A0A077Z7E6_TRITR Loading...

AMME syndrome candidate gene 1 protein

AlphaFold DB , UniProt , Accession A0A077Z7E6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 308 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
1M43.5Very low34.5Very low235 Ų235152.5 Ų152.5100%1.15880%0.795SS**  0134.70-76-72.7-176.900108.3
2P56.7Low33.9Very low109 Ų109146.4 Ų146.471%0.70880%0.796SS**  -127.5149109.74.916.7000114.4
3F33.8Very low33.5Very low194 Ų194144.8 Ų144.885%0.85180%0.8SS**  trans45.1118.7148-64.2-77.8000119.7
4S30.4Very low33Very low93 Ų93143.8 Ų143.865%0.6581%0.806SS**  cis57.5102.246.8-154.30000115.1
5H36.2Very low33Very low145 Ų145139.7 Ų139.767%0.67181%0.809SS**  167.3137.5118.2-99.417.7000116.5
6K31.1Very low32.8Very low161 Ų161137.3 Ų137.370%0.781%0.811SS**  trans67113135.8-69.8177180170.60119.7
7R24.2Very low32.8Very low242 Ų242141.4 Ų141.491%0.91382%0.816SS**  70.7120.389-80-170.6-179.5-174.10.6114.4
8S33.1Very low32.3Very low96 Ų96144.8 Ų144.867%0.67182%0.819SS**  165.8133.9113.9-163.40000112.7
9M31.5Very low32.1Very low181 Ų181147.3 Ų147.389%0.89282%0.824SS**  trans38.8156.6141.3-62.9-176.2-163.100121.6
10A27.2Very low31.9Very low77 Ų77149.4 Ų149.464%0.63682%0.824SS**  cis-176.9171.9-20.100000105.6
11T31.2Very low31.8Very low145 Ų145150.2 Ų150.289%0.8983%0.826SS**  trans85.3119.8159.655.20000122.6
12G27.8Very low31Very low79 Ų79145.5 Ų145.581%0.81481%0.806SS**  trans92.7144.3145.400000116.4
13C28.4Very low29.6Very low126 Ų126147.9 Ų147.985%0.85181%0.812SS**  cis-167.7162.7-12.1-167.10000106.7
14C26.8Very low29.4Very low130 Ų130144 Ų14488%0.87881%0.809SS**  trans-43.9137.7-174-55.70000117.6
15G33.6Very low29.3Very low82 Ų82145 Ų14585%0.84581%0.814SS**  trans-145.7101164.700000110.7
16A29.4Very low29Very low102 Ų102142.9 Ų142.984%0.84382%0.815SS**  trans-76.2125.4175.800000111
17K32.1Very low28.8Very low207 Ų207143.4 Ų143.490%0.983%0.825SS**  trans-160.5116.1149.5-131.4169.7-178.7174.40112.6
18K25.3Very low28.8Very low202 Ų202138.6 Ų138.688%0.87882%0.817SS**  trans-11.8123.3159.5-68.9170.7172176.70115.9
19Q28.4Very low28.3Very low193 Ų193140 Ų14090%0.90283%0.825SS**  trans-145.8140.7138.1-116.3174.4-9.200111.2
20K26.5Very low27.8Very low189 Ų189141.6 Ų141.682%0.82283%0.827SS**  trans-83.1106.5-162.1-176.1179.3179.7-177.50108.9
21L30.7Very low27.7Very low166 Ų166144.7 Ų144.787%0.86983%0.834SS**  trans-95.4108.4170.6-78.6164.4000108.5N23L21-N23 PolarHBondContact O-N 3.45Å
22N26.3Very low27.3Very low137 Ų137143.8 Ų143.873%0.73383%0.828SS**  trans-66.7112.6166.2-84.9-5.1000108.1S24N22-S24 PolarHBondContact O-N 3.31Å
23N28.5Very low27.1Very low158 Ų158145.9 Ų145.985%0.84583%0.83SS**  trans-74.3115.6160.1-99.1-1.8000108.1L21L21-N23 PolarHBondContact O-N 3.45Å
24S28.8Very low26.9Very low113 Ų113144.9 Ų144.979%0.7983%0.831SS**PPolyproline II helixtrans-61.1127.2165-51.80000109.2N22N22-S24 PolarHBondContact O-N 3.31Å
25P28.9Very low26.8Very low115 Ų115143.3 Ų143.375%0.74783%0.827SS**PPolyproline II helixtrans-76.2140171.33.511.8000110.2
26S29.3Very low26Very low99 Ų99145.3 Ų145.369%0.69283%0.828SS**PPolyproline II helixtrans-48.7130.6164.636.80000111.5D28S26-D28 PolarHBondContact O-N 3.05Å; S26-D28 VanDerWaalsContact O-N 3.11Å
27L26.6Very low25.8Very low173 Ų173145 Ų14591%0.90683%0.826SS**  trans-71.196.5174.5-72.5160.9000109.2
28D24.2Very low25.4Very low141 Ų141140.6 Ų140.675%0.75482%0.821SS**  trans-74.5143.9168-80.8-39.6000111.2S26S26-D28 PolarHBondContact O-N 3.05Å; S26-D28 VanDerWaalsContact O-N 3.11Å
29C22.3Very low25.3Very low124 Ų124135.3 Ų135.384%0.83881%0.81SS**  trans-56.2132.9-175.2-57.80000112.7D31C29-D31 PolarHBondContact O-N 3.11Å; C29-D31 VanDerWaalsContact O-N 3.13Å
30F22.2Very low25Very low215 Ų215134 Ų13494%0.94381%0.809SS**  trans-66.3106.2168.2-82.5-90.2000109.7
31D23.8Very low25Very low143 Ų143128.6 Ų128.677%0.76581%0.806SS**  trans-115.7137.4162.4-141.4-20.1000109.9C29C29-D31 PolarHBondContact O-N 3.11Å; C29-D31 VanDerWaalsContact O-N 3.13Å
32T23.5Very low24.6Very low125 Ų125125.5 Ų125.577%0.76780%0.798SS**  trans-76.7132.3-178.724.40000111.9
33S22.9Very low24.5Very low124 Ų124127.5 Ų127.587%0.86781%0.806SS**  trans-164.1114.7160.1-73.60000111
34A24.1Very low24.5Very low105 Ų105123.7 Ų123.787%0.86880%0.804SS**  trans153.2138.1158.800000107.7
35A25Very low24.3Very low96 Ų96126.1 Ų126.179%0.79381%0.808SS**  cis-156.2152.86.200000109
36S18.1Very low24.1Very low124 Ų124123.8 Ų123.887%0.86781%0.805SS**  trans-74.7139.816719.90000111.6
37A25.4Very low24.1Very low97 Ų97126.9 Ų126.980%0.80281%0.813SS**  trans-167.6102.1151.100000107.4
38S22.8Very low23.8Very low114 Ų114123.8 Ų123.880%0.79780%0.804SS**  70.5101.992.1-93.80000115.9
39S23Very low24Very low91 Ų91125 Ų12564%0.63681%0.811SS**  53.9117.6121.964.30000120.9
40N23Very low24Very low166 Ų166130 Ų13089%0.88881%0.812SS**  154.9144.7106.8-86.4-24000114.3
41G24.8Very low24.6Very low74 Ų74124.9 Ų124.976%0.76380%0.801SS**  trans106.298.916300000113.2
42S23.3Very low24.7Very low101 Ų101129.3 Ų129.371%0.70681%0.807SS**  cis78.3114.436.8-151.10000115.6
43M25Very low24.7Very low179 Ų179134.1 Ų134.188%0.88281%0.811SS**  trans79.4125.1148.5-70.1168.2-179.500120.3
44G28.4Very low25.1Very low79 Ų79137.4 Ų137.481%0.81481%0.812SS**  trans17969.9171.700000111
45D23.8Very low25.2Very low163 Ų163140.8 Ų140.887%0.87281%0.81SS**  trans-55160169.4-71.5-58.9000113.4
46G25.6Very low25.3Very low67 Ų67141.4 Ų141.469%0.69181%0.809SS**  trans147.677.6147.500000117.9
47L27.6Very low25.9Very low164 Ų164140 Ų14086%0.85980%0.799SS**  52.4117.7129-70.6156.2000120.6
48C21Very low26.3Very low107 Ų107142.9 Ų142.972%0.72380%0.8SS**  trans-17.9137.1146.954.60000118.2
49D28.7Very low26.4Very low167 Ų167147.2 Ų147.289%0.89381%0.805SS**  -151.9142.5129.8-128.6-22.2000113.2
50R22.4Very low26.9Very low229 Ų229148.3 Ų148.386%0.86481%0.809SS**  trans-138.1160.9178.9-147.1-160.3-178.8-178.11.8103.6
51P33.7Very low27.3Very low107 Ų107145.9 Ų145.970%0.69580%0.801SS**  cis-134.7-179.3-4.337.7-18.2000113.5
52R26.2Very low27.8Very low236 Ų236148.5 Ų148.589%0.89180%0.802SS**  149.1126.5110.6-161.2171.2-164.1-155.23.4113.2
53R23.8Very low28.3Very low227 Ų227150.9 Ų150.986%0.85781%0.807SS**  trans-55.3140.4172.7-66.1169.7173.1167.6-3.7113
54Q31.2Very low28.7Very low193 Ų193149.5 Ų149.590%0.90280%0.803SS**  trans-138.6145.6139.4-72.7-161.69.200111.2
55H26.2Very low29.3Very low175 Ų175156.9 Ų156.981%0.8181%0.806SS**  trans-77.3164.7-168.7-112.7-115.9000113.5
56S27.1Very low30.2Very low110 Ų110156.7 Ų156.777%0.76980%0.804SS**  trans76.7137.3152.982.80000114.6
57S30.5Very low30.8Very low95 Ų95161.8 Ų161.866%0.66481%0.807SS**  cis-168.9156.922.149.20000109.5
58L34.1Very low31.2Very low156 Ų156164.5 Ų164.582%0.81781%0.806SS**  trans66.297.8148.7-64156.3000118.7
59F24.1Very low32.2Very low206 Ų206166.4 Ų166.490%0.90480%0.804SS**  trans-54.3140156.9-63.5-89.1000111
60P33.4Very low32.8Very low113 Ų113164.1 Ų164.173%0.73479%0.792SS**  -138.9150.4113.233.9-19.4000114.7
61T32.8Very low33.8Very low116 Ų116158.4 Ų158.471%0.71279%0.786SS**  trans76.397.5154.7-43.10000117.9N63T61-N63 PolarHBondContact O-N 2.78Å
62V35.3Very low34.8Very low129 Ų129159 Ų15978%0.78279%0.788SS**  trans-6.984.4139.1-171.50000113.4N64V62-N64 PolarHBondContact O-N 3.49Å
63N33.9Very low37.1Very low151 Ų151155.9 Ų155.981%0.80778%0.783SS**  trans-79115.8156-91.9-22.8000106.7T61 R65T61-N63 PolarHBondContact O-N 2.78Å; N63-R65 PolarHBondContact O-N 2.97Å
64N33.7Very low40Very low149 Ų149151.9 Ų151.980%0.79777%0.768SS**  trans-44.283.5163.7-80.1-27.6000109.8V62 L66V62-N64 PolarHBondContact O-N 3.49Å; N64-L66 PolarHBondContact O-N 2.88Å
65R40.5Very low42.9Very low234 Ų234144 Ų14488%0.88373%0.733SS**  trans-75.385.6162.9-156.4-178.9-69.9-150.21.1103.1N63 K67N63-R65 PolarHBondContact O-N 2.97Å; R65-K67 VanDerWaalsContact C-N 3.25Å; R65-K67 PolarHBondContact O-N 3.24Å
66L41.8Very low46.1Very low160 Ų160135.8 Ų135.884%0.83870%0.696SS**  trans-33.1102163.8-81.8158.8000105.8N64 R68N64-L66 PolarHBondContact O-N 2.88Å; L66-R68 VanDerWaalsContact C-N 3.25Å; L66-R68 PolarHBondContact O-N 2.83Å
67K37.9Very low49.2Very low174 Ų174131.8 Ų131.876%0.75767%0.668SS**  trans-60.3105.4178.1-138.2179.2-175.6-174.30101.5R65 E69R65-K67 VanDerWaalsContact C-N 3.25Å; R65-K67 PolarHBondContact O-N 3.24Å; K67-E69 HydrophobicContact CB-CG 4.29Å; K67-E69 PolarHBondContact O-N 2.83Å
68R38.1Very low52.3Low220 Ų220131.4 Ų131.483%0.8365%0.654SS**  trans-66.774.2169.1-172.4177.1174.9169-1.2104.7L66 N70L66-R68 VanDerWaalsContact C-N 3.25Å; L66-R68 PolarHBondContact O-N 2.83Å; R68-N70 PolarHBondContact O-N 3.1Å
69E40.3Very low55.2Low147 Ų147127.6 Ų127.669%0.68763%0.632SS**  trans-6487160.8-71.2-179.1176.800103.3K67 C71K67-E69 HydrophobicContact CB-CG 4.29Å; K67-E69 PolarHBondContact O-N 2.83Å; E69-C71 PolarHBondContact O-N 2.87Å
70N41.1Very low58.6Low119 Ų119117.8 Ų117.864%0.63659%0.589SS**  trans-62.175.3147.9-95.121.5000105R68 T72R68-N70 PolarHBondContact O-N 3.1Å; N70-T72 PolarHBondContact O-N 3.41Å
71C44.5Very low61.7Low110 Ų110112.4 Ų112.474%0.74355%0.554SS**  trans-66.590.7158-1620000102.8E69 E73E69-C71 PolarHBondContact O-N 2.87Å; C71-E73 VanDerWaalsContact C-N 3.28Å; C71-E73 PolarHBondContact O-N 2.87Å
72T55.1Low64.7Low118 Ų118107.1 Ų107.172%0.72452%0.521SS*.  trans-58.3102.6170.736.30000105.6N70 R74N70-T72 PolarHBondContact O-N 3.41Å; T72-R74 PolarHBondContact O-N 3.41Å
73E74.3Confident67.7Low171 Ų171101.4 Ų101.480%0.79949%0.486SS*.  trans-58.6128.9179.2-172.1174.8-167.300107.9C71 V75C71-E73 VanDerWaalsContact C-N 3.28Å; C71-E73 PolarHBondContact O-N 2.87Å; E73-V75 PolarHBondContact O-N 3.46Å
74R84.3Confident70.8Confident144 Ų14494.2 Ų94.254%0.54345%0.448SS..  trans-57.3122.6179.8-175.6-170-73.1-140.51.2108.5T72 V76 E266 K267T72-R74 PolarHBondContact O-N 3.41Å; R74-V76 WeakPolarHBondContact CD-O 3.47Å; R74-V76 HydrophobicContact CG-CG1 3.73Å; R74-V76 WeakPolarHBondContact CG-O 3.29Å; R74-E266 WeakPolarHBondContact CG-OE2 3.46Å; R74-K267 PolarHBondContact NH1-O 2.94Å
75V91.4Very high73.8Confident27 Ų2787.1 Ų87.116%0.16441%0.41CS..  trans-75.8-40.3177.8-1770000110.4E73 S77 M80 F108 L169 E266E73-V75 PolarHBondContact O-N 3.46Å; V75-S77 PolarHBondContact O-N 3.37Å; V75-M80 WeakPolarHBondContact O-CE 3.36Å; V75-F108 HydrophobicContact CB-CZ 4.41Å; V75-F108 HydrophobicContact CG1-CE2 3.64Å; V75-F108 HydrophobicContact CG1-CZ 3.75Å; V75-F108 HydrophobicContact CG2-CZ 4.25Å; V75-L169 HydrophobicContact CB-CD1 4.28Å; V75-L169 HydrophobicContact CG1-CD1 3.9Å; V75-E266 PolarHBondContact N-OE2 3.41Å
76V93.2Very high76.5Confident3 Ų377 Ų772%0.01837%0.373CS..  trans-70.9126.1179.776.20000110.8R74 M80 V167 L169 E266 M268R74-V76 WeakPolarHBondContact CD-O 3.47Å; R74-V76 HydrophobicContact CG-CG1 3.73Å; R74-V76 WeakPolarHBondContact CG-O 3.29Å; V76-M80 HydrophobicContact CG2-SD 4.15Å; V76-V167 HydrophobicContact CG2-CB 4.31Å; V76-V167 HydrophobicContact CG2-CG1 4.01Å; V76-L169 HydrophobicContact CB-CD1 4.01Å; V76-L169 HydrophobicContact CB-CG 4.17Å; V76-L169 HydrophobicContact CG2-CD1 4.38Å; V76-L169 HydrophobicContact CG2-CG 4.21Å; V76-E266 HydrophobicContact CB-CB 4.08Å; V76-E266 HydrophobicContact CG1-CB 3.6Å; V76-E266 PolarHBondContact N-OE2 3.43Å; V76-M268 HydrophobicContact CB-CB 4.44Å; V76-M268 HydrophobicContact CG1-CB 4.02Å; V76-M268 HydrophobicContact CG1-CE 4.47Å; V76-M268 HydrophobicContact CG2-CB 3.6Å; V76-M268 WeakPolarHBondContact O-CE 3.33Å
77S93.7Very high79.2Confident26 Ų2669.6 Ų69.618%0.18233%0.334CS..  trans-121.7162.4-176.5900000111.9V75 E79 M80V75-S77 PolarHBondContact O-N 3.37Å; S77-E79 WeakPolarHBondContact CB-OE2 3.12Å; S77-E79 PolarHBondContact O-N 3.26Å; S77-E79 PolarHBondContact OG-N 3.3Å; S77-E79 PolarHBondContact OG-OE2 3.02Å; S77-M80 WeakPolarHBondContact O-CB 3.41Å; S77-M80 PolarHBondContact O-N 3.44Å
78K94.6Very high82.1Confident87 Ų8761.3 Ų61.338%0.37830%0.298SS..Hα-helixtrans-63.1-34.4176.8-70.8-170.9-179.7-169.50111.2M80 V81 L82 M268 V270 E274 L278K78-M80 PolarHBondContact O-N 3.29Å; K78-V81 WeakPolarHBondContact O-CB 3.25Å; K78-V81 PolarHBondContact O-N 2.92Å; K78-L82 WeakPolarHBondContact O-CG 3.2Å; K78-L82 PolarHBondContact O-N 3.16Å; K78-M268 HydrophobicContact CG-CE 4.29Å; K78-M268 HydrophobicContact CG-CG 4.17Å; K78-M268 HydrophobicContact CG-SD 3.78Å; K78-V270 HydrophobicContact CB-CG2 4.45Å; K78-V270 HydrophobicContact CG-CG2 4.33Å; K78-E274 WeakPolarHBondContact CE-OE1 3.38Å; K78-E274 IonicContact NZ-OE1 2.97Å; K78-E274 PolarHBondContact NZ-OE1 3.18Å; K78-L278 HydrophobicContact CD-CD1 4.19Å
79E94.7Very high84.9Confident75 Ų7552 Ų5235%0.3526%0.263SS..Hα-helixtrans-58.4-33.9179.7-62.269.6-153.800112.4S77 V81 L82 F83 F103S77-E79 WeakPolarHBondContact CB-OE2 3.12Å; S77-E79 PolarHBondContact O-N 3.26Å; S77-E79 PolarHBondContact OG-N 3.3Å; S77-E79 PolarHBondContact OG-OE2 3.02Å; E79-V81 VanDerWaalsContact C-N 3.33Å; E79-L82 PolarHBondContact O-N 3.37Å; E79-F83 WeakPolarHBondContact O-CB 3.36Å; E79-F83 PolarHBondContact O-N 3.32Å; E79-F103 HydrophobicContact CB-CB 4.42Å; E79-F103 HydrophobicContact CB-CD1 3.69Å; E79-F103 HydrophobicContact CB-CE1 4.43Å; E79-F103 HydrophobicContact CB-CG 4.45Å; E79-F103 WeakPolarHBondContact O-CE1 3.33Å
80M96.8Very high87.6Confident0 Ų046.9 Ų46.90%024%0.24CC..Hα-helixtrans-62.8-41.9174.8-62-178.5-174.800111.5V75 V76 S77 K78 F83 C84 F103 V104 L134 L138 L169V75-M80 WeakPolarHBondContact O-CE 3.36Å; V76-M80 HydrophobicContact CG2-SD 4.15Å; S77-M80 WeakPolarHBondContact O-CB 3.41Å; S77-M80 PolarHBondContact O-N 3.44Å; K78-M80 PolarHBondContact O-N 3.29Å; M80-F83 PolarHBondContact O-N 3.14Å; M80-C84 PolarHBondContact O-N 2.98Å; M80-C84 PolarHBondContact O-SG 3.45Å; M80-F103 HydrophobicContact CB-CZ 4.41Å; M80-F103 HydrophobicContact CE-CD2 4.24Å; M80-F103 HydrophobicContact CG-CD1 4.36Å; M80-F103 HydrophobicContact CG-CD2 3.98Å; M80-F103 HydrophobicContact CG-CE1 4.25Å; M80-F103 HydrophobicContact CG-CE2 3.9Å; M80-F103 HydrophobicContact CG-CG 4.23Å; M80-F103 HydrophobicContact CG-CZ 4.05Å; M80-V104 HydrophobicContact CE-CG1 4.02Å; M80-L134 HydrophobicContact CE-CD1 3.75Å; M80-L134 HydrophobicContact SD-CD2 4.34Å; M80-L138 HydrophobicContact CB-CD1 3.71Å; M80-L138 HydrophobicContact CG-CD1 3.99Å; M80-L169 HydrophobicContact SD-CD1 4.18Å
81V97.7Very high90.2Very high0 Ų046 Ų460%023%0.232CC..Hα-helixtrans-72.4-41.2178.5-168.70000111.1K78 E79 F83 C84 F85 C165 V167 M268 V270K78-V81 WeakPolarHBondContact O-CB 3.25Å; K78-V81 PolarHBondContact O-N 2.92Å; E79-V81 VanDerWaalsContact C-N 3.33Å; V81-F83 VanDerWaalsContact C-N 3.26Å; V81-F83 PolarHBondContact O-N 3.04Å; V81-C84 WeakPolarHBondContact O-CB 3.41Å; V81-C84 PolarHBondContact O-N 2.82Å; V81-C84 VanDerWaalsContact O-N 3.12Å; V81-F85 HydrophobicContact CG1-CD2 4.41Å; V81-F85 HydrophobicContact CG1-CE2 4.39Å; V81-F85 PolarHBondContact O-N 3.08Å; V81-F85 VanDerWaalsContact O-N 3.09Å; V81-C165 HydrophobicContact CG1-CB 3.54Å; V81-C165 VanDerWaalsContact CG1-O 3.24Å; V81-C165 WeakPolarHBondContact CG1-O 3.42Å; V81-V167 HydrophobicContact CB-CG2 4.47Å; V81-V167 HydrophobicContact CG2-CB 4.08Å; V81-V167 HydrophobicContact CG2-CG2 3.92Å; V81-M268 HydrophobicContact CG2-CB 3.76Å; V81-M268 HydrophobicContact CG2-CG 3.64Å; V81-M268 WeakPolarHBondContact CG2-O 3.49Å; V81-V270 HydrophobicContact CB-CB 4.13Å; V81-V270 HydrophobicContact CB-CG2 3.8Å; V81-V270 HydrophobicContact CG1-CB 3.61Å; V81-V270 HydrophobicContact CG1-CG2 3.83Å; V81-V270 HydrophobicContact CG2-CG2 4.22Å
82L96.5Very high92.7Very high6 Ų642.9 Ų42.93%0.03121%0.207CC..Hα-helixtrans-59.9-38.8174.4-60.7179.4000111.4K78 E79 C84 F85 D86 V270 Y275 L278K78-L82 WeakPolarHBondContact O-CG 3.2Å; K78-L82 PolarHBondContact O-N 3.16Å; E79-L82 PolarHBondContact O-N 3.37Å; L82-C84 VanDerWaalsContact C-N 3.34Å; L82-C84 PolarHBondContact O-N 3.34Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 2.7Å; L82-D86 PolarHBondContact O-N 3.2Å; L82-V270 HydrophobicContact CD2-CG1 4.12Å; L82-Y275 HydrophobicContact CB-CD2 4.32Å; L82-Y275 HydrophobicContact CD2-CD2 3.58Å; L82-Y275 HydrophobicContact CD2-CG 4.3Å; L82-L278 HydrophobicContact CD1-CB 4.06Å; L82-L278 HydrophobicContact CD1-CD1 4.22Å; L82-L278 HydrophobicContact CD2-CB 4.18Å; L82-L278 HydrophobicContact CD2-CD1 3.99Å
83F97.4Very high94.6Very high9 Ų940.3 Ų40.34%0.03919%0.186CC..Hα-helixtrans-64.4-37.2175.3177.5-110.1000112.3E79 M80 V81 D86 V87 P98 P101 F103 L138 R139E79-F83 WeakPolarHBondContact O-CB 3.36Å; E79-F83 PolarHBondContact O-N 3.32Å; M80-F83 PolarHBondContact O-N 3.14Å; V81-F83 VanDerWaalsContact C-N 3.26Å; V81-F83 PolarHBondContact O-N 3.04Å; F83-D86 PolarHBondContact O-N 3.37Å; F83-V87 HydrophobicContact CD1-CG2 4.32Å; F83-V87 HydrophobicContact CD2-CG2 4.33Å; F83-V87 HydrophobicContact CE1-CG2 3.96Å; F83-V87 HydrophobicContact CE2-CG2 3.97Å; F83-V87 HydrophobicContact CZ-CG2 3.77Å; F83-V87 WeakPolarHBondContact O-CB 3.44Å; F83-V87 VanDerWaalsContact O-CG2 3.25Å; F83-V87 WeakPolarHBondContact O-CG2 3.2Å; F83-V87 PolarHBondContact O-N 3.17Å; F83-P98 HydrophobicContact CD2-CG 4.5Å; F83-P98 HydrophobicContact CE2-CB 4.46Å; F83-P98 HydrophobicContact CE2-CG 3.98Å; F83-P101 HydrophobicContact CD1-CG 4.29Å; F83-P101 HydrophobicContact CD2-CB 3.94Å; F83-P101 HydrophobicContact CD2-CG 4.05Å; F83-P101 HydrophobicContact CE1-CG 4.17Å; F83-P101 HydrophobicContact CE2-CB 4.23Å; F83-P101 HydrophobicContact CE2-CG 3.94Å; F83-P101 HydrophobicContact CG-CB 4.2Å; F83-P101 HydrophobicContact CG-CG 4.22Å; F83-P101 HydrophobicContact CZ-CG 3.99Å; F83-F103 HydrophobicContact CB-CE1 3.77Å; F83-F103 HydrophobicContact CB-CZ 4.18Å; F83-F103 HydrophobicContact CD1-CE1 4.47Å; F83-F103 HydrophobicContact CD1-CZ 4.07Å; F83-F103 HydrophobicContact CG-CE1 4.17Å; F83-F103 HydrophobicContact CG-CZ 4.23Å; F83-L138 HydrophobicContact CD1-CB 4.04Å; F83-L138 HydrophobicContact CE1-CB 4.21Å; F83-R139 HydrophobicContact CE1-CB 4.07Å; F83-R139 HydrophobicContact CZ-CB 4.23Å
84C98.3Very high95.5Very high0 Ų035.5 Ų35.50%018%0.182CC..Hα-helixtrans-62.4-42.7173-62.80000111.8M80 V81 L82 V87 L88 W114 A142 C165M80-C84 PolarHBondContact O-N 2.98Å; M80-C84 PolarHBondContact O-SG 3.45Å; V81-C84 WeakPolarHBondContact O-CB 3.41Å; V81-C84 PolarHBondContact O-N 2.82Å; V81-C84 VanDerWaalsContact O-N 3.12Å; L82-C84 VanDerWaalsContact C-N 3.34Å; L82-C84 PolarHBondContact O-N 3.34Å; C84-V87 PolarHBondContact O-N 3.38Å; C84-L88 PolarHBondContact O-N 3.46Å; C84-W114 HydrophobicContact CB-CH2 4.41Å; C84-W114 HydrophobicContact CB-CZ2 4.33Å; C84-A142 HydrophobicContact CB-CB 3.91Å; C84-C165 VanDerWaalsContact CB-SG 3.57Å
85F98.2Very high96Very high0 Ų033.9 Ų33.90%018%0.179CC..Hα-helixtrans-61.6-44.6171.9-87.5-73.6000112.5V81 L82 V87 L88 Y89 W114 F160 L163 C165 V270 Y272 Y275V81-F85 HydrophobicContact CG1-CD2 4.41Å; V81-F85 HydrophobicContact CG1-CE2 4.39Å; V81-F85 PolarHBondContact O-N 3.08Å; V81-F85 VanDerWaalsContact O-N 3.09Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 2.7Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 2.89Å; F85-L88 PolarHBondContact O-N 3.5Å; F85-Y89 VanDerWaalsContact O-CB 3.29Å; F85-Y89 WeakPolarHBondContact O-CB 3.31Å; F85-Y89 PolarHBondContact O-N 3.01Å; F85-W114 HydrophobicContact CD1-CH2 4.2Å; F85-W114 AromaticContact CD1-CZ3 3.92Å; F85-W114 HydrophobicContact CD1-CZ3 3.92Å; F85-W114 HydrophobicContact CE1-CH2 4.49Å; F85-W114 AromaticContact CE1-CZ3 3.77Å; F85-W114 HydrophobicContact CE1-CZ3 3.77Å; F85-W114 HydrophobicContact CE2-CZ3 4.49Å; F85-W114 HydrophobicContact CG-CH2 4.35Å; F85-W114 HydrophobicContact CG-CZ3 4.35Å; F85-W114 HydrophobicContact CZ-CZ3 4.07Å; F85-F160 HydrophobicContact CD1-CE2 4.12Å; F85-F160 HydrophobicContact CD1-CZ 4.12Å; F85-L163 HydrophobicContact CE1-CB 4.13Å; F85-C165 HydrophobicContact CD2-CB 3.84Å; F85-C165 HydrophobicContact CE2-CB 3.38Å; F85-C165 HydrophobicContact CZ-CB 3.84Å; F85-V270 HydrophobicContact CE2-CB 4.42Å; F85-V270 HydrophobicContact CE2-CG1 4.38Å; F85-V270 WeakPolarHBondContact CE2-O 3.29Å; F85-Y272 HydrophobicContact CE1-CD2 4.23Å; F85-Y275 HydrophobicContact CB-CD1 4.12Å; F85-Y275 HydrophobicContact CB-CD2 3.39Å; F85-Y275 HydrophobicContact CB-CE1 4.1Å; F85-Y275 HydrophobicContact CB-CE2 3.4Å; F85-Y275 HydrophobicContact CB-CG 3.79Å; F85-Y275 HydrophobicContact CD1-CD1 4.18Å; F85-Y275 HydrophobicContact CD1-CG 4.22Å; F85-Y275 HydrophobicContact CD2-CD2 4.04Å; F85-Y275 AromaticContact CD2-CG 3.98Å; F85-Y275 HydrophobicContact CD2-CG 3.98Å; F85-Y275 HydrophobicContact CG-CD1 4.13Å; F85-Y275 AromaticContact CG-CD2 3.83Å; F85-Y275 HydrophobicContact CG-CD2 3.83Å; F85-Y275 HydrophobicContact CG-CE2 4.29Å; F85-Y275 AromaticContact CG-CG 3.76Å; F85-Y275 HydrophobicContact CG-CG 3.76Å
