ų1166.4 Ų66.49%0.09137%0.374CS..Hα-helixtrans-60.4-40.9176.400000112.1T182 N183 L184 L189 Q190 L191T182-A186 WeakPolarHBondContact O-CB 3.43Å; T182-A186 PolarHBondContact O-N 3.27Å; N183-A186 PolarHBondContact O-N 3.3Å; L184-A186 PolarHBondContact O-N 3.37Å; A186-L189 PolarHBondContact O-N 3.46Å; A186-Q190 PolarHBondContact O-N 3.33Å; A186-L191 PolarHBondContact O-N 3.44Å; A186-L191 VanDerWaalsContact O-N 3.15Å
187G85.8Confident77.8Confident52 Ų5268.4 Ų68.454%0.53637%0.372SS..Hα-helixtrans-65.9-45.1176.400000113.1N183 L184 V185 L189 Q190N183-G187 PolarHBondContact O-N 3.26Å; L184-G187 PolarHBondContact O-N 2.9Å; V185-G187 VanDerWaalsContact C-N 3.31Å; V185-G187 PolarHBondContact O-N 3.42Å; G187-L189 VanDerWaalsContact C-N 3.27Å; G187-L189 PolarHBondContact O-N 3.27Å; G187-Q190 PolarHBondContact O-N 3.33Å
188C85.3Confident75.7Confident65 Ų6572.4 Ų72.444%0.43940%0.397SS..Hα-helixtrans-64.8-30.4178-71.70000113.2C131 L184 V185C131-C188 HydrophobicContact CB-CB 3.84Å; C131-C188 VanDerWaalsContact CB-SG 3.58Å; C131-C188 WeakPolarHBondContact SG-CB 3.38Å; L184-C188 PolarHBondContact O-N 2.86Å; L184-C188 PolarHBondContact O-SG 3Å; L184-C188 VanDerWaalsContact O-SG 3.35Å; V185-C188 PolarHBondContact O-N 3.35Å
189L81.8Confident73.5Confident51 Ų5174.9 Ų74.927%0.26740%0.404SS..THydrogen-bonded Turntrans-95.58.3179.3-62175.9000113.2Y169 V170 L173 V185 A186 G187 L191Y169-L189 HydrophobicContact CE1-CD1 4.45Å; V170-L189 HydrophobicContact CG2-CB 4.27Å; V170-L189 HydrophobicContact CG2-CD1 3.43Å; V170-L189 VanDerWaalsContact CG2-CD1 3.43Å; V170-L189 HydrophobicContact CG2-CG 4.48Å; L173-L189 HydrophobicContact CD1-CD1 3.97Å; V185-L189 HydrophobicContact CG1-CD1 3.87Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 WeakPolarHBondContact O-CG 3.47Å; V185-L189 PolarHBondContact O-N 2.95Å; A186-L189 PolarHBondContact O-N 3.46Å; G187-L189 VanDerWaalsContact C-N 3.27Å; G187-L189 PolarHBondContact O-N 3.27Å; L189-L191 PolarHBondContact O-N 3.43Å; L189-L191 VanDerWaalsContact O-N 3.11Å
190Q73.6Confident71.5Confident175 Ų17574 Ų7482%0.81840%0.4SS*.THydrogen-bonded Turntrans50.935.2176.2-59.7176.114.800113.4A186 G187 N192A186-Q190 PolarHBondContact O-N 3.33Å; G187-Q190 PolarHBondContact O-N 3.33Å; Q190-N192 PolarHBondContact O-N 2.89Å
191L64.8Low69.3Low24 Ų2477.3 Ų77.313%0.12641%0.408CS..  trans-70.3128.9170.3-75.2-174.7000108.6L166 V170 A186 L189 S193 F196L166-L191 HydrophobicContact CD2-CD2 3.48Å; L166-L191 VanDerWaalsContact CD2-CD2 3.48Å; L166-L191 HydrophobicContact CG-CD2 3.74Å; V170-L191 HydrophobicContact CB-CD1 3.63Å; V170-L191 HydrophobicContact CG1-CD1 3.74Å; V170-L191 HydrophobicContact CG2-CD1 3.47Å; V170-L191 VanDerWaalsContact CG2-CD1 3.47Å; V170-L191 HydrophobicContact CG2-CG 4.17Å; A186-L191 PolarHBondContact O-N 3.44Å; A186-L191 VanDerWaalsContact O-N 3.15Å; L189-L191 PolarHBondContact O-N 3.43Å; L189-L191 VanDerWaalsContact O-N 3.11Å; L191-S193 PolarHBondContact O-N 2.9Å; L191-F196 HydrophobicContact CD1-CD2 3.9Å; L191-F196 HydrophobicContact CD1-CE2 4.45Å; L191-F196 HydrophobicContact CD1-CG 4.47Å
