A0A087Y6A4_POEFO Loading...

DAN domain family, member 5

AlphaFold DB , UniProt , Accession A0A087Y6A4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 256 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
1I42.9Very low47.1Very low222 Ų222150.6 Ų150.6100%1.13882%0.818SS**  0108.10-56.3166.9000104.5
2M40.8Very low47.2Very low151 Ų151148.1 Ų148.174%0.74482%0.815SS**  cis-143.3144.137.6-63.2-179.165.100111.1
3A42.8Very low47.3Very low95 Ų95144.8 Ų144.879%0.78582%0.819SS**  trans-87.1130166.500000108.9
4F46.1Very low47.1Very low184 Ų184143.1 Ų143.181%0.80782%0.821SS**  trans-95.2112172.1-84.4-85.8000109.2
5L49.2Very low47.1Very low165 Ų165139.9 Ų139.986%0.86482%0.818SS**  trans-87.8118.7172.3-71.6167.5000108.9S7L5-S7 PolarHBondContact O-N 3.31Å
6I57.8Low46.9Very low158 Ų158137.6 Ų137.681%0.8182%0.82SS**  trans-79.1115.7173.5-62.1169.5000107.6
7S46.4Very low46.7Very low109 Ų109135.4 Ų135.476%0.76281%0.814SS**  trans-85.9117.8173-69.70000110.1L5L5-S7 PolarHBondContact O-N 3.31Å
8L47.4Very low46.4Very low151 Ų151133.1 Ų133.179%0.79181%0.812SS**  trans-89.6113.9172.6-123.3122.5000108.9I10L8-I10 HydrophobicContact CD2-CG1 4.38Å
9V48.4Very low46Very low124 Ų124135.7 Ų135.775%0.75281%0.811SS**  trans-91.1113.1173.9178.30000108.3
10I49.4Very low45.6Very low144 Ų144136.9 Ų136.974%0.73881%0.811SS**  trans-99.5111.3173.8-57.5175.3000107.8L8L8-I10 HydrophobicContact CD2-CG1 4.38Å
11L46.9Very low45.1Very low154 Ų154139 Ų13981%0.80681%0.811SS**PPolyproline II helixtrans-83.3125.9171-82.7138.2000109.7
12P48Very low45Very low120 Ų120133.7 Ų133.778%0.77979%0.79SS**PPolyproline II helixtrans-82.3119172.730.3-29.5000110.7S14P12-S14 PolarHBondContact O-N 3.43Å
13A48.3Very low44.9Very low106 Ų106137 Ų13788%0.87680%0.796SS**PPolyproline II helixtrans-74.1117.2167.700000109.5
14S45.2Very low44.6Very low121 Ų121140 Ų14085%0.84680%0.799SS**PPolyproline II helixtrans-88.5116.9170.648.10000109.4P12P12-S14 PolarHBondContact O-N 3.43Å
15A47Very low44.1Very low94 Ų94136.5 Ų136.578%0.77780%0.797SS**  trans-80.3115.4171.300000109S17A15-S17 PolarHBondContact O-N 3.41Å
16A43.6Very low43.6Very low103 Ų103136.5 Ų136.585%0.85180%0.798SS**  trans-76.6110.7171.700000109.6
17S44.4Very low42.5Very low101 Ų101136.3 Ų136.371%0.70680%0.797SS**  trans-86.2106.9170-50.60000109.5A15 F19A15-S17 PolarHBondContact O-N 3.41Å; S17-F19 PolarHBondContact O-N 3.22Å
18A40.3Very low41.9Very low94 Ų94142.3 Ų142.378%0.77780%0.803SS**  trans-78.2114.1171.400000109.8
19F39Very low40.9Very low183 Ų183142.2 Ų142.280%0.80380%0.799SS**  trans-85.3114.1167.5-80.4-84.4000109.5S17S17-F19 PolarHBondContact O-N 3.22Å
20I38.3Very low40.3Very low158 Ų158140.5 Ų140.581%0.8179%0.792SS**  trans-83.7115.7172-61.2171.2000107.7