86D97Very high96.1Very high20 Ų2040.1 Ų40.111%0.10721%0.206CC..Hα-helixtrans-59.7-46.1176.9-74.4-22.4000110.4L82 F83 L88 Y89 H90 P98 Y275 R279L82-D86 PolarHBondContact O-N 3.2Å; F83-D86 PolarHBondContact O-N 3.37Å; D86-L88 PolarHBondContact O-N 3.46Å; D86-Y89 PolarHBondContact O-N 3.29Å; D86-H90 PolarHBondContact O-N 3.27Å; D86-H90 PolarHBondContact O-ND1 2.81Å; D86-P98 HydrophobicContact CB-CB 4.28Å; D86-P98 HydrophobicContact CB-CG 4.29Å; D86-Y275 VanDerWaalsContact OD1-CE2 3.3Å; D86-Y275 WeakPolarHBondContact OD1-CE2 3.22Å; D86-Y275 PolarHBondContact OD1-OH 3.21Å; D86-R279 IonicContact OD1-CZ 3.45Å; D86-R279 IonicContact OD1-NE 3.66Å; D86-R279 IonicContact OD1-NH1 3.62Å; D86-R279 PolarHBondContact OD1-NH1 3.19Å; D86-R279 IonicContact OD2-CZ 3.89Å; D86-R279 IonicContact OD2-NH1 3.67Å; D86-R279 PolarHBondContact OD2-NH1 3.2Å
87V98Very high96.1Very high5 Ų544.1 Ų44.13%0.0323%0.232CC..Hα-helixtrans-59-47.8177.5168.30000111.3F83 C84 F85 H91 P98 R139 A142 L143F83-V87 HydrophobicContact CD1-CG2 4.32Å; F83-V87 HydrophobicContact CD2-CG2 4.33Å; F83-V87 HydrophobicContact CE1-CG2 3.96Å; F83-V87 HydrophobicContact CE2-CG2 3.97Å; F83-V87 HydrophobicContact CZ-CG2 3.77Å; F83-V87 WeakPolarHBondContact O-CB 3.44Å; F83-V87 VanDerWaalsContact O-CG2 3.25Å; F83-V87 WeakPolarHBondContact O-CG2 3.2Å; F83-V87 PolarHBondContact O-N 3.17Å; C84-V87 PolarHBondContact O-N 3.38Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 2.89Å; V87-H91 WeakPolarHBondContact O-CB 3.36Å; V87-H91 PolarHBondContact O-N 2.9Å; V87-H91 VanDerWaalsContact O-N 3.14Å; V87-P98 HydrophobicContact CB-CG 4.33Å; V87-P98 HydrophobicContact CG2-CG 3.54Å; V87-R139 HydrophobicContact CG1-CG 4.11Å; V87-R139 HydrophobicContact CG2-CB 4.32Å; V87-R139 HydrophobicContact CG2-CG 4.05Å; V87-A142 HydrophobicContact CB-CB 4.46Å; V87-A142 HydrophobicContact CG1-CB 4.2Å; V87-L143 HydrophobicContact CG1-CD1 4.1Å; V87-L143 HydrophobicContact CG1-CD2 3.7Å; V87-L143 HydrophobicContact CG1-CG 3.62Å
88L98Very high96.1Very high0 Ų043.6 Ų43.60%023%0.228CC..Hα-helixtrans-64.8-43.1178.6-178.859000111.8C84 F85 D86 H91 L92 W114 A146 F147 I155 F160 L163C84-L88 PolarHBondContact O-N 3.46Å; F85-L88 PolarHBondContact O-N 3.5Å; D86-L88 PolarHBondContact O-N 3.46Å; L88-H91 PolarHBondContact O-N 3.29Å; L88-L92 HydrophobicContact CD1-CD1 4Å; L88-L92 HydrophobicContact CD1-CG 4.04Å; L88-L92 HydrophobicContact CG-CD1 3.88Å; L88-L92 HydrophobicContact CG-CG 4.36Å; L88-L92 WeakPolarHBondContact O-CG 3.21Å; L88-L92 PolarHBondContact O-N 3.35Å; L88-W114 HydrophobicContact CB-CH2 3.99Å; L88-W114 HydrophobicContact CB-CZ2 3.98Å; L88-W114 HydrophobicContact CD2-CD2 4.25Å; L88-W114 HydrophobicContact CD2-CE3 4.15Å; L88-W114 HydrophobicContact CD2-CH2 3.51Å; L88-W114 HydrophobicContact CD2-CZ2 3.62Å; L88-W114 HydrophobicContact CD2-CZ3 3.77Å; L88-W114 HydrophobicContact CG-CH2 4.4Å; L88-W114 HydrophobicContact CG-CZ2 4.38Å; L88-A146 HydrophobicContact CD1-CB 3.76Å; L88-F147 HydrophobicContact CD1-CE1 4.35Å; L88-F147 HydrophobicContact CD1-CE2 3.67Å; L88-F147 HydrophobicContact CD1-CZ 3.4Å; L88-F147 VanDerWaalsContact CD1-CZ 3.4Å; L88-I155 HydrophobicContact CD2-CG2 4.44Å; L88-F160 HydrophobicContact CB-CE2 4.2Å; L88-F160 HydrophobicContact CD2-CD2 3.89Å; L88-F160 HydrophobicContact CD2-CE2 3.85Å; L88-F160 HydrophobicContact CG-CD2 4.08Å; L88-F160 HydrophobicContact CG-CE2 3.85Å; L88-L163 HydrophobicContact CD2-CD1 3.69Å
89Y97.1Very high96Very high24 Ų2448.6 Ų48.69%0.09425%0.25CS..Hα-helixtrans-58.8-50.7177.9175.8-96.2000112.1F85 D86 H91 L92 K93 F95 W157 F160 F287F85-Y89 VanDerWaalsContact O-CB 3.29Å; F85-Y89 WeakPolarHBondContact O-CB 3.31Å; F85-Y89 PolarHBondContact O-N 3.01Å; D86-Y89 PolarHBondContact O-N 3.29Å; Y89-H91 VanDerWaalsContact C-N 3.27Å; Y89-H91 PolarHBondContact O-N 2.82Å; Y89-L92 PolarHBondContact O-N 3.48Å; Y89-K93 HydrophobicContact CD2-CG 4.27Å; Y89-K93 HydrophobicContact CE1-CG 4.05Å; Y89-K93 HydrophobicContact CE2-CD 4.38Å; Y89-K93 HydrophobicContact CE2-CG 3.75Å; Y89-K93 WeakPolarHBondContact O-CG 3.32Å; Y89-K93 PolarHBondContact O-N 2.95Å; Y89-F95 AromaticContact CE1-CD2 3.93Å; Y89-F95 HydrophobicContact CE1-CD2 3.93Å; Y89-F95 AromaticContact CE1-CE2 3.76Å; Y89-F95 HydrophobicContact CE1-CE2 3.76Å; Y89-W157 AromaticContact CD2-CH2 3.99Å; Y89-W157 HydrophobicContact CD2-CH2 3.99Å; Y89-W157 AromaticContact CD2-CZ3 3.83Å; Y89-W157 HydrophobicContact CD2-CZ3 3.83Å; Y89-W157 AromaticContact CE2-CH2 3.71Å; Y89-W157 HydrophobicContact CE2-CH2 3.71Å; Y89-W157 AromaticContact CE2-CZ3 3.94Å; Y89-W157 HydrophobicContact CE2-CZ3 3.94Å; Y89-F160 AromaticContact CD2-CE1 3.73Å; Y89-F160 HydrophobicContact CD2-CE1 3.73Å; Y89-F160 HydrophobicContact CD2-CZ 4.07Å; Y89-F160 HydrophobicContact CG-CE1 4.47Å; Y89-F160 HydrophobicContact CG-CZ 4.38Å; Y89-F287 AromaticContact CD1-CE1 3.93Å; Y89-F287 HydrophobicContact CD1-CE1 3.93Å; Y89-F287 HydrophobicContact CD2-CD1 4.3Å; Y89-F287 AromaticContact CD2-CE1 3.54Å; Y89-F287 HydrophobicContact CD2-CE1 3.54Å; Y89-F287 HydrophobicContact CD2-CZ 4.26Å; Y89-F287 HydrophobicContact CE1-CD1 4.1Å; Y89-F287 AromaticContact CE1-CE1 3.62Å; Y89-F287 HydrophobicContact CE1-CE1 3.62Å; Y89-F287 AromaticContact CE2-CD1 3.5Å; Y89-F287 HydrophobicContact CE2-CD1 3.5Å; Y89-F287 AromaticContact CE2-CE1 3.18Å; Y89-F287 HydrophobicContact CE2-CE1 3.18Å; Y89-F287 HydrophobicContact CE2-CZ 4.26Å; Y89-F287 AromaticContact CG-CE1 3.91Å; Y89-F287 HydrophobicContact CG-CE1 3.91Å; Y89-F287 AromaticContact CZ-CD1 3.39Å; Y89-F287 AromaticContact CZ-CE1 3.25Å; Y89-F287 WeakPolarHBondContact OH-CD1 3.36Å
90H97.1Very high95.8Very high41 Ų4152.6 Ų52.619%0.1927%0.269CS..Hα-helixtrans-62.1-39.6-179.3-71.670.2000110.4D86 K93 G94 F95 E96D86-H90 PolarHBondContact O-N 3.27Å; D86-H90 PolarHBondContact O-ND1 2.81Å; H90-K93 PolarHBondContact O-N 3.21Å; H90-G94 PolarHBondContact O-N 3.44Å; H90-F95 HydrophobicContact CB-CB 4.07Å; H90-F95 PolarHBondContact O-N 3.33Å; H90-E96 PolarHBondContact CD2-O 2.99Å
91H96.8Very high95.6Very high101 Ų10153.4 Ų53.447%0.46827%0.274SS..Hα-helixtrans-63.2-49176-168.686000112.6V87 L88 Y89 K93 G94 L143 F147V87-H91 WeakPolarHBondContact O-CB 3.36Å; V87-H91 PolarHBondContact O-N 2.9Å; V87-H91 VanDerWaalsContact O-N 3.14Å; L88-H91 PolarHBondContact O-N 3.29Å; Y89-H91 VanDerWaalsContact C-N 3.27Å; Y89-H91 PolarHBondContact O-N 2.82Å; H91-K93 PolarHBondContact O-N 3.27Å; H91-G94 PolarHBondContact O-N 3.31Å; H91-G94 VanDerWaalsContact O-N 3.11Å; H91-L143 HydrophobicContact CB-CD2 3.64Å; H91-F147 HydrophobicContact CB-CE2 4.43Å; H91-F147 AromaticContact CD2-CE2 3.2Å; H91-F147 WeakPolarHBondContact CD2-CE2 3.43Å; H91-F147 AromaticContact CD2-CZ 3.42Å; H91-F147 VanDerWaalsContact CD2-CZ 3.42Å; H91-F147 WeakPolarHBondContact CD2-CZ 3.24Å; H91-F147 AromaticContact CG-CE2 3.87Å; H91-F147 AromaticContact NE2-CE2 3.7Å
92L96.2Very high95.3Very high44 Ų4461.7 Ų61.723%0.2332%0.317CS..Hα-helixtrans-64.1-29.1-179.7-71.3172.3000113.1L88 Y89 F147 W157 F160L88-L92 HydrophobicContact CD1-CD1 4Å; L88-L92 HydrophobicContact CD1-CG 4.04Å; L88-L92 HydrophobicContact CG-CD1 3.88Å; L88-L92 HydrophobicContact CG-CG 4.36Å; L88-L92 WeakPolarHBondContact O-CG 3.21Å; L88-L92 PolarHBondContact O-N 3.35Å; Y89-L92 PolarHBondContact O-N 3.48Å; L92-F147 HydrophobicContact CD2-CE1 4.07Å; L92-F147 HydrophobicContact CD2-CZ 3.87Å; L92-F147 HydrophobicContact CG-CZ 4.31Å; L92-W157 HydrophobicContact CB-CE3 3.9Å; L92-W157 HydrophobicContact CB-CZ3 4.47Å; L92-W157 HydrophobicContact CD1-CE3 4.06Å; L92-F160 HydrophobicContact CD1-CB 4.09Å; L92-F160 HydrophobicContact CD1-CD2 3.53Å; L92-F160 HydrophobicContact CD1-CE2 4.24Å; L92-F160 HydrophobicContact CD1-CG 3.96Å
93K94.9Very high95.1Very high64 Ų6462.7 Ų62.728%0.27832%0.322SS..Hα-helixtrans-89.1-6.3176.5-67.5-63.7-163.8-177.90114Y89 H90 H91 F95 W157 E291Y89-K93 HydrophobicContact CD2-CG 4.27Å; Y89-K93 HydrophobicContact CE1-CG 4.05Å; Y89-K93 HydrophobicContact CE2-CD 4.38Å; Y89-K93 HydrophobicContact CE2-CG 3.75Å; Y89-K93 WeakPolarHBondContact O-CG 3.32Å; Y89-K93 PolarHBondContact O-N 2.95Å; H90-K93 PolarHBondContact O-N 3.21Å; H91-K93 PolarHBondContact O-N 3.27Å; K93-F95 VanDerWaalsContact C-N 3.29Å; K93-F95 HydrophobicContact CB-CD1 4.22Å; K93-F95 HydrophobicContact CB-CD2 3.69Å; K93-F95 HydrophobicContact CB-CE1 4.17Å; K93-F95 HydrophobicContact CB-CE2 3.63Å; K93-F95 HydrophobicContact CB-CG 3.99Å; K93-F95 HydrophobicContact CB-CZ 3.88Å; K93-F95 HydrophobicContact CG-CD2 4.4Å; K93-F95 HydrophobicContact CG-CE2 4.03Å; K93-F95 HydrophobicContact CG-CZ 4.42Å; K93-W157 HydrophobicContact CD-CE3 4.49Å; K93-W157 HydrophobicContact CD-CH2 4.32Å; K93-W157 HydrophobicContact CD-CZ3 4.23Å; K93-W157 VanDerWaalsContact CE-CZ2 3.43Å; K93-W157 HydrophobicContact CG-CZ3 4.37Å; K93-E291 IonicContact NZ-OE1 2.78Å; K93-E291 PolarHBondContact NZ-OE1 3.11Å
94G93.7Very high94.9Very high69 Ų6965.2 Ų65.271%0.71134%0.338SS*.THydrogen-bonded Turntrans68.327.5-174.600000113.6H90 H91H90-G94 PolarHBondContact O-N 3.44Å; H91-G94 PolarHBondContact O-N 3.31Å; H91-G94 VanDerWaalsContact O-N 3.11Å
95F94.4Very high94.8Very high110 Ų11069.1 Ų69.148%0.48236%0.358SS..PPolyproline II helixtrans-85.5159.4172.9-60.5-26.4000111.3Y89 H90 K93Y89-F95 AromaticContact CE1-CD2 3.93Å; Y89-F95 HydrophobicContact CE1-CD2 3.93Å; Y89-F95 AromaticContact CE1-CE2 3.76Å; Y89-F95 HydrophobicContact CE1-CE2 3.76Å; H90-F95 HydrophobicContact CB-CB 4.07Å; H90-F95 PolarHBondContact O-N 3.33Å; K93-F95 VanDerWaalsContact C-N 3.29Å; K93-F95 HydrophobicContact CB-CD1 4.22Å; K93-F95 HydrophobicContact CB-CD2 3.69Å; K93-F95 HydrophobicContact CB-CE1 4.17Å; K93-F95 HydrophobicContact CB-CE2 3.63Å; K93-F95 HydrophobicContact CB-CG 3.99Å; K93-F95 HydrophobicContact CB-CZ 3.88Å; K93-F95 HydrophobicContact CG-CD2 4.4Å; K93-F95 HydrophobicContact CG-CE2 4.03Å; K93-F95 HydrophobicContact CG-CZ 4.42Å
96E93.5Very high94.7Very high159 Ų15976.2 Ų76.274%0.74339%0.385SS*.PPolyproline II helixtrans-56.9147.6170.6-72.2-58.7132.800111.1H90H90-E96 PolarHBondContact CD2-O 2.99Å
97P93.5Very high94.6Very high87 Ų8781.5 Ų81.557%0.56541%0.409SS*.PPolyproline II helixtrans-55.3144.2-179.7-23.132.3000111.9R139P97-R139 VanDerWaalsContact CB-NH1 3.3Å
98P92.9Very high94.6Very high15 Ų1582.7 Ų82.710%0.09741%0.414CS..PPolyproline II helixtrans-60.5150-179.925.4-35.2000111F83 D86 V87 R139F83-P98 HydrophobicContact CD2-CG 4.5Å; F83-P98 HydrophobicContact CE2-CB 4.46Å; F83-P98 HydrophobicContact CE2-CG 3.98Å; D86-P98 HydrophobicContact CB-CB 4.28Å; D86-P98 HydrophobicContact CB-CG 4.29Å; V87-P98 HydrophobicContact CB-CG 4.33Å; V87-P98 HydrophobicContact CG2-CG 3.54Å; P98-R139 PolarHBondContact O-NH1 2.92Å; P98-R139 VanDerWaalsContact O-NH1 3.08Å; P98-R139 PolarHBondContact O-NH2 2.9Å
99K92.2Very high94.5Very high192 Ų19283.1 Ų83.184%0.83542%0.417SS*.PPolyproline II helixtrans-52.1159.4175.8-64.2-179.2-177.6175.60111.3
100Q90.7Very high94.5Very high158 Ų15882 Ų8274%0.73841%0.412SS*.PPolyproline II helixtrans-57133.8176.1-76.9-171.6-24.600110.8
101P92.5Very high94.5Very high17 Ų1781.3 Ų81.311%0.1141%0.409CS..PPolyproline II helixtrans-72.6157.5-179.728-30.6000111.5F83 F103 H135F83-P101 HydrophobicContact CD1-CG 4.29Å; F83-P101 HydrophobicContact CD2-CB 3.94Å; F83-P101 HydrophobicContact CD2-CG 4.05Å; F83-P101 HydrophobicContact CE1-CG 4.17Å; F83-P101 HydrophobicContact CE2-CB 4.23Å; F83-P101 HydrophobicContact CE2-CG 3.94Å; F83-P101 HydrophobicContact CG-CB 4.2Å; F83-P101 HydrophobicContact CG-CG 4.22Å; F83-P101 HydrophobicContact CZ-CG 3.99Å; P101-F103 HydrophobicContact CB-CD1 3.65Å; P101-F103 HydrophobicContact CB-CE1 3.25Å; P101-F103 HydrophobicContact CB-CE2 4.28Å; P101-F103 HydrophobicContact CB-CG 4.34Å; P101-F103 HydrophobicContact CB-CZ 3.59Å; P101-F103 HydrophobicContact CG-CD1 4.41Å; P101-F103 HydrophobicContact CG-CE1 3.75Å; P101-F103 HydrophobicContact CG-CE2 4Å; P101-F103 HydrophobicContact CG-CZ 3.5Å; P101-F103 VanDerWaalsContact CG-CZ 3.5Å; P101-H135 HydrophobicContact CG-CB 4.34Å; P101-H135 PolarHBondContact O-CE1 2.86Å
102L91.6Very high94.5Very high174 Ų17476.5 Ų76.591%0.91139%0.386SS*.SBendtrans-93.7-6.9-176.3-59.8177.8000114
103F93.2Very high94.6Very high28 Ų2874.8 Ų74.812%0.12338%0.378CS..SBendtrans-75.5165.5177.357.3-107.5000111.5E79 M80 F83 P101 N105 L134 H135 L138E79-F103 HydrophobicContact CB-CB 4.42Å; E79-F103 HydrophobicContact CB-CD1 3.69Å; E79-F103 HydrophobicContact CB-CE1 4.43Å; E79-F103 HydrophobicContact CB-CG 4.45Å; E79-F103 WeakPolarHBondContact O-CE1 3.33Å; M80-F103 HydrophobicContact CB-CZ 4.41Å; M80-F103 HydrophobicContact CE-CD2 4.24Å; M80-F103 HydrophobicContact CG-CD1 4.36Å; M80-F103 HydrophobicContact CG-CD2 3.98Å; M80-F103 HydrophobicContact CG-CE1 4.25Å; M80-F103 HydrophobicContact CG-CE2 3.9Å; M80-F103 HydrophobicContact CG-CG 4.23Å; M80-F103 HydrophobicContact CG-CZ 4.05Å; F83-F103 HydrophobicContact CB-CE1 3.77Å; F83-F103 HydrophobicContact CB-CZ 4.18Å; F83-F103 HydrophobicContact CD1-CE1 4.47Å; F83-F103 HydrophobicContact CD1-CZ 4.07Å; F83-F103 HydrophobicContact CG-CE1 4.17Å; F83-F103 HydrophobicContact CG-CZ 4.23Å; P101-F103 HydrophobicContact CB-CD1 3.65Å; P101-F103 HydrophobicContact CB-CE1 3.25Å; P101-F103 HydrophobicContact CB-CE2 4.28Å; P101-F103 HydrophobicContact CB-CG 4.34Å; P101-F103 HydrophobicContact CB-CZ 3.59Å; P101-F103 HydrophobicContact CG-CD1 4.41Å; P101-F103 HydrophobicContact CG-CE1 3.75Å; P101-F103 HydrophobicContact CG-CE2 4Å; P101-F103 HydrophobicContact CG-CZ 3.5Å; P101-F103 VanDerWaalsContact CG-CZ 3.5Å; F103-N105 PolarHBondContact O-N 3.47Å; F103-L134 HydrophobicContact CE2-CB 4.33Å; F103-H135 AromaticContact CD2-NE2 3.97Å; F103-H135 AromaticContact CE2-CD2 3.63Å; F103-H135 AromaticContact CE2-NE2 3.97Å; F103-H135 PolarHBondContact O-NE2 3.04Å; F103-L138 HydrophobicContact CE2-CD1 3.92Å; F103-L138 HydrophobicContact CZ-CD1 3.73Å
104V93.1Very high94.8Very high62 Ų6271.7 Ų71.738%0.37637%0.365SS..  trans-49131.1-179.554.70000113.1M80 R106 L134M80-V104 HydrophobicContact CE-CG1 4.02Å; V104-R106 HydrophobicContact CG2-CB 4.21Å; V104-R106 HydrophobicContact CG2-CG 3.59Å; V104-L134 HydrophobicContact CG1-CD1 4.48Å; V104-L134 VanDerWaalsContact O-CD1 3.3Å; V104-L134 WeakPolarHBondContact O-CD1 3.36Å
105N95.9Very high95Very high81 Ų8170 Ų7043%0.43334%0.338SS..  trans-106.662.2178.3-163.127.1000112.4F103 L134 H135F103-N105 PolarHBondContact O-N 3.47Å; N105-L134 PolarHBondContact OD1-N 3.47Å; N105-H135 WeakPolarHBondContact CB-NE2 3.03Å; N105-H135 VanDerWaalsContact CG-CD2 3.44Å; N105-H135 WeakPolarHBondContact OD1-CB 3.14Å; N105-H135 PolarHBondContact OD1-CD2 2.94Å; N105-H135 PolarHBondContact OD1-N 3.45Å
106R95.4Very high95.1Very high150 Ų15065.9 Ų65.957%0.56632%0.322SS*.  trans-84.9171.3172.1-77.4172.9-169.91775.1110.4V104 F108 L134V104-R106 HydrophobicContact CG2-CB 4.21Å; V104-R106 HydrophobicContact CG2-CG 3.59Å; R106-F108 HydrophobicContact CB-CD2 4.08Å; R106-F108 HydrophobicContact CB-CE2 3.49Å; R106-F108 VanDerWaalsContact CB-CE2 3.49Å; R106-F108 HydrophobicContact CB-CZ 4.4Å; R106-L134 HydrophobicContact CB-CD1 4.36Å; R106-L134 VanDerWaalsContact O-CG 3.26Å; R106-L134 WeakPolarHBondContact O-CG 3.46Å; R106-L134 PolarHBondContact O-N 3.45Å
107E96.7Very high95.2Very high131 Ų13159.5 Ų59.561%0.61230%0.299SS*.EExtended strand (participates in β ladder)trans-101.7128.7177-57.6-172153.300111.2T132E107-T132 VanDerWaalsContact CA-O 3.24Å; E107-T132 WeakPolarHBondContact CA-O 3.46Å
108F96.9Very high95.2Very high30 Ų3064.9 Ų64.913%0.13231%0.313CS..EExtended strand (participates in β ladder)trans-143.9144.7176.6-70.8-85.4000109.8V75 R106 T132 L134 L169 M171V75-F108 HydrophobicContact CB-CZ 4.41Å; V75-F108 HydrophobicContact CG1-CE2 3.64Å; V75-F108 HydrophobicContact CG1-CZ 3.75Å; V75-F108 HydrophobicContact CG2-CZ 4.25Å; R106-F108 HydrophobicContact CB-CD2 4.08Å; R106-F108 HydrophobicContact CB-CE2 3.49Å; R106-F108 VanDerWaalsContact CB-CE2 3.49Å; R106-F108 HydrophobicContact CB-CZ 4.4Å; F108-T132 PolarHBondContact N-O 3.46Å; F108-T132 PolarHBondContact O-N 3.32Å; F108-T132 VanDerWaalsContact O-N 3.17Å; F108-L134 HydrophobicContact CD2-CD1 4Å; F108-L134 HydrophobicContact CD2-CD2 4.12Å; F108-L134 HydrophobicContact CD2-CG 4.06Å; F108-L134 HydrophobicContact CE2-CD1 4.26Å; F108-L169 HydrophobicContact CB-CB 4.47Å; F108-L169 HydrophobicContact CB-CD2 4.26Å; F108-L169 HydrophobicContact CD2-CD1 4.28Å; F108-L169 HydrophobicContact CG-CB 4.49Å; F108-L169 HydrophobicContact CG-CD1 4.39Å; F108-M171 HydrophobicContact CE1-CE 4.48Å
109P96.3Very high95.2Very high8 Ų871.6 Ų71.65%0.05235%0.348CS..EExtended strand (participates in β ladder)trans-63133.5155.5-12.628.1000108.3T128 F129 L170 F173P109-T128 CarbonylContact C-O 3.45Å; P109-T128 WeakPolarHBondContact CA-O 3.37Å; P109-T128 VanDerWaalsContact CB-O 3.25Å; P109-T128 WeakPolarHBondContact CB-O 3.33Å; P109-F129 WeakPolarHBondContact CG-O 3.21Å; P109-L170 HydrophobicContact CB-CB 4.14Å; P109-L170 HydrophobicContact CB-CD1 4.43Å; P109-L170 HydrophobicContact CB-CG 4.47Å; P109-L170 PolarHBondContact O-N 2.92Å; P109-F173 HydrophobicContact CB-CZ 4.44Å; P109-F173 HydrophobicContact CG-CE2 3.88Å; P109-F173 HydrophobicContact CG-CZ 4.24Å
110L96.6Very high95.3Very high0 Ų067.3 Ų67.30%033%0.33CS..EExtended strand (participates in β ladder)trans-146154.7-17170.782.2000112.2V112 G127 T128 T132 L134 L138 Y141 S168 L169L110-V112 HydrophobicContact CD1-CG2 4.14Å; L110-G127 CarbonylContact O-C 3.54Å; L110-G127 WeakPolarHBondContact O-CA 3.46Å; L110-T128 PolarHBondContact N-O 3.46Å; L110-T128 PolarHBondContact O-N 3.05Å; L110-T132 HydrophobicContact CD2-CG2 3.92Å; L110-T132 HydrophobicContact CG-CG2 4.18Å; L110-L134 HydrophobicContact CD2-CD2 4.17Å; L110-L138 HydrophobicContact CD1-CD2 4.19Å; L110-L138 HydrophobicContact CD2-CD2 4.13Å; L110-L138 HydrophobicContact CD2-CG 4.21Å; L110-Y141 HydrophobicContact CD1-CD2 3.57Å; L110-Y141 HydrophobicContact CD1-CG 4.07Å; L110-Y141 HydrophobicContact CG-CD2 4.28Å; L110-S168 CarbonylContact C-O 3.56Å; L110-S168 VanDerWaalsContact CA-O 3.24Å; L110-S168 WeakPolarHBondContact CA-O 3.24Å; L110-L169 HydrophobicContact CB-CD2 3.76Å
111F96.9Very high95.5Very high27 Ų2767.2 Ų67.212%0.11833%0.327CS..EExtended strand (participates in β ladder)trans-128138.5173.2-78.3-104.5000109.6F129 S168 L170F111-F129 HydrophobicContact CE2-CD2 4.48Å; F111-F129 HydrophobicContact CE2-CE1 4.27Å; F111-F129 AromaticContact CE2-CE2 3.93Å; F111-F129 HydrophobicContact CE2-CE2 3.93Å; F111-F129 AromaticContact CE2-CZ 3.74Å; F111-F129 HydrophobicContact CE2-CZ 3.74Å; F111-F129 HydrophobicContact CZ-CD2 4.28Å; F111-F129 AromaticContact CZ-CE2 3.55Å; F111-F129 HydrophobicContact CZ-CE2 3.55Å; F111-F129 AromaticContact CZ-CZ 3.69Å; F111-F129 HydrophobicContact CZ-CZ 3.69Å; F111-S168 PolarHBondContact N-O 3.36Å; F111-S168 PolarHBondContact O-N 2.61Å; F111-L170 HydrophobicContact CD2-CD1 3.88Å; F111-L170 HydrophobicContact CD2-CD2 4.5Å; F111-L170 HydrophobicContact CD2-CG 4.27Å; F111-L170 HydrophobicContact CE2-CD1 3.7Å
112V98.2Very high95.6Very high0 Ų069.6 Ų69.60%034%0.338CS..EExtended strand (participates in β ladder)trans-110.9128.3168.4-177.70000107.9L110 C125 I126 L138 A142 S145 S166L110-V112 HydrophobicContact CD1-CG2 4.14Å; V112-C125 WeakPolarHBondContact O-CA 3.3Å; V112-I126 PolarHBondContact N-O 3.34Å; V112-I126 PolarHBondContact O-N 3.36Å; V112-I126 VanDerWaalsContact O-N 3.16Å; V112-L138 HydrophobicContact CG2-CD2 4.15Å; V112-A142 HydrophobicContact CG1-CB 4.42Å; V112-S145 VanDerWaalsContact O-CB 3.27Å; V112-S145 WeakPolarHBondContact O-CB 3.41Å; V112-S166 WeakPolarHBondContact CA-O 3.39Å