192N50.3Low66.8Low130 Ų13081.8 Ų81.870%0.69544%0.438SS*.  trans-55.3107.5167.6-77.4-66.4000107.8Q190 R194 N195Q190-N192 PolarHBondContact O-N 2.89Å; N192-R194 PolarHBondContact O-N 2.89Å; N192-N195 PolarHBondContact O-N 3.36Å
193S53Low64.5Low88 Ų8888.2 Ų88.262%0.61547%0.468SS*.THydrogen-bonded Turntrans-53.3-18.6-169.8-38.80000114L191 N195L191-S193 PolarHBondContact O-N 2.9Å; S193-N195 PolarHBondContact O-N 3.16Å
194R52.8Low62.2Low229 Ų22992.3 Ų92.386%0.86449%0.49SS*.THydrogen-bonded Turntrans-70.8-18.2178.3-76.2-175.3162.4177.1-4.6115.6N192N192-R194 PolarHBondContact O-N 2.89Å
195N50.8Low59.6Low122 Ų12292.8 Ų92.865%0.65251%0.505SS*.THydrogen-bonded Turntrans-100.8-17.9-177.1-72.8-58.5000114.8N192 S193N192-N195 PolarHBondContact O-N 3.36Å; S193-N195 PolarHBondContact O-N 3.16Å
196F51.1Low57.1Low10 Ų1096.2 Ų96.24%0.04454%0.541CS..THydrogen-bonded Turntrans-94.8-34.5-170.2-166.6-93.3000114V170 Q171 C174 T182 L191 T198V170-F196 HydrophobicContact CB-CD2 4.43Å; V170-F196 HydrophobicContact CB-CE2 3.76Å; V170-F196 HydrophobicContact CB-CZ 4.33Å; V170-F196 HydrophobicContact CG1-CD2 4.18Å; V170-F196 HydrophobicContact CG1-CE1 4.46Å; V170-F196 HydrophobicContact CG1-CE2 3.54Å; V170-F196 HydrophobicContact CG1-CZ 3.7Å; Q171-F196 HydrophobicContact CB-CE2 4.3Å; Q171-F196 HydrophobicContact CB-CZ 4.46Å; Q171-F196 HydrophobicContact CG-CD2 4.44Å; Q171-F196 HydrophobicContact CG-CE2 3.54Å; Q171-F196 HydrophobicContact CG-CZ 3.96Å; C174-F196 HydrophobicContact CB-CE1 4.34Å; C174-F196 HydrophobicContact CB-CZ 4.13Å; T182-F196 HydrophobicContact CG2-CD1 4.4Å; T182-F196 HydrophobicContact CG2-CE1 3.83Å; L191-F196 HydrophobicContact CD1-CD2 3.9Å; L191-F196 HydrophobicContact CD1-CE2 4.45Å; L191-F196 HydrophobicContact CD1-CG 4.47Å; F196-T198 PolarHBondContact O-N 3.46Å
197L56.1Low55.2Low90 Ų90107.2 Ų107.247%0.47158%0.58SS.*Hα-helixtrans-69.6-30.7-176.4-83162.1000113.4E199L197-E199 VanDerWaalsContact C-N 3.33Å; L197-E199 PolarHBondContact O-N 2.93Å
198T52.4Low52.9Low102 Ų102115.6 Ų115.663%0.62660%0.597SS**Hα-helixtrans-70.9-24.6-176.131.70000113.6F196F196-T198 PolarHBondContact O-N 3.46Å
199E48.9Very low50.6Low94 Ų94116 Ų11644%0.43961%0.612SS.*Hα-helixtrans-94.1-32-179-121.1-143.7113.600113.7Q171 L197 Q201 C202Q171-E199 PolarHBondContact NE2-OE2 3.07Å; L197-E199 VanDerWaalsContact C-N 3.33Å; L197-E199 PolarHBondContact O-N 2.93Å; E199-Q201 PolarHBondContact O-N 3.27Å; E199-C202 PolarHBondContact O-N 3.16Å; E199-C202 VanDerWaalsContact O-N 3.16Å
200Q53Low48.6Very low77 Ų77119.6 Ų119.636%0.3664%0.641SS.*Hα-helixtrans-64.3-29.9-179.8-161.584.349.600112.1C202Q200-C202 VanDerWaalsContact C-N 3.33Å
201Q47.8Very low46.7Very low161 Ų161114 Ų11475%0.75263%0.63SS**THydrogen-bonded Turntrans-77.7-15.4179.2-162.5159.69.700113.4E199E199-Q201 PolarHBondContact O-N 3.27Å
202C41.2Very low45.6Very low100 Ų100118.4 Ų118.468%0.67666%0.663SS**THydrogen-bonded Turntrans-86.9-15.7-178.9-75.30000114.5E199 Q200E199-C202 PolarHBondContact O-N 3.16Å; E199-C202 VanDerWaalsContact O-N 3.16Å; Q200-C202 VanDerWaalsContact C-N 3.33Å
203Q44.9Very low45Very low145 Ų145121.8 Ų121.868%0.67867%0.672SS**SBendtrans-89.4-20.9-177.5-68.6-170.528.400114.3
204D43.5Very low44.3Very low169 Ų169121.4 Ų121.490%0.90467%0.669SS**SBendtrans-105.56.1176.9-101.9-26.9000113.8