21F34.3Very low39.4Very low183 Ų183145.8 Ų145.880%0.80380%0.803SS**PPolyproline II helixtrans-86.5135.1168.9-83.7-87000110.2
22P41.4Very low38.7Very low109 Ų109142 Ų14271%0.70880%0.802SS**PPolyproline II helixtrans-80.8127.3-178.831.1-31000111.6
23Y37.7Very low38Very low220 Ų220145.2 Ų145.286%0.86381%0.806SS**PPolyproline II helixtrans-71.4124.3165.3-117-100.7000109.1
24N38Very low37.4Very low158 Ų158145 Ų14585%0.84580%0.804SS**  trans-112.6102.9160.9-85.1-37.1000108.5
25S35.6Very low36.9Very low111 Ų111147.9 Ų147.978%0.77681%0.805SS**  trans-77.4119164.742.90000108.8
26L38.1Very low36.3Very low166 Ų166149.3 Ų149.387%0.86981%0.809SS**  trans-123.995165.6-134.8161.7000108.7
27L35.3Very low36.2Very low154 Ų154150.4 Ų150.481%0.80681%0.81SS**  trans-70.6119.4173-154.6155.1000107.1
28R32.8Very low35.5Very low235 Ų235149.2 Ų149.289%0.88781%0.814SS**  trans-140.3124.3162.3-158.5170.7-173.8171.51.7111.7
29E27.6Very low35.3Very low149 Ų149148.7 Ų148.770%0.69682%0.818SS**  trans-55.3154-172.2-166.158.8-123.800116
30S36.1Very low34.9Very low88 Ų88143.8 Ų143.862%0.61582%0.818SS**  trans-55.1152.8176.163.40000116.5
31R30.6Very low34.9Very low254 Ų254141.3 Ų141.396%0.95882%0.822SS**  178134.5122.8-123.4176.5169.3180-3.4112.5
32G31Very low35.6Very low76 Ų76136.2 Ų136.278%0.78482%0.821SS**  trans13975.1155.500000114.8
33E32.7Very low35.5Very low186 Ų186140.4 Ų140.487%0.86983%0.831SS**  trans-58.3138.7162.1-72.9154.1127.700111.3
34A36.5Very low35.7Very low102 Ų102134.6 Ų134.684%0.84383%0.829SS**  trans-143.295.4148.600000106.9
35E35.5Very low35.8Very low182 Ų182136.6 Ų136.685%0.8583%0.833SS**  trans-63140.5165.1-69.8175.1102.300110
36S32.5Very low36.3Very low124 Ų124139.9 Ų139.987%0.86784%0.836SS**  trans-149.1113.6142.8-171.10000108.7
37S42.5Very low36.6Very low125 Ų125134.9 Ų134.987%0.87483%0.825SS**  trans-79150176.7-159.90000110.7
38G29.5Very low37.1Very low77 Ų77133.6 Ų133.679%0.79482%0.824SS**  trans177.284.7173.800000111.5
39G35.7Very low37.7Very low83 Ų83128.3 Ų128.386%0.85682%0.817SS**  trans-80.9159.6171.800000112.9
40G31.6Very low38.8Very low79 Ų79129.8 Ų129.881%0.81482%0.821SS**  trans139.5104159.400000116.3
41A37.1Very low39.7Very low107 Ų107131.7 Ų131.788%0.88483%0.829SS**  trans51.8101.8149.800000120.2
42G49.9Very low41Very low76 Ų76124.9 Ų124.978%0.78482%0.815SS**  trans64.286.8131.900000118
43Q39.5Very low41.7Very low196 Ų196130.2 Ų130.292%0.91682%0.82SS**  trans-161.2147.7147.4-116.1164.82900111.1E45Q43-E45 PolarHBondContact O-N 3.35Å
44A42.7Very low42.4Very low99 Ų99126.4 Ų126.482%0.81881%0.805SS**  trans-45.6122.4-171.800000113.1Q46A44-Q46 PolarHBondContact O-N 3.39Å
45E39.8Very low43.4Very low199 Ų199125.1 Ų125.193%0.9378%0.784SS**  trans-70.295.4177-68.1-135.5154.900110.6Q43 G47Q43-E45 PolarHBondContact O-N 3.35Å; E45-G47 PolarHBondContact O-N 2.93Å