113T97.8Very high95.9Very high8 Ų863 Ų635%0.04930%0.301CS..EExtended strand (participates in β ladder)trans-123.5126.8-177.8-59.20000109.6E115 L122 G124 C125 C165 S166T113-E115 HydrophobicContact CG2-CG 4.23Å; T113-L122 HydrophobicContact CG2-CD1 3.49Å; T113-L122 VanDerWaalsContact CG2-CD1 3.49Å; T113-G124 CarbonylContact C-O 3.49Å; T113-G124 WeakPolarHBondContact CA-O 3.47Å; T113-C125 HydrophobicContact CG2-CB 4.09Å; T113-C125 PolarHBondContact OG1-SG 3.48Å; T113-C165 CarbonylContact O-C 3.58Å; T113-C165 WeakPolarHBondContact O-CA 3.26Å; T113-S166 PolarHBondContact N-O 3.2Å; T113-S166 PolarHBondContact O-N 3.34Å
114W98.5Very high96Very high0 Ų061.6 Ų61.60%030%0.295CS..EExtended strand (participates in β ladder)trans-102.5132.7170.2-62.9104.8000109.6C84 F85 L88 R123 G124 A142 S145 I155 L163 H164 C165C84-W114 HydrophobicContact CB-CH2 4.41Å; C84-W114 HydrophobicContact CB-CZ2 4.33Å; F85-W114 HydrophobicContact CD1-CH2 4.2Å; F85-W114 AromaticContact CD1-CZ3 3.92Å; F85-W114 HydrophobicContact CD1-CZ3 3.92Å; F85-W114 HydrophobicContact CE1-CH2 4.49Å; F85-W114 AromaticContact CE1-CZ3 3.77Å; F85-W114 HydrophobicContact CE1-CZ3 3.77Å; F85-W114 HydrophobicContact CE2-CZ3 4.49Å; F85-W114 HydrophobicContact CG-CH2 4.35Å; F85-W114 HydrophobicContact CG-CZ3 4.35Å; F85-W114 HydrophobicContact CZ-CZ3 4.07Å; L88-W114 HydrophobicContact CB-CH2 3.99Å; L88-W114 HydrophobicContact CB-CZ2 3.98Å; L88-W114 HydrophobicContact CD2-CD2 4.25Å; L88-W114 HydrophobicContact CD2-CE3 4.15Å; L88-W114 HydrophobicContact CD2-CH2 3.51Å; L88-W114 HydrophobicContact CD2-CZ2 3.62Å; L88-W114 HydrophobicContact CD2-CZ3 3.77Å; L88-W114 HydrophobicContact CG-CH2 4.4Å; L88-W114 HydrophobicContact CG-CZ2 4.38Å; W114-R123 HydrophobicContact CB-CB 4.32Å; W114-R123 WeakPolarHBondContact O-CA 3.43Å; W114-R123 WeakPolarHBondContact O-CB 3.25Å; W114-R123 PolarHBondContact O-N 2.59Å; W114-G124 PolarHBondContact N-O 3.34Å; W114-G124 PolarHBondContact O-N 2.97Å; W114-G124 VanDerWaalsContact O-N 3.13Å; W114-A142 HydrophobicContact CZ2-CB 4.37Å; W114-A142 PolarHBondContact NE1-O 2.87Å; W114-A142 VanDerWaalsContact NE1-O 3.1Å; W114-S145 PolarHBondContact NE1-OG 2.82Å; W114-I155 HydrophobicContact CB-CD1 3.72Å; W114-I155 HydrophobicContact CD2-CD1 4.3Å; W114-I155 HydrophobicContact CG-CD1 3.71Å; W114-L163 HydrophobicContact CE3-CB 4.19Å; W114-L163 HydrophobicContact CE3-CD1 3.95Å; W114-L163 HydrophobicContact CZ3-CB 4.43Å; W114-L163 HydrophobicContact CZ3-CD1 4.16Å; W114-H164 WeakPolarHBondContact CA-O 3.49Å; W114-C165 HydrophobicContact CE3-CB 3.8Å; W114-C165 HydrophobicContact CH2-CB 3.87Å; W114-C165 HydrophobicContact CZ3-CB 3.43Å; W114-C165 VanDerWaalsContact CZ3-CB 3.43Å
115E98.1Very high96.2Very high34 Ų3459.7 Ų59.716%0.15928%0.284CS..EExtended strand (participates in β ladder)trans-126.2153.9172-62.1165.6137.200108.7T113 K120 K121 L163 H164T113-E115 HydrophobicContact CG2-CG 4.23Å; E115-K120 HydrophobicContact CB-CB 4.06Å; E115-K120 HydrophobicContact CG-CB 4.44Å; E115-K121 CarbonylContact C-O 3.52Å; E115-K121 WeakPolarHBondContact CA-O 3.44Å; E115-L163 CarbonylContact O-C 3.58Å; E115-L163 VanDerWaalsContact O-CA 3.31Å; E115-L163 WeakPolarHBondContact O-CA 3.47Å; E115-H164 HydrophobicContact CB-CB 4.23Å; E115-H164 PolarHBondContact N-O 3.41Å; E115-H164 PolarHBondContact O-N 3.4Å
116V97.5Very high96.2Very high23 Ų2358.1 Ų58.114%0.13928%0.275CS..EExtended strand (participates in β ladder)trans-129.7141.3-177.168.10000112K121 R123 E159 R162 L163V116-K121 HydrophobicContact CG1-CB 4.32Å; V116-K121 PolarHBondContact N-O 2.86Å; V116-K121 PolarHBondContact O-N 3.28Å; V116-R123 HydrophobicContact CB-CB 4.28Å; V116-R123 HydrophobicContact CB-CG 4.38Å; V116-R123 HydrophobicContact CG1-CB 4.16Å; V116-R123 HydrophobicContact CG1-CG 4.29Å; V116-E159 HydrophobicContact CG2-CB 4.31Å; V116-R162 HydrophobicContact CG2-CB 3.95Å; V116-L163 HydrophobicContact CB-CD2 4.07Å; V116-L163 HydrophobicContact CG2-CD2 4.21Å
117G95.5Very high96.1Very high25 Ų2551.9 Ų51.926%0.25826%0.258SS..THydrogen-bonded Turntrans78.8-178.9173.200000114D119 K120 R162G117-D119 VanDerWaalsContact C-N 3.31Å; G117-D119 PolarHBondContact O-N 3.09Å; G117-K120 PolarHBondContact O-N 3.26Å; G117-K120 VanDerWaalsContact O-N 3.15Å; G117-R162 PolarHBondContact N-O 2.86Å
118K92.7Very high96Very high199 Ų19946.8 Ų46.887%0.86524%0.236SC*.THydrogen-bonded Turntrans-66.1-34.8-174.1-65-178179.4179.40112.8K120K118-K120 PolarHBondContact O-N 3.12Å
119D92.9Very high95.8Very high157 Ų15748 Ų4884%0.8424%0.241SC*.THydrogen-bonded Turntrans-82.63.3179.4-51.1-38.4000112.4G117 K121G117-D119 VanDerWaalsContact C-N 3.31Å; G117-D119 PolarHBondContact O-N 3.09Å; D119-K121 VanDerWaalsContact C-N 3.33Å; D119-K121 PolarHBondContact O-N 3.21Å
120K93.7Very high95.7Very high102 Ų10252.5 Ų52.544%0.44327%0.268SS..THydrogen-bonded Turntrans5049.6-179.1-60.1-177.2-179.5179.20112.8E115 G117 K118 L122E115-K120 HydrophobicContact CB-CB 4.06Å; E115-K120 HydrophobicContact CG-CB 4.44Å; G117-K120 PolarHBondContact O-N 3.26Å; G117-K120 VanDerWaalsContact O-N 3.15Å; K118-K120 PolarHBondContact O-N 3.12Å; K120-L122 PolarHBondContact O-N 3.5Å
121K95Very high95.5Very high156 Ų15655.7 Ų55.768%0.67829%0.29SS*.EExtended strand (participates in β ladder)trans-63.4128.7178.3-176.6179.9178.1-177.60109.6E115 V116 D119 R123E115-K121 CarbonylContact C-O 3.52Å; E115-K121 WeakPolarHBondContact CA-O 3.44Å; V116-K121 HydrophobicContact CG1-CB 4.32Å; V116-K121 PolarHBondContact N-O 2.86Å; V116-K121 PolarHBondContact O-N 3.28Å; D119-K121 VanDerWaalsContact C-N 3.33Å; D119-K121 PolarHBondContact O-N 3.21Å; K121-R123 PolarHBondContact O-N 2.9Å
122L95.3Very high95.4Very high66 Ų6655.4 Ų55.435%0.34629%0.291SS..EExtended strand (participates in β ladder)trans-55.1126.3176.4-173.365.1000110.7T113 K120 C125 F152T113-L122 HydrophobicContact CG2-CD1 3.49Å; T113-L122 VanDerWaalsContact CG2-CD1 3.49Å; K120-L122 PolarHBondContact O-N 3.5Å; L122-C125 HydrophobicContact CD1-CB 4.06Å; L122-F152 HydrophobicContact CB-CZ 4.35Å; L122-F152 HydrophobicContact CD2-CE2 4.45Å; L122-F152 HydrophobicContact CD2-CZ 3.87Å; L122-F152 HydrophobicContact CG-CE2 4.33Å; L122-F152 HydrophobicContact CG-CZ 3.76Å; L122-F152 VanDerWaalsContact O-CE1 3.26Å; L122-F152 WeakPolarHBondContact O-CE1 3.01Å
123R96.8Very high95.4Very high35 Ų3556.5 Ų56.513%0.13230%0.298CS..EExtended strand (participates in β ladder)trans-119.5-18.8-175.2-170.361.7-172.887.3-2.9113.4W114 V116 K121 F152 D153 P154 I155 E159 L163W114-R123 HydrophobicContact CB-CB 4.32Å; W114-R123 WeakPolarHBondContact O-CA 3.43Å; W114-R123 WeakPolarHBondContact O-CB 3.25Å; W114-R123 PolarHBondContact O-N 2.59Å; V116-R123 HydrophobicContact CB-CB 4.28Å; V116-R123 HydrophobicContact CB-CG 4.38Å; V116-R123 HydrophobicContact CG1-CB 4.16Å; V116-R123 HydrophobicContact CG1-CG 4.29Å; K121-R123 PolarHBondContact O-N 2.9Å; R123-F152 VanDerWaalsContact NH1-CB 3.28Å; R123-F152 WeakPolarHBondContact O-CB 3.43Å; R123-F152 WeakPolarHBondContact O-CD2 3.29Å; R123-F152 VanDerWaalsContact O-CG 3.29Å; R123-F152 WeakPolarHBondContact O-CG 3.1Å; R123-D153 PolarHBondContact NH1-O 3.27Å; R123-D153 PolarHBondContact NH2-O 3.24Å; R123-P154 PolarHBondContact NH2-O 2.95Å; R123-I155 HydrophobicContact CG-CD1 3.92Å; R123-I155 HydrophobicContact CG-CG1 3.85Å; R123-E159 WeakPolarHBondContact CD-OE2 3.16Å; R123-E159 IonicContact CZ-OE1 3.18Å; R123-E159 VanDerWaalsContact CZ-OE1 3.26Å; R123-E159 IonicContact CZ-OE2 2.9Å; R123-E159 VanDerWaalsContact NE-CD 3.31Å; R123-E159 IonicContact NE-OE1 2.68Å; R123-E159 PolarHBondContact NE-OE1 2.86Å; R123-E159 IonicContact NE-OE2 2.85Å; R123-E159 PolarHBondContact NE-OE2 2.8Å; R123-E159 IonicContact NH2-OE1 3.85Å; R123-E159 PolarHBondContact NH2-OE1 3.18Å; R123-L163 HydrophobicContact CG-CD2 4.44Å
124G97.2Very high95.4Very high0 Ų056.1 Ų56.10%030%0.296CS..EExtended strand (participates in β ladder)trans178.4143.1173.700000110.6T113 W114 S145T113-G124 CarbonylContact C-O 3.49Å; T113-G124 WeakPolarHBondContact CA-O 3.47Å; W114-G124 PolarHBondContact N-O 3.34Å; W114-G124 PolarHBondContact O-N 2.97Å; W114-G124 VanDerWaalsContact O-N 3.13Å; G124-S145 VanDerWaalsContact CA-O 3.31Å; G124-S145 WeakPolarHBondContact CA-O 3.22Å
125C95.8Very high95.3Very high21 Ų2157.3 Ų57.314%0.14230%0.302CS..EExtended strand (participates in β ladder)trans-153.6113.9173.6174.40000110.1V112 T113 L122 D149 R151V112-C125 WeakPolarHBondContact O-CA 3.3Å; T113-C125 HydrophobicContact CG2-CB 4.09Å; T113-C125 PolarHBondContact OG1-SG 3.48Å; L122-C125 HydrophobicContact CD1-CB 4.06Å; C125-D149 PolarHBondContact N-OD2 2.9Å; C125-R151 PolarHBondContact O-NH2 3.15Å
126I95.8Very high95.3Very high49 Ų4961.2 Ų61.225%0.25132%0.32SS..EExtended strand (participates in β ladder)trans-139.5147.9178.7-58-69.2000108.3V112 Y141 A144 D149V112-I126 PolarHBondContact N-O 3.34Å; V112-I126 PolarHBondContact O-N 3.36Å; V112-I126 VanDerWaalsContact O-N 3.16Å; I126-Y141 HydrophobicContact CG2-CD1 3.89Å; I126-Y141 HydrophobicContact CG2-CE1 4.2Å; I126-A144 HydrophobicContact CB-CB 4.47Å; I126-A144 HydrophobicContact CG2-CB 4.13Å; I126-D149 HydrophobicContact CD1-CB 3.94Å; I126-D149 HydrophobicContact CG1-CB 3.82Å
127G94.6Very high95.3Very high19 Ų1960.1 Ų60.120%0.19631%0.313CS..EExtended strand (participates in β ladder)trans-170.5-165.1-177.700000111.4L110L110-G127 CarbonylContact O-C 3.54Å; L110-G127 WeakPolarHBondContact O-CA 3.46Å
128T94.3Very high95.4Very high24 Ų2458.9 Ų58.915%0.14730%0.301CS..EExtended strand (participates in β ladder)trans-145.5151.3-179-176.80000112.3P109 L110 T130 T132 Y141P109-T128 CarbonylContact C-O 3.45Å; P109-T128 WeakPolarHBondContact CA-O 3.37Å; P109-T128 VanDerWaalsContact CB-O 3.25Å; P109-T128 WeakPolarHBondContact CB-O 3.33Å; L110-T128 PolarHBondContact N-O 3.46Å; L110-T128 PolarHBondContact O-N 3.05Å; T128-T130 WeakPolarHBondContact CG2-O 3.26Å; T128-T130 PolarHBondContact OG1-N 3.17Å; T128-T132 HydrophobicContact CG2-CG2 4.04Å; T128-Y141 VanDerWaalsContact CB-OH 3.24Å; T128-Y141 WeakPolarHBondContact CB-OH 3.34Å; T128-Y141 HydrophobicContact CG2-CD2 4.38Å; T128-Y141 HydrophobicContact CG2-CE2 3.44Å; T128-Y141 VanDerWaalsContact CG2-CE2 3.44Å; T128-Y141 WeakPolarHBondContact CG2-OH 3.48Å
129F92.3Very high95.6Very high56 Ų5652.4 Ų52.425%0.24627%0.271CS..EExtended strand (participates in β ladder)trans-91.6-6.4169.4-71.3-78.9000112.9P109 F111 L170 F173 T220 F263P109-F129 WeakPolarHBondContact CG-O 3.21Å; F111-F129 HydrophobicContact CE2-CD2 4.48Å; F111-F129 HydrophobicContact CE2-CE1 4.27Å; F111-F129 AromaticContact CE2-CE2 3.93Å; F111-F129 HydrophobicContact CE2-CE2 3.93Å; F111-F129 AromaticContact CE2-CZ 3.74Å; F111-F129 HydrophobicContact CE2-CZ 3.74Å; F111-F129 HydrophobicContact CZ-CD2 4.28Å; F111-F129 AromaticContact CZ-CE2 3.55Å; F111-F129 HydrophobicContact CZ-CE2 3.55Å; F111-F129 AromaticContact CZ-CZ 3.69Å; F111-F129 HydrophobicContact CZ-CZ 3.69Å; F129-L170 HydrophobicContact CD1-CD1 3.81Å; F129-L170 HydrophobicContact CE1-CD1 3.38Å; F129-L170 HydrophobicContact CZ-CD1 4.09Å; F129-F173 AromaticContact CD1-CE1 4Å; F129-F173 HydrophobicContact CD1-CE1 4Å; F129-F173 HydrophobicContact CD1-CZ 4.12Å; F129-F173 HydrophobicContact CE1-CE1 4.48Å; F129-T220 HydrophobicContact CE1-CG2 3.44Å; F129-T220 VanDerWaalsContact CE1-CG2 3.44Å; F129-T220 HydrophobicContact CE2-CG2 4.01Å; F129-T220 WeakPolarHBondContact CE2-OG1 3.37Å; F129-T220 HydrophobicContact CZ-CG2 3.07Å; F129-T220 WeakPolarHBondContact CZ-OG1 3.48Å; F129-F263 HydrophobicContact CE1-CE1 4.15Å; F129-F263 HydrophobicContact CE1-CZ 4.11Å
130T93.7Very high95.9Very high102 Ų10249.6 Ų49.663%0.62625%0.253SS*.EExtended strand (participates in β ladder)trans-90.1134.1173.8-560000109.2T128 T132T128-T130 WeakPolarHBondContact CG2-O 3.26Å; T128-T130 PolarHBondContact OG1-N 3.17Å; T130-T132 PolarHBondContact O-N 3.32Å
131S93.9Very high96.1Very high66 Ų6646.5 Ų46.546%0.46224%0.239SC..EExtended strand (participates in β ladder)trans-58.5127.9174.6-59.90000110.7
132T94.9Very high96.3Very high21 Ų2139 Ų3913%0.12921%0.206CC..EExtended strand (participates in β ladder)trans-131.7149.9174.4178.40000109.2E107 F108 L110 T128 T130 L134 Y141E107-T132 VanDerWaalsContact CA-O 3.24Å; E107-T132 WeakPolarHBondContact CA-O 3.46Å; F108-T132 PolarHBondContact N-O 3.46Å; F108-T132 PolarHBondContact O-N 3.32Å; F108-T132 VanDerWaalsContact O-N 3.17Å; L110-T132 HydrophobicContact CD2-CG2 3.92Å; L110-T132 HydrophobicContact CG-CG2 4.18Å; T128-T132 HydrophobicContact CG2-CG2 4.04Å; T130-T132 PolarHBondContact O-N 3.32Å; T132-L134 PolarHBondContact O-N 3.25Å; T132-Y141 HydrophobicContact CG2-CE2 4.24Å
133S97.1Very high96.4Very high23 Ų2338.1 Ų38.116%0.16120%0.201CC..EExtended strand (participates in β ladder)trans-55.4133.517274.50000110.1H135 Q136 G137S133-H135 PolarHBondContact O-N 3.47Å; S133-Q136 PolarHBondContact O-N 3.2Å; S133-Q136 WeakPolarHBondContact OG-CB 3.43Å; S133-Q136 PolarHBondContact OG-N 2.95Å; S133-G137 PolarHBondContact O-N 3.25Å
134L97.3Very high96.5Very high0 Ų037 Ų370%020%0.2CC..Hα-helixtrans-55.5-39.8-177.6-77167.2000111.6M80 F103 V104 N105 R106 F108 L110 T132 L138 L169M80-L134 HydrophobicContact CE-CD1 3.75Å; M80-L134 HydrophobicContact SD-CD2 4.34Å; F103-L134 HydrophobicContact CE2-CB 4.33Å; V104-L134 HydrophobicContact CG1-CD1 4.48Å; V104-L134 VanDerWaalsContact O-CD1 3.3Å; V104-L134 WeakPolarHBondContact O-CD1 3.36Å; N105-L134 PolarHBondContact OD1-N 3.47Å; R106-L134 HydrophobicContact CB-CD1 4.36Å; R106-L134 VanDerWaalsContact O-CG 3.26Å; R106-L134 WeakPolarHBondContact O-CG 3.46Å; R106-L134 PolarHBondContact O-N 3.45Å; F108-L134 HydrophobicContact CD2-CD1 4Å; F108-L134 HydrophobicContact CD2-CD2 4.12Å; F108-L134 HydrophobicContact CD2-CG 4.06Å; F108-L134 HydrophobicContact CE2-CD1 4.26Å; L110-L134 HydrophobicContact CD2-CD2 4.17Å; T132-L134 PolarHBondContact O-N 3.25Å; L134-L138 HydrophobicContact CB-CD1 4.42Å; L134-L138 HydrophobicContact CD2-CD1 4.47Å; L134-L138 WeakPolarHBondContact O-CB 3.33Å; L134-L138 WeakPolarHBondContact O-CD1 3.45Å; L134-L138 WeakPolarHBondContact O-CG 3.44Å; L134-L138 PolarHBondContact O-N 3.43Å; L134-L169 HydrophobicContact CD2-CD1 4.04Å; L134-L169 HydrophobicContact CD2-CD2 3.48Å; L134-L169 VanDerWaalsContact CD2-CD2 3.48Å; L134-L169 HydrophobicContact CD2-CG 4.43Å
135H97.4Very high96.5Very high26 Ų2637 Ų3712%0.1220%0.2CC..Hα-helixtrans-64.7-45.8-178.8-70.2-161.7000112.4P101 F103 N105 S133P101-H135 HydrophobicContact CG-CB 4.34Å; P101-H135 PolarHBondContact O-CE1 2.86Å; F103-H135 AromaticContact CD2-NE2 3.97Å; F103-H135 AromaticContact CE2-CD2 3.63Å; F103-H135 AromaticContact CE2-NE2 3.97Å; F103-H135 PolarHBondContact O-NE2 3.04Å; N105-H135 WeakPolarHBondContact CB-NE2 3.03Å; N105-H135 VanDerWaalsContact CG-CD2 3.44Å; N105-H135 WeakPolarHBondContact OD1-CB 3.14Å; N105-H135 PolarHBondContact OD1-CD2 2.94Å; N105-H135 PolarHBondContact OD1-N 3.45Å; S133-H135 PolarHBondContact O-N 3.47Å
136Q97.2Very high96.6Very high115 Ų11536.2 Ų36.254%0.53719%0.194SC..Hα-helixtrans-72.9-50.9178.7-179.6-178-14.200110.8S133 L138 R139 E140S133-Q136 PolarHBondContact O-N 3.2Å; S133-Q136 WeakPolarHBondContact OG-CB 3.43Å; S133-Q136 PolarHBondContact OG-N 2.95Å; Q136-L138 PolarHBondContact O-N 3.24Å; Q136-R139 PolarHBondContact O-N 3.21Å; Q136-E140 WeakPolarHBondContact O-CB 3.19Å; Q136-E140 PolarHBondContact O-N 2.66Å
137G97.3Very high96.7Very high0 Ų036.3 Ų36.30%019%0.193CC..Hα-helixtrans-60.8-46.8-175.200000111.7S133 R139 E140 Y141S133-G137 PolarHBondContact O-N 3.25Å; G137-R139 VanDerWaalsContact C-N 3.31Å; G137-R139 PolarHBondContact O-N 3.44Å; G137-E140 PolarHBondContact O-N 2.78Å; G137-Y141 VanDerWaalsContact O-CB 3.29Å; G137-Y141 WeakPolarHBondContact O-CB 3.41Å; G137-Y141 WeakPolarHBondContact O-CD2 3.4Å; G137-Y141 PolarHBondContact O-N 2.85Å
138L98.3Very high96.9Very high0 Ų043.4 Ų43.40%022%0.219CC..Hα-helixtrans-62.7-38.5178.4-67.3172.5000112.2M80 F83 F103 L110 V112 L134 Q136 A142 V167M80-L138 HydrophobicContact CB-CD1 3.71Å; M80-L138 HydrophobicContact CG-CD1 3.99Å; F83-L138 HydrophobicContact CD1-CB 4.04Å; F83-L138 HydrophobicContact CE1-CB 4.21Å; F103-L138 HydrophobicContact CE2-CD1 3.92Å; F103-L138 HydrophobicContact CZ-CD1 3.73Å; L110-L138 HydrophobicContact CD1-CD2 4.19Å; L110-L138 HydrophobicContact CD2-CD2 4.13Å; L110-L138 HydrophobicContact CD2-CG 4.21Å; V112-L138 HydrophobicContact CG2-CD2 4.15Å; L134-L138 HydrophobicContact CB-CD1 4.42Å; L134-L138 HydrophobicContact CD2-CD1 4.47Å; L134-L138 WeakPolarHBondContact O-CB 3.33Å; L134-L138 WeakPolarHBondContact O-CD1 3.45Å; L134-L138 WeakPolarHBondContact O-CG 3.44Å; L134-L138 PolarHBondContact O-N 3.43Å; Q136-L138 PolarHBondContact O-N 3.24Å; L138-A142 WeakPolarHBondContact O-CB 3.34Å; L138-A142 PolarHBondContact O-N 3.03Å; L138-V167 HydrophobicContact CD2-CB 4.35Å; L138-V167 HydrophobicContact CD2-CG1 3.58Å; L138-V167 HydrophobicContact CD2-CG2 3.78Å
139R97.8Very high97Very high62 Ų6242.7 Ų42.723%0.23421%0.214CC..Hα-helixtrans-64.5-49.6176.5-177-173.5-57.9-85.64.5111.4F83 V87 P97 P98 Q136 G137 L143F83-R139 HydrophobicContact CE1-CB 4.07Å; F83-R139 HydrophobicContact CZ-CB 4.23Å; V87-R139 HydrophobicContact CG1-CG 4.11Å; V87-R139 HydrophobicContact CG2-CB 4.32Å; V87-R139 HydrophobicContact CG2-CG 4.05Å; P97-R139 VanDerWaalsContact CB-NH1 3.3Å; P98-R139 PolarHBondContact O-NH1 2.92Å; P98-R139 VanDerWaalsContact O-NH1 3.08Å; P98-R139 PolarHBondContact O-NH2 2.9Å; Q136-R139 PolarHBondContact O-N 3.21Å; G137-R139 VanDerWaalsContact C-N 3.31Å; G137-R139 PolarHBondContact O-N 3.44Å; R139-L143 PolarHBondContact O-N 3.11Å
140E97.9Very high97.2Very high98 Ų9845.9 Ų45.946%0.45824%0.243SC..Hα-helixtrans-64.7-50.6-178.1-178.8171.7-175.800111.3Q136 G137 L143 A144Q136-E140 WeakPolarHBondContact O-CB 3.19Å; Q136-E140 PolarHBondContact O-N 2.66Å; G137-E140 PolarHBondContact O-N 2.78Å; E140-L143 PolarHBondContact O-N 2.99Å; E140-A144 WeakPolarHBondContact O-CB 3.31Å; E140-A144 PolarHBondContact O-N 2.89Å
141Y98.4Very high97.2Very high37 Ų3747.9 Ų47.915%0.14524%0.239CC..Hα-helixtrans-75.2-24.7-176.7-67.5-63.2000113.1L110 I126 T128 T132 G137 S145L110-Y141 HydrophobicContact CD1-CD2 3.57Å; L110-Y141 HydrophobicContact CD1-CG 4.07Å; L110-Y141 HydrophobicContact CG-CD2 4.28Å; I126-Y141 HydrophobicContact CG2-CD1 3.89Å; I126-Y141 HydrophobicContact CG2-CE1 4.2Å; T128-Y141 VanDerWaalsContact CB-OH 3.24Å; T128-Y141 WeakPolarHBondContact CB-OH 3.34Å; T128-Y141 HydrophobicContact CG2-CD2 4.38Å; T128-Y141 HydrophobicContact CG2-CE2 3.44Å; T128-Y141 VanDerWaalsContact CG2-CE2 3.44Å; T128-Y141 WeakPolarHBondContact CG2-OH 3.48Å; T132-Y141 HydrophobicContact CG2-CE2 4.24Å; G137-Y141 VanDerWaalsContact O-CB 3.29Å; G137-Y141 WeakPolarHBondContact O-CB 3.41Å; G137-Y141 WeakPolarHBondContact O-CD2 3.4Å; G137-Y141 PolarHBondContact O-N 2.85Å; Y141-S145 WeakPolarHBondContact O-CB 3.31Å; Y141-S145 PolarHBondContact O-N 3.27Å; Y141-S145 PolarHBondContact O-OG 3.47Å
142A98.5Very high97.4Very high0 Ų047.5 Ų47.50%023%0.23CC..Hα-helixtrans-61.8-44.1168.900000111.9C84 V87 V112 W114 L138 S145 A146C84-A142 HydrophobicContact CB-CB 3.91Å; V87-A142 HydrophobicContact CB-CB 4.46Å; V87-A142 HydrophobicContact CG1-CB 4.2Å; V112-A142 HydrophobicContact CG1-CB 4.42Å; W114-A142 HydrophobicContact CZ2-CB 4.37Å; W114-A142 PolarHBondContact NE1-O 2.87Å; W114-A142 VanDerWaalsContact NE1-O 3.1Å; L138-A142 WeakPolarHBondContact O-CB 3.34Å; L138-A142 PolarHBondContact O-N 3.03Å; A142-S145 PolarHBondContact O-OG 2.92Å; A142-A146 WeakPolarHBondContact O-CB 3.26Å; A142-A146 PolarHBondContact O-N 3.41Å
143L98.4Very high97.5Very high46 Ų4652.8 Ų52.824%0.24126%0.257CS..Hα-helixtrans-75.3-41.4177-62.1177.4000111.9V87 H91 R139 E140 A146 F147V87-L143 HydrophobicContact CG1-CD1 4.1Å; V87-L143 HydrophobicContact CG1-CD2 3.7Å; V87-L143 HydrophobicContact CG1-CG 3.62Å; H91-L143 HydrophobicContact CB-CD2 3.64Å; R139-L143 PolarHBondContact O-N 3.11Å; E140-L143 PolarHBondContact O-N 2.99Å; L143-A146 PolarHBondContact O-N 3.31Å; L143-F147 HydrophobicContact CB-CD2 4.28Å; L143-F147 HydrophobicContact CD2-CD2 4.23Å; L143-F147 HydrophobicContact CD2-CE2 3.78Å; L143-F147 WeakPolarHBondContact O-CB 3.35Å; L143-F147 VanDerWaalsContact O-CD2 3.24Å; L143-F147 WeakPolarHBondContact O-CD2 3.35Å; L143-F147 PolarHBondContact O-N 3.24Å