205G35.5Very low43.7Very low52 Ų52119.4 Ų119.454%0.53667%0.672SS.*  trans-108.953.3-175.700000114R207G205-R207 PolarHBondContact O-N 3.49Å
206G39.3Very low42.9Very low74 Ų74120.6 Ų120.676%0.76367%0.673SS**  trans-68.3111.9168.800000111.4
207R47.6Very low42.2Very low242 Ų242125.8 Ų125.891%0.91371%0.711SS**  trans98.879.7162.6-51.7-174.8-166.1-112.13.7117.5G205G205-R207 PolarHBondContact O-N 3.49Å
208Y37.7Very low41.2Very low228 Ų228131 Ų13189%0.89473%0.726SS**SBend-159.2156.4126.347.6-95000110.5
209G35.8Very low41.1Very low74 Ų74131.6 Ų131.676%0.76373%0.731SS**  trans-57.1142.8-155.100000117.6G211G209-G211 PolarHBondContact O-N 3.2Å
210S40.2Very low40.5Very low126 Ų126138.3 Ų138.388%0.88175%0.754SS**  trans-50.1121.2158.1170.80000111.6
211G34.7Very low39.8Very low57 Ų57143.4 Ų143.459%0.58878%0.778SS**  trans-134.595.5166.100000109.7G209 F213G209-G211 PolarHBondContact O-N 3.2Å; G211-F213 PolarHBondContact O-N 3.28Å
212S41.9Very low39Very low116 Ų116141.9 Ų141.981%0.81178%0.784SS**  trans-61.1115169-74.10000110
213F36.8Very low38.7Very low201 Ų201141.6 Ų141.688%0.88279%0.789SS**  trans-94.7100.1163.1-78.5-80.6000109.4G211 M215G211-F213 PolarHBondContact O-N 3.28Å; F213-M215 PolarHBondContact O-N 3.24Å
214S37.8Very low38.4Very low80 Ų80146.2 Ų146.256%0.55980%0.8SS**  trans-66.2120.1163.4-176.70000109.1H216S214-H216 PolarHBondContact O-N 3.4Å; S214-H216 PolarHBondContact OG-NE2 3.23Å; S214-H216 VanDerWaalsContact OG-NE2 3.14Å
215M40.5Very low38.2Very low187 Ų187146.1 Ų146.192%0.92180%0.799SS**  trans-70.2100.1168.7-90.7-8512700109.2F213F213-M215 PolarHBondContact O-N 3.24Å
216H34.9Very low38Very low147 Ų147148.9 Ų148.968%0.68181%0.81SS**  trans-99.6115.3165.7-75.5-57000110.7S214 Y218S214-H216 PolarHBondContact O-N 3.4Å; S214-H216 PolarHBondContact OG-NE2 3.23Å; S214-H216 VanDerWaalsContact OG-NE2 3.14Å; H216-Y218 HydrophobicContact CB-CD2 4.4Å; H216-Y218 HydrophobicContact CB-CE2 4.49Å
217S36.3Very low37.7Very low119 Ų119151 Ų15183%0.83281%0.813SS**  trans-78119.2166.6-175.40000108.9
218Y34.3Very low37.9Very low201 Ų201145 Ų14579%0.78881%0.805SS**  trans-125.2130.3167.2-93.2-81.6000110.5H216H216-Y218 HydrophobicContact CB-CD2 4.4Å; H216-Y218 HydrophobicContact CB-CE2 4.49Å
219P50.1Low37.7Very low114 Ų114142.4 Ų142.474%0.7480%0.801SS**  trans-87129.7176.433.9-28.4000109.6
220Y36.3Very low37.5Very low234 Ų234143.7 Ų143.792%0.91880%0.797SS**  trans-111.8121.2163.4-109.8-91.4000109.2
221Q39.5Very low37.4Very low184 Ų184146.1 Ų146.186%0.8679%0.794SS**  trans-115.2124.3173.2-146.4172.921.300106.2
222C31.2Very low38.1Very low129 Ų129149 Ų14987%0.87280%0.803SS**  trans164.5144.6159.9-92.70000107.6
223A35Very low37.6Very low94 Ų94147.1 Ų147.178%0.77780%0.802SS**  cis-160.5151.2-28.500000103.9
224R37.7Very low37.4Very low242 Ų242142.9 Ų142.991%0.91380%0.797SS**  trans-59.2149-172.6-57-169.3178.9-173.21113.5
225L39Very low37.2Very low168 Ų168146.3 Ų146.388%0.8881%0.809SS**  trans-157.8117.4139.7-99149.7000110.5
226S31.7Very low36.9Very low110 Ų110143.2 Ų143.277%0.76981%0.806SS**  trans47.6110148-56.50000122.4
227S33.3Very low37Very low118 Ų118145 Ų14583%0.82581%0.814SS**  trans-73.8171.3135.3-86.80000109.9