46Q44.8Very low44.5Very low180 Ų180121.4 Ų121.484%0.84178%0.776SS**  trans-74.9100.9163.2-170.6169.33.500107.9A44 T48A44-Q46 PolarHBondContact O-N 3.39Å; Q46-T48 PolarHBondContact O-N 2.79Å
47G44.2Very low45.7Very low62 Ų62125.6 Ų125.664%0.63977%0.772SS**  trans-51126.7177.800000111.6E45 V49E45-G47 PolarHBondContact O-N 2.93Å; G47-V49 PolarHBondContact O-N 3.25Å; G47-V49 VanDerWaalsContact O-N 3.12Å
48T46.1Very low46.2Very low127 Ų127125.3 Ų125.378%0.77976%0.761SS**  trans-74.6103.6178.6-60.50000109.6Q46 K50Q46-T48 PolarHBondContact O-N 2.79Å; T48-K50 HydrophobicContact CG2-CG 4.42Å; T48-K50 PolarHBondContact O-N 3.12Å
49V45.8Very low47.3Very low123 Ų123127 Ų12775%0.74575%0.752SS**  trans-79.8100.3168.9-178.30000108.3G47 V51G47-V49 PolarHBondContact O-N 3.25Å; G47-V49 VanDerWaalsContact O-N 3.12Å; V49-V51 HydrophobicContact CG1-CG2 4.17Å; V49-V51 PolarHBondContact O-N 3.23Å; V49-V51 VanDerWaalsContact O-N 3.12Å
50K51.2Low48Very low181 Ų181128.5 Ų128.579%0.78774%0.743SS**  trans-73.999.8166.8-86.2-173.7176.4177.30109T48 V52T48-K50 HydrophobicContact CG2-CG 4.42Å; T48-K50 PolarHBondContact O-N 3.12Å; K50-V52 PolarHBondContact O-N 2.02Å; K50-V52 VanDerWaalsContact O-N 3.08Å
51V54.4Low48.8Very low127 Ų127129.9 Ų129.977%0.7774%0.741SS**  trans-71100.8168.6-178.20000107.7V49 Q53V49-V51 HydrophobicContact CG1-CG2 4.17Å; V49-V51 PolarHBondContact O-N 3.23Å; V49-V51 VanDerWaalsContact O-N 3.12Å; V51-Q53 PolarHBondContact O-N 3.07Å
52V57Low49.1Very low112 Ų112128.9 Ų128.968%0.67973%0.727SS**  trans-78.3109.1170.5-178.30000107.3K50 L54K50-V52 PolarHBondContact O-N 2.02Å; K50-V52 VanDerWaalsContact O-N 3.08Å; V52-L54 HydrophobicContact CG1-CD2 4.04Å; V52-L54 PolarHBondContact O-N 3.12Å; V52-L54 VanDerWaalsContact O-N 3.07Å
53Q46Very low48.9Very low187 Ų187129.8 Ų129.887%0.87473%0.727SS**  trans-7499.1176-156.8169.525.100108.4V51 D55V51-Q53 PolarHBondContact O-N 3.07Å; Q53-D55 PolarHBondContact O-N 3.26Å
54L48.3Very low49.4Very low107 Ų107129.2 Ų129.256%0.5672%0.722SS**  trans-74.4110.9176.6-63.8176.1000108.8V52 P56V52-L54 HydrophobicContact CG1-CD2 4.04Å; V52-L54 PolarHBondContact O-N 3.12Å; V52-L54 VanDerWaalsContact O-N 3.07Å; L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.36Å
55D57.6Low49.5Very low74 Ų74133.6 Ų133.640%0.39672%0.723SS.*  trans-70.7116.5173-176.8-7.1000109.5Q53 R57 N58Q53-D55 PolarHBondContact O-N 3.26Å; D55-R57 PolarHBondContact O-N 3.03Å; D55-R57 WeakPolarHBondContact OD1-CB 3.4Å; D55-R57 PolarHBondContact OD1-N 2.84Å; D55-N58 PolarHBondContact O-N 3.31Å; D55-N58 VanDerWaalsContact O-N 3.16Å; D55-N58 PolarHBondContact OD2-ND2 3.28Å
56P59Low49.9Very low105 Ų105136 Ų13668%0.68272%0.723SS**THydrogen-bonded Turntrans-57.9-20.3179.7-21.331.7000113.7L54L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.36Å