144A98.2Very high97.5Very high12 Ų1255.6 Ų55.610%0.09927%0.274CS..Hα-helixtrans-64.2-43.618000000111.7I126 E140 A146 F147 K148 D149I126-A144 HydrophobicContact CB-CB 4.47Å; I126-A144 HydrophobicContact CG2-CB 4.13Å; E140-A144 WeakPolarHBondContact O-CB 3.31Å; E140-A144 PolarHBondContact O-N 2.89Å; A144-A146 VanDerWaalsContact C-N 3.28Å; A144-A146 PolarHBondContact O-N 3.41Å; A144-F147 PolarHBondContact O-N 2.83Å; A144-K148 HydrophobicContact CB-CB 4.45Å; A144-K148 HydrophobicContact CB-CD 4.39Å; A144-K148 CarbonylContact O-C 3.55Å; A144-K148 WeakPolarHBondContact O-CA 3.2Å; A144-K148 WeakPolarHBondContact O-CB 3.27Å; A144-K148 PolarHBondContact O-N 3.35Å; A144-D149 PolarHBondContact O-N 3.26Å
145S98.1Very high97.6Very high1 Ų155.8 Ų55.81%0.00728%0.275CS..Hα-helixtrans-66.2-29.6175.458.40000112.9V112 W114 G124 Y141 A142V112-S145 VanDerWaalsContact O-CB 3.27Å; V112-S145 WeakPolarHBondContact O-CB 3.41Å; W114-S145 PolarHBondContact NE1-OG 2.82Å; G124-S145 VanDerWaalsContact CA-O 3.31Å; G124-S145 WeakPolarHBondContact CA-O 3.22Å; Y141-S145 WeakPolarHBondContact O-CB 3.31Å; Y141-S145 PolarHBondContact O-N 3.27Å; Y141-S145 PolarHBondContact O-OG 3.47Å; A142-S145 PolarHBondContact O-OG 2.92Å
146A98.2Very high97.5Very high3 Ų355.5 Ų55.53%0.02528%0.28CS..Hα-helixtrans-80.1-32177.700000114.1L88 A142 L143 A144 I155L88-A146 HydrophobicContact CD1-CB 3.76Å; A142-A146 WeakPolarHBondContact O-CB 3.26Å; A142-A146 PolarHBondContact O-N 3.41Å; L143-A146 PolarHBondContact O-N 3.31Å; A144-A146 VanDerWaalsContact C-N 3.28Å; A144-A146 PolarHBondContact O-N 3.41Å; A146-I155 HydrophobicContact CB-CB 4.3Å; A146-I155 HydrophobicContact CB-CD1 3.86Å; A146-I155 HydrophobicContact CB-CG1 4.29Å; A146-I155 WeakPolarHBondContact O-CG1 3.47Å; A146-I155 PolarHBondContact O-N 3.14Å
147F98Very high97.4Very high51 Ų5154.7 Ų54.722%0.22427%0.272CS..Hα-helixtrans-128.7-16.7-166.3-55.8-58.5000115.6L88 H91 L92 L143 A144 P154 I155L88-F147 HydrophobicContact CD1-CE1 4.35Å; L88-F147 HydrophobicContact CD1-CE2 3.67Å; L88-F147 HydrophobicContact CD1-CZ 3.4Å; L88-F147 VanDerWaalsContact CD1-CZ 3.4Å; H91-F147 HydrophobicContact CB-CE2 4.43Å; H91-F147 AromaticContact CD2-CE2 3.2Å; H91-F147 WeakPolarHBondContact CD2-CE2 3.43Å; H91-F147 AromaticContact CD2-CZ 3.42Å; H91-F147 VanDerWaalsContact CD2-CZ 3.42Å; H91-F147 WeakPolarHBondContact CD2-CZ 3.24Å; H91-F147 AromaticContact CG-CE2 3.87Å; H91-F147 AromaticContact NE2-CE2 3.7Å; L92-F147 HydrophobicContact CD2-CE1 4.07Å; L92-F147 HydrophobicContact CD2-CZ 3.87Å; L92-F147 HydrophobicContact CG-CZ 4.31Å; L143-F147 HydrophobicContact CB-CD2 4.28Å; L143-F147 HydrophobicContact CD2-CD2 4.23Å; L143-F147 HydrophobicContact CD2-CE2 3.78Å; L143-F147 WeakPolarHBondContact O-CB 3.35Å; L143-F147 VanDerWaalsContact O-CD2 3.24Å; L143-F147 WeakPolarHBondContact O-CD2 3.35Å; L143-F147 PolarHBondContact O-N 3.24Å; A144-F147 PolarHBondContact O-N 2.83Å; F147-P154 HydrophobicContact CD1-CB 3.95Å; F147-I155 HydrophobicContact CE1-CB 4.48Å; F147-I155 WeakPolarHBondContact CE1-O 3.24Å
148K97.7Very high97.4Very high169 Ų16960 Ų6074%0.73530%0.3SS*.SBendtrans-119.33.6-173.6-57.7-176.8-179.8178.40113.3A144 S150A144-K148 HydrophobicContact CB-CB 4.45Å; A144-K148 HydrophobicContact CB-CD 4.39Å; A144-K148 CarbonylContact O-C 3.55Å; A144-K148 WeakPolarHBondContact O-CA 3.2Å; A144-K148 WeakPolarHBondContact O-CB 3.27Å; A144-K148 PolarHBondContact O-N 3.35Å; K148-S150 PolarHBondContact O-N 2.61Å; K148-S150 VanDerWaalsContact O-N 3.15Å
149D96.9Very high97.2Very high9 Ų960.8 Ų60.85%0.04830%0.304CS..  trans-78.195.7172.1-169.4-17.6000110C125 I126 A144 R151 F152C125-D149 PolarHBondContact N-OD2 2.9Å; I126-D149 HydrophobicContact CD1-CB 3.94Å; I126-D149 HydrophobicContact CG1-CB 3.82Å; A144-D149 PolarHBondContact O-N 3.26Å; D149-R151 PolarHBondContact O-N 3.1Å; D149-R151 WeakPolarHBondContact OD1-CB 3.41Å; D149-R151 WeakPolarHBondContact OD1-CG 3.24Å; D149-R151 IonicContact OD1-CZ 3.32Å; D149-R151 PolarHBondContact OD1-N 3.43Å; D149-R151 IonicContact OD1-NE 3.45Å; D149-R151 PolarHBondContact OD1-NE 3.13Å; D149-R151 IonicContact OD1-NH2 2.7Å; D149-R151 IonicContact OD2-CZ 2.77Å; D149-R151 IonicContact OD2-NE 2.69Å; D149-R151 PolarHBondContact OD2-NE 2.85Å; D149-R151 IonicContact OD2-NH2 3.52Å; D149-R151 PolarHBondContact OD2-NH2 3.19Å; D149-F152 HydrophobicContact CB-CD2 4.12Å; D149-F152 PolarHBondContact O-N 3.16Å; D149-F152 WeakPolarHBondContact OD2-CE2 3.4Å
150S96.2Very high97.2Very high123 Ų12357.9 Ų57.986%0.8629%0.293SS*.THydrogen-bonded Turntrans-55.2-12.5-177.162.30000116K148 F152K148-S150 PolarHBondContact O-N 2.61Å; K148-S150 VanDerWaalsContact O-N 3.15Å; S150-F152 PolarHBondContact O-N 2.97Å
151R94.5Very high97.2Very high144 Ų14457.1 Ų57.154%0.54329%0.292SS..THydrogen-bonded Turntrans-72.9-16.9174.4-60.5176.5-66.6176.1-4112.6C125 D149C125-R151 PolarHBondContact O-NH2 3.15Å; D149-R151 PolarHBondContact O-N 3.1Å; D149-R151 WeakPolarHBondContact OD1-CB 3.41Å; D149-R151 WeakPolarHBondContact OD1-CG 3.24Å; D149-R151 IonicContact OD1-CZ 3.32Å; D149-R151 PolarHBondContact OD1-N 3.43Å; D149-R151 IonicContact OD1-NE 3.45Å; D149-R151 PolarHBondContact OD1-NE 3.13Å; D149-R151 IonicContact OD1-NH2 2.7Å; D149-R151 IonicContact OD2-CZ 2.77Å; D149-R151 IonicContact OD2-NE 2.69Å; D149-R151 PolarHBondContact OD2-NE 2.85Å; D149-R151 IonicContact OD2-NH2 3.52Å; D149-R151 PolarHBondContact OD2-NH2 3.19Å
152F97Very high97.1Very high58 Ų5861.1 Ų61.125%0.25431%0.307SS..SBendtrans-138.2152.8-174.1-45.1-83.2000111.1L122 R123 D149 S150L122-F152 HydrophobicContact CB-CZ 4.35Å; L122-F152 HydrophobicContact CD2-CE2 4.45Å; L122-F152 HydrophobicContact CD2-CZ 3.87Å; L122-F152 HydrophobicContact CG-CE2 4.33Å; L122-F152 HydrophobicContact CG-CZ 3.76Å; L122-F152 VanDerWaalsContact O-CE1 3.26Å; L122-F152 WeakPolarHBondContact O-CE1 3.01Å; R123-F152 VanDerWaalsContact NH1-CB 3.28Å; R123-F152 WeakPolarHBondContact O-CB 3.43Å; R123-F152 WeakPolarHBondContact O-CD2 3.29Å; R123-F152 VanDerWaalsContact O-CG 3.29Å; R123-F152 WeakPolarHBondContact O-CG 3.1Å; D149-F152 HydrophobicContact CB-CD2 4.12Å; D149-F152 PolarHBondContact O-N 3.16Å; D149-F152 WeakPolarHBondContact OD2-CE2 3.4Å; S150-F152 PolarHBondContact O-N 2.97Å
153D96.9Very high97.1Very high131 Ų13161.1 Ų61.170%0.70131%0.307SS*.PPolyproline II helixtrans-66.5153.2169.5-65.4-44.1000110.6R123 I155R123-D153 PolarHBondContact NH1-O 3.27Å; R123-D153 PolarHBondContact NH2-O 3.24Å; D153-I155 PolarHBondContact O-N 3.11Å
154P97.8Very high97.1Very high82 Ų8260.6 Ų60.653%0.53230%0.303SS..PPolyproline II helixtrans-48.2137.5173.4-31.538.7000113.1R123 F147 G156R123-P154 PolarHBondContact NH2-O 2.95Å; F147-P154 HydrophobicContact CD1-CB 3.95Å; P154-G156 PolarHBondContact O-N 2.87Å
155I98.1Very high97.1Very high4 Ų460 Ų602%0.02130%0.298CS..PPolyproline II helixtrans-63.4127.6178.4-71-179.3000110.9L88 W114 R123 A146 F147 D153 E159 L163L88-I155 HydrophobicContact CD2-CG2 4.44Å; W114-I155 HydrophobicContact CB-CD1 3.72Å; W114-I155 HydrophobicContact CD2-CD1 4.3Å; W114-I155 HydrophobicContact CG-CD1 3.71Å; R123-I155 HydrophobicContact CG-CD1 3.92Å; R123-I155 HydrophobicContact CG-CG1 3.85Å; A146-I155 HydrophobicContact CB-CB 4.3Å; A146-I155 HydrophobicContact CB-CD1 3.86Å; A146-I155 HydrophobicContact CB-CG1 4.29Å; A146-I155 WeakPolarHBondContact O-CG1 3.47Å; A146-I155 PolarHBondContact O-N 3.14Å; F147-I155 HydrophobicContact CE1-CB 4.48Å; F147-I155 WeakPolarHBondContact CE1-O 3.24Å; D153-I155 PolarHBondContact O-N 3.11Å; I155-E159 WeakPolarHBondContact CA-OE1 3.39Å; I155-E159 HydrophobicContact CG2-CG 3.95Å; I155-L163 HydrophobicContact CD1-CD1 4.43Å; I155-L163 HydrophobicContact CD1-CD2 4.37Å; I155-L163 HydrophobicContact CG2-CD1 3.88Å
156G95.3Very high97.1Very high20 Ų2060 Ų6021%0.20630%0.298CS..PPolyproline II helixtrans-88.4162.9179.100000114.4P154 D158 E159 F160P154-G156 PolarHBondContact O-N 2.87Å; G156-D158 VanDerWaalsContact C-N 3.26Å; G156-D158 WeakPolarHBondContact CA-OD1 3.09Å; G156-D158 PolarHBondContact O-N 2.8Å; G156-E159 PolarHBondContact N-OE1 3.48Å; G156-E159 WeakPolarHBondContact O-CG 3.29Å; G156-E159 PolarHBondContact O-N 2.91Å; G156-F160 PolarHBondContact O-N 3.25Å
157W96.4Very high97Very high98 Ų9859.8 Ų59.837%0.37130%0.297SS..Hα-helixtrans-65.4-31.6171.5177.1-107000112.4Y89 L92 K93 E159 F160 E291Y89-W157 AromaticContact CD2-CH2 3.99Å; Y89-W157 HydrophobicContact CD2-CH2 3.99Å; Y89-W157 AromaticContact CD2-CZ3 3.83Å; Y89-W157 HydrophobicContact CD2-CZ3 3.83Å; Y89-W157 AromaticContact CE2-CH2 3.71Å; Y89-W157 HydrophobicContact CE2-CH2 3.71Å; Y89-W157 AromaticContact CE2-CZ3 3.94Å; Y89-W157 HydrophobicContact CE2-CZ3 3.94Å; L92-W157 HydrophobicContact CB-CE3 3.9Å; L92-W157 HydrophobicContact CB-CZ3 4.47Å; L92-W157 HydrophobicContact CD1-CE3 4.06Å; K93-W157 HydrophobicContact CD-CE3 4.49Å; K93-W157 HydrophobicContact CD-CH2 4.32Å; K93-W157 HydrophobicContact CD-CZ3 4.23Å; K93-W157 VanDerWaalsContact CE-CZ2 3.43Å; K93-W157 HydrophobicContact CG-CZ3 4.37Å; W157-E159 PolarHBondContact O-N 3.37Å; W157-F160 HydrophobicContact CE3-CB 4.14Å; W157-F160 HydrophobicContact CE3-CD1 4.21Å; W157-F160 HydrophobicContact CE3-CG 4.24Å; W157-F160 AromaticContact CH2-CD1 3.84Å; W157-F160 HydrophobicContact CH2-CD1 3.84Å; W157-F160 HydrophobicContact CH2-CE1 4.32Å; W157-F160 HydrophobicContact CZ3-CB 4.27Å; W157-F160 AromaticContact CZ3-CD1 3.49Å; W157-F160 HydrophobicContact CZ3-CD1 3.49Å; W157-F160 VanDerWaalsContact CZ3-CD1 3.49Å; W157-F160 HydrophobicContact CZ3-CE1 4.02Å; W157-F160 AromaticContact CZ3-CG 3.95Å; W157-F160 HydrophobicContact CZ3-CG 3.95Å; W157-F160 WeakPolarHBondContact O-CB 3.36Å; W157-F160 PolarHBondContact O-N 2.96Å; W157-E291 WeakPolarHBondContact CZ2-OE1 3.4Å
158D95.7Very high96.9Very high111 Ų11157.4 Ų57.459%0.59429%0.286SS*.Hα-helixtrans-66.1-20.2-178.664.9-65.8000113.9G156 R162G156-D158 VanDerWaalsContact C-N 3.26Å; G156-D158 WeakPolarHBondContact CA-OD1 3.09Å; G156-D158 PolarHBondContact O-N 2.8Å; D158-R162 PolarHBondContact O-NH1 3.32Å
159E96.1Very high96.8Very high17 Ų1749.3 Ų49.38%0.07925%0.251CS..Hα-helixtrans-106.8-10.1177.266.4-177.914600114.1V116 R123 I155 G156 W157 N161 R162V116-E159 HydrophobicContact CG2-CB 4.31Å; R123-E159 WeakPolarHBondContact CD-OE2 3.16Å; R123-E159 IonicContact CZ-OE1 3.18Å; R123-E159 VanDerWaalsContact CZ-OE1 3.26Å; R123-E159 IonicContact CZ-OE2 2.9Å; R123-E159 VanDerWaalsContact NE-CD 3.31Å; R123-E159 IonicContact NE-OE1 2.68Å; R123-E159 PolarHBondContact NE-OE1 2.86Å; R123-E159 IonicContact NE-OE2 2.85Å; R123-E159 PolarHBondContact NE-OE2 2.8Å; R123-E159 IonicContact NH2-OE1 3.85Å; R123-E159 PolarHBondContact NH2-OE1 3.18Å; I155-E159 WeakPolarHBondContact CA-OE1 3.39Å; I155-E159 HydrophobicContact CG2-CG 3.95Å; G156-E159 PolarHBondContact N-OE1 3.48Å; G156-E159 WeakPolarHBondContact O-CG 3.29Å; G156-E159 PolarHBondContact O-N 2.91Å; W157-E159 PolarHBondContact O-N 3.37Å; E159-N161 PolarHBondContact O-N 3.46Å; E159-N161 VanDerWaalsContact O-N 3.11Å; E159-R162 VanDerWaalsContact CB-NH2 3.27Å; E159-R162 PolarHBondContact O-N 2.92Å
160F97.2Very high96.6Very high2 Ų249 Ų491%0.00925%0.249CC..Hα-helixtrans-51.8-40.5-175.7-177.4-109.2000113F85 L88 Y89 L92 G156 W157 R162 L163 Y272F85-F160 HydrophobicContact CD1-CE2 4.12Å; F85-F160 HydrophobicContact CD1-CZ 4.12Å; L88-F160 HydrophobicContact CB-CE2 4.2Å; L88-F160 HydrophobicContact CD2-CD2 3.89Å; L88-F160 HydrophobicContact CD2-CE2 3.85Å; L88-F160 HydrophobicContact CG-CD2 4.08Å; L88-F160 HydrophobicContact CG-CE2 3.85Å; Y89-F160 AromaticContact CD2-CE1 3.73Å; Y89-F160 HydrophobicContact CD2-CE1 3.73Å; Y89-F160 HydrophobicContact CD2-CZ 4.07Å; Y89-F160 HydrophobicContact CG-CE1 4.47Å; Y89-F160 HydrophobicContact CG-CZ 4.38Å; L92-F160 HydrophobicContact CD1-CB 4.09Å; L92-F160 HydrophobicContact CD1-CD2 3.53Å; L92-F160 HydrophobicContact CD1-CE2 4.24Å; L92-F160 HydrophobicContact CD1-CG 3.96Å; G156-F160 PolarHBondContact O-N 3.25Å; W157-F160 HydrophobicContact CE3-CB 4.14Å; W157-F160 HydrophobicContact CE3-CD1 4.21Å; W157-F160 HydrophobicContact CE3-CG 4.24Å; W157-F160 AromaticContact CH2-CD1 3.84Å; W157-F160 HydrophobicContact CH2-CD1 3.84Å; W157-F160 HydrophobicContact CH2-CE1 4.32Å; W157-F160 HydrophobicContact CZ3-CB 4.27Å; W157-F160 AromaticContact CZ3-CD1 3.49Å; W157-F160 HydrophobicContact CZ3-CD1 3.49Å; W157-F160 VanDerWaalsContact CZ3-CD1 3.49Å; W157-F160 HydrophobicContact CZ3-CE1 4.02Å; W157-F160 AromaticContact CZ3-CG 3.95Å; W157-F160 HydrophobicContact CZ3-CG 3.95Å; W157-F160 WeakPolarHBondContact O-CB 3.36Å; W157-F160 PolarHBondContact O-N 2.96Å; F160-R162 PolarHBondContact O-N 3Å; F160-L163 HydrophobicContact CD2-CD1 3.96Å; F160-L163 PolarHBondContact O-N 3.24Å; F160-Y272 HydrophobicContact CD1-CD2 4.23Å; F160-Y272 AromaticContact CD1-CE2 3.73Å; F160-Y272 HydrophobicContact CD1-CE2 3.73Å; F160-Y272 HydrophobicContact CE1-CD2 4.01Å; F160-Y272 AromaticContact CE1-CE2 3.44Å; F160-Y272 HydrophobicContact CE1-CE2 3.44Å; F160-Y272 VanDerWaalsContact CE1-CE2 3.44Å; F160-Y272 HydrophobicContact CZ-CD2 4.46Å; F160-Y272 HydrophobicContact CZ-CE2 4.24Å
161N96.8Very high96.5Very high82 Ų8244.5 Ų44.544%0.43922%0.215SC..THydrogen-bonded Turntrans-75.6-3-179.567.5-0.2000115E159 Y272E159-N161 PolarHBondContact O-N 3.46Å; E159-N161 VanDerWaalsContact O-N 3.11Å; N161-Y272 VanDerWaalsContact CA-CD1 3.47Å; N161-Y272 HydrophobicContact CB-CD1 3.87Å; N161-Y272 HydrophobicContact CB-CE1 3.63Å; N161-Y272 HydrophobicContact CB-CG 4.44Å; N161-Y272 WeakPolarHBondContact O-CD1 3.48Å
162R97.5Very high96.4Very high121 Ų12141.9 Ų41.946%0.45721%0.212SC..THydrogen-bonded Turntrans-111.84.8176.5-57.3-173.8-60.2-106.10.9112.7V116 G117 D158 E159 F160V116-R162 HydrophobicContact CG2-CB 3.95Å; G117-R162 PolarHBondContact N-O 2.86Å; D158-R162 PolarHBondContact O-NH1 3.32Å; E159-R162 VanDerWaalsContact CB-NH2 3.27Å; E159-R162 PolarHBondContact O-N 2.92Å; F160-R162 PolarHBondContact O-N 3Å
163L98.3Very high96.2Very high0 Ų042.9 Ų42.90%022%0.216CC..EExtended strand (participates in β ladder)trans-78.6151.2-175.3-65.9177000112.5F85 L88 W114 E115 V116 R123 I155 F160 Y272F85-L163 HydrophobicContact CE1-CB 4.13Å; L88-L163 HydrophobicContact CD2-CD1 3.69Å; W114-L163 HydrophobicContact CE3-CB 4.19Å; W114-L163 HydrophobicContact CE3-CD1 3.95Å; W114-L163 HydrophobicContact CZ3-CB 4.43Å; W114-L163 HydrophobicContact CZ3-CD1 4.16Å; E115-L163 CarbonylContact O-C 3.58Å; E115-L163 VanDerWaalsContact O-CA 3.31Å; E115-L163 WeakPolarHBondContact O-CA 3.47Å; V116-L163 HydrophobicContact CB-CD2 4.07Å; V116-L163 HydrophobicContact CG2-CD2 4.21Å; R123-L163 HydrophobicContact CG-CD2 4.44Å; I155-L163 HydrophobicContact CD1-CD1 4.43Å; I155-L163 HydrophobicContact CD1-CD2 4.37Å; I155-L163 HydrophobicContact CG2-CD1 3.88Å; F160-L163 HydrophobicContact CD2-CD1 3.96Å; F160-L163 PolarHBondContact O-N 3.24Å; L163-Y272 WeakPolarHBondContact O-CB 3.38Å; L163-Y272 PolarHBondContact O-N 3.38Å
164H98.3Very high96.2Very high34 Ų3441 Ų4116%0.15720%0.203CC..EExtended strand (participates in β ladder)trans-118.7134160.9-61.4-104.1000107.3W114 E115 V270 S271W114-H164 WeakPolarHBondContact CA-O 3.49Å; E115-H164 HydrophobicContact CB-CB 4.23Å; E115-H164 PolarHBondContact N-O 3.41Å; E115-H164 PolarHBondContact O-N 3.4Å; H164-V270 WeakPolarHBondContact CA-O 3.34Å; H164-S271 VanDerWaalsContact CE1-CB 3.44Å; H164-S271 WeakPolarHBondContact CE1-CB 3.07Å; H164-S271 WeakPolarHBondContact ND1-CB 3.24Å
165C98.4Very high96Very high0 Ų042 Ų420%021%0.208CC..EExtended strand (participates in β ladder)trans-109.3136.3174.8-172.20000108.6V81 C84 F85 T113 W114 T269 V270V81-C165 HydrophobicContact CG1-CB 3.54Å; V81-C165 VanDerWaalsContact CG1-O 3.24Å; V81-C165 WeakPolarHBondContact CG1-O 3.42Å; C84-C165 VanDerWaalsContact CB-SG 3.57Å; F85-C165 HydrophobicContact CD2-CB 3.84Å; F85-C165 HydrophobicContact CE2-CB 3.38Å; F85-C165 HydrophobicContact CZ-CB 3.84Å; T113-C165 CarbonylContact O-C 3.58Å; T113-C165 WeakPolarHBondContact O-CA 3.26Å; W114-C165 HydrophobicContact CE3-CB 3.8Å; W114-C165 HydrophobicContact CH2-CB 3.87Å; W114-C165 HydrophobicContact CZ3-CB 3.43Å; W114-C165 VanDerWaalsContact CZ3-CB 3.43Å; C165-T269 CarbonylContact O-C 3.59Å; C165-T269 VanDerWaalsContact O-CA 3.29Å; C165-T269 WeakPolarHBondContact O-CA 3.27Å; C165-V270 PolarHBondContact N-O 3.47Å; C165-V270 PolarHBondContact O-N 3.11Å
166S97.3Very high95.8Very high0 Ų042.3 Ų42.30%021%0.211CC..EExtended strand (participates in β ladder)trans-123135.5170.4-56.70000110.4V112 T113 M268 T269V112-S166 WeakPolarHBondContact CA-O 3.39Å; T113-S166 PolarHBondContact N-O 3.2Å; T113-S166 PolarHBondContact O-N 3.34Å; S166-M268 CarbonylContact C-O 3.53Å; S166-M268 WeakPolarHBondContact CA-O 2.92Å; S166-T269 WeakPolarHBondContact CB-OG1 3.3Å; S166-T269 WeakPolarHBondContact OG-CB 3.09Å; S166-T269 VanDerWaalsContact OG-CG2 3.26Å; S166-T269 WeakPolarHBondContact OG-CG2 3.4Å; S166-T269 PolarHBondContact OG-OG1 2.9Å
167V97.1Very high95.7Very high0 Ų048.7 Ų48.70%024%0.24CC..EExtended strand (participates in β ladder)trans-110.8125.1169.2171.70000107.6V76 V81 L138 L169 K267 M268V76-V167 HydrophobicContact CG2-CB 4.31Å; V76-V167 HydrophobicContact CG2-CG1 4.01Å; V81-V167 HydrophobicContact CB-CG2 4.47Å; V81-V167 HydrophobicContact CG2-CB 4.08Å; V81-V167 HydrophobicContact CG2-CG2 3.92Å; L138-V167 HydrophobicContact CD2-CB 4.35Å; L138-V167 HydrophobicContact CD2-CG1 3.58Å; L138-V167 HydrophobicContact CD2-CG2 3.78Å; V167-L169 HydrophobicContact CG1-CD2 3.99Å; V167-L169 HydrophobicContact CG1-CG 4.49Å; V167-K267 WeakPolarHBondContact O-CA 3.26Å; V167-M268 PolarHBondContact N-O 3.06Å; V167-M268 PolarHBondContact O-N 3.01Å
168S94.5Very high95.5Very high0 Ų047.9 Ų47.90%024%0.243CC..EExtended strand (participates in β ladder)trans-116119.9174.9-61.20000109.5L110 F111 E266 K267L110-S168 CarbonylContact C-O 3.56Å; L110-S168 VanDerWaalsContact CA-O 3.24Å; L110-S168 WeakPolarHBondContact CA-O 3.24Å; F111-S168 PolarHBondContact N-O 3.36Å; F111-S168 PolarHBondContact O-N 2.61Å; S168-E266 CarbonylContact C-O 3.58Å; S168-E266 WeakPolarHBondContact CA-O 3.38Å; S168-K267 WeakPolarHBondContact OG-CG 3.29Å
169L95.4Very high95.3Very high0 Ų044.2 Ų44.20%022%0.221CC..EExtended strand (participates in β ladder)trans-98.2125.1172.6-55.7-173.4000109V75 V76 M80 F108 L110 L134 V167 M171 S265 E266V75-L169 HydrophobicContact CB-CD1 4.28Å; V75-L169 HydrophobicContact CG1-CD1 3.9Å; V76-L169 HydrophobicContact CB-CD1 4.01Å; V76-L169 HydrophobicContact CB-CG 4.17Å; V76-L169 HydrophobicContact CG2-CD1 4.38Å; V76-L169 HydrophobicContact CG2-CG 4.21Å; M80-L169 HydrophobicContact SD-CD1 4.18Å; F108-L169 HydrophobicContact CB-CB 4.47Å; F108-L169 HydrophobicContact CB-CD2 4.26Å; F108-L169 HydrophobicContact CD2-CD1 4.28Å; F108-L169 HydrophobicContact CG-CB 4.49Å; F108-L169 HydrophobicContact CG-CD1 4.39Å; L110-L169 HydrophobicContact CB-CD2 3.76Å; L134-L169 HydrophobicContact CD2-CD1 4.04Å; L134-L169 HydrophobicContact CD2-CD2 3.48Å; L134-L169 VanDerWaalsContact CD2-CD2 3.48Å; L134-L169 HydrophobicContact CD2-CG 4.43Å; V167-L169 HydrophobicContact CG1-CD2 3.99Å; V167-L169 HydrophobicContact CG1-CG 4.49Å; L169-M171 HydrophobicContact CB-CE 3.99Å; L169-S265 CarbonylContact O-C 3.5Å; L169-S265 WeakPolarHBondContact O-CA 3.44Å; L169-E266 PolarHBondContact N-O 3.18Å; L169-E266 PolarHBondContact O-N 3.49Å
170L94.1Very high95.1Very high1 Ų146.4 Ų46.41%0.00523%0.232CC..EExtended strand (participates in β ladder)trans-93.7137.9179.8-45-172.9000109.9P109 F111 F129 F173 L222 F263 Q264P109-L170 HydrophobicContact CB-CB 4.14Å; P109-L170 HydrophobicContact CB-CD1 4.43Å; P109-L170 HydrophobicContact CB-CG 4.47Å; P109-L170 PolarHBondContact O-N 2.92Å; F111-L170 HydrophobicContact CD2-CD1 3.88Å; F111-L170 HydrophobicContact CD2-CD2 4.5Å; F111-L170 HydrophobicContact CD2-CG 4.27Å; F111-L170 HydrophobicContact CE2-CD1 3.7Å; F129-L170 HydrophobicContact CD1-CD1 3.81Å; F129-L170 HydrophobicContact CE1-CD1 3.38Å; F129-L170 HydrophobicContact CZ-CD1 4.09Å; L170-F173 HydrophobicContact CB-CE2 3.87Å; L170-F173 HydrophobicContact CB-CZ 3.66Å; L170-F173 HydrophobicContact CD1-CZ 4.12Å; L170-L222 HydrophobicContact CD2-CD2 3.99Å; L170-F263 HydrophobicContact CB-CD2 4.15Å; L170-F263 HydrophobicContact CD1-CD2 4.3Å; L170-F263 HydrophobicContact CD1-CE2 3.93Å; L170-F263 HydrophobicContact CD1-CZ 4.36Å; L170-F263 HydrophobicContact CD2-CD2 4.13Å; L170-F263 HydrophobicContact CD2-CE2 3.77Å; L170-F263 HydrophobicContact CG-CD2 4.43Å; L170-F263 HydrophobicContact CG-CE2 4.29Å; L170-Q264 WeakPolarHBondContact CA-O 3.38Å