228P50.8Low37.7Very low117 Ų117144.7 Ų144.776%0.7681%0.809SS**  cis-140.8179.820.137.5-16.4000115.7
229H33.6Very low38Very low172 Ų172142.2 Ų142.280%0.79681%0.809SS**  140.2153.5127.9-156.470.4000115.6
230C32.7Very low37.2Very low102 Ų102147.4 Ų147.469%0.68981%0.814SS**  trans-76.6164.6-151.4-58.10000118.1
231Q36.7Very low37Very low176 Ų176142.2 Ų142.282%0.82281%0.807SS**  trans-45.1-174.9164.2-64.4-75.5-34.800115.8
232P49.4Very low36.8Very low119 Ų119142.7 Ų142.777%0.77381%0.809SS**  cis-132.2178.9-28.625.7-3.1000112.9
233G32.6Very low36.9Very low76 Ų76140.4 Ų140.478%0.78481%0.807SS**  trans161.7108.9157.200000120.2
234S32.3Very low36.8Very low112 Ų112146 Ų14678%0.78381%0.809SS**  trans71.7113.5136.5-125.80000123.7
235N32.8Very low36.5Very low151 Ų151139 Ų13981%0.80780%0.796SS**  trans45.7122.7133.6-71.72.2000122.2
236S35.6Very low36.1Very low123 Ų123137 Ų13786%0.8680%0.796SS**  -176127.7109.236.70000112.7
237H36.7Very low36.3Very low183 Ų183136.2 Ų136.285%0.84780%0.797SS**  trans-69154.7157-79.7-75000109.2
238P49.8Very low36.5Very low113 Ų113141.3 Ų141.373%0.73480%0.799SS**  -155.915869.636.7-13.1000120.1
239L40.6Very low35.8Very low149 Ų149141.8 Ų141.878%0.7880%0.796SS**  trans58.9129.7135.1-64.1166.5000124.5
240R34.2Very low35.7Very low224 Ų224139.4 Ų139.485%0.84580%0.799SS**  trans68141.1143.6-79.7-175174.8-121.30.7116.7
241T32.7Very low36.1Very low125 Ų125141.5 Ų141.577%0.76780%0.802SS**  cis-161.4155.441.316.50000111.7
242H34.3Very low36.1Very low194 Ų194144 Ų14490%0.89881%0.806SS**  trans-55.3153.6167.8-101.9-93.2000115.1
243G32.6Very low35.3Very low81 Ų81141.9 Ų141.984%0.83581%0.805SS**  trans-174.3100158.900000112.5
244Y34.1Very low35.4Very low210 Ų210141.8 Ų141.882%0.82480%0.804SS**  trans-93.1149.3-178.9-179.9-100.5000111.3
245C31.3Very low35.6Very low95 Ų95142.7 Ų142.764%0.64281%0.81SS**  trans43.9119.1164.9-830000121.6
246S31.2Very low35.7Very low126 Ų126139.2 Ų139.288%0.88181%0.81SS**PPolyproline II helixtrans-68.1127.1162.3-158.50000110.7
247A34.7Very low35.9Very low94 Ų94138.9 Ų138.978%0.77781%0.808SS**PPolyproline II helixtrans-82.3143.5172.500000110.8
248Y39.2Very low36.6Very low225 Ų225135.5 Ų135.588%0.88280%0.802SS**PPolyproline II helixtrans-71.9159.3170.6-142.2-103.5000110.5
249D35Very low36.1Very low128 Ų128139 Ų13968%0.68481%0.809SS**  trans89.1108.8169-127.2-61.7000118
250S32.5Very low35.9Very low122 Ų122141.9 Ų141.985%0.85381%0.811SS**  -172.6116.8116.1-82.50000112.2
251L39.4Very low36.5Very low146 Ų146138.5 Ų138.576%0.76481%0.81SS**  trans-70.4125.3167.5-165.978.7000110.7
252Y37.9Very low36.7Very low229 Ų229137 Ų13790%0.89880%0.804SS**  166.2140.9129.8-117.7-100.5000112.1
253G32.2Very low37.4Very low73 Ų73133.2 Ų133.275%0.75380%0.797SS**  trans149.290.6161.800000112.9
254G34.2Very low37.8Very low75 Ų75138.8 Ų138.877%0.77380%0.801SS**  trans-75174.4-17000000116.6
255S37.3Very low38.1Very low130 Ų130139 Ų13991%0.90980%0.802SS**  trans171.5140.7144.143.40000109.6
256G34.7Very low38.8Very low78 Ų78143.6 Ų143.680%0.80481%0.814SS**  trans98.779.1157.400000116.9
257S38.8Very low39.3Very low116 Ų116139.9 Ų139.981%0.81180%0.795SS**  trans-77144.5153.1-1770000109.3