57R57.1Low49.6Very low211 Ų211139.7 Ų139.780%0.79673%0.73SS**THydrogen-bonded Turntrans-79-23.3-177.4-60.9-176.6179.3-145.80.5113.2D55D55-R57 PolarHBondContact O-N 3.03Å; D55-R57 WeakPolarHBondContact OD1-CB 3.4Å; D55-R57 PolarHBondContact OD1-N 2.84Å
58N51.8Low49.3Very low120 Ų120140.1 Ų140.164%0.64273%0.734SS**G310 helixtrans-89.2-6.6-176.7-69.1-42.9000114.1D55D55-N58 PolarHBondContact O-N 3.31Å; D55-N58 VanDerWaalsContact O-N 3.16Å; D55-N58 PolarHBondContact OD2-ND2 3.28Å
59L54.3Low48.9Very low113 Ų113142.4 Ų142.459%0.59274%0.741SS**G310 helixtrans-90.42.6177-64.8174.9000113.8S61L59-S61 VanDerWaalsContact C-N 3.26Å; L59-S61 PolarHBondContact O-N 2.77Å
60V50.4Low48.6Very low113 Ų113143.6 Ų143.669%0.68575%0.748SS**G310 helixtrans-81.5-0.1-178-176.20000112.6S62V60-S62 PolarHBondContact O-N 2.85Å
61S47.8Very low48.3Very low109 Ų109142.9 Ų142.976%0.76275%0.748SS**G310 helixtrans-85.22.6-176.481.90000115.6L59 A63L59-S61 VanDerWaalsContact C-N 3.26Å; L59-S61 PolarHBondContact O-N 2.77Å; S61-A63 PolarHBondContact O-N 3.43Å
62S42.8Very low47.5Very low86 Ų86148.2 Ų148.260%0.60175%0.754SS**SBendtrans-74.7107.7167.464.10000109.3V60 F64V60-S62 PolarHBondContact O-N 2.85Å; S62-F64 VanDerWaalsContact C-N 3.33Å; S62-F64 PolarHBondContact O-N 2.73Å
63A46.7Very low46.1Very low94 Ų94146.7 Ų146.778%0.77776%0.761SS**SBendtrans-63.970.4-168.100000115.6S61S61-A63 PolarHBondContact O-N 3.43Å
64F49.8Very low45.7Very low184 Ų184142.3 Ų142.381%0.80776%0.757SS**  trans-128.25171.4-86.3-81.1000115.5S62S62-F64 VanDerWaalsContact C-N 3.33Å; S62-F64 PolarHBondContact O-N 2.73Å
65F44.1Very low45.6Very low192 Ų192142.7 Ų142.784%0.84277%0.766SS**  trans-127.668.6177-63.9-77.3000112.3
66R48.4Very low44.7Very low248 Ų248144 Ų14494%0.93678%0.781SS**  trans-135.283.8160.5-73-162.4-169.2-139.15.3111.2
67R39.6Very low44Very low258 Ų258148.1 Ų148.197%0.97479%0.791SS**SBendtrans-174116.5154.2-105.1176.6-172.9-177.72.3106.3
68G36.4Very low43Very low71 Ų71142.5 Ų142.573%0.73279%0.789SS**  cis-160.2132.6-8.600000106.8
69L37.8Very low42.6Very low176 Ų176142 Ų14292%0.92180%0.795SS**  trans-128.9103.3162.1-82.2169.2000105.4
70T39.9Very low42.4Very low147 Ų147148.2 Ų148.290%0.90281%0.811SS**  trans-71.5125169.340.20000108.3
71Q44.1Very low42.4Very low167 Ų167151 Ų15178%0.7882%0.821SS**  trans-78.5151.8170.6-78.4-1693.600111.3
72R37.6Very low42.7Very low238 Ų238151.2 Ų151.290%0.89882%0.823SS**  trans87110140.9-107.9176.4-169177.13.9119.7
73G28.9Very low43Very low80 Ų80155.4 Ų155.483%0.82583%0.83SS**  trans-163.4111.2141.400000109.2
74A37Very low43.8Very low95 Ų95154.5 Ų154.579%0.78582%0.816SS**  trans-90.1149.8157.100000106.6
75P47Very low44.1Very low115 Ų115149.5 Ų149.575%0.74781%0.809SS**  -150.9175.571.136.6-15.1000117.2