171M93.5Very high94.8Very high29 Ų2948.5 Ų48.514%0.14324%0.244CC..EExtended strand (participates in β ladder)trans-153.2169.2-17458.9-168.772.700111.4F108 L169 F173 Q264 E266F108-M171 HydrophobicContact CE1-CE 4.48Å; L169-M171 HydrophobicContact CB-CE 3.99Å; M171-F173 PolarHBondContact O-N 3.15Å; M171-Q264 HydrophobicContact CG-CB 4.3Å; M171-Q264 PolarHBondContact N-O 2.94Å; M171-Q264 PolarHBondContact O-N 3.37Å; M171-Q264 VanDerWaalsContact O-O 3.09Å; M171-E266 HydrophobicContact CE-CB 3.8Å; M171-E266 HydrophobicContact CE-CG 3.53Å; M171-E266 HydrophobicContact SD-CG 3.91Å
172N92.4Very high94.5Very high90 Ų9045.1 Ų45.148%0.48123%0.225SC..EExtended strand (participates in β ladder)trans55.552.8175.1-53-22.6000112.3E174 Q264N172-E174 PolarHBondContact O-N 3.47Å; N172-Q264 HydrophobicContact CB-CB 4.44Å; N172-Q264 HydrophobicContact CB-CG 4.46Å; N172-Q264 PolarHBondContact ND2-OE1 3.43Å
173F94Very high94Very high78 Ų7845 Ų4534%0.34223%0.229SC..EExtended strand (participates in β ladder)trans-71.3124.3174.6-70.9-95.7000109.9P109 F129 L170 M171 I261 R262 F263P109-F173 HydrophobicContact CB-CZ 4.44Å; P109-F173 HydrophobicContact CG-CE2 3.88Å; P109-F173 HydrophobicContact CG-CZ 4.24Å; F129-F173 AromaticContact CD1-CE1 4Å; F129-F173 HydrophobicContact CD1-CE1 4Å; F129-F173 HydrophobicContact CD1-CZ 4.12Å; F129-F173 HydrophobicContact CE1-CE1 4.48Å; L170-F173 HydrophobicContact CB-CE2 3.87Å; L170-F173 HydrophobicContact CB-CZ 3.66Å; L170-F173 HydrophobicContact CD1-CZ 4.12Å; M171-F173 PolarHBondContact O-N 3.15Å; F173-I261 HydrophobicContact CB-CG2 4.19Å; F173-I261 HydrophobicContact CD1-CG2 3.94Å; F173-R262 CarbonylContact C-O 3.47Å; F173-R262 WeakPolarHBondContact CA-O 3.36Å; F173-F263 HydrophobicContact CD1-CB 3.58Å; F173-F263 HydrophobicContact CD1-CD1 4.07Å; F173-F263 HydrophobicContact CD1-CG 4.06Å; F173-F263 HydrophobicContact CD2-CB 4.25Å; F173-F263 HydrophobicContact CE1-CB 3.64Å; F173-F263 AromaticContact CE1-CD1 3.66Å; F173-F263 HydrophobicContact CE1-CD1 3.66Å; F173-F263 HydrophobicContact CE1-CD2 4.44Å; F173-F263 HydrophobicContact CE1-CE1 4.45Å; F173-F263 AromaticContact CE1-CG 3.65Å; F173-F263 HydrophobicContact CE1-CG 3.65Å; F173-F263 HydrophobicContact CE2-CB 4.29Å; F173-F263 HydrophobicContact CG-CB 3.9Å; F173-F263 HydrophobicContact CZ-CB 4.01Å; F173-F263 HydrophobicContact CZ-CD1 4.43Å; F173-F263 HydrophobicContact CZ-CD2 4.46Å; F173-F263 HydrophobicContact CZ-CG 4.05Å
174E95.3Very high93Very high91 Ų9146.1 Ų46.143%0.42524%0.236SC..EExtended strand (participates in β ladder)trans-131.8133.2-179.7-66.6174.8-172.300109N172 A176 I261 R262N172-E174 PolarHBondContact O-N 3.47Å; E174-A176 PolarHBondContact O-N 2.93Å; E174-I261 CarbonylContact O-C 3.54Å; E174-I261 VanDerWaalsContact O-CA 3.27Å; E174-I261 WeakPolarHBondContact O-CA 2.95Å; E174-I261 WeakPolarHBondContact O-CG2 3.22Å; E174-R262 HydrophobicContact CB-CG 3.96Å; E174-R262 PolarHBondContact N-O 3.07Å; E174-R262 PolarHBondContact O-N 2.85Å; E174-R262 IonicContact OE2-CZ 3.22Å; E174-R262 IonicContact OE2-NE 2.73Å; E174-R262 PolarHBondContact OE2-NE 2.87Å; E174-R262 IonicContact OE2-NH2 3.88Å; E174-R262 PolarHBondContact OE2-NH2 3.27Å
175V95.3Very high91.6Very high104 Ų10446.4 Ų46.463%0.6324%0.241SC*.EExtended strand (participates in β ladder)trans-71125.8167.7-177.70000106.9I261V175-I261 HydrophobicContact CG2-CG1 4.46Å
176A94Very high89.7Confident10 Ų1051.2 Ų51.28%0.08327%0.266CS..  trans-82.1153.3178.100000110.6E174 D178 D181 L260E174-A176 PolarHBondContact O-N 2.93Å; A176-D178 VanDerWaalsContact C-N 3.32Å; A176-D181 WeakPolarHBondContact CA-OD2 3.43Å; A176-D181 HydrophobicContact CB-CB 4.02Å; A176-D181 WeakPolarHBondContact CB-O 3.37Å; A176-L260 HydrophobicContact CB-CB 4.16Å; A176-L260 HydrophobicContact CB-CD2 3.4Å; A176-L260 HydrophobicContact CB-CG 4.35Å; A176-L260 PolarHBondContact N-O 2.89Å
177D92.5Very high87.7Confident154 Ų15452.9 Ų52.982%0.82428%0.277SS*.SBendtrans-68-35-179.8-72.7-30.4000111.9D181D177-D181 HydrophobicContact CB-CB 4.41Å; D177-D181 PolarHBondContact N-OD2 2.98Å
178D91.4Very high85.6Confident82 Ų8260.3 Ų60.344%0.43931%0.31SS..SBendtrans-148.4180174.369.135.1000112.1A176 M180 D181A176-D178 VanDerWaalsContact C-N 3.32Å; D178-M180 PolarHBondContact O-N 2.67Å; D178-M180 VanDerWaalsContact OD1-CA 3.24Å; D178-M180 WeakPolarHBondContact OD1-CA 3.43Å; D178-M180 VanDerWaalsContact OD1-CB 3.28Å; D178-M180 WeakPolarHBondContact OD1-CB 3.47Å; D178-M180 PolarHBondContact OD1-N 3.34Å; D178-D181 PolarHBondContact O-N 3.03Å; D178-D181 PolarHBondContact OD1-N 2.82Å
179Y92.4Very high83.3Confident33 Ų3370.9 Ų70.913%0.12935%0.351CS..THydrogen-bonded Turntrans-71.1-7.4-178.571.3-88.1000114.5W182 I237 R255 L260Y179-W182 PolarHBondContact O-NE1 2.78Å; Y179-I237 HydrophobicContact CD2-CG1 4.21Å; Y179-R255 HydrophobicContact CD1-CB 3.97Å; Y179-R255 WeakPolarHBondContact CD1-O 3.4Å; Y179-R255 HydrophobicContact CD2-CB 4.07Å; Y179-R255 HydrophobicContact CE1-CB 3.82Å; Y179-R255 HydrophobicContact CE2-CB 3.87Å; Y179-R255 HydrophobicContact CE2-CG 4.45Å; Y179-R255 HydrophobicContact CG-CB 4.1Å; Y179-L260 WeakPolarHBondContact O-CD1 3.3Å
180M90.9Very high81Confident63 Ų6379.3 Ų79.331%0.3139%0.393SS..THydrogen-bonded Turntrans-104.2-15.5176.9-56.9-64-151.100113D178 W182 H233 I234D178-M180 PolarHBondContact O-N 2.67Å; D178-M180 VanDerWaalsContact OD1-CA 3.24Å; D178-M180 WeakPolarHBondContact OD1-CA 3.43Å; D178-M180 VanDerWaalsContact OD1-CB 3.28Å; D178-M180 WeakPolarHBondContact OD1-CB 3.47Å; D178-M180 PolarHBondContact OD1-N 3.34Å; M180-W182 PolarHBondContact O-N 3.13Å; M180-H233 HydrophobicContact CE-CB 4.5Å; M180-H233 PolarHBondContact O-CD2 2.81Å; M180-H233 PolarHBondContact O-NE2 2.92Å; M180-H233 HydrophobicContact SD-CB 3.35Å; M180-H233 WeakPolarHBondContact SD-CB 3.2Å; M180-I234 HydrophobicContact CE-CD1 4.13Å; M180-I234 HydrophobicContact CE-CG1 3.61Å
181D90.9Very high78.9Confident47 Ų4789.9 Ų89.925%0.25143%0.433SS..  trans-73.462.1-176.5175.637.8000113.1A176 D177 D178 R262A176-D181 WeakPolarHBondContact CA-OD2 3.43Å; A176-D181 HydrophobicContact CB-CB 4.02Å; A176-D181 WeakPolarHBondContact CB-O 3.37Å; D177-D181 HydrophobicContact CB-CB 4.41Å; D177-D181 PolarHBondContact N-OD2 2.98Å; D178-D181 PolarHBondContact O-N 3.03Å; D178-D181 PolarHBondContact OD1-N 2.82Å; D181-R262 WeakPolarHBondContact O-CD 3.47Å; D181-R262 PolarHBondContact O-NH1 2.85Å; D181-R262 IonicContact OD1-CZ 3.03Å; D181-R262 IonicContact OD1-NH1 3.4Å; D181-R262 PolarHBondContact OD1-NH1 3.27Å; D181-R262 IonicContact OD2-CZ 2.77Å; D181-R262 IonicContact OD2-NH1 3.14Å; D181-R262 PolarHBondContact OD2-NH1 2.75Å
182W91.3Very high76.7Confident11 Ų1194.3 Ų94.34%0.04246%0.463CS..SBendtrans-157.9155.2173.460-77.7000109.9Y179 M180 V184 H203 I205 A226 H233 T236 L260 R262Y179-W182 PolarHBondContact O-NE1 2.78Å; M180-W182 PolarHBondContact O-N 3.13Å; W182-V184 HydrophobicContact CD2-CG2 4.49Å; W182-V184 HydrophobicContact CE3-CG2 3.8Å; W182-V184 HydrophobicContact CH2-CG2 3.22Å; W182-V184 HydrophobicContact CZ2-CG2 4Å; W182-V184 HydrophobicContact CZ3-CB 4.21Å; W182-V184 HydrophobicContact CZ3-CG2 3.13Å; W182-H203 HydrophobicContact CB-CB 4.18Å; W182-I205 HydrophobicContact CB-CG2 4.02Å; W182-I205 HydrophobicContact CD2-CD1 4.49Å; W182-I205 HydrophobicContact CD2-CG2 3.5Å; W182-I205 VanDerWaalsContact CD2-CG2 3.5Å; W182-I205 HydrophobicContact CE3-CG2 3.64Å; W182-I205 HydrophobicContact CG-CG2 3.66Å; W182-I205 HydrophobicContact CH2-CD1 4.02Å; W182-I205 HydrophobicContact CZ2-CD1 3.79Å; W182-I205 HydrophobicContact CZ3-CD1 4.43Å; W182-I205 HydrophobicContact CZ3-CG2 4.25Å; W182-A226 HydrophobicContact CH2-CB 4.1Å; W182-A226 HydrophobicContact CZ3-CB 4.23Å; W182-H233 AromaticContact CD1-CD2 3.99Å; W182-H233 AromaticContact CD2-CD2 3.96Å; W182-H233 AromaticContact CE2-CD2 3.44Å; W182-H233 VanDerWaalsContact CE2-CD2 3.44Å; W182-H233 HydrophobicContact CZ2-CB 4.19Å; W182-H233 AromaticContact CZ2-CD2 3.76Å; W182-H233 AromaticContact NE1-CD2 3.48Å; W182-H233 PolarHBondContact NE1-CD2 3.26Å; W182-H233 PolarHBondContact O-NE2 2.99Å; W182-T236 HydrophobicContact CH2-CG2 3.71Å; W182-T236 HydrophobicContact CZ2-CG2 4.09Å; W182-L260 HydrophobicContact CB-CD2 4.43Å; W182-L260 HydrophobicContact CG-CD1 4.35Å; W182-L260 HydrophobicContact CG-CD2 4.45Å; W182-R262 HydrophobicContact CB-CB 4.32Å
183E87.7Confident74.7Confident118 Ų11894.2 Ų94.255%0.55147%0.466SS*.  trans-102.2116.1-176-65.7-178-177.300112.6C185 V202 H203E183-C185 PolarHBondContact O-N 2.82Å; E183-V202 HydrophobicContact CB-CB 4.2Å; E183-V202 HydrophobicContact CB-CG2 4.43Å; E183-H203 PolarHBondContact N-ND1 3.01Å; E183-H203 VanDerWaalsContact N-ND1 3.15Å
184V76.4Confident72.6Confident24 Ų2499.4 Ų99.415%0.14550%0.496CS..  trans-84.795.3162.9-169.70000108W182 I186 A226 V227W182-V184 HydrophobicContact CD2-CG2 4.49Å; W182-V184 HydrophobicContact CE3-CG2 3.8Å; W182-V184 HydrophobicContact CH2-CG2 3.22Å; W182-V184 HydrophobicContact CZ2-CG2 4Å; W182-V184 HydrophobicContact CZ3-CB 4.21Å; W182-V184 HydrophobicContact CZ3-CG2 3.13Å; V184-I186 HydrophobicContact CG1-CD1 4.15Å; V184-I186 HydrophobicContact CG1-CG1 3.67Å; V184-I186 PolarHBondContact O-N 2.9Å; V184-A226 HydrophobicContact CG1-CB 4.32Å; V184-V227 HydrophobicContact CG1-CG2 3.87Å
185C69.3Low70.5Confident39 Ų39100.3 Ų100.326%0.26451%0.508SS..  trans-76.598.5170.1-166.10000110E183 C187 Q199 G201 V202 V227E183-C185 PolarHBondContact O-N 2.82Å; C185-C187 WeakPolarHBondContact CB-SG 3.36Å; C185-C187 PolarHBondContact O-N 2.77Å; C185-C187 WeakPolarHBondContact SG-CB 3.5Å; C185-C187 CovalentContact SG-SG 2.08Å; C185-C187 PolarHBondContact SG-SG 2.97Å; C185-Q199 WeakPolarHBondContact CB-O 3.44Å; C185-Q199 PolarHBondContact SG-O 2.86Å; C185-Q199 VanDerWaalsContact SG-O 3.42Å; C185-G201 PolarHBondContact O-N 2.68Å; C185-V202 HydrophobicContact CB-CG2 4.26Å; C185-V227 VanDerWaalsContact O-CG2 3.31Å; C185-V227 WeakPolarHBondContact O-CG2 3.5Å
186I58.2Low68.2Low101 Ų10199 Ų9952%0.51852%0.516SS..  trans-86.668.8165.1-49.7178.2000107.7V184 F188V184-I186 HydrophobicContact CG1-CD1 4.15Å; V184-I186 HydrophobicContact CG1-CG1 3.67Å; V184-I186 PolarHBondContact O-N 2.9Å; I186-F188 PolarHBondContact O-N 2.89Å; I186-F188 VanDerWaalsContact O-N 3.08Å
187C55.8Low66.1Low36 Ų36104.8 Ų104.824%0.24354%0.539CS..  trans-86.265.1175.59.40000109.5C185 Q199C185-C187 WeakPolarHBondContact CB-SG 3.36Å; C185-C187 PolarHBondContact O-N 2.77Å; C185-C187 WeakPolarHBondContact SG-CB 3.5Å; C185-C187 CovalentContact SG-SG 2.08Å; C185-C187 PolarHBondContact SG-SG 2.97Å; C187-Q199 PolarHBondContact SG-O 3.16Å
188F53.2Low63.8Low156 Ų156103.3 Ų103.368%0.68453%0.531SS*.SBendtrans-98.5-4.2177.9-137.8-94.9000115I186I186-F188 PolarHBondContact O-N 2.89Å; I186-F188 VanDerWaalsContact O-N 3.08Å
189Y45Very low61.9Low221 Ų221104.6 Ų104.687%0.86753%0.534SS*.SBendtrans-141.34176.1-83.5-77.2000116.9
190M48.1Very low60Low177 Ų177106.1 Ų106.187%0.87254%0.544SS*.SBendtrans-100.3106.1174.8-75.8-165.9-156.100111.4
191R48.7Very low58.6Low224 Ų224103.4 Ų103.485%0.84553%0.532SS*.  trans25.2124.5153-143177.1-169-159.62.6116.1V193R191-V193 PolarHBondContact O-N 2.93Å
192P48.9Very low58Low121 Ų121102.7 Ų102.779%0.78653%0.53SS*.  trans-51.1113.2176.721.1-31.4000109.1L194P192-L194 PolarHBondContact O-N 2.78Å; P192-L194 VanDerWaalsContact O-N 3.12Å
193V50.3Low57.9Low89 Ų89103.2 Ų103.254%0.53953%0.532SS..  trans-56.7122.5172.2-177.90000105.4R191 T195 G196R191-V193 PolarHBondContact O-N 2.93Å; V193-T195 WeakPolarHBondContact CG1-OG1 3.46Å; V193-T195 PolarHBondContact O-N 2.78Å; V193-G196 PolarHBondContact O-N 2.87Å
194L48.9Very low58.1Low186 Ų18697.6 Ų97.697%0.97451%0.506SS*.THydrogen-bonded Turntrans-53.7-8.5-179.8-85.9159.7000113.9P192P192-L194 PolarHBondContact O-N 2.78Å; P192-L194 VanDerWaalsContact O-N 3.12Å
195T52.3Low59Low110 Ų11096.6 Ų96.668%0.67550%0.5SS*.THydrogen-bonded Turntrans-964.5176.954.80000114.5V193 K197V193-T195 WeakPolarHBondContact CG1-OG1 3.46Å; V193-T195 PolarHBondContact O-N 2.78Å; T195-K197 PolarHBondContact O-N 2.89Å
196G46.4Very low60.2Low77 Ų7797.9 Ų97.979%0.79450%0.499SS*.SBendtrans648.3176.600000114.7V193V193-G196 PolarHBondContact O-N 2.87Å
197K48.9Very low62Low132 Ų13293 Ų9357%0.57448%0.475SS*.  trans-101.288.9-179.5-165.1179.5-178.1-1790109.1T195 Q199T195-K197 PolarHBondContact O-N 2.89Å; K197-Q199 HydrophobicContact CD-CG 4.29Å; K197-Q199 HydrophobicContact CG-CG 4.05Å; K197-Q199 PolarHBondContact O-N 2.92Å
198L45.7Very low64Low123 Ų12392.9 Ų92.964%0.64447%0.47SS*.  trans-71.7106.8168.3-175.961.5000108.1I200L198-I200 HydrophobicContact CD1-CD1 4.33Å; L198-I200 HydrophobicContact CD1-CG1 4.11Å; L198-I200 HydrophobicContact CD2-CD1 3.49Å; L198-I200 VanDerWaalsContact CD2-CD1 3.49Å; L198-I200 HydrophobicContact CD2-CG1 4.13Å; L198-I200 HydrophobicContact CG-CD1 3.77Å; L198-I200 HydrophobicContact CG-CG1 3.83Å; L198-I200 PolarHBondContact O-N 2.91Å
199Q50.7Low65.9Low108 Ų10885.7 Ų85.751%0.50544%0.439SS..  trans-9568174.6-65.8-172.9-72.200109.9C185 C187 K197C185-Q199 WeakPolarHBondContact CB-O 3.44Å; C185-Q199 PolarHBondContact SG-O 2.86Å; C185-Q199 VanDerWaalsContact SG-O 3.42Å; C187-Q199 PolarHBondContact SG-O 3.16Å; K197-Q199 HydrophobicContact CD-CG 4.29Å; K197-Q199 HydrophobicContact CG-CG 4.05Å; K197-Q199 PolarHBondContact O-N 2.92Å
200I53.5Low68.2Low65 Ų6580.5 Ų80.533%0.33342%0.422SS..  trans-67.4131.3167-73.8160.9000108L198 V227L198-I200 HydrophobicContact CD1-CD1 4.33Å; L198-I200 HydrophobicContact CD1-CG1 4.11Å; L198-I200 HydrophobicContact CD2-CD1 3.49Å; L198-I200 VanDerWaalsContact CD2-CD1 3.49Å; L198-I200 HydrophobicContact CD2-CG1 4.13Å; L198-I200 HydrophobicContact CG-CD1 3.77Å; L198-I200 HydrophobicContact CG-CG1 3.83Å; L198-I200 PolarHBondContact O-N 2.91Å; I200-V227 HydrophobicContact CG2-CB 3.75Å; I200-V227 HydrophobicContact CG2-CG1 3.72Å; I200-V227 HydrophobicContact CG2-CG2 3.9Å
201G61.3Low70.1Confident7 Ų773.5 Ų73.57%0.07239%0.388CS..  trans55.189.1175.900000112.6C185 H203 P223C185-G201 PolarHBondContact O-N 2.68Å; G201-H203 VanDerWaalsContact C-N 3.26Å; G201-H203 PolarHBondContact O-N 3.29Å; G201-P223 WeakPolarHBondContact CA-O 3.42Å; G201-P223 WeakPolarHBondContact O-CB 3.44Å
202V77.3Confident71.7Confident32 Ų3269.6 Ų69.619%0.19438%0.384CS..SBendtrans-65.7-37-177.7179.90000110.8E183 C185E183-V202 HydrophobicContact CB-CB 4.2Å; E183-V202 HydrophobicContact CB-CG2 4.43Å; C185-V202 HydrophobicContact CB-CG2 4.26Å
203H89.3Confident73.4Confident21 Ų2173.8 Ų73.810%0.09738%0.384CS..  trans-119.1129.1-173.5-61.1104.2000111.8W182 E183 G201 P223 R262 F263W182-H203 HydrophobicContact CB-CB 4.18Å; E183-H203 PolarHBondContact N-ND1 3.01Å; E183-H203 VanDerWaalsContact N-ND1 3.15Å; G201-H203 VanDerWaalsContact C-N 3.26Å; G201-H203 PolarHBondContact O-N 3.29Å; H203-P223 WeakPolarHBondContact O-CA 3.01Å; H203-R262 HydrophobicContact CB-CB 4.17Å; H203-F263 CarbonylContact C-O 3.43Å; H203-F263 WeakPolarHBondContact CA-O 3.22Å
204G92.3Very high75.1Confident1 Ų172 Ų721%0.0139%0.385CS..EExtended strand (participates in β ladder)trans-80.2153.4154.200000108.9Y221 R262 F263G204-Y221 WeakPolarHBondContact CA-O 3.35Å; G204-R262 CarbonylContact O-C 3.55Å; G204-R262 WeakPolarHBondContact O-CA 3.44Å; G204-F263 PolarHBondContact N-O 2.83Å; G204-F263 WeakPolarHBondContact O-CD1 3.35Å; G204-F263 PolarHBondContact O-N 2.9Å
205I94.6Very high77.1Confident2 Ų265.7 Ų65.71%0.0136%0.355CS..EExtended strand (participates in β ladder)trans-128.8130.5-175.859.4166.6000111.2W182 T220 Y221 T236 I237 L240 L260W182-I205 HydrophobicContact CB-CG2 4.02Å; W182-I205 HydrophobicContact CD2-CD1 4.49Å; W182-I205 HydrophobicContact CD2-CG2 3.5Å; W182-I205 VanDerWaalsContact CD2-CG2 3.5Å; W182-I205 HydrophobicContact CE3-CG2 3.64Å; W182-I205 HydrophobicContact CG-CG2 3.66Å; W182-I205 HydrophobicContact CH2-CD1 4.02Å; W182-I205 HydrophobicContact CZ2-CD1 3.79Å; W182-I205 HydrophobicContact CZ3-CD1 4.43Å; W182-I205 HydrophobicContact CZ3-CG2 4.25Å; I205-T220 VanDerWaalsContact O-CA 3.31Å; I205-T220 WeakPolarHBondContact O-CA 3.1Å; I205-T220 WeakPolarHBondContact O-CG2 3.16Å; I205-Y221 PolarHBondContact N-O 2.74Å; I205-Y221 PolarHBondContact O-N 3.33Å; I205-T236 HydrophobicContact CD1-CG2 3.7Å; I205-I237 HydrophobicContact CD1-CD1 3.91Å; I205-L240 HydrophobicContact CD1-CD2 3.86Å; I205-L240 HydrophobicContact CG1-CD2 3.94Å; I205-L260 HydrophobicContact CB-CD1 4.36Å; I205-L260 HydrophobicContact CB-CG 4.46Å; I205-L260 HydrophobicContact CD1-CD1 4.49Å; I205-L260 HydrophobicContact CG2-CD1 4.23Å; I205-L260 HydrophobicContact CG2-CD2 4.13Å; I205-L260 HydrophobicContact CG2-CG 4.46Å
206R95.5Very high79Confident66 Ų6666.4 Ų66.425%0.24935%0.349CS..EExtended strand (participates in β ladder)trans-112.8124.7168173.1177.9169.3-169.5-3.7107.7E208 A219 T220 I261 F263R206-E208 IonicContact CZ-OE1 3.02Å; R206-E208 VanDerWaalsContact CZ-OE1 3.32Å; R206-E208 IonicContact NE-OE1 2.78Å; R206-E208 IonicContact NH2-OE1 3.88Å; R206-E208 PolarHBondContact NH2-OE1 2.91Å; R206-A219 WeakPolarHBondContact CA-O 3.49Å; R206-T220 HydrophobicContact CB-CG2 4.18Å; R206-I261 HydrophobicContact CB-CB 4.39Å; R206-I261 PolarHBondContact N-O 3.2Å; R206-I261 PolarHBondContact O-N 2.86Å; R206-F263 HydrophobicContact CB-CE1 4.4Å
207I96.2Very high81.3Confident0 Ų066.8 Ų66.80%033%0.329CS..EExtended strand (participates in β ladder)trans-104146.317464.3173.5000110.5F209 A218 A219 I237 L240 L241 V258 C259 L260I207-F209 HydrophobicContact CD1-CD1 3.98Å; I207-F209 HydrophobicContact CD1-CE1 4.01Å; I207-F209 HydrophobicContact CG1-CD1 4.13Å; I207-F209 HydrophobicContact CG1-CE1 4.27Å; I207-A218 WeakPolarHBondContact O-CA 3.43Å; I207-A218 WeakPolarHBondContact O-CB 3.24Å; I207-A219 HydrophobicContact CG1-CB 4.37Å; I207-A219 PolarHBondContact N-O 2.85Å; I207-A219 PolarHBondContact O-N 2.92Å; I207-A219 VanDerWaalsContact O-N 3.11Å; I207-I237 HydrophobicContact CG2-CD1 3.93Å; I207-L240 HydrophobicContact CB-CD2 4.29Å; I207-L240 HydrophobicContact CD1-CB 3.89Å; I207-L240 HydrophobicContact CD1-CD2 3.92Å; I207-L240 HydrophobicContact CD1-CG 3.6Å; I207-L240 HydrophobicContact CG1-CD2 3.71Å; I207-L240 HydrophobicContact CG1-CG 3.73Å; I207-L240 HydrophobicContact CG2-CD2 3.84Å; I207-L241 HydrophobicContact CD1-CD2 3.72Å; I207-L241 HydrophobicContact CD1-CG 3.87Å; I207-V258 HydrophobicContact CB-CG1 3.54Å; I207-V258 HydrophobicContact CD1-CG1 4.45Å; I207-V258 HydrophobicContact CG2-CG1 3.68Å; I207-C259 CarbonylContact C-O 3.56Å; I207-C259 WeakPolarHBondContact CA-O 3.47Å; I207-L260 HydrophobicContact CG2-CD1 4.32Å; I207-L260 HydrophobicContact CG2-CG 4.38Å
208E96.1Very high83.5Confident32 Ų3263 Ų6315%0.1532%0.322CS..EExtended strand (participates in β ladder)trans-124.4131.5169.3-52.5-164.7151.500109.4R206 K216 K217 A218 C259R206-E208 IonicContact CZ-OE1 3.02Å; R206-E208 VanDerWaalsContact CZ-OE1 3.32Å; R206-E208 IonicContact NE-OE1 2.78Å; R206-E208 IonicContact NH2-OE1 3.88Å; R206-E208 PolarHBondContact NH2-OE1 2.91Å; E208-K216 WeakPolarHBondContact OE2-CE 3.2Å; E208-K216 IonicContact OE2-NZ 2.85Å; E208-K216 PolarHBondContact OE2-NZ 3.15Å; E208-K217 WeakPolarHBondContact CA-O 3.25Å; E208-A218 HydrophobicContact CG-CB 4.31Å; E208-C259 HydrophobicContact CB-CB 4.3Å; E208-C259 PolarHBondContact N-O 2.75Å; E208-C259 PolarHBondContact O-N 3.17Å
209F95.1Very high85.8Confident6 Ų657.5 Ų57.53%0.02629%0.294CS..EExtended strand (participates in β ladder)trans-150.9164-177.263.1-85.9000110.9I207 K217 L241 Y246 F254 V258I207-F209 HydrophobicContact CD1-CD1 3.98Å; I207-F209 HydrophobicContact CD1-CE1 4.01Å; I207-F209 HydrophobicContact CG1-CD1 4.13Å; I207-F209 HydrophobicContact CG1-CE1 4.27Å; F209-K217 HydrophobicContact CD2-CB 4.29Å; F209-K217 HydrophobicContact CE1-CB 4.04Å; F209-K217 HydrophobicContact CE2-CB 3.77Å; F209-K217 HydrophobicContact CE2-CG 4.33Å; F209-K217 HydrophobicContact CZ-CB 3.65Å; F209-K217 HydrophobicContact CZ-CG 4.49Å; F209-K217 PolarHBondContact N-O 2.77Å; F209-K217 PolarHBondContact O-N 2.7Å; F209-L241 HydrophobicContact CB-CD2 4.28Å; F209-L241 HydrophobicContact CD1-CD2 3.51Å; F209-L241 HydrophobicContact CD2-CD2 3.95Å; F209-L241 HydrophobicContact CE1-CD2 3.69Å; F209-L241 HydrophobicContact CE2-CD2 4.12Å; F209-L241 HydrophobicContact CG-CD2 3.64Å; F209-L241 HydrophobicContact CZ-CD2 3.98Å; F209-Y246 HydrophobicContact CE2-CD2 4.36Å; F209-Y246 HydrophobicContact CE2-CG 4.44Å; F209-F254 HydrophobicContact CD2-CZ 4.17Å; F209-V258 HydrophobicContact CB-CG2 4.34Å