258P53Low40.2Very low113 Ų113141.4 Ų141.473%0.73480%0.798SS**  trans-124.4147.7137.727.7-13.4000111.2
259E38Very low40.9Very low186 Ų186138.9 Ų138.987%0.86980%0.798SS**  trans-61.4134.3-175.5-61.7130.5148.100111.9
260Y35.8Very low41.5Very low209 Ų209138.2 Ų138.282%0.8280%0.804SS**  trans-130.9105.6159.2-151.5-99.4000109.6
261N47Very low42.6Very low154 Ų154137.6 Ų137.682%0.82480%0.797SS**  trans-68.2120.8168.7-151.5-47.9000107.4
262S38.1Very low43.3Very low92 Ų92136.1 Ų136.164%0.64380%0.796SS**  trans-128.9130.2170.5-106.40000110.1
263P47.5Very low43.6Very low116 Ų116133.6 Ų133.675%0.75380%0.797SS**  trans-80.5154.5-17033.5-33.9000111.9Y265P263-Y265 PolarHBondContact O-N 3.25Å
264E42.5Very low44.2Very low197 Ų197135.9 Ų135.992%0.92180%0.801SS**  trans-46.5117168.2-68.3166.4152.900111.2
265Y39Very low44.9Very low214 Ų214140 Ų14084%0.83980%0.803SS**  trans-110.393.7161.9-168-96.5000108.2P263P263-Y265 PolarHBondContact O-N 3.25Å
266E47.9Very low44.8Very low192 Ų192141.4 Ų141.490%0.89780%0.8SS**  trans-84119.4171.4-168177.2-16900109.4
267G41.6Very low45.1Very low48 Ų48141.1 Ų141.150%0.49580%0.797SS.*  trans125.5166.2146.500000117.6
268P52.7Low45.3Very low127 Ų127143.1 Ų143.183%0.82580%0.799SS**  cis-115.2155.5-14.634.7-20000113.2
269L53.8Low44.6Very low171 Ų171147.9 Ų147.990%0.89581%0.808SS**PPolyproline II helixtrans-58.3127.2170.4-63.3158.7000110.6
270S48.7Very low44.5Very low115 Ų115144.4 Ų144.480%0.80481%0.805SS**PPolyproline II helixtrans-59.9126.6167.6-61.40000110.2
271P54.5Low44.6Very low109 Ų109141.7 Ų141.771%0.70880%0.804SS**PPolyproline II helixtrans-72.9145.6172.429.1-31.1000110.1L273P271-L273 PolarHBondContact O-N 2.86Å
272P53.4Low44.1Very low115 Ų115144 Ų14475%0.74781%0.806SS**PPolyproline II helixtrans-67133.5177.127.6-32.4000110.3C274P272-C274 PolarHBondContact O-N 3.06Å; P272-C274 VanDerWaalsContact O-N 3.16Å
273L45.3Very low43.9Very low175 Ų175147.7 Ų147.792%0.91681%0.813SS**  trans-68.1107.9174-70.2166.2000109.6P271 I275P271-L273 PolarHBondContact O-N 2.86Å; L273-I275 PolarHBondContact O-N 3.09Å
274C45.3Very low43.3Very low122 Ų122151.5 Ų151.582%0.82482%0.821SS**  trans-77.7106.8168.5-48.80000108.8P272 N276P272-C274 PolarHBondContact O-N 3.06Å; P272-C274 VanDerWaalsContact O-N 3.16Å; C274-N276 PolarHBondContact O-N 3.19Å
275I47.1Very low42.9Very low162 Ų162145.4 Ų145.483%0.83181%0.811SS**  trans-9486.3171.2-134.8154.8000108.7L273L273-I275 PolarHBondContact O-N 3.09Å
276N36.9Very low42.6Very low158 Ų158141.2 Ų141.285%0.84581%0.813SS**  trans-134.8100.2167.1-98.471.1000108.2C274C274-N276 PolarHBondContact O-N 3.19Å
277G40.9Very low41.9Very low72 Ų72137 Ų13774%0.74281%0.811SS**  trans-68.1134.1174.400000111.5
278N42.1Very low41.4Very low158 Ų158140.3 Ų140.385%0.84583%0.827SS**  trans-166.394.4151.7-108.62000108.9
279F37.7Very low41.1Very low213 Ų213139.6 Ų139.693%0.93482%0.822SS**  trans-113102.7160.7-106.3-86.7000108.1
280S36.6Very low40.2Very low114 Ų114140.5 Ų140.580%0.79782%0.822SS**  trans-81.5110.5163.9-87.50000108.8K282S280-K282 PolarHBondContact O-N 2.95Å
281L37.6Very low39.6Very low151 Ų151142.6 Ų142.679%0.79182%0.823SS**  trans-84.4106.4166.8-16874.1000108.4H283L281-H283 PolarHBondContact O-N 3.04Å