76S37.5Very low44.9Very low101 Ų101147.8 Ų147.871%0.70680%0.801SS**  trans75.6120.8147.658.40000121.9
77H45.2Very low45.3Very low193 Ų193141 Ų14189%0.89478%0.783SS**  trans29.8109.1138-76.2-102.4000118.4
78A35.9Very low46.1Very low93 Ų93133.3 Ų133.377%0.76977%0.769SS**  trans-173.5135.8130.100000112
79S44.2Very low47.1Very low110 Ų110140.6 Ų140.677%0.76978%0.775SS**  trans58.2100.6151.637.90000119.3L81S79-L81 PolarHBondContact O-N 3.07Å
80R49.9Very low47.7Very low243 Ų243135.2 Ų135.292%0.91776%0.762SS**  trans-43.1128.2152.4-63.6174.6-172.8-109.60.3109.8S82R80-S82 PolarHBondContact O-N 2.87Å
81L50.4Low48.4Very low171 Ų171139.9 Ų139.990%0.89576%0.763SS**PPolyproline II helixtrans-57.5121.7170.3-68.5165.1000109.2S79 F83S79-L81 PolarHBondContact O-N 3.07Å; L81-F83 PolarHBondContact O-N 3.08Å
82S54.4Low48.6Very low114 Ų114138 Ų13880%0.79777%0.765SS**PPolyproline II helixtrans-62.9129.4177.9-38.70000109.9R80R80-S82 PolarHBondContact O-N 2.87Å
83F48.9Very low49Very low174 Ų174129.4 Ų129.476%0.76375%0.75SS**PPolyproline II helixtrans-55.1146.1167.9-86.6-97.8000110.6L81 A85 L87L81-F83 PolarHBondContact O-N 3.08Å; F83-A85 PolarHBondContact O-N 2.82Å; F83-L87 HydrophobicContact CD1-CD1 4.44Å
84P61.8Low50Low74 Ų74132.3 Ų132.348%0.48176%0.755SS.*PPolyproline II helixtrans-61.5136.1178.624.3-32.6000111.4F86 L87P84-F86 HydrophobicContact CB-CD1 4.03Å; P84-F86 HydrophobicContact CB-CE1 4.38Å; P84-F86 HydrophobicContact CG-CD1 4.07Å; P84-F86 HydrophobicContact CG-CE1 3.96Å; P84-F86 PolarHBondContact O-N 2.8Å; P84-L87 PolarHBondContact O-N 3.25Å; P84-L87 VanDerWaalsContact O-N 3.15Å
85A57.8Low50Low79 Ų79132.5 Ų132.565%0.65376%0.756SS**THydrogen-bonded Turntrans-59.9-9-170.400000115.8F83 L87 S88F83-A85 PolarHBondContact O-N 2.82Å; A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 2.79Å; A85-S88 WeakPolarHBondContact CA-OG 3.11Å; A85-S88 PolarHBondContact O-OG 2.97Å
86F60.9Low50Low156 Ų156136.1 Ų136.168%0.68476%0.763SS**THydrogen-bonded Turntrans-75-18.7177.192.9-91.7000113P84P84-F86 HydrophobicContact CB-CD1 4.03Å; P84-F86 HydrophobicContact CB-CE1 4.38Å; P84-F86 HydrophobicContact CG-CD1 4.07Å; P84-F86 HydrophobicContact CG-CE1 3.96Å; P84-F86 PolarHBondContact O-N 2.8Å
87L56Low50Low106 Ų106135.8 Ų135.856%0.55577%0.766SS**SBendtrans-94.9-10.9179-64.1175.5000113.6F83 P84 A85 R89F83-L87 HydrophobicContact CD1-CD1 4.44Å; P84-L87 PolarHBondContact O-N 3.25Å; P84-L87 VanDerWaalsContact O-N 3.15Å; A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 2.79Å; L87-R89 VanDerWaalsContact C-N 3.3Å
88S57.2Low49.8Very low97 Ų97132.5 Ų132.568%0.67876%0.762SS**SBendtrans-81.9-4.2177.137.10000114.3A85 G90A85-S88 WeakPolarHBondContact CA-OG 3.11Å; A85-S88 PolarHBondContact O-OG 2.97Å; S88-G90 PolarHBondContact O-N 3.02Å