210H92.3Very high87.9Confident112 Ų11253.2 Ų53.252%0.51928%0.276SS..EExtended strand (participates in β ladder)trans-103.1135.5172.5-63.184.7000109.1S215H210-S215 WeakPolarHBondContact CA-O 3.45Å
211N87.4Confident89.7Confident30 Ų3051.5 Ų51.516%0.1627%0.265CS..  trans-75.3175.5169.869.72.5000111R213 G214 S215N211-R213 PolarHBondContact O-N 3.4Å; N211-R213 VanDerWaalsContact O-N 3.15Å; N211-R213 WeakPolarHBondContact OD1-CA 3.46Å; N211-R213 WeakPolarHBondContact OD1-CB 3.22Å; N211-R213 PolarHBondContact OD1-N 2.95Å; N211-R213 VanDerWaalsContact OD1-N 3.09Å; N211-G214 PolarHBondContact O-N 3.42Å; N211-G214 PolarHBondContact OD1-N 2.92Å; N211-G214 VanDerWaalsContact OD1-N 3.09Å; N211-S215 PolarHBondContact N-O 3.15Å; N211-S215 WeakPolarHBondContact OD1-CA 3.44Å; N211-S215 WeakPolarHBondContact OD1-CB 3.29Å; N211-S215 PolarHBondContact OD1-N 3.3Å; N211-S215 PolarHBondContact OD1-O 3.36Å
212D83.7Confident91Very high141 Ų14152.3 Ų52.375%0.75427%0.268SS*.THydrogen-bonded Turntrans-52.1-29.7172.358.3-22.7000113.9G214D212-G214 VanDerWaalsContact C-N 3.29Å
213R84.7Confident91.5Very high209 Ų20951.1 Ų51.179%0.78926%0.261SS*.THydrogen-bonded Turntrans-85.35.1176.6-57.4-178.1-178.7-156-3.4113.8N211 S215N211-R213 PolarHBondContact O-N 3.4Å; N211-R213 VanDerWaalsContact O-N 3.15Å; N211-R213 WeakPolarHBondContact OD1-CA 3.46Å; N211-R213 WeakPolarHBondContact OD1-CB 3.22Å; N211-R213 PolarHBondContact OD1-N 2.95Å; N211-R213 VanDerWaalsContact OD1-N 3.09Å; R213-S215 PolarHBondContact O-N 3.33Å
214G85Confident91.2Very high53 Ų5351.7 Ų51.755%0.54626%0.263SS..SBendtrans71.46.6-177.300000114.8N211 D212N211-G214 PolarHBondContact O-N 3.42Å; N211-G214 PolarHBondContact OD1-N 2.92Å; N211-G214 VanDerWaalsContact OD1-N 3.09Å; D212-G214 VanDerWaalsContact C-N 3.29Å
215S90.3Very high90.9Very high52 Ų5253.1 Ų53.136%0.36427%0.272SS..  trans-76.1128.1174.9-46.60000110.3H210 N211 R213H210-S215 WeakPolarHBondContact CA-O 3.45Å; N211-S215 PolarHBondContact N-O 3.15Å; N211-S215 WeakPolarHBondContact OD1-CA 3.44Å; N211-S215 WeakPolarHBondContact OD1-CB 3.29Å; N211-S215 PolarHBondContact OD1-N 3.3Å; N211-S215 PolarHBondContact OD1-O 3.36Å; R213-S215 PolarHBondContact O-N 3.33Å
216K93.5Very high90.6Very high125 Ų12553.2 Ų53.254%0.54327%0.273SS..EExtended strand (participates in β ladder)trans-67133.1172.9-168.9174.6-179.2179.80110.1E208E208-K216 WeakPolarHBondContact OE2-CE 3.2Å; E208-K216 IonicContact OE2-NZ 2.85Å; E208-K216 PolarHBondContact OE2-NZ 3.15Å
217K95.2Very high90.2Very high86 Ų8651 Ų5137%0.37427%0.267SS..EExtended strand (participates in β ladder)trans-129.6154.9175.9-65.1-62.7177.4-1690109.4E208 F209E208-K217 WeakPolarHBondContact CA-O 3.25Å; F209-K217 HydrophobicContact CD2-CB 4.29Å; F209-K217 HydrophobicContact CE1-CB 4.04Å; F209-K217 HydrophobicContact CE2-CB 3.77Å; F209-K217 HydrophobicContact CE2-CG 4.33Å; F209-K217 HydrophobicContact CZ-CB 3.65Å; F209-K217 HydrophobicContact CZ-CG 4.49Å; F209-K217 PolarHBondContact N-O 2.77Å; F209-K217 PolarHBondContact O-N 2.7Å
218A94.1Very high89.7Confident51 Ų5157.4 Ų57.442%0.42130%0.297SS..EExtended strand (participates in β ladder)trans-140.1149.817400000110.1I207 E208I207-A218 WeakPolarHBondContact O-CA 3.43Å; I207-A218 WeakPolarHBondContact O-CB 3.24Å; E208-A218 HydrophobicContact CG-CB 4.31Å
219A94.5Very high89.3Confident8 Ų861.1 Ų61.17%0.06631%0.314CS..EExtended strand (participates in β ladder)trans-148.3147.6172.400000109.5R206 I207 L240R206-A219 WeakPolarHBondContact CA-O 3.49Å; I207-A219 HydrophobicContact CG1-CB 4.37Å; I207-A219 PolarHBondContact N-O 2.85Å; I207-A219 PolarHBondContact O-N 2.92Å; I207-A219 VanDerWaalsContact O-N 3.11Å; A219-L240 HydrophobicContact CB-CD1 3.46Å; A219-L240 VanDerWaalsContact CB-CD1 3.46Å; A219-L240 HydrophobicContact CB-CG 3.87Å; A219-L240 WeakPolarHBondContact CB-O 3.34Å
220T93.3Very high88.9Confident18 Ų1863.2 Ų63.211%0.1134%0.337CS..EExtended strand (participates in β ladder)trans-126.8144.5-179.8-49.50000112.3F129 I205 R206 K243 F263F129-T220 HydrophobicContact CE1-CG2 3.44Å; F129-T220 VanDerWaalsContact CE1-CG2 3.44Å; F129-T220 HydrophobicContact CE2-CG2 4.01Å; F129-T220 WeakPolarHBondContact CE2-OG1 3.37Å; F129-T220 HydrophobicContact CZ-CG2 3.07Å; F129-T220 WeakPolarHBondContact CZ-OG1 3.48Å; I205-T220 VanDerWaalsContact O-CA 3.31Å; I205-T220 WeakPolarHBondContact O-CA 3.1Å; I205-T220 WeakPolarHBondContact O-CG2 3.16Å; R206-T220 HydrophobicContact CB-CG2 4.18Å; T220-K243 PolarHBondContact O-NZ 3.32Å; T220-F263 HydrophobicContact CG2-CE1 3.55Å; T220-F263 HydrophobicContact CG2-CZ 3.56Å
221Y92.4Very high88.8Confident29 Ų2960.4 Ų60.411%0.11432%0.322CS..EExtended strand (participates in β ladder)trans-117.5140.5159.2-77-41000111G204 I205 V225 W231 T236 S239 L240 K243 F263G204-Y221 WeakPolarHBondContact CA-O 3.35Å; I205-Y221 PolarHBondContact N-O 2.74Å; I205-Y221 PolarHBondContact O-N 3.33Å; Y221-V225 HydrophobicContact CD1-CB 4.01Å; Y221-V225 HydrophobicContact CD1-CG1 3.52Å; Y221-V225 HydrophobicContact CD1-CG2 4.14Å; Y221-V225 HydrophobicContact CD2-CG1 4.4Å; Y221-V225 HydrophobicContact CE1-CG1 3.8Å; Y221-V225 HydrophobicContact CG-CB 4.11Å; Y221-V225 HydrophobicContact CG-CG1 3.86Å; Y221-W231 HydrophobicContact CD2-CZ3 4.35Å; Y221-W231 HydrophobicContact CE2-CE3 4.41Å; Y221-W231 HydrophobicContact CE2-CH2 4.48Å; Y221-W231 AromaticContact CE2-CZ3 3.62Å; Y221-W231 HydrophobicContact CE2-CZ3 3.62Å; Y221-W231 AromaticContact CZ-CZ3 3.8Å; Y221-T236 HydrophobicContact CD2-CG2 3.96Å; Y221-S239 PolarHBondContact OH-OG 3.5Å; Y221-S239 VanDerWaalsContact OH-OG 3.09Å; Y221-L240 HydrophobicContact CD1-CD1 4.23Å; Y221-L240 HydrophobicContact CD2-CB 3.9Å; Y221-L240 HydrophobicContact CD2-CD1 3.57Å; Y221-L240 HydrophobicContact CD2-CD2 4.11Å; Y221-L240 HydrophobicContact CD2-CG 4.06Å; Y221-L240 HydrophobicContact CE1-CD1 4.33Å; Y221-L240 HydrophobicContact CE2-CB 3.66Å; Y221-L240 HydrophobicContact CE2-CD1 3.64Å; Y221-L240 HydrophobicContact CE2-CG 4.17Å; Y221-L240 HydrophobicContact CG-CD1 3.85Å; Y221-K243 HydrophobicContact CD1-CD 4.3Å; Y221-K243 HydrophobicContact CE1-CD 3.45Å; Y221-K243 VanDerWaalsContact CE1-CD 3.45Å; Y221-F263 WeakPolarHBondContact O-CZ 3.37Å
222L88.4Confident88.9Confident25 Ų2562.6 Ų62.613%0.13133%0.334CS..  trans-73.4158.3170.1-63.7179.7000109.7L170 E224 V225 F263L170-L222 HydrophobicContact CD2-CD2 3.99Å; L222-E224 HydrophobicContact CB-CG 4.43Å; L222-E224 WeakPolarHBondContact CB-OE2 3.33Å; L222-E224 PolarHBondContact O-N 3.19Å; L222-E224 VanDerWaalsContact O-N 3.13Å; L222-V225 HydrophobicContact CB-CG2 4.24Å; L222-V225 PolarHBondContact O-N 2.85Å; L222-F263 HydrophobicContact CD2-CE2 4.24Å; L222-F263 HydrophobicContact CD2-CZ 4.33Å
223P87.3Confident89.3Confident7 Ų758.4 Ų58.45%0.04531%0.31CS..Hα-helixtrans-57-31.8-173.5-13.217.5000114.6G201 H203 V225 S265G201-P223 WeakPolarHBondContact CA-O 3.42Å; G201-P223 WeakPolarHBondContact O-CB 3.44Å; H203-P223 WeakPolarHBondContact O-CA 3.01Å; P223-V225 PolarHBondContact O-N 3.3Å; P223-S265 WeakPolarHBondContact CG-OG 3.26Å
224E83.4Confident89.7Confident32 Ų3251.6 Ų51.615%0.1529%0.288CS..Hα-helixtrans-68.8-27.6178.157.3-97.5-125.700114.2L222 A226 V227 E228 K267L222-E224 HydrophobicContact CB-CG 4.43Å; L222-E224 WeakPolarHBondContact CB-OE2 3.33Å; L222-E224 PolarHBondContact O-N 3.19Å; L222-E224 VanDerWaalsContact O-N 3.13Å; E224-A226 PolarHBondContact O-N 3.29Å; E224-V227 PolarHBondContact O-N 3.31Å; E224-E228 WeakPolarHBondContact O-CB 3.48Å; E224-E228 WeakPolarHBondContact O-CG 3.21Å; E224-E228 PolarHBondContact O-N 3.39Å; E224-K267 IonicContact OE1-NZ 3.26Å; E224-K267 PolarHBondContact OE1-NZ 3.11Å
225V86.8Confident90.2Very high31 Ų3153.6 Ų53.619%0.18828%0.283CS..Hα-helixtrans-66.3-45.5-165.7179.40000112.3Y221 L222 P223 V227 E228 Q229 W231Y221-V225 HydrophobicContact CD1-CB 4.01Å; Y221-V225 HydrophobicContact CD1-CG1 3.52Å; Y221-V225 HydrophobicContact CD1-CG2 4.14Å; Y221-V225 HydrophobicContact CD2-CG1 4.4Å; Y221-V225 HydrophobicContact CE1-CG1 3.8Å; Y221-V225 HydrophobicContact CG-CB 4.11Å; Y221-V225 HydrophobicContact CG-CG1 3.86Å; L222-V225 HydrophobicContact CB-CG2 4.24Å; L222-V225 PolarHBondContact O-N 2.85Å; P223-V225 PolarHBondContact O-N 3.3Å; V225-V227 VanDerWaalsContact C-N 3.28Å; V225-V227 PolarHBondContact O-N 2.96Å; V225-E228 PolarHBondContact O-N 3.2Å; V225-Q229 HydrophobicContact CG1-CG 4.41Å; V225-Q229 WeakPolarHBondContact O-CB 3.47Å; V225-Q229 VanDerWaalsContact O-CG 3.22Å; V225-Q229 WeakPolarHBondContact O-CG 3.47Å; V225-Q229 PolarHBondContact O-N 2.89Å; V225-Q229 VanDerWaalsContact O-N 3.13Å; V225-W231 HydrophobicContact CG1-CZ3 4.31Å
226A88.1Confident90.3Very high5 Ų551.1 Ų51.14%0.04127%0.266CS..Hα-helixtrans-62.1-39.7179.900000111.3W182 V184 E224 Q229 G230 W231 T236W182-A226 HydrophobicContact CH2-CB 4.1Å; W182-A226 HydrophobicContact CZ3-CB 4.23Å; V184-A226 HydrophobicContact CG1-CB 4.32Å; E224-A226 PolarHBondContact O-N 3.29Å; A226-Q229 PolarHBondContact O-N 3.25Å; A226-G230 PolarHBondContact O-N 3.03Å; A226-G230 VanDerWaalsContact O-N 3.11Å; A226-W231 PolarHBondContact O-N 2.79Å; A226-T236 HydrophobicContact CB-CG2 3.92Å
227V86.6Confident90.5Very high19 Ų1945.1 Ų45.112%0.11524%0.24CC..Hα-helixtrans-73-42.8-178.6-174.80000111.5V184 C185 I200 E224 V225 Q229 G230V184-V227 HydrophobicContact CG1-CG2 3.87Å; C185-V227 VanDerWaalsContact O-CG2 3.31Å; C185-V227 WeakPolarHBondContact O-CG2 3.5Å; I200-V227 HydrophobicContact CG2-CB 3.75Å; I200-V227 HydrophobicContact CG2-CG1 3.72Å; I200-V227 HydrophobicContact CG2-CG2 3.9Å; E224-V227 PolarHBondContact O-N 3.31Å; V225-V227 VanDerWaalsContact C-N 3.28Å; V225-V227 PolarHBondContact O-N 2.96Å; V227-Q229 PolarHBondContact O-N 3.31Å; V227-G230 PolarHBondContact O-N 2.75Å
228E85.9Confident90.5Very high135 Ų13542.9 Ų42.963%0.63123%0.232SC*.Hα-helixtrans-60.8-33176.4-76.5179.1179.600112.5E224 V225E224-E228 WeakPolarHBondContact O-CB 3.48Å; E224-E228 WeakPolarHBondContact O-CG 3.21Å; E224-E228 PolarHBondContact O-N 3.39Å; V225-E228 PolarHBondContact O-N 3.2Å
229Q87.2Confident90.6Very high110 Ų11041.9 Ų41.951%0.51422%0.222SC..THydrogen-bonded Turntrans-86.3-9.5177.1-60.6-61.3-47.200113.4V225 A226 V227 W231V225-Q229 HydrophobicContact CG1-CG 4.41Å; V225-Q229 WeakPolarHBondContact O-CB 3.47Å; V225-Q229 VanDerWaalsContact O-CG 3.22Å; V225-Q229 WeakPolarHBondContact O-CG 3.47Å; V225-Q229 PolarHBondContact O-N 2.89Å; V225-Q229 VanDerWaalsContact O-N 3.13Å; A226-Q229 PolarHBondContact O-N 3.25Å; V227-Q229 PolarHBondContact O-N 3.31Å; Q229-W231 HydrophobicContact CB-CD2 3.44Å; Q229-W231 VanDerWaalsContact CB-CD2 3.44Å; Q229-W231 VanDerWaalsContact CB-CE2 3.4Å; Q229-W231 HydrophobicContact CB-CE3 3.87Å; Q229-W231 HydrophobicContact CB-CG 3.75Å; Q229-W231 HydrophobicContact CB-CH2 4.19Å; Q229-W231 HydrophobicContact CB-CZ2 3.81Å; Q229-W231 HydrophobicContact CB-CZ3 4.22Å; Q229-W231 HydrophobicContact CG-CD2 4.07Å; Q229-W231 HydrophobicContact CG-CE3 4.09Å; Q229-W231 HydrophobicContact CG-CH2 3.74Å; Q229-W231 HydrophobicContact CG-CZ2 3.73Å; Q229-W231 HydrophobicContact CG-CZ3 3.92Å; Q229-W231 PolarHBondContact O-N 3.11Å
230G87.1Confident90.7Very high49 Ų4941.5 Ų41.551%0.50522%0.219SC..THydrogen-bonded Turntrans63.429.8-173.800000113.1A226 V227A226-G230 PolarHBondContact O-N 3.03Å; A226-G230 VanDerWaalsContact O-N 3.11Å; V227-G230 PolarHBondContact O-N 2.75Å
231W89.8Confident90.8Very high54 Ų5440.7 Ų40.721%0.20521%0.214CC..  trans-82.3137.3-179.8-68.3-20.6000111.4Y221 V225 A226 Q229 Q235 T236 S239Y221-W231 HydrophobicContact CD2-CZ3 4.35Å; Y221-W231 HydrophobicContact CE2-CE3 4.41Å; Y221-W231 HydrophobicContact CE2-CH2 4.48Å; Y221-W231 AromaticContact CE2-CZ3 3.62Å; Y221-W231 HydrophobicContact CE2-CZ3 3.62Å; Y221-W231 AromaticContact CZ-CZ3 3.8Å; V225-W231 HydrophobicContact CG1-CZ3 4.31Å; A226-W231 PolarHBondContact O-N 2.79Å; Q229-W231 HydrophobicContact CB-CD2 3.44Å; Q229-W231 VanDerWaalsContact CB-CD2 3.44Å; Q229-W231 VanDerWaalsContact CB-CE2 3.4Å; Q229-W231 HydrophobicContact CB-CE3 3.87Å; Q229-W231 HydrophobicContact CB-CG 3.75Å; Q229-W231 HydrophobicContact CB-CH2 4.19Å; Q229-W231 HydrophobicContact CB-CZ2 3.81Å; Q229-W231 HydrophobicContact CB-CZ3 4.22Å; Q229-W231 HydrophobicContact CG-CD2 4.07Å; Q229-W231 HydrophobicContact CG-CE3 4.09Å; Q229-W231 HydrophobicContact CG-CH2 3.74Å; Q229-W231 HydrophobicContact CG-CZ2 3.73Å; Q229-W231 HydrophobicContact CG-CZ3 3.92Å; Q229-W231 PolarHBondContact O-N 3.11Å; W231-Q235 HydrophobicContact CB-CB 3.87Å; W231-Q235 HydrophobicContact CG-CB 3.96Å; W231-T236 VanDerWaalsContact CB-OG1 3.22Å; W231-T236 WeakPolarHBondContact CB-OG1 3.18Å; W231-T236 HydrophobicContact CE3-CG2 4.36Å; W231-S239 WeakPolarHBondContact CH2-OG 3.5Å; W231-S239 VanDerWaalsContact CZ3-OG 3.3Å; W231-S239 WeakPolarHBondContact CZ3-OG 3.37Å
232D90Very high91Very high76 Ų7645 Ų4541%0.40623%0.23SC..  trans-74.4179.7161.67022000111.1I234 Q235 T236D232-I234 VanDerWaalsContact C-N 3.33Å; D232-I234 PolarHBondContact O-N 2.89Å; D232-I234 PolarHBondContact OD1-N 2.99Å; D232-Q235 VanDerWaalsContact N-OE1 3.13Å; D232-Q235 WeakPolarHBondContact OD1-CB 3.34Å; D232-Q235 VanDerWaalsContact OD1-CG 3.29Å; D232-Q235 WeakPolarHBondContact OD1-CG 3.21Å; D232-Q235 PolarHBondContact OD1-N 2.69Å; D232-T236 WeakPolarHBondContact O-CB 3.47Å; D232-T236 PolarHBondContact O-N 2.7Å; D232-T236 PolarHBondContact O-OG1 3.47Å
233H90.6Very high91.3Very high53 Ų5349.6 Ų49.625%0.24525%0.249CC..Hα-helixtrans-58-43.7179.1-64.174.3000112.8M180 W182 T236 I237M180-H233 HydrophobicContact CE-CB 4.5Å; M180-H233 PolarHBondContact O-CD2 2.81Å; M180-H233 PolarHBondContact O-NE2 2.92Å; M180-H233 HydrophobicContact SD-CB 3.35Å; M180-H233 WeakPolarHBondContact SD-CB 3.2Å; W182-H233 AromaticContact CD1-CD2 3.99Å; W182-H233 AromaticContact CD2-CD2 3.96Å; W182-H233 AromaticContact CE2-CD2 3.44Å; W182-H233 VanDerWaalsContact CE2-CD2 3.44Å; W182-H233 HydrophobicContact CZ2-CB 4.19Å; W182-H233 AromaticContact CZ2-CD2 3.76Å; W182-H233 AromaticContact NE1-CD2 3.48Å; W182-H233 PolarHBondContact NE1-CD2 3.26Å; W182-H233 PolarHBondContact O-NE2 2.99Å; H233-T236 PolarHBondContact O-N 2.87Å; H233-I237 WeakPolarHBondContact O-CG1 3.48Å; H233-I237 PolarHBondContact O-N 3.46Å
234I94Very high91.6Very high66 Ų6649.9 Ų49.934%0.33825%0.253SS..Hα-helixtrans-66.2-50.3-177-64.9176.5000110.2M180 D232 T236 I237 D238M180-I234 HydrophobicContact CE-CD1 4.13Å; M180-I234 HydrophobicContact CE-CG1 3.61Å; D232-I234 VanDerWaalsContact C-N 3.33Å; D232-I234 PolarHBondContact O-N 2.89Å; D232-I234 PolarHBondContact OD1-N 2.99Å; I234-T236 VanDerWaalsContact C-N 3.27Å; I234-T236 PolarHBondContact O-N 2.82Å; I234-I237 PolarHBondContact O-N 2.91Å; I234-D238 WeakPolarHBondContact O-CB 3.48Å; I234-D238 PolarHBondContact O-N 2.76Å
235Q94.7Very high92Very high94 Ų9450.6 Ų50.644%0.43927%0.269SS..Hα-helixtrans-60-40.3179.2-69.2174.7-35.400111.1W231 D232 S239W231-Q235 HydrophobicContact CB-CB 3.87Å; W231-Q235 HydrophobicContact CG-CB 3.96Å; D232-Q235 VanDerWaalsContact N-OE1 3.13Å; D232-Q235 WeakPolarHBondContact OD1-CB 3.34Å; D232-Q235 VanDerWaalsContact OD1-CG 3.29Å; D232-Q235 WeakPolarHBondContact OD1-CG 3.21Å; D232-Q235 PolarHBondContact OD1-N 2.69Å; Q235-S239 WeakPolarHBondContact O-CB 3.49Å; Q235-S239 PolarHBondContact O-N 3.09Å
236T94.2Very high92.3Very high0 Ų050.3 Ų50.30%027%0.265CS..Hα-helixtrans-64.1-48.7177.6-54.60000111.1W182 I205 Y221 A226 W231 D232 H233 I234 S239 L240W182-T236 HydrophobicContact CH2-CG2 3.71Å; W182-T236 HydrophobicContact CZ2-CG2 4.09Å; I205-T236 HydrophobicContact CD1-CG2 3.7Å; Y221-T236 HydrophobicContact CD2-CG2 3.96Å; A226-T236 HydrophobicContact CB-CG2 3.92Å; W231-T236 VanDerWaalsContact CB-OG1 3.22Å; W231-T236 WeakPolarHBondContact CB-OG1 3.18Å; W231-T236 HydrophobicContact CE3-CG2 4.36Å; D232-T236 WeakPolarHBondContact O-CB 3.47Å; D232-T236 PolarHBondContact O-N 2.7Å; D232-T236 PolarHBondContact O-OG1 3.47Å; H233-T236 PolarHBondContact O-N 2.87Å; I234-T236 VanDerWaalsContact C-N 3.27Å; I234-T236 PolarHBondContact O-N 2.82Å; T236-S239 PolarHBondContact O-N 3.15Å; T236-L240 WeakPolarHBondContact O-CB 3.44Å; T236-L240 PolarHBondContact O-N 3.31Å
237I95.9Very high92.5Very high0 Ų059.3 Ų59.30%030%0.303CS..Hα-helixtrans-64.6-43.8-179.5-65.9-66.8000111Y179 I205 I207 H233 I234 S239 L240 L241 R255 L260Y179-I237 HydrophobicContact CD2-CG1 4.21Å; I205-I237 HydrophobicContact CD1-CD1 3.91Å; I207-I237 HydrophobicContact CG2-CD1 3.93Å; H233-I237 WeakPolarHBondContact O-CG1 3.48Å; H233-I237 PolarHBondContact O-N 3.46Å; I234-I237 PolarHBondContact O-N 2.91Å; I237-S239 PolarHBondContact O-N 2.95Å; I237-L240 PolarHBondContact O-N 2.88Å; I237-L241 HydrophobicContact CG2-CD1 4.14Å; I237-L241 HydrophobicContact CG2-CG 4.45Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 WeakPolarHBondContact O-CG 3.4Å; I237-L241 PolarHBondContact O-N 3.25Å; I237-R255 HydrophobicContact CG2-CG 4.44Å; I237-L260 HydrophobicContact CD1-CD1 3.67Å
238D96.4Very high92.7Very high39 Ų3959.8 Ų59.821%0.20931%0.312CS..Hα-helixtrans-61.9-46.9178.1-75.19.1000111.2I234 L240 L241 R242 I250 R255I234-D238 WeakPolarHBondContact O-CB 3.48Å; I234-D238 PolarHBondContact O-N 2.76Å; D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 3.03Å; D238-L241 PolarHBondContact O-N 2.85Å; D238-R242 WeakPolarHBondContact O-CG 3.47Å; D238-R242 PolarHBondContact O-N 2.88Å; D238-I250 HydrophobicContact CB-CD1 3.94Å; D238-I250 WeakPolarHBondContact OD1-CG2 3.44Å; D238-R255 IonicContact OD1-CZ 3.36Å; D238-R255 IonicContact OD1-NE 2.74Å; D238-R255 PolarHBondContact OD1-NE 3.28Å; D238-R255 IonicContact OD1-NH2 3.34Å; D238-R255 PolarHBondContact OD1-NH2 2.85Å; D238-R255 VanDerWaalsContact OD1-NH2 3.14Å; D238-R255 IonicContact OD2-CZ 3.73Å; D238-R255 IonicContact OD2-NE 3.84Å; D238-R255 IonicContact OD2-NH2 2.67Å; D238-R255 PolarHBondContact OD2-NH2 3.42Å
239S96.3Very high93Very high30 Ų3060.6 Ų60.621%0.2132%0.315CS..Hα-helixtrans-59.8-42.4175.6-175.90000111.7Y221 W231 Q235 T236 I237 R242 K243Y221-S239 PolarHBondContact OH-OG 3.5Å; Y221-S239 VanDerWaalsContact OH-OG 3.09Å; W231-S239 WeakPolarHBondContact CH2-OG 3.5Å; W231-S239 VanDerWaalsContact CZ3-OG 3.3Å; W231-S239 WeakPolarHBondContact CZ3-OG 3.37Å; Q235-S239 WeakPolarHBondContact O-CB 3.49Å; Q235-S239 PolarHBondContact O-N 3.09Å; T236-S239 PolarHBondContact O-N 3.15Å; I237-S239 PolarHBondContact O-N 2.95Å; S239-R242 WeakPolarHBondContact O-CB 3.06Å; S239-R242 PolarHBondContact O-N 3.43Å; S239-K243 WeakPolarHBondContact O-CB 3.35Å; S239-K243 PolarHBondContact O-N 3.09Å
240L95.5Very high93.3Very high0 Ų056.1 Ų56.10%030%0.295CS..Hα-helixtrans-69.3-37.2-179.3-168.855.7000112.4I205 I207 A219 Y221 T236 I237 D238 K243 G244I205-L240 HydrophobicContact CD1-CD2 3.86Å; I205-L240 HydrophobicContact CG1-CD2 3.94Å; I207-L240 HydrophobicContact CB-CD2 4.29Å; I207-L240 HydrophobicContact CD1-CB 3.89Å; I207-L240 HydrophobicContact CD1-CD2 3.92Å; I207-L240 HydrophobicContact CD1-CG 3.6Å; I207-L240 HydrophobicContact CG1-CD2 3.71Å; I207-L240 HydrophobicContact CG1-CG 3.73Å; I207-L240 HydrophobicContact CG2-CD2 3.84Å; A219-L240 HydrophobicContact CB-CD1 3.46Å; A219-L240 VanDerWaalsContact CB-CD1 3.46Å; A219-L240 HydrophobicContact CB-CG 3.87Å; A219-L240 WeakPolarHBondContact CB-O 3.34Å; Y221-L240 HydrophobicContact CD1-CD1 4.23Å; Y221-L240 HydrophobicContact CD2-CB 3.9Å; Y221-L240 HydrophobicContact CD2-CD1 3.57Å; Y221-L240 HydrophobicContact CD2-CD2 4.11Å; Y221-L240 HydrophobicContact CD2-CG 4.06Å; Y221-L240 HydrophobicContact CE1-CD1 4.33Å; Y221-L240 HydrophobicContact CE2-CB 3.66Å; Y221-L240 HydrophobicContact CE2-CD1 3.64Å; Y221-L240 HydrophobicContact CE2-CG 4.17Å; Y221-L240 HydrophobicContact CG-CD1 3.85Å; T236-L240 WeakPolarHBondContact O-CB 3.44Å; T236-L240 PolarHBondContact O-N 3.31Å; I237-L240 PolarHBondContact O-N 2.88Å; D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 3.03Å; L240-K243 HydrophobicContact CD1-CD 4.24Å; L240-K243 WeakPolarHBondContact O-CB 3.31Å; L240-K243 PolarHBondContact O-N 3.5Å; L240-G244 PolarHBondContact O-N 3.09Å