282K36.8Very low38.8Very low202 Ų202146 Ų14688%0.87883%0.83SS**  trans-72.8110.2167.4-72.9-179.2170-176.20108.5S280S280-K282 PolarHBondContact O-N 2.95Å
283H35.2Very low38.4Very low171 Ų171149.6 Ų149.679%0.79283%0.834SS**  trans-102.6109.1161.2-118.5-79.5000108.9L281L281-H283 PolarHBondContact O-N 3.04Å
284Q34.5Very low37.8Very low196 Ų196144.7 Ų144.792%0.91683%0.826SS**  trans-73.7117.6164.4-173.899.150.600107.1
285G32.5Very low37.4Very low69 Ų69149.7 Ų149.771%0.71183%0.829SS**  trans-153124.5176.600000109.5
286S33.8Very low36.8Very low126 Ų126150.2 Ų150.288%0.88183%0.827SS**  trans-62.1151.9-168.442.40000116
287A33.6Very low36.8Very low103 Ų103152.6 Ų152.685%0.85183%0.826SS**  trans-65.8149.1-175.800000116.6
288S30.1Very low36.9Very low118 Ų118152.3 Ų152.383%0.82581%0.813SS**  trans-163.6142.9132.1-165.70000110
289P46.9Very low37.1Very low111 Ų111150.6 Ų150.672%0.72180%0.801SS**  trans-102.5161.5-160.838.8-30.8000114
290E34.2Very low37.3Very low191 Ų191148.6 Ų148.689%0.89379%0.794SS**  trans143.194.4147-81.6-176.7164.900111.5
291N37.3Very low37.3Very low158 Ų158153.1 Ų153.185%0.84580%0.796SS**  -170.4102.8127.6-135.8-16.9000109.7
292E36.7Very low37.4Very low182 Ų182151.6 Ų151.685%0.8580%0.798SS**  trans-71.3127.7165.8-73.8-175.4127.900109.8
293K44.9Very low37.3Very low189 Ų189145.4 Ų145.482%0.82279%0.791SS**  trans-167.195144.9-101.1151.4-168.1-177.30108.3
294G34.2Very low37.6Very low72 Ų72145.6 Ų145.674%0.74280%0.797SS**  trans-74.9134.3177.500000112.4
295Y35.2Very low38.4Very low227 Ų227142.6 Ų142.689%0.8979%0.794SS**  trans-129.892.6153.9-73-79.1000107.2Y297Y295-Y297 PolarHBondContact O-N 3.36Å
296H35.9Very low38.5Very low174 Ų174142.5 Ų142.581%0.80679%0.793SS**  trans-91.688.3179.2-161-52000108.5S298H296-S298 PolarHBondContact O-N 3.31Å
297Y36.7Very low38.6Very low207 Ų207142.3 Ų142.381%0.81279%0.792SS**  trans-83.189.7169.9-159.5-95.9000108.4Y295 M299Y295-Y297 PolarHBondContact O-N 3.36Å; Y297-M299 HydrophobicContact CD1-CG 4.29Å; Y297-M299 HydrophobicContact CE1-CG 4.1Å; Y297-M299 HydrophobicContact CE1-SD 3.79Å
298S41.9Very low38.7Very low67 Ų67149 Ų14947%0.46980%0.795SS.*  trans-90.4114.9174.4-163.40000109.6H296 H300H296-S298 PolarHBondContact O-N 3.31Å; S298-H300 PolarHBondContact O-N 3.07Å
299M46.8Very low39.7Very low122 Ų122148.9 Ų148.960%0.60179%0.792SS**  trans-77.9109.2168.9-75.9-72.3-72.500109Y297 Y301Y297-M299 HydrophobicContact CD1-CG 4.29Å; Y297-M299 HydrophobicContact CE1-CG 4.1Å; Y297-M299 HydrophobicContact CE1-SD 3.79Å; M299-Y301 HydrophobicContact CE-CE2 4.1Å; M299-Y301 PolarHBondContact O-N 3.33Å
300H40.9Very low39.2Very low171 Ų171148.7 Ų148.779%0.79280%0.799SS**  trans-77.8103.7170.3-65.2-74.4000109.6S298S298-H300 PolarHBondContact O-N 3.07Å
301Y37.4Very low39.1Very low209 Ų209142.6 Ų142.682%0.8279%0.787SS**  trans-91.3115.2162.2-96.8-88.2000109.5M299M299-Y301 HydrophobicContact CE-CE2 4.1Å; M299-Y301 PolarHBondContact O-N 3.33Å
302S40.6Very low38.8Very low119 Ų119139.7 Ų139.783%0.83279%0.785SS**  trans-67.9126.7170.4-590000110.2
303G34.6Very low38.9Very low71 Ų71139.1 Ų139.173%0.73278%0.783SS**  trans-79.1150.3175.200000113.5