89R57.3Low50.4Low224 Ų224137.6 Ų137.685%0.84577%0.767SS**SBendtrans-87.487.7171-72.7-91.6166.685.9-3.5108.1L87L87-R89 VanDerWaalsContact C-N 3.3Å
90G48.9Very low50.3Low63 Ų63139.4 Ų139.465%0.64977%0.768SS**  trans-53.3150.2167.300000111.6S88S88-G90 PolarHBondContact O-N 3.02Å
91R56Low50.4Low245 Ų245133.8 Ų133.893%0.92576%0.763SS**  trans-42.1123.9174.4-117.9-177.2-167.9-164.83.7111.1G93R91-G93 PolarHBondContact O-N 3.16Å
92P48.4Very low50.1Low128 Ų128131.9 Ų131.983%0.83176%0.758SS**  trans-61.6118.5163.7-18.831.2000109.1
93G46Very low49.6Very low57 Ų57130.4 Ų130.459%0.58875%0.748SS**  trans-67.516616600000111.3R91 A95R91-G93 PolarHBondContact O-N 3.16Å; G93-A95 PolarHBondContact O-N 3.18Å
94P48.2Very low49.5Very low141 Ų141128.1 Ų128.192%0.91675%0.75SS**  trans-71.4115-167.829.3-32.1000110.8
95A38.9Very low48.8Very low98 Ų98131.1 Ų131.181%0.8176%0.762SS**PPolyproline II helixtrans-85.4137168.500000109.9G93G93-A95 PolarHBondContact O-N 3.18Å
96Q45.5Very low48.1Very low192 Ų192138.4 Ų138.490%0.89777%0.772SS**PPolyproline II helixtrans-60.8139.5178.7-71.1174.7-18.900111.8
97A38.4Very low47.6Very low94 Ų94139.9 Ų139.978%0.77778%0.781SS**PPolyproline II helixtrans-74.7134.4-177.500000112.7
98P41.5Very low47.1Very low124 Ų124142.6 Ų142.681%0.80580%0.795SS**PPolyproline II helixtrans-78.3132.5151.5-9.627.5000109.5D100P98-D100 PolarHBondContact O-N 2.86Å
99K47.6Very low46.7Very low199 Ų199149 Ų14987%0.86580%0.804SS**PPolyproline II helixtrans-62.1121172.1-70172.1176.5175.20109.5
100D41.9Very low46.2Very low148 Ų148143.9 Ų143.979%0.79180%0.8SS**  trans-171.4138135-87.3-27.9000110P98 V102P98-D100 PolarHBondContact O-N 2.86Å; D100-V102 PolarHBondContact O-N 2.79Å
101P51.5Low46.3Very low125 Ų125145.5 Ų145.581%0.81279%0.791SS**  trans-92.588.4-173.935.4-29.2000110.2
102V45.7Very low46.2Very low132 Ų132143.2 Ų143.280%0.878%0.782SS**  trans-125.588162.8-174.70000108.4D100 P104D100-V102 PolarHBondContact O-N 2.79Å; V102-P104 WeakPolarHBondContact O-CD 3.06Å
103S42.6Very low46.6Very low82 Ų82141.9 Ų141.957%0.57377%0.774SS**  trans-60.6120172.3-177.60000110.1L105S103-L105 PolarHBondContact O-N 2.86Å
104P48.4Very low47.5Very low127 Ų127142.1 Ų142.183%0.82577%0.77SS**SBendtrans-81.842.5172.534.3-31.8000111V102V102-P104 WeakPolarHBondContact O-CD 3.06Å
105L45.6Very low48.2Very low136 Ų136139.1 Ų139.171%0.71274%0.744SS**  trans-112.763.1173.6-73.2178.8000110.6S103S103-L105 PolarHBondContact O-N 2.86Å
106R44.5Very low49.6Very low232 Ų232136.9 Ų136.988%0.87573%0.725SS**  trans-138.819.1167.3-81-147.1174.4-168.71.8116.7
107H50.3Low50.9Low188 Ų188131.6 Ų131.687%0.8770%0.703SS**  trans-121.714.2173.9-68.1-8.2000115.8R109H107-R109 VanDerWaalsContact C-N 3.32Å; H107-R109 PolarHBondContact O-N 2.82Å