241L96.5Very high93.7Very high0 Ų055.9 Ų55.90%028%0.283CS..Hα-helixtrans-60.3-45.5170.6-77172.2000111.3I207 F209 I237 D238 K243 G244 G245 Y246 I250 F254 V258I207-L241 HydrophobicContact CD1-CD2 3.72Å; I207-L241 HydrophobicContact CD1-CG 3.87Å; F209-L241 HydrophobicContact CB-CD2 4.28Å; F209-L241 HydrophobicContact CD1-CD2 3.51Å; F209-L241 HydrophobicContact CD2-CD2 3.95Å; F209-L241 HydrophobicContact CE1-CD2 3.69Å; F209-L241 HydrophobicContact CE2-CD2 4.12Å; F209-L241 HydrophobicContact CG-CD2 3.64Å; F209-L241 HydrophobicContact CZ-CD2 3.98Å; I237-L241 HydrophobicContact CG2-CD1 4.14Å; I237-L241 HydrophobicContact CG2-CG 4.45Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 WeakPolarHBondContact O-CG 3.4Å; I237-L241 PolarHBondContact O-N 3.25Å; D238-L241 PolarHBondContact O-N 2.85Å; L241-K243 PolarHBondContact O-N 3.13Å; L241-G244 CarbonylContact O-C 3.55Å; L241-G244 PolarHBondContact O-N 2.9Å; L241-G245 PolarHBondContact O-N 3.47Å; L241-Y246 VanDerWaalsContact O-CB 3.27Å; L241-Y246 WeakPolarHBondContact O-CB 3.49Å; L241-Y246 PolarHBondContact O-N 3.39Å; L241-I250 HydrophobicContact CB-CD1 4.32Å; L241-I250 HydrophobicContact CD1-CD1 4.26Å; L241-I250 HydrophobicContact CD1-CG1 4.38Å; L241-I250 HydrophobicContact CD1-CG2 3.86Å; L241-F254 HydrophobicContact CD1-CD1 4.01Å; L241-F254 HydrophobicContact CD1-CE1 3.88Å; L241-F254 HydrophobicContact CD2-CE1 3.77Å; L241-F254 HydrophobicContact CG-CE1 4.46Å; L241-V258 HydrophobicContact CD1-CG2 4.48Å; L241-V258 HydrophobicContact CD2-CG2 4.07Å
242R95.7Very high93.9Very high121 Ų12156.6 Ų56.646%0.45730%0.295SS..Hα-helixtrans-60.9-44174.8-65.3-56.2-175.1-165.9-2.1111.5D238 S239 G244 G245 Y246 K247 G248D238-R242 WeakPolarHBondContact O-CG 3.47Å; D238-R242 PolarHBondContact O-N 2.88Å; S239-R242 WeakPolarHBondContact O-CB 3.06Å; S239-R242 PolarHBondContact O-N 3.43Å; R242-G244 VanDerWaalsContact C-N 3.29Å; R242-G244 PolarHBondContact O-N 2.86Å; R242-G245 WeakPolarHBondContact O-CA 3.41Å; R242-G245 PolarHBondContact O-N 2.88Å; R242-Y246 VanDerWaalsContact CD-O 3.27Å; R242-Y246 WeakPolarHBondContact CD-O 3.15Å; R242-Y246 PolarHBondContact NH1-O 3.24Å; R242-K247 PolarHBondContact NH1-O 3.25Å; R242-G248 PolarHBondContact NH1-O 3Å; R242-G248 PolarHBondContact NH2-O 2.83Å; R242-G248 VanDerWaalsContact NH2-O 3.07Å
243K94.5Very high94.1Very high120 Ų12059.4 Ų59.452%0.52231%0.306SS..Hα-helixtrans-60.5-36174.8177.8170.1179-890112.6T220 Y221 S239 L240 L241 G245T220-K243 PolarHBondContact O-NZ 3.32Å; Y221-K243 HydrophobicContact CD1-CD 4.3Å; Y221-K243 HydrophobicContact CE1-CD 3.45Å; Y221-K243 VanDerWaalsContact CE1-CD 3.45Å; S239-K243 WeakPolarHBondContact O-CB 3.35Å; S239-K243 PolarHBondContact O-N 3.09Å; L240-K243 HydrophobicContact CD1-CD 4.24Å; L240-K243 WeakPolarHBondContact O-CB 3.31Å; L240-K243 PolarHBondContact O-N 3.5Å; L241-K243 PolarHBondContact O-N 3.13Å; K243-G245 PolarHBondContact O-N 3.44Å
244G93.5Very high94.2Very high13 Ų1359.2 Ų59.213%0.13430%0.304CS..THydrogen-bonded Turntrans-74.2-0.117300000114.7L240 L241 R242L240-G244 PolarHBondContact O-N 3.09Å; L241-G244 CarbonylContact O-C 3.55Å; L241-G244 PolarHBondContact O-N 2.9Å; R242-G244 VanDerWaalsContact C-N 3.29Å; R242-G244 PolarHBondContact O-N 2.86Å
245G92.6Very high94.3Very high47 Ų4757.5 Ų57.549%0.48529%0.293SS..THydrogen-bonded Turntrans89.213.2177.200000114.8L241 R242 K243 K247L241-G245 PolarHBondContact O-N 3.47Å; R242-G245 WeakPolarHBondContact O-CA 3.41Å; R242-G245 PolarHBondContact O-N 2.88Å; K243-G245 PolarHBondContact O-N 3.44Å; G245-K247 PolarHBondContact O-N 3.03Å
246Y93.9Very high94.3Very high26 Ų2657.1 Ų57.110%0.10230%0.301CS..  trans-70116.8173.8-173.6-109000110.8F209 L241 R242 G248 H249 I250 F254F209-Y246 HydrophobicContact CE2-CD2 4.36Å; F209-Y246 HydrophobicContact CE2-CG 4.44Å; L241-Y246 VanDerWaalsContact O-CB 3.27Å; L241-Y246 WeakPolarHBondContact O-CB 3.49Å; L241-Y246 PolarHBondContact O-N 3.39Å; R242-Y246 VanDerWaalsContact CD-O 3.27Å; R242-Y246 WeakPolarHBondContact CD-O 3.15Å; R242-Y246 PolarHBondContact NH1-O 3.24Å; Y246-G248 WeakPolarHBondContact CE1-O 3.37Å; Y246-H249 WeakPolarHBondContact CE1-O 3.42Å; Y246-H249 PolarHBondContact OH-O 3.47Å; Y246-I250 HydrophobicContact CD1-CD1 4.36Å; Y246-I250 HydrophobicContact CD1-CG1 3.73Å; Y246-I250 HydrophobicContact CE1-CG1 3.61Å; Y246-F254 HydrophobicContact CD1-CE1 4.12Å; Y246-F254 HydrophobicContact CD2-CE1 4.04Å; Y246-F254 HydrophobicContact CD2-CE2 4.37Å; Y246-F254 AromaticContact CD2-CZ 3.63Å; Y246-F254 HydrophobicContact CD2-CZ 3.63Å; Y246-F254 HydrophobicContact CE1-CD1 4.18Å; Y246-F254 AromaticContact CE1-CE1 3.94Å; Y246-F254 HydrophobicContact CE1-CE1 3.94Å; Y246-F254 HydrophobicContact CE1-CZ 4.27Å; Y246-F254 HydrophobicContact CE2-CD2 4.4Å; Y246-F254 AromaticContact CE2-CE1 3.86Å; Y246-F254 HydrophobicContact CE2-CE1 3.86Å; Y246-F254 AromaticContact CE2-CE2 3.65Å; Y246-F254 HydrophobicContact CE2-CE2 3.65Å; Y246-F254 AromaticContact CE2-CZ 3.34Å; Y246-F254 HydrophobicContact CE2-CZ 3.34Å; Y246-F254 HydrophobicContact CG-CE1 4.17Å; Y246-F254 HydrophobicContact CG-CZ 4.22Å; Y246-F254 AromaticContact CZ-CE1 3.79Å; Y246-F254 AromaticContact CZ-CE2 3.89Å; Y246-F254 AromaticContact CZ-CZ 3.68Å
247K91Very high94.2Very high194 Ų19460.1 Ų60.184%0.84333%0.332SS*.  trans-102.6-10.4-177.9-64.9-176.2-179.2-177.50113.9R242 G245R242-K247 PolarHBondContact NH1-O 3.25Å; G245-K247 PolarHBondContact O-N 3.03Å
248G90.6Very high94.1Very high29 Ų2960.6 Ų60.630%0.29934%0.335SS..SBendtrans-70.6179.2-179.100000114R242 Y246R242-G248 PolarHBondContact NH1-O 3Å; R242-G248 PolarHBondContact NH2-O 2.83Å; R242-G248 VanDerWaalsContact NH2-O 3.07Å; Y246-G248 WeakPolarHBondContact CE1-O 3.37Å
249H93Very high94.1Very high151 Ų15161.2 Ų61.270%0.69934%0.342SS*.  trans-72.5135.3167.4-174.3-97.6000109.4Y246 T251Y246-H249 WeakPolarHBondContact CE1-O 3.42Å; Y246-H249 PolarHBondContact OH-O 3.47Å; H249-T251 VanDerWaalsContact ND1-CG2 3.34Å; H249-T251 WeakPolarHBondContact ND1-CG2 3.35Å
250I94.5Very high94.2Very high17 Ų1759.9 Ų59.99%0.08733%0.332CS..  trans-98101.6-178.1-55.4169.1000107.9D238 L241 Y246 R255D238-I250 HydrophobicContact CB-CD1 3.94Å; D238-I250 WeakPolarHBondContact OD1-CG2 3.44Å; L241-I250 HydrophobicContact CB-CD1 4.32Å; L241-I250 HydrophobicContact CD1-CD1 4.26Å; L241-I250 HydrophobicContact CD1-CG1 4.38Å; L241-I250 HydrophobicContact CD1-CG2 3.86Å; Y246-I250 HydrophobicContact CD1-CD1 4.36Å; Y246-I250 HydrophobicContact CD1-CG1 3.73Å; Y246-I250 HydrophobicContact CE1-CG1 3.61Å; I250-R255 HydrophobicContact CG2-CG 3.9Å
251T94.7Very high94.2Very high44 Ų4461.1 Ų61.127%0.2734%0.339SS..  trans-93.4160.3175.874.70000110.9H249 E253 F254 R255H249-T251 VanDerWaalsContact ND1-CG2 3.34Å; H249-T251 WeakPolarHBondContact ND1-CG2 3.35Å; T251-E253 WeakPolarHBondContact CB-OE2 3.49Å; T251-E253 PolarHBondContact O-N 2.78Å; T251-E253 PolarHBondContact OG1-N 2.82Å; T251-E253 PolarHBondContact OG1-OE2 3.13Å; T251-F254 WeakPolarHBondContact O-CB 3.34Å; T251-F254 PolarHBondContact O-N 2.87Å; T251-F254 VanDerWaalsContact O-N 3.13Å; T251-F254 PolarHBondContact OG1-N 2.83Å; T251-R255 PolarHBondContact O-N 3.25Å; T251-R255 VanDerWaalsContact O-N 3.09Å
252P94.1Very high94.1Very high69 Ų6963.4 Ų63.445%0.44835%0.347SS..Hα-helixtrans-53.5-39.7171.9-25.736000113.1F254 R255 S256P252-F254 VanDerWaalsContact C-N 3.31Å; P252-F254 PolarHBondContact O-N 2.79Å; P252-R255 WeakPolarHBondContact O-CB 3.36Å; P252-R255 PolarHBondContact O-N 2.98Å; P252-R255 VanDerWaalsContact O-N 3.16Å; P252-S256 PolarHBondContact O-N 3.3Å; P252-S256 PolarHBondContact O-OG 3.43Å
253E93.5Very high94.1Very high135 Ų13557.6 Ų57.663%0.63133%0.325SS*.Hα-helixtrans-64.3-37.9178.9-56.770.1-148.800111.2T251 S256 G257T251-E253 WeakPolarHBondContact CB-OE2 3.49Å; T251-E253 PolarHBondContact O-N 2.78Å; T251-E253 PolarHBondContact OG1-N 2.82Å; T251-E253 PolarHBondContact OG1-OE2 3.13Å; E253-S256 PolarHBondContact O-N 2.97Å; E253-G257 PolarHBondContact O-N 3.02Å
254F94.2Very high93.9Very high49 Ų4955.5 Ų55.522%0.21532%0.317CS..Hα-helixtrans-66.1-41.1174.8-171.6-95.2000111.5F209 L241 Y246 T251 P252 S256 G257F209-F254 HydrophobicContact CD2-CZ 4.17Å; L241-F254 HydrophobicContact CD1-CD1 4.01Å; L241-F254 HydrophobicContact CD1-CE1 3.88Å; L241-F254 HydrophobicContact CD2-CE1 3.77Å; L241-F254 HydrophobicContact CG-CE1 4.46Å; Y246-F254 HydrophobicContact CD1-CE1 4.12Å; Y246-F254 HydrophobicContact CD2-CE1 4.04Å; Y246-F254 HydrophobicContact CD2-CE2 4.37Å; Y246-F254 AromaticContact CD2-CZ 3.63Å; Y246-F254 HydrophobicContact CD2-CZ 3.63Å; Y246-F254 HydrophobicContact CE1-CD1 4.18Å; Y246-F254 AromaticContact CE1-CE1 3.94Å; Y246-F254 HydrophobicContact CE1-CE1 3.94Å; Y246-F254 HydrophobicContact CE1-CZ 4.27Å; Y246-F254 HydrophobicContact CE2-CD2 4.4Å; Y246-F254 AromaticContact CE2-CE1 3.86Å; Y246-F254 HydrophobicContact CE2-CE1 3.86Å; Y246-F254 AromaticContact CE2-CE2 3.65Å; Y246-F254 HydrophobicContact CE2-CE2 3.65Å; Y246-F254 AromaticContact CE2-CZ 3.34Å; Y246-F254 HydrophobicContact CE2-CZ 3.34Å; Y246-F254 HydrophobicContact CG-CE1 4.17Å; Y246-F254 HydrophobicContact CG-CZ 4.22Å; Y246-F254 AromaticContact CZ-CE1 3.79Å; Y246-F254 AromaticContact CZ-CE2 3.89Å; Y246-F254 AromaticContact CZ-CZ 3.68Å; T251-F254 WeakPolarHBondContact O-CB 3.34Å; T251-F254 PolarHBondContact O-N 2.87Å; T251-F254 VanDerWaalsContact O-N 3.13Å; T251-F254 PolarHBondContact OG1-N 2.83Å; P252-F254 VanDerWaalsContact C-N 3.31Å; P252-F254 PolarHBondContact O-N 2.79Å; F254-S256 VanDerWaalsContact C-N 3.33Å; F254-S256 PolarHBondContact O-N 2.88Å; F254-G257 PolarHBondContact O-N 3.39Å; F254-G257 VanDerWaalsContact O-N 3.11Å
255R94.9Very high93.8Very high29 Ų2956.5 Ų56.511%0.10932%0.323CS..Hα-helixtrans-60.6-42.8175.1-63.7-176.3-170.1101.21.4111.6Y179 I237 D238 I250 T251 P252 G257 V258Y179-R255 HydrophobicContact CD1-CB 3.97Å; Y179-R255 WeakPolarHBondContact CD1-O 3.4Å; Y179-R255 HydrophobicContact CD2-CB 4.07Å; Y179-R255 HydrophobicContact CE1-CB 3.82Å; Y179-R255 HydrophobicContact CE2-CB 3.87Å; Y179-R255 HydrophobicContact CE2-CG 4.45Å; Y179-R255 HydrophobicContact CG-CB 4.1Å; I237-R255 HydrophobicContact CG2-CG 4.44Å; D238-R255 IonicContact OD1-CZ 3.36Å; D238-R255 IonicContact OD1-NE 2.74Å; D238-R255 PolarHBondContact OD1-NE 3.28Å; D238-R255 IonicContact OD1-NH2 3.34Å; D238-R255 PolarHBondContact OD1-NH2 2.85Å; D238-R255 VanDerWaalsContact OD1-NH2 3.14Å; D238-R255 IonicContact OD2-CZ 3.73Å; D238-R255 IonicContact OD2-NE 3.84Å; D238-R255 IonicContact OD2-NH2 2.67Å; D238-R255 PolarHBondContact OD2-NH2 3.42Å; I250-R255 HydrophobicContact CG2-CG 3.9Å; T251-R255 PolarHBondContact O-N 3.25Å; T251-R255 VanDerWaalsContact O-N 3.09Å; P252-R255 WeakPolarHBondContact O-CB 3.36Å; P252-R255 PolarHBondContact O-N 2.98Å; P252-R255 VanDerWaalsContact O-N 3.16Å; R255-G257 PolarHBondContact O-N 2.81Å; R255-V258 VanDerWaalsContact O-CB 3.31Å; R255-V258 WeakPolarHBondContact O-CB 3.27Å; R255-V258 PolarHBondContact O-N 2.69Å
256S93.8Very high93.8Very high86 Ų8656.1 Ų56.160%0.60131%0.308SS*.Hα-helixtrans-62.6-22.2175.9-65.30000113.8P252 E253 F254P252-S256 PolarHBondContact O-N 3.3Å; P252-S256 PolarHBondContact O-OG 3.43Å; E253-S256 PolarHBondContact O-N 2.97Å; F254-S256 VanDerWaalsContact C-N 3.33Å; F254-S256 PolarHBondContact O-N 2.88Å
257G92.9Very high93.7Very high63 Ų6358.1 Ų58.165%0.64932%0.317SS*.THydrogen-bonded Turntrans-85.6-3.2174.400000114.8E253 F254 R255E253-G257 PolarHBondContact O-N 3.02Å; F254-G257 PolarHBondContact O-N 3.39Å; F254-G257 VanDerWaalsContact O-N 3.11Å; R255-G257 PolarHBondContact O-N 2.81Å
258V94.8Very high93.9Very high10 Ų1050.1 Ų50.16%0.06128%0.283CS..  trans-78.7127.3178.41760000109.7I207 F209 L241 R255 L260I207-V258 HydrophobicContact CB-CG1 3.54Å; I207-V258 HydrophobicContact CD1-CG1 4.45Å; I207-V258 HydrophobicContact CG2-CG1 3.68Å; F209-V258 HydrophobicContact CB-CG2 4.34Å; L241-V258 HydrophobicContact CD1-CG2 4.48Å; L241-V258 HydrophobicContact CD2-CG2 4.07Å; R255-V258 VanDerWaalsContact O-CB 3.31Å; R255-V258 WeakPolarHBondContact O-CB 3.27Å; R255-V258 PolarHBondContact O-N 2.69Å; V258-L260 PolarHBondContact O-N 2.82Å
259C96.3Very high94.1Very high53 Ų5351 Ų5136%0.35828%0.283SS..EExtended strand (participates in β ladder)trans-81.9115.5168.61790000108.6I207 E208I207-C259 CarbonylContact C-O 3.56Å; I207-C259 WeakPolarHBondContact CA-O 3.47Å; E208-C259 HydrophobicContact CB-CB 4.3Å; E208-C259 PolarHBondContact N-O 2.75Å; E208-C259 PolarHBondContact O-N 3.17Å
260L97.2Very high94.3Very high2 Ų243.9 Ų43.91%0.0125%0.25CC..EExtended strand (participates in β ladder)trans-101.9133.9177.9-171.8148.5000110.3A176 Y179 W182 I205 I207 I237 V258 R262A176-L260 HydrophobicContact CB-CB 4.16Å; A176-L260 HydrophobicContact CB-CD2 3.4Å; A176-L260 HydrophobicContact CB-CG 4.35Å; A176-L260 PolarHBondContact N-O 2.89Å; Y179-L260 WeakPolarHBondContact O-CD1 3.3Å; W182-L260 HydrophobicContact CB-CD2 4.43Å; W182-L260 HydrophobicContact CG-CD1 4.35Å; W182-L260 HydrophobicContact CG-CD2 4.45Å; I205-L260 HydrophobicContact CB-CD1 4.36Å; I205-L260 HydrophobicContact CB-CG 4.46Å; I205-L260 HydrophobicContact CD1-CD1 4.49Å; I205-L260 HydrophobicContact CG2-CD1 4.23Å; I205-L260 HydrophobicContact CG2-CD2 4.13Å; I205-L260 HydrophobicContact CG2-CG 4.46Å; I207-L260 HydrophobicContact CG2-CD1 4.32Å; I207-L260 HydrophobicContact CG2-CG 4.38Å; I237-L260 HydrophobicContact CD1-CD1 3.67Å; V258-L260 PolarHBondContact O-N 2.82Å; L260-R262 HydrophobicContact CD2-CB 4.13Å
261I96.4Very high94.5Very high25 Ų2544 Ų4413%0.12825%0.252CS..EExtended strand (participates in β ladder)trans-118.4116.3172-56.2168.2000106.8F173 E174 V175 R206F173-I261 HydrophobicContact CB-CG2 4.19Å; F173-I261 HydrophobicContact CD1-CG2 3.94Å; E174-I261 CarbonylContact O-C 3.54Å; E174-I261 VanDerWaalsContact O-CA 3.27Å; E174-I261 WeakPolarHBondContact O-CA 2.95Å; E174-I261 WeakPolarHBondContact O-CG2 3.22Å; V175-I261 HydrophobicContact CG2-CG1 4.46Å; R206-I261 HydrophobicContact CB-CB 4.39Å; R206-I261 PolarHBondContact N-O 3.2Å; R206-I261 PolarHBondContact O-N 2.86Å
262R95.1Very high94.6Very high48 Ų4843.1 Ų43.118%0.18124%0.244CC..EExtended strand (participates in β ladder)trans-91.1149.4173.667-178.1-178.2-151.1-1.6110.3F173 E174 D181 W182 H203 G204 L260F173-R262 CarbonylContact C-O 3.47Å; F173-R262 WeakPolarHBondContact CA-O 3.36Å; E174-R262 HydrophobicContact CB-CG 3.96Å; E174-R262 PolarHBondContact N-O 3.07Å; E174-R262 PolarHBondContact O-N 2.85Å; E174-R262 IonicContact OE2-CZ 3.22Å; E174-R262 IonicContact OE2-NE 2.73Å; E174-R262 PolarHBondContact OE2-NE 2.87Å; E174-R262 IonicContact OE2-NH2 3.88Å; E174-R262 PolarHBondContact OE2-NH2 3.27Å; D181-R262 WeakPolarHBondContact O-CD 3.47Å; D181-R262 PolarHBondContact O-NH1 2.85Å; D181-R262 IonicContact OD1-CZ 3.03Å; D181-R262 IonicContact OD1-NH1 3.4Å; D181-R262 PolarHBondContact OD1-NH1 3.27Å; D181-R262 IonicContact OD2-CZ 2.77Å; D181-R262 IonicContact OD2-NH1 3.14Å; D181-R262 PolarHBondContact OD2-NH1 2.75Å; W182-R262 HydrophobicContact CB-CB 4.32Å; H203-R262 HydrophobicContact CB-CB 4.17Å; G204-R262 CarbonylContact O-C 3.55Å; G204-R262 WeakPolarHBondContact O-CA 3.44Å; L260-R262 HydrophobicContact CD2-CB 4.13Å
263F93.8Very high94.6Very high0 Ų043 Ų430%025%0.245CC..EExtended strand (participates in β ladder)trans-148.4159.1176.660.9-90000110.9F129 L170 F173 H203 G204 R206 T220 Y221 L222F129-F263 HydrophobicContact CE1-CE1 4.15Å; F129-F263 HydrophobicContact CE1-CZ 4.11Å; L170-F263 HydrophobicContact CB-CD2 4.15Å; L170-F263 HydrophobicContact CD1-CD2 4.3Å; L170-F263 HydrophobicContact CD1-CE2 3.93Å; L170-F263 HydrophobicContact CD1-CZ 4.36Å; L170-F263 HydrophobicContact CD2-CD2 4.13Å; L170-F263 HydrophobicContact CD2-CE2 3.77Å; L170-F263 HydrophobicContact CG-CD2 4.43Å; L170-F263 HydrophobicContact CG-CE2 4.29Å; F173-F263 HydrophobicContact CD1-CB 3.58Å; F173-F263 HydrophobicContact CD1-CD1 4.07Å; F173-F263 HydrophobicContact CD1-CG 4.06Å; F173-F263 HydrophobicContact CD2-CB 4.25Å; F173-F263 HydrophobicContact CE1-CB 3.64Å; F173-F263 AromaticContact CE1-CD1 3.66Å; F173-F263 HydrophobicContact CE1-CD1 3.66Å; F173-F263 HydrophobicContact CE1-CD2 4.44Å; F173-F263 HydrophobicContact CE1-CE1 4.45Å; F173-F263 AromaticContact CE1-CG 3.65Å; F173-F263 HydrophobicContact CE1-CG 3.65Å; F173-F263 HydrophobicContact CE2-CB 4.29Å; F173-F263 HydrophobicContact CG-CB 3.9Å; F173-F263 HydrophobicContact CZ-CB 4.01Å; F173-F263 HydrophobicContact CZ-CD1 4.43Å; F173-F263 HydrophobicContact CZ-CD2 4.46Å; F173-F263 HydrophobicContact CZ-CG 4.05Å; H203-F263 CarbonylContact C-O 3.43Å; H203-F263 WeakPolarHBondContact CA-O 3.22Å; G204-F263 PolarHBondContact N-O 2.83Å; G204-F263 WeakPolarHBondContact O-CD1 3.35Å; G204-F263 PolarHBondContact O-N 2.9Å; R206-F263 HydrophobicContact CB-CE1 4.4Å; T220-F263 HydrophobicContact CG2-CE1 3.55Å; T220-F263 HydrophobicContact CG2-CZ 3.56Å; Y221-F263 WeakPolarHBondContact O-CZ 3.37Å; L222-F263 HydrophobicContact CD2-CE2 4.24Å; L222-F263 HydrophobicContact CD2-CZ 4.33Å
264Q92.1Very high94.7Very high75 Ų7539.3 Ų39.335%0.3523%0.227SC..EExtended strand (participates in β ladder)trans-101.4160.8173-66177.3-13.700110L170 M171 N172L170-Q264 WeakPolarHBondContact CA-O 3.38Å; M171-Q264 HydrophobicContact CG-CB 4.3Å; M171-Q264 PolarHBondContact N-O 2.94Å; M171-Q264 PolarHBondContact O-N 3.37Å; M171-Q264 VanDerWaalsContact O-O 3.09Å; N172-Q264 HydrophobicContact CB-CB 4.44Å; N172-Q264 HydrophobicContact CB-CG 4.46Å; N172-Q264 PolarHBondContact ND2-OE1 3.43Å
265S90.5Very high94.8Very high35 Ų3537 Ų3725%0.24522%0.217CC..EExtended strand (participates in β ladder)trans-137.3139.3172.869.80000112.5L169 P223L169-S265 CarbonylContact O-C 3.5Å; L169-S265 WeakPolarHBondContact O-CA 3.44Å; P223-S265 WeakPolarHBondContact CG-OG 3.26Å
266E91.9Very high94.8Very high39 Ų3936 Ų3618%0.18221%0.214CC..EExtended strand (participates in β ladder)trans-98124.9164-71.4-171.517600110R74 V75 V76 S168 L169 M171R74-E266 WeakPolarHBondContact CG-OE2 3.46Å; V75-E266 PolarHBondContact N-OE2 3.41Å; V76-E266 HydrophobicContact CB-CB 4.08Å; V76-E266 HydrophobicContact CG1-CB 3.6Å; V76-E266 PolarHBondContact N-OE2 3.43Å; S168-E266 CarbonylContact C-O 3.58Å; S168-E266 WeakPolarHBondContact CA-O 3.38Å; L169-E266 PolarHBondContact N-O 3.18Å; L169-E266 PolarHBondContact O-N 3.49Å; M171-E266 HydrophobicContact CE-CB 3.8Å; M171-E266 HydrophobicContact CE-CG 3.53Å; M171-E266 HydrophobicContact SD-CG 3.91Å
267K92.1Very high94.7Very high67 Ų6734.9 Ų34.929%0.29121%0.207SC..EExtended strand (participates in β ladder)trans-116136.6-178.9-171.1172.6-176.4175.30111.3R74 V167 S168 E224R74-K267 PolarHBondContact NH1-O 2.94Å; V167-K267 WeakPolarHBondContact O-CA 3.26Å; S168-K267 WeakPolarHBondContact OG-CG 3.29Å; E224-K267 IonicContact OE1-NZ 3.26Å; E224-K267 PolarHBondContact OE1-NZ 3.11Å
268M95Very high94.6Very high27 Ų2734.3 Ų34.313%0.13319%0.189CC..EExtended strand (participates in β ladder)trans-125.9132.5168.5-172.265.368.300109.1V76 K78 V81 S166 V167V76-M268 HydrophobicContact CB-CB 4.44Å; V76-M268 HydrophobicContact CG1-CB 4.02Å; V76-M268 HydrophobicContact CG1-CE 4.47Å; V76-M268 HydrophobicContact CG2-CB 3.6Å; V76-M268 WeakPolarHBondContact O-CE 3.33Å; K78-M268 HydrophobicContact CG-CE 4.29Å; K78-M268 HydrophobicContact CG-CG 4.17Å; K78-M268 HydrophobicContact CG-SD 3.78Å; V81-M268 HydrophobicContact CG2-CB 3.76Å; V81-M268 HydrophobicContact CG2-CG 3.64Å; V81-M268 WeakPolarHBondContact CG2-O 3.49Å; S166-M268 CarbonylContact C-O 3.53Å; S166-M268 WeakPolarHBondContact CA-O 2.92Å; V167-M268 PolarHBondContact N-O 3.06Å; V167-M268 PolarHBondContact O-N 3.01Å
269T96Very high94Very high48 Ų4836.6 Ų36.629%0.29420%0.196SC..EExtended strand (participates in β ladder)trans-125.3135.5179.2-55.90000109.7C165 S166C165-T269 CarbonylContact O-C 3.59Å; C165-T269 VanDerWaalsContact O-CA 3.29Å; C165-T269 WeakPolarHBondContact O-CA 3.27Å; S166-T269 WeakPolarHBondContact CB-OG1 3.3Å; S166-T269 WeakPolarHBondContact OG-CB 3.09Å; S166-T269 VanDerWaalsContact OG-CG2 3.26Å; S166-T269 WeakPolarHBondContact OG-CG2 3.4Å; S166-T269 PolarHBondContact OG-OG1 2.9Å