304L41.8Very low38.2Very low176 Ų176137.7 Ų137.792%0.92178%0.784SS**  trans-138.7133.6155.1-79.2173.6000108.6
305P50.3Low38.4Very low132 Ų132142.6 Ų142.686%0.85779%0.792SS**  trans-101.3158.6175.637.5-29.9000112.3
306G34.9Very low38.2Very low67 Ų67137.9 Ų137.969%0.69179%0.787SS**  trans143.592.7163.800000112.2
307S35.1Very low38.2Very low122 Ų122139.6 Ų139.685%0.85379%0.792SS**  98.7105.18661.90000112.8
308R37.2Very low37.8Very low243 Ų243132.9 Ų132.992%0.91779%0.786SS**  trans-61.8165.1156.6-92.1-177.5171.7-148.9-1.3110.6
309P50.3Low37.3Very low117 Ų117135.2 Ų135.276%0.7680%0.803SS**  cis-144.7152.948.336.8-13.8000117
310A35.3Very low36.6Very low106 Ų106135 Ų13588%0.87681%0.813SS**  60.7123.1106.500000116.8
311G32.2Very low36.1Very low63 Ų63130.7 Ų130.765%0.64982%0.815SS**  trans-178.194.7169.100000111.6
312A31.5Very low36.1Very low97 Ų97125.3 Ų125.380%0.80281%0.813SS**  trans-85.8134.9174.300000110.4
313H38.4Very low35.8Very low171 Ų171131.6 Ų131.679%0.79282%0.819SS**  trans-140.596.7164.8-35.1-67.5000109.9
314N31.3Very low35.6Very low158 Ų158134.4 Ų134.485%0.84583%0.827SS**  trans-71.1131.4154.5-89.5-21.3000108.1
315L37.6Very low35Very low175 Ų175129.8 Ų129.892%0.91682%0.822SS**  trans-139.6110.5152-76.5-179.9000110.6
316V32.5Very low34.2Very low129 Ų129130.8 Ų130.878%0.78282%0.819SS**  trans-73.7135.7160.9160.10000109.1
317F34.4Very low33.9Very low209 Ų209135.6 Ų135.692%0.91782%0.823SS**  trans-175.2132.5146.3-101-78000105.1
318G29.3Very low33.8Very low67 Ų67133.7 Ų133.769%0.69181%0.809SS**  cis120.28424.500000109.4
319S31.3Very low33.5Very low116 Ų116130.3 Ų130.381%0.81180%0.804SS**  trans39.4132.9148.8-157.20000121.9
320S32.6Very low32.7Very low117 Ų117132.7 Ų132.782%0.81881%0.81SS**  146.8137.6113.1-59.80000113.1
321G29.5Very low32.7Very low80 Ų80133.8 Ų133.883%0.82581%0.806SS**  trans153.784.5158.200000116
322A36.8Very low32.8Very low96 Ų96138.1 Ų138.179%0.79381%0.814SS**  trans-72.9152.4169.200000112.5
323R34.7Very low33.6Very low252 Ų252138 Ų13895%0.95181%0.805SS**  trans-173.2131.6136.1-103.8161.2171.5-90-5.8113.3
324S29.8Very low33.3Very low129 Ų129139.9 Ų139.990%0.90281%0.806SS**  trans-63.3158.5177-50.10000114.9
325G29.5Very low33.8Very low79 Ų79139.9 Ų139.981%0.81480%0.801SS**  trans-167.6118.3162.100000111.1
326I34.1Very low33.5Very low154 Ų154136.8 Ų136.879%0.7979%0.785SS**  trans-94167.5-172.435.5170000112
327H28.6Very low33.9Very low167 Ų167138.9 Ų138.977%0.77379%0.789SS**  trans79.3137.5157.2-94.8-82.2000116.2
328S32.7Very low34.2Very low82 Ų82135.1 Ų135.157%0.57377%0.774SS**  cis-171.7159.93.6-14.20000109
329E32.2Very low34.5Very low172 Ų172140.4 Ų140.480%0.80479%0.785SS**  trans61114.5141-46.3-92.4143.200119.5
330N33Very low34.9Very low167 Ų167141.9 Ų141.989%0.89378%0.779SS**  -171.6119.7121.5-93.8-21.4000111.3
331V35.5Very low35.1Very low129 Ų129145.8 Ų145.878%0.78278%0.784SS**  trans-108.1154.4174.9174.70000108.3
332L32.8Very low35.4Very low155 Ų155150.6 Ų150.681%0.81279%0.785SS**  trans109.8155.7161.4-60177.4000114.6
333P49.8Very low35.3Very low95 Ų95157 Ų15762%0.61779%0.789SS**  cis-130.5171.7-49.934.9-19.9000108.9
334Y32.5Very low35.6Very low209 Ų209149 Ų14982%0.8278%0.776SS**  trans179.9110.7141.8-105.6-81.8000111.5