108L45.6Very low52.7Low163 Ų163132.7 Ų132.785%0.85370%0.695SS**  trans-90.180.1156.9-66.5176.9000108.3P110L108-P110 VanDerWaalsContact O-CD 3.32Å; L108-P110 WeakPolarHBondContact O-CD 3.44Å
109R48.8Very low54.3Low230 Ų230131.4 Ų131.487%0.86868%0.677SS**  trans-58.2120.7159.5-168.5175.3-171.8148.81.4105.8H107 Q111H107-R109 VanDerWaalsContact C-N 3.32Å; H107-R109 PolarHBondContact O-N 2.82Å; R109-Q111 PolarHBondContact O-N 2.81Å
110P46.4Very low55.7Low117 Ų117128.9 Ų128.976%0.7667%0.666SS**  trans-59.6107172.1-17.930.2000106.6L108 R112L108-P110 VanDerWaalsContact O-CD 3.32Å; L108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-R112 PolarHBondContact O-N 2.86Å
111Q51.3Low57.7Low98 Ų98128.2 Ų128.246%0.45866%0.656SS.*  trans-56.3130.4162.8-80.2-144.4-30.200105.8R109 E115 K119R109-Q111 PolarHBondContact O-N 2.81Å; Q111-E115 PolarHBondContact NE2-OE1 3.21Å; Q111-E115 PolarHBondContact OE1-OE1 2.93Å; Q111-K119 VanDerWaalsContact NE2-NZ 3.16Å
112R54.2Low59.2Low196 Ų196127.8 Ų127.874%0.7464%0.643SS**  trans-49.9138.3-176.7-69.2178.5179135.6-4.7108.4P110 A114 E115 A116P110-R112 PolarHBondContact O-N 2.86Å; R112-A114 PolarHBondContact O-N 3.17Å; R112-E115 PolarHBondContact O-N 3.38Å; R112-A116 PolarHBondContact O-N 3.48Å
113P56.4Low61Low101 Ų101122.9 Ų122.966%0.65662%0.619SS**Hα-helixtrans-47.4-39.5-177.6-28.334.1000112.2E115 A116 D117P113-E115 PolarHBondContact O-N 3.43Å; P113-A116 PolarHBondContact O-N 3.47Å; P113-D117 WeakPolarHBondContact O-CB 3.48Å; P113-D117 PolarHBondContact O-N 2.8Å; P113-D117 VanDerWaalsContact O-OD2 3.09Å
114A63.7Low62.8Low61 Ų61123.8 Ų123.850%0.50462%0.617SS.*Hα-helixtrans-60.1-35.3176.400000115.1R112 L118R112-A114 PolarHBondContact O-N 3.17Å; A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.32Å; A114-L118 WeakPolarHBondContact O-CD1 3.43Å; A114-L118 WeakPolarHBondContact O-CG 3.38Å; A114-L118 PolarHBondContact O-N 2.88Å
115E64.4Low64.5Low79 Ų79123.5 Ų123.537%0.36961%0.605SS.*Hα-helixtrans-76.5-37.9179.8-161.8-170.7149.600111.3Q111 R112 P113 L118 K119Q111-E115 PolarHBondContact NE2-OE1 3.21Å; Q111-E115 PolarHBondContact OE1-OE1 2.93Å; R112-E115 PolarHBondContact O-N 3.38Å; P113-E115 PolarHBondContact O-N 3.43Å; E115-L118 PolarHBondContact O-N 2.91Å; E115-K119 WeakPolarHBondContact O-CB 3.39Å; E115-K119 VanDerWaalsContact O-CG 3.3Å; E115-K119 WeakPolarHBondContact O-CG 3.44Å; E115-K119 PolarHBondContact O-N 2.76Å; E115-K119 IonicContact OE1-NZ 2.68Å; E115-K119 PolarHBondContact OE1-NZ 3.28Å
116A66.9Low66.2Low50 Ų50122.5 Ų122.541%0.41360%0.598SS.*Hα-helixtrans-67.1-40.3172.600000111.3R112 P113 K119 K120R112-A116 PolarHBondContact O-N 3.48Å; P113-A116 PolarHBondContact O-N 3.47Å; A116-K119 PolarHBondContact O-N 2.97Å; A116-K120 WeakPolarHBondContact O-CB 3.41Å; A116-K120 PolarHBondContact O-N 2.83Å