270V97.2Very high93.3Very high0 Ų038.8 Ų38.80%020%0.201CC..EExtended strand (participates in β ladder)trans-132.8134.4176.8176.80000108.2K78 V81 L82 F85 H164 C165 E274K78-V270 HydrophobicContact CB-CG2 4.45Å; K78-V270 HydrophobicContact CG-CG2 4.33Å; V81-V270 HydrophobicContact CB-CB 4.13Å; V81-V270 HydrophobicContact CB-CG2 3.8Å; V81-V270 HydrophobicContact CG1-CB 3.61Å; V81-V270 HydrophobicContact CG1-CG2 3.83Å; V81-V270 HydrophobicContact CG2-CG2 4.22Å; L82-V270 HydrophobicContact CD2-CG1 4.12Å; F85-V270 HydrophobicContact CE2-CB 4.42Å; F85-V270 HydrophobicContact CE2-CG1 4.38Å; F85-V270 WeakPolarHBondContact CE2-O 3.29Å; H164-V270 WeakPolarHBondContact CA-O 3.34Å; C165-V270 PolarHBondContact N-O 3.47Å; C165-V270 PolarHBondContact O-N 3.11Å; V270-E274 HydrophobicContact CG1-CB 3.87Å; V270-E274 HydrophobicContact CG1-CG 3.91Å
271S97.6Very high92.2Very high20 Ų2044 Ų4414%0.1424%0.237CC..EExtended strand (participates in β ladder)trans-81.1159.7171.864.80000111.1H164 S273 E274 Y275H164-S271 VanDerWaalsContact CE1-CB 3.44Å; H164-S271 WeakPolarHBondContact CE1-CB 3.07Å; H164-S271 WeakPolarHBondContact ND1-CB 3.24Å; S271-S273 PolarHBondContact O-N 2.96Å; S271-S273 PolarHBondContact OG-OG 3.28Å; S271-E274 PolarHBondContact O-N 3.48Å; S271-E274 VanDerWaalsContact O-N 3.15Å; S271-E274 WeakPolarHBondContact OG-CB 3.42Å; S271-E274 PolarHBondContact OG-N 2.95Å; S271-E274 VanDerWaalsContact OG-N 3.16Å; S271-Y275 PolarHBondContact O-N 2.88Å
272Y97.3Very high90.9Very high26 Ų2650.2 Ų50.210%0.10226%0.258CS..Hα-helixtrans-54.3-41.6171.3176.5-98.3000112.4F85 F160 N161 L163 E274 Y275 V276 W295F85-Y272 HydrophobicContact CE1-CD2 4.23Å; F160-Y272 HydrophobicContact CD1-CD2 4.23Å; F160-Y272 AromaticContact CD1-CE2 3.73Å; F160-Y272 HydrophobicContact CD1-CE2 3.73Å; F160-Y272 HydrophobicContact CE1-CD2 4.01Å; F160-Y272 AromaticContact CE1-CE2 3.44Å; F160-Y272 HydrophobicContact CE1-CE2 3.44Å; F160-Y272 VanDerWaalsContact CE1-CE2 3.44Å; F160-Y272 HydrophobicContact CZ-CD2 4.46Å; F160-Y272 HydrophobicContact CZ-CE2 4.24Å; N161-Y272 VanDerWaalsContact CA-CD1 3.47Å; N161-Y272 HydrophobicContact CB-CD1 3.87Å; N161-Y272 HydrophobicContact CB-CE1 3.63Å; N161-Y272 HydrophobicContact CB-CG 4.44Å; N161-Y272 WeakPolarHBondContact O-CD1 3.48Å; L163-Y272 WeakPolarHBondContact O-CB 3.38Å; L163-Y272 PolarHBondContact O-N 3.38Å; Y272-E274 VanDerWaalsContact C-N 3.35Å; Y272-E274 PolarHBondContact O-N 3.48Å; Y272-Y275 HydrophobicContact CD2-CD1 4.06Å; Y272-Y275 HydrophobicContact CE2-CD1 4.12Å; Y272-Y275 HydrophobicContact CE2-CE1 4.39Å; Y272-Y275 WeakPolarHBondContact O-CB 3.27Å; Y272-Y275 PolarHBondContact O-N 2.99Å; Y272-V276 HydrophobicContact CD1-CG2 4.13Å; Y272-V276 HydrophobicContact CD2-CG2 4.39Å; Y272-V276 HydrophobicContact CE1-CG2 3.56Å; Y272-V276 HydrophobicContact CE2-CG2 3.82Å; Y272-V276 WeakPolarHBondContact O-CG2 3.5Å; Y272-V276 PolarHBondContact O-N 2.7Å; Y272-W295 AromaticContact CD1-CH2 3.99Å; Y272-W295 HydrophobicContact CD1-CH2 3.99Å; Y272-W295 HydrophobicContact CD1-CZ2 4.13Å; Y272-W295 AromaticContact CE1-CH2 3.68Å; Y272-W295 HydrophobicContact CE1-CH2 3.68Å; Y272-W295 AromaticContact CE1-CZ2 3.67Å; Y272-W295 HydrophobicContact CE1-CZ2 3.67Å
273S95.2Very high89.1Confident65 Ų6551.2 Ų51.246%0.45528%0.284SS..Hα-helixtrans-59.1-44.8177.453.10000112.4S271 V276 S277S271-S273 PolarHBondContact O-N 2.96Å; S271-S273 PolarHBondContact OG-OG 3.28Å; S273-V276 PolarHBondContact O-N 3.38Å; S273-S277 PolarHBondContact O-N 3.42Å; S273-S277 VanDerWaalsContact O-N 3.11Å; S273-S277 PolarHBondContact O-OG 3.04Å; S273-S277 VanDerWaalsContact O-OG 3.14Å
274E95.1Very high87.2Confident58 Ų5852.4 Ų52.427%0.27130%0.296SS..Hα-helixtrans-68.9-38.4176.8-177.9178.4-175.600111.6K78 V270 S271 Y272 V276 S277 L278K78-E274 WeakPolarHBondContact CE-OE1 3.38Å; K78-E274 IonicContact NZ-OE1 2.97Å; K78-E274 PolarHBondContact NZ-OE1 3.18Å; V270-E274 HydrophobicContact CG1-CB 3.87Å; V270-E274 HydrophobicContact CG1-CG 3.91Å; S271-E274 PolarHBondContact O-N 3.48Å; S271-E274 VanDerWaalsContact O-N 3.15Å; S271-E274 WeakPolarHBondContact OG-CB 3.42Å; S271-E274 PolarHBondContact OG-N 2.95Å; S271-E274 VanDerWaalsContact OG-N 3.16Å; Y272-E274 VanDerWaalsContact C-N 3.35Å; Y272-E274 PolarHBondContact O-N 3.48Å; E274-V276 PolarHBondContact O-N 3.03Å; E274-S277 PolarHBondContact O-N 3.32Å; E274-L278 HydrophobicContact CG-CD1 3.72Å; E274-L278 HydrophobicContact CG-CG 4.19Å; E274-L278 WeakPolarHBondContact O-CB 3.45Å; E274-L278 VanDerWaalsContact O-CG 3.29Å; E274-L278 WeakPolarHBondContact O-CG 3.16Å; E274-L278 PolarHBondContact O-N 3.47Å
275Y95.9Very high85Confident0 Ų057.4 Ų57.40%032%0.32CS..Hα-helixtrans-55.9-49.7173.4162.3-104.4000111.8L82 F85 D86 S271 Y272 L278 R279 F287L82-Y275 HydrophobicContact CB-CD2 4.32Å; L82-Y275 HydrophobicContact CD2-CD2 3.58Å; L82-Y275 HydrophobicContact CD2-CG 4.3Å; F85-Y275 HydrophobicContact CB-CD1 4.12Å; F85-Y275 HydrophobicContact CB-CD2 3.39Å; F85-Y275 HydrophobicContact CB-CE1 4.1Å; F85-Y275 HydrophobicContact CB-CE2 3.4Å; F85-Y275 HydrophobicContact CB-CG 3.79Å; F85-Y275 HydrophobicContact CD1-CD1 4.18Å; F85-Y275 HydrophobicContact CD1-CG 4.22Å; F85-Y275 HydrophobicContact CD2-CD2 4.04Å; F85-Y275 AromaticContact CD2-CG 3.98Å; F85-Y275 HydrophobicContact CD2-CG 3.98Å; F85-Y275 HydrophobicContact CG-CD1 4.13Å; F85-Y275 AromaticContact CG-CD2 3.83Å; F85-Y275 HydrophobicContact CG-CD2 3.83Å; F85-Y275 HydrophobicContact CG-CE2 4.29Å; F85-Y275 AromaticContact CG-CG 3.76Å; F85-Y275 HydrophobicContact CG-CG 3.76Å; D86-Y275 VanDerWaalsContact OD1-CE2 3.3Å; D86-Y275 WeakPolarHBondContact OD1-CE2 3.22Å; D86-Y275 PolarHBondContact OD1-OH 3.21Å; S271-Y275 PolarHBondContact O-N 2.88Å; Y272-Y275 HydrophobicContact CD2-CD1 4.06Å; Y272-Y275 HydrophobicContact CE2-CD1 4.12Å; Y272-Y275 HydrophobicContact CE2-CE1 4.39Å; Y272-Y275 WeakPolarHBondContact O-CB 3.27Å; Y272-Y275 PolarHBondContact O-N 2.99Å; Y275-L278 PolarHBondContact O-N 2.08Å; Y275-R279 HydrophobicContact CD2-CG 4.08Å; Y275-R279 HydrophobicContact CE2-CG 3.65Å; Y275-R279 WeakPolarHBondContact O-CG 3.33Å; Y275-R279 PolarHBondContact O-N 3.42Å; Y275-F287 HydrophobicContact CE1-CE2 4.14Å; Y275-F287 AromaticContact CE1-CZ 3.78Å; Y275-F287 HydrophobicContact CE1-CZ 3.78Å
276V93.9Very high82.7Confident8 Ų860.1 Ų60.15%0.04833%0.334CS..Hα-helixtrans-61.5-46.7177.9172.70000110.9Y272 S273 E274 L278 R279 Q280 F287 W295Y272-V276 HydrophobicContact CD1-CG2 4.13Å; Y272-V276 HydrophobicContact CD2-CG2 4.39Å; Y272-V276 HydrophobicContact CE1-CG2 3.56Å; Y272-V276 HydrophobicContact CE2-CG2 3.82Å; Y272-V276 WeakPolarHBondContact O-CG2 3.5Å; Y272-V276 PolarHBondContact O-N 2.7Å; S273-V276 PolarHBondContact O-N 3.38Å; E274-V276 PolarHBondContact O-N 3.03Å; V276-L278 PolarHBondContact O-N 2.94Å; V276-R279 PolarHBondContact O-N 2.82Å; V276-Q280 WeakPolarHBondContact O-CG 3.21Å; V276-Q280 PolarHBondContact O-N 2.87Å; V276-F287 HydrophobicContact CG2-CE2 4.39Å; V276-W295 HydrophobicContact CB-CZ3 4.32Å; V276-W295 HydrophobicContact CG1-CZ3 4.07Å; V276-W295 HydrophobicContact CG2-CH2 4.44Å
277S92.9Very high80.8Confident63 Ų6359.4 Ų59.444%0.44133%0.331SS..Hα-helixtrans-60.6-43.6178.2-630000112.5S273 E274 Q280 C281S273-S277 PolarHBondContact O-N 3.42Å; S273-S277 VanDerWaalsContact O-N 3.11Å; S273-S277 PolarHBondContact O-OG 3.04Å; S273-S277 VanDerWaalsContact O-OG 3.14Å; E274-S277 PolarHBondContact O-N 3.32Å; S277-Q280 PolarHBondContact O-N 3.12Å; S277-C281 PolarHBondContact O-N 3.15Å; S277-C281 VanDerWaalsContact O-N 3.17Å; S277-C281 PolarHBondContact O-SG 2.77Å
278L89.8Confident78.6Confident52 Ų5259.3 Ų59.327%0.27234%0.339SS..Hα-helixtrans-69.8-32.6179.8-72.1172.1000112.7K78 L82 E274 Y275 V276 R282K78-L278 HydrophobicContact CD-CD1 4.19Å; L82-L278 HydrophobicContact CD1-CB 4.06Å; L82-L278 HydrophobicContact CD1-CD1 4.22Å; L82-L278 HydrophobicContact CD2-CB 4.18Å; L82-L278 HydrophobicContact CD2-CD1 3.99Å; E274-L278 HydrophobicContact CG-CD1 3.72Å; E274-L278 HydrophobicContact CG-CG 4.19Å; E274-L278 WeakPolarHBondContact O-CB 3.45Å; E274-L278 VanDerWaalsContact O-CG 3.29Å; E274-L278 WeakPolarHBondContact O-CG 3.16Å; E274-L278 PolarHBondContact O-N 3.47Å; Y275-L278 PolarHBondContact O-N 2.08Å; V276-L278 PolarHBondContact O-N 2.94Å; L278-R282 WeakPolarHBondContact O-CD 3.31Å; L278-R282 VanDerWaalsContact O-CG 3.26Å; L278-R282 WeakPolarHBondContact O-CG 3.33Å
279R83.7Confident76Confident58 Ų5862.6 Ų62.622%0.21936%0.362CS..Hα-helixtrans-67.6-40.8172.6-75-78.8-66.9-165.24111.7D86 Y275 V276 R282D86-R279 IonicContact OD1-CZ 3.45Å; D86-R279 IonicContact OD1-NE 3.66Å; D86-R279 IonicContact OD1-NH1 3.62Å; D86-R279 PolarHBondContact OD1-NH1 3.19Å; D86-R279 IonicContact OD2-CZ 3.89Å; D86-R279 IonicContact OD2-NH1 3.67Å; D86-R279 PolarHBondContact OD2-NH1 3.2Å; Y275-R279 HydrophobicContact CD2-CG 4.08Å; Y275-R279 HydrophobicContact CE2-CG 3.65Å; Y275-R279 WeakPolarHBondContact O-CG 3.33Å; Y275-R279 PolarHBondContact O-N 3.42Å; V276-R279 PolarHBondContact O-N 2.82Å; R279-R282 PolarHBondContact O-N 2.96Å
280Q80.1Confident73.7Confident98 Ų9863.9 Ų63.946%0.45838%0.377SS..Hα-helixtrans-61.4-45.3177.6-73.1173.42.600112.2V276 S277 R282 G283V276-Q280 WeakPolarHBondContact O-CG 3.21Å; V276-Q280 PolarHBondContact O-N 2.87Å; S277-Q280 PolarHBondContact O-N 3.12Å; Q280-R282 PolarHBondContact O-N 2.93Å; Q280-G283 PolarHBondContact O-N 3.22Å
281C74.5Confident71.4Confident113 Ų11367.1 Ų67.176%0.76439%0.392SS*.Hα-helixtrans-64.1-20178-67.70000113.9S277S277-C281 PolarHBondContact O-N 3.15Å; S277-C281 VanDerWaalsContact O-N 3.17Å; S277-C281 PolarHBondContact O-SG 2.77Å
282R70.1Confident69Low154 Ų15467.8 Ų67.858%0.58140%0.396SS*.THydrogen-bonded Turntrans-95.2-0.4-176.2-67.7176.688.1167.811114.1L278 R279 Q280 G284L278-R282 WeakPolarHBondContact O-CD 3.31Å; L278-R282 VanDerWaalsContact O-CG 3.26Å; L278-R282 WeakPolarHBondContact O-CG 3.33Å; R279-R282 PolarHBondContact O-N 2.96Å; Q280-R282 PolarHBondContact O-N 2.93Å; R282-G284 PolarHBondContact O-N 2.73Å
283G57.4Low66.5Low70 Ų7070.7 Ų70.772%0.72241%0.412SS*.THydrogen-bonded Turntrans64.517.3-177.400000114.2Q280Q280-G283 PolarHBondContact O-N 3.22Å
284G52.7Low64.3Low25 Ų2569.5 Ų69.526%0.25841%0.41SS..  trans-66.8145.4171.800000110R282 V286R282-G284 PolarHBondContact O-N 2.73Å; G284-V286 PolarHBondContact O-N 2.68Å
285E46.1Very low61.8Low180 Ų18072.1 Ų72.184%0.84142%0.418SS*.  trans-38.3106.2177.8-70.4177.9176.400110.5F287E285-F287 PolarHBondContact O-N 3.45Å
286V43Very low59.4Low91 Ų9179.4 Ų79.455%0.55245%0.449SS*.  trans-70.4128.4-176.51800000106.5G284 V292G284-V286 PolarHBondContact O-N 2.68Å; V286-V292 HydrophobicContact CG1-CG2 4.06Å
287F51.5Low57.2Low24 Ų2483 Ų8311%0.10547%0.468CS..  trans-39.2144.6170.7-59.8-68.3000111.1Y89 Y275 V276 E285Y89-F287 AromaticContact CD1-CE1 3.93Å; Y89-F287 HydrophobicContact CD1-CE1 3.93Å; Y89-F287 HydrophobicContact CD2-CD1 4.3Å; Y89-F287 AromaticContact CD2-CE1 3.54Å; Y89-F287 HydrophobicContact CD2-CE1 3.54Å; Y89-F287 HydrophobicContact CD2-CZ 4.26Å; Y89-F287 HydrophobicContact CE1-CD1 4.1Å; Y89-F287 AromaticContact CE1-CE1 3.62Å; Y89-F287 HydrophobicContact CE1-CE1 3.62Å; Y89-F287 AromaticContact CE2-CD1 3.5Å; Y89-F287 HydrophobicContact CE2-CD1 3.5Å; Y89-F287 AromaticContact CE2-CE1 3.18Å; Y89-F287 HydrophobicContact CE2-CE1 3.18Å; Y89-F287 HydrophobicContact CE2-CZ 4.26Å; Y89-F287 AromaticContact CG-CE1 3.91Å; Y89-F287 HydrophobicContact CG-CE1 3.91Å; Y89-F287 AromaticContact CZ-CD1 3.39Å; Y89-F287 AromaticContact CZ-CE1 3.25Å; Y89-F287 WeakPolarHBondContact OH-CD1 3.36Å; Y275-F287 HydrophobicContact CE1-CE2 4.14Å; Y275-F287 AromaticContact CE1-CZ 3.78Å; Y275-F287 HydrophobicContact CE1-CZ 3.78Å; V276-F287 HydrophobicContact CG2-CE2 4.39Å; E285-F287 PolarHBondContact O-N 3.45Å
288S44.8Very low55.2Low65 Ų6581.8 Ų81.846%0.45546%0.462SS..  trans-46.8141.9-172.283.70000111.3A290 E291S288-A290 PolarHBondContact O-N 2.74Å; S288-E291 PolarHBondContact O-N 3.16Å
289P41.4Very low53.2Low97 Ų9786.6 Ų86.663%0.6348%0.481SS*.Hα-helixtrans-50.1-28-175.2-29.734.6000114.6E291 V292 I293P289-E291 PolarHBondContact O-N 3.09Å; P289-V292 PolarHBondContact O-N 2.77Å; P289-I293 HydrophobicContact CB-CD1 4.32Å; P289-I293 WeakPolarHBondContact O-CB 3.44Å; P289-I293 WeakPolarHBondContact O-CD1 3.28Å; P289-I293 WeakPolarHBondContact O-CG1 3.31Å; P289-I293 PolarHBondContact O-N 3.14Å
290A46.9Very low51.3Low74 Ų7492.1 Ų92.161%0.61250%0.502SS*.Hα-helixtrans-63.8-37.5178.700000113.7S288 V292 G294S288-A290 PolarHBondContact O-N 2.74Å; A290-V292 VanDerWaalsContact C-N 3.32Å; A290-G294 PolarHBondContact O-N 2.98Å
291E50.2Low49.9Very low68 Ų6893.6 Ų93.632%0.31851%0.512SS..Hα-helixtrans-73.1-29.3177-68.1177.2158.300110.9K93 W157 S288 P289K93-E291 IonicContact NZ-OE1 2.78Å; K93-E291 PolarHBondContact NZ-OE1 3.11Å; W157-E291 WeakPolarHBondContact CZ2-OE1 3.4Å; S288-E291 PolarHBondContact O-N 3.16Å; P289-E291 PolarHBondContact O-N 3.09Å
292V46.7Very low49Very low35 Ų3594.3 Ų94.321%0.21251%0.507CS..Hα-helixtrans-79.5-35.8177.5-176.80000112.4V286 P289 A290 G294 W295 K296V286-V292 HydrophobicContact CG1-CG2 4.06Å; P289-V292 PolarHBondContact O-N 2.77Å; A290-V292 VanDerWaalsContact C-N 3.32Å; V292-G294 VanDerWaalsContact C-N 3.3Å; V292-G294 PolarHBondContact O-N 2.79Å; V292-W295 PolarHBondContact O-N 3.42Å; V292-W295 VanDerWaalsContact O-N 3.16Å; V292-K296 PolarHBondContact O-N 3.24Å
293I45.7Very low48.1Very low86 Ų8690.7 Ų90.744%0.44150%0.502SS..Hα-helixtrans-64.9-35.9177.7-72.4160.1000110.7P289 W295 K296 N297P289-I293 HydrophobicContact CB-CD1 4.32Å; P289-I293 WeakPolarHBondContact O-CB 3.44Å; P289-I293 WeakPolarHBondContact O-CD1 3.28Å; P289-I293 WeakPolarHBondContact O-CG1 3.31Å; P289-I293 PolarHBondContact O-N 3.14Å; I293-W295 PolarHBondContact O-N 3.13Å; I293-K296 PolarHBondContact O-N 3.29Å; I293-N297 VanDerWaalsContact CG2-ND2 3.29Å; I293-N297 WeakPolarHBondContact CG2-ND2 3.29Å; I293-N297 VanDerWaalsContact O-CB 3.25Å; I293-N297 WeakPolarHBondContact O-CB 3.5Å; I293-N297 VanDerWaalsContact O-CG 3.26Å; I293-N297 PolarHBondContact O-N 3.48Å; I293-N297 PolarHBondContact O-ND2 2.77Å
294G47.3Very low47.6Very low40 Ų4093.5 Ų93.541%0.41250%0.495SS..Hα-helixtrans-54.9-38.3172.700000112.7A290 V292 A298A290-G294 PolarHBondContact O-N 2.98Å; V292-G294 VanDerWaalsContact C-N 3.3Å; V292-G294 PolarHBondContact O-N 2.79Å; G294-A298 VanDerWaalsContact O-CB 3.24Å; G294-A298 WeakPolarHBondContact O-CB 3.21Å; G294-A298 PolarHBondContact O-N 2.98Å
295W44.2Very low47.5Very low114 Ų11496.4 Ų96.443%0.43251%0.509SS..Hα-helixtrans-82.3-38.7178.8-8319.3000114.1Y272 V276 V292 I293 N297 A298 F299Y272-W295 AromaticContact CD1-CH2 3.99Å; Y272-W295 HydrophobicContact CD1-CH2 3.99Å; Y272-W295 HydrophobicContact CD1-CZ2 4.13Å; Y272-W295 AromaticContact CE1-CH2 3.68Å; Y272-W295 HydrophobicContact CE1-CH2 3.68Å; Y272-W295 AromaticContact CE1-CZ2 3.67Å; Y272-W295 HydrophobicContact CE1-CZ2 3.67Å; V276-W295 HydrophobicContact CB-CZ3 4.32Å; V276-W295 HydrophobicContact CG1-CZ3 4.07Å; V276-W295 HydrophobicContact CG2-CH2 4.44Å; V292-W295 PolarHBondContact O-N 3.42Å; V292-W295 VanDerWaalsContact O-N 3.16Å; I293-W295 PolarHBondContact O-N 3.13Å; W295-N297 PolarHBondContact O-N 3.31Å; W295-A298 PolarHBondContact O-N 3.4Å; W295-F299 WeakPolarHBondContact O-CB 3.47Å; W295-F299 PolarHBondContact O-N 3.08Å
296K44.8Very low47.6Very low153 Ų15398 Ų9867%0.66551%0.509SS*.Hα-helixtrans-62-37.8171.5-73.6-171.6177.3-176.50111.1V292 I293 R300V292-K296 PolarHBondContact O-N 3.24Å; I293-K296 PolarHBondContact O-N 3.29Å; K296-R300 WeakPolarHBondContact O-CB 3.34Å; K296-R300 PolarHBondContact O-N 3.24Å
297N47Very low47.5Very low83 Ų83100.2 Ų100.244%0.44452%0.517SS..Hα-helixtrans-71.2-40.2174.8-70.6-17.9000112I293 W295 R300 L301I293-N297 VanDerWaalsContact CG2-ND2 3.29Å; I293-N297 WeakPolarHBondContact CG2-ND2 3.29Å; I293-N297 VanDerWaalsContact O-CB 3.25Å; I293-N297 WeakPolarHBondContact O-CB 3.5Å; I293-N297 VanDerWaalsContact O-CG 3.26Å; I293-N297 PolarHBondContact O-N 3.48Å; I293-N297 PolarHBondContact O-ND2 2.77Å; W295-N297 PolarHBondContact O-N 3.31Å; N297-R300 PolarHBondContact O-N 3.22Å; N297-L301 VanDerWaalsContact O-CB 3.31Å; N297-L301 WeakPolarHBondContact O-CB 3.34Å; N297-L301 WeakPolarHBondContact O-CG 3.49Å; N297-L301 PolarHBondContact O-N 3.21Å
298A50.6Low47Very low38 Ų38111.5 Ų111.531%0.31457%0.57SS.*Hα-helixtrans-64.2-43.5174.400000112.3G294 W295 R300 L301 I302G294-A298 VanDerWaalsContact O-CB 3.24Å; G294-A298 WeakPolarHBondContact O-CB 3.21Å; G294-A298 PolarHBondContact O-N 2.98Å; W295-A298 PolarHBondContact O-N 3.4Å; A298-R300 VanDerWaalsContact C-N 3.33Å; A298-R300 PolarHBondContact O-N 3.42Å; A298-L301 PolarHBondContact O-N 2.8Å; A298-I302 WeakPolarHBondContact O-CB 3.46Å; A298-I302 WeakPolarHBondContact O-CD1 3.35Å; A298-I302 WeakPolarHBondContact O-CG1 3.39Å; A298-I302 PolarHBondContact O-N 3.44Å
299F48.5Very low47.1Very low153 Ų153113.9 Ų113.967%0.67158%0.576SS**Hα-helixtrans-64.2-40175.5-131.4-91.3000111.1W295 I302 V303W295-F299 WeakPolarHBondContact O-CB 3.47Å; W295-F299 PolarHBondContact O-N 3.08Å; F299-I302 PolarHBondContact O-N 3.33Å; F299-V303 HydrophobicContact CD1-CG2 3.78Å; F299-V303 HydrophobicContact CE1-CG2 3.98Å; F299-V303 WeakPolarHBondContact O-CB 3.43Å; F299-V303 VanDerWaalsContact O-CG2 3.26Å; F299-V303 WeakPolarHBondContact O-CG2 3.28Å; F299-V303 PolarHBondContact O-N 2.84Å
300R44.5Very low47.4Very low173 Ų173114.7 Ų114.765%0.65357%0.573SS**Hα-helixtrans-65.2-38.8174.9-161.6175-173.5172.21.4111.8K296 N297 A298 F304K296-R300 WeakPolarHBondContact O-CB 3.34Å; K296-R300 PolarHBondContact O-N 3.24Å; N297-R300 PolarHBondContact O-N 3.22Å; A298-R300 VanDerWaalsContact C-N 3.33Å; A298-R300 PolarHBondContact O-N 3.42Å; R300-F304 HydrophobicContact CG-CD2 3.97Å; R300-F304 HydrophobicContact CG-CE2 4.38Å; R300-F304 WeakPolarHBondContact O-CB 3.09Å; R300-F304 PolarHBondContact O-N 2.73Å
301L50.3Low47.5Very low130 Ų130117 Ų11768%0.68157%0.571SS**Hα-helixtrans-74.8-25.7177.7-72.8169.8000113.7N297 A298 P305N297-L301 VanDerWaalsContact O-CB 3.31Å; N297-L301 WeakPolarHBondContact O-CB 3.34Å; N297-L301 WeakPolarHBondContact O-CG 3.49Å; N297-L301 PolarHBondContact O-N 3.21Å; A298-L301 PolarHBondContact O-N 2.8Å; L301-P305 WeakPolarHBondContact O-CD 3.38Å; L301-P305 WeakPolarHBondContact O-CG 3.29Å
302I55.3Low47.3Very low128 Ų128119.9 Ų119.966%0.65659%0.586SS**Hα-helixtrans-85.8-36.2178.4-67.5165.1000111.3A298 F299 P305A298-I302 WeakPolarHBondContact O-CB 3.46Å; A298-I302 WeakPolarHBondContact O-CD1 3.35Å; A298-I302 WeakPolarHBondContact O-CG1 3.39Å; A298-I302 PolarHBondContact O-N 3.44Å; F299-I302 PolarHBondContact O-N 3.33Å; I302-P305 WeakPolarHBondContact O-CD 3.24Å
303V51.8Low47.4Very low78 Ų78125.2 Ų125.247%0.47361%0.609SS.*Hα-helixtrans-85.9-30.6-175.1178.50000112.7F299F299-V303 HydrophobicContact CD1-CG2 3.78Å; F299-V303 HydrophobicContact CE1-CG2 3.98Å; F299-V303 WeakPolarHBondContact O-CB 3.43Å; F299-V303 VanDerWaalsContact O-CG2 3.26Å; F299-V303 WeakPolarHBondContact O-CG2 3.28Å; F299-V303 PolarHBondContact O-N 2.84Å
304F47.1Very low47.5Very low129 Ų129127.8 Ų127.857%0.56662%0.62SS**G310 helixtrans-88.8-8.7-174.4-82.3-89.7000119.2R300 Y306R300-F304 HydrophobicContact CG-CD2 3.97Å; R300-F304 HydrophobicContact CG-CE2 4.38Å; R300-F304 WeakPolarHBondContact O-CB 3.09Å; R300-F304 PolarHBondContact O-N 2.73Å; F304-Y306 PolarHBondContact O-N 2.88Å
305P50.9Low47.5Very low86 Ų86134.1 Ų134.156%0.55864%0.635SS**G310 helixtrans-72.6-5.6177.5-15.329.7000114.6L301 I302L301-P305 WeakPolarHBondContact O-CD 3.38Å; L301-P305 WeakPolarHBondContact O-CG 3.29Å; I302-P305 WeakPolarHBondContact O-CD 3.24Å
306Y46.5Very low47.7Very low213 Ų213135.6 Ų135.684%0.83565%0.651SS**G310 helixtrans-109.314.6-178.5-78.4-79.6000114.5F304F304-Y306 PolarHBondContact O-N 2.88Å
307L41.8Very low48Very low138 Ų138134.2 Ų134.272%0.72365%0.649SS**  trans-125.865.1170.1-77.8167.4000110.3
308Q41.3Very low48.1Very low261 Ų261138.8 Ų138.8100%1.2267%0.668SS**  trans-150.30155-106.3-176.6-30.500108.2

Retrieved 308 of 308 residues in 307.4 ms (Link to these results)