335H41Very low36.8Very low159 Ų159148.2 Ų148.274%0.73677%0.768SS**  trans45.9102.3139.1-74-84.7000121.9
336D32.2Very low37.2Very low109 Ų109151 Ų15158%0.58377%0.769SS**  trans-35.1122.4137.6-169.36.1000114H338D336-H338 IonicContact OD1-CE1 2.82Å; D336-H338 IonicContact OD1-CG 3.74Å; D336-H338 PolarHBondContact OD1-N 3.2Å; D336-H338 IonicContact OD1-ND1 3.81Å; D336-H338 PolarHBondContact OD1-ND1 2.82Å; D336-H338 IonicContact OD2-ND1 2.76Å
337M40.1Very low37.5Very low174 Ų174153.8 Ų153.886%0.85777%0.771SS**  trans-137.592.9150.7-81.9-738900108.5L339M337-L339 PolarHBondContact O-N 3.11Å
338H39.8Very low37.9Very low130 Ų130152.1 Ų152.160%0.60277%0.768SS**  trans-48.8121.1161-88.560000111.8D336 H340D336-H338 IonicContact OD1-CE1 2.82Å; D336-H338 IonicContact OD1-CG 3.74Å; D336-H338 PolarHBondContact OD1-N 3.2Å; D336-H338 IonicContact OD1-ND1 3.81Å; D336-H338 PolarHBondContact OD1-ND1 2.82Å; D336-H338 IonicContact OD2-ND1 2.76Å; H338-H340 AromaticContact CD2-CD2 3.76Å; H338-H340 AromaticContact CD2-NE2 3.85Å
339L36.3Very low38.4Very low178 Ų178156 Ų15693%0.93278%0.776SS**  trans-12998.2148.7-13086.5000108.6M337M337-L339 PolarHBondContact O-N 3.11Å
340H39.6Very low39.1Very low147 Ų147155.6 Ų155.668%0.68178%0.779SS**  trans-68.2124.4164.3-87.9-86.5000109.2H338H338-H340 AromaticContact CD2-CD2 3.76Å; H338-H340 AromaticContact CD2-NE2 3.85Å
341H37.4Very low39.6Very low198 Ų198156 Ų15692%0.91778%0.781SS**  trans-147.4136.1131.9-103.9-12.5000112.5
342E35Very low40.1Very low181 Ų181153.6 Ų153.685%0.84678%0.775SS**PPolyproline II helixtrans-89.4155.5-154.5-138.3-166.216300112.2
343R35.4Very low40.6Very low232 Ų232154.7 Ų154.788%0.87577%0.773SS**PPolyproline II helixtrans-79.3136.1174.3-167.6-175.6-18096.7-1.9109
344A40.2Very low40.6Very low83 Ų83159.3 Ų159.369%0.68678%0.784SS**PPolyproline II helixtrans-53.7162.6161.900000111
345P55.5Low41Very low112 Ų112157.2 Ų157.273%0.72778%0.782SS**  -163.5-167.771.540.3-15.5000117.7
346V37.9Very low41.1Very low138 Ų138160.7 Ų160.784%0.83681%0.806SS**  trans95.6129.9152.2-67.40000122.8
347Y39.7Very low41.5Very low213 Ų213163.3 Ų163.384%0.83582%0.817SS**  trans-40.2156.2167.2-79.9-110000114
348D38.3Very low41.6Very low132 Ų132162.7 Ų162.771%0.70682%0.815SS**  -173.7156.455.5-128-22.9000111.9
349E43Very low41.7Very low162 Ų162164.6 Ų164.676%0.75783%0.827SS**  trans45.3123.3139.1-136.5169.2-164.900122.6
350L46.6Very low42Very low164 Ų164163.8 Ų163.886%0.85982%0.82SS**  170.498126.2-89.3167.9000109.7
351N42.7Very low42.2Very low175 Ų175164.8 Ų164.894%0.93683%0.829SS**  trans-132.697.3163.7-146.621.1000109.5
352A46.1Very low42.5Very low79 Ų79162.6 Ų162.665%0.65382%0.823SS**  trans-153.8140.7167.100000110.9
353F42.9Very low43Very low178 Ų178161.3 Ų161.378%0.78182%0.822SS**  trans75.9121.1169-76.3-94.4000117
354F49.5Very low43.6Very low192 Ų192155.8 Ų155.884%0.84282%0.817SS**  -156.2153.557.9-106.1-93000114.4
355H42Very low43.9Very low166 Ų166161.9 Ų161.977%0.76983%0.828SS**  trans-50.9146.6161.3-84.4-93.8000114.5
356N42.3Very low42.8Very low232 Ų232166.5 Ų166.5100%1.24184%0.838SS**  -149.50125.6-134.6-66.4000110

Retrieved 356 of 356 residues in 71.4 ms (Link to these results)