117D72.7Confident67.6Low82 Ų82118.9 Ų118.944%0.43958%0.584SS.*Hα-helixtrans-67.6-37.9175.6-72.7-34.5000112.2P113 K120 K121P113-D117 WeakPolarHBondContact O-CB 3.48Å; P113-D117 PolarHBondContact O-N 2.8Å; P113-D117 VanDerWaalsContact O-OD2 3.09Å; D117-K120 PolarHBondContact O-N 3.48Å; D117-K121 WeakPolarHBondContact O-CB 3.49Å; D117-K121 VanDerWaalsContact O-CG 3.22Å; D117-K121 WeakPolarHBondContact O-CG 3.31Å; D117-K121 PolarHBondContact O-N 2.8Å
118L76.6Confident68.9Low117 Ų117114.3 Ų114.361%0.61356%0.563SS**Hα-helixtrans-63.7-44.6172.5-81.7164.1000111.2A114 E115 K120 K121 Q122A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.32Å; A114-L118 WeakPolarHBondContact O-CD1 3.43Å; A114-L118 WeakPolarHBondContact O-CG 3.38Å; A114-L118 PolarHBondContact O-N 2.88Å; E115-L118 PolarHBondContact O-N 2.91Å; L118-K120 PolarHBondContact O-N 2.95Å; L118-K121 PolarHBondContact O-N 3.47Å; L118-Q122 WeakPolarHBondContact O-CB 3.36Å; L118-Q122 PolarHBondContact O-N 2.92Å
119K75.5Confident70.5Confident97 Ų97113.4 Ų113.442%0.42255%0.552SS.*Hα-helixtrans-64.6-38.1175.7-73.7172.9-174.9167.90112.2Q111 E115 A116 Q122 G123Q111-K119 VanDerWaalsContact NE2-NZ 3.16Å; E115-K119 WeakPolarHBondContact O-CB 3.39Å; E115-K119 VanDerWaalsContact O-CG 3.3Å; E115-K119 WeakPolarHBondContact O-CG 3.44Å; E115-K119 PolarHBondContact O-N 2.76Å; E115-K119 IonicContact OE1-NZ 2.68Å; E115-K119 PolarHBondContact OE1-NZ 3.28Å; A116-K119 PolarHBondContact O-N 2.97Å; K119-Q122 PolarHBondContact O-N 2.87Å; K119-G123 PolarHBondContact O-N 3.43Å
120K77.8Confident71.5Confident145 Ų145107.2 Ų107.263%0.6354%0.54SS*.Hα-helixtrans-65.8-45.9174.8-174.3178.6177.4-178.20111.7A116 D117 L118 Q122 G123 L124A116-K120 WeakPolarHBondContact O-CB 3.41Å; A116-K120 PolarHBondContact O-N 2.83Å; D117-K120 PolarHBondContact O-N 3.48Å; L118-K120 PolarHBondContact O-N 2.95Å; K120-Q122 VanDerWaalsContact C-N 3.34Å; K120-G123 PolarHBondContact O-N 3.42Å; K120-L124 HydrophobicContact CG-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CG 3.05Å; K120-L124 PolarHBondContact O-N 2.73Å
121K82.2Confident72.6Confident134 Ų134105.3 Ų105.358%0.58352%0.522SS*.Hα-helixtrans-62.7-41174.6-74174.9-178.2-175.50111.5D117 L118 L124 Q125D117-K121 WeakPolarHBondContact O-CB 3.49Å; D117-K121 VanDerWaalsContact O-CG 3.22Å; D117-K121 WeakPolarHBondContact O-CG 3.31Å; D117-K121 PolarHBondContact O-N 2.8Å; L118-K121 PolarHBondContact O-N 3.47Å; K121-L124 PolarHBondContact O-N 2.92Å; K121-Q125 WeakPolarHBondContact O-CB 3.18Å; K121-Q125 VanDerWaalsContact O-CG 3.31Å; K121-Q125 WeakPolarHBondContact O-CG 3.27Å; K121-Q125 PolarHBondContact O-N 3Å
122Q84.7Confident73.2Confident116 Ų116106 Ų10654%0.54253%0.529SS..Hα-helixtrans-64.7-42.7175.3-169.4175.720.400111.4L118 K119 K120 Q125 M126L118-Q122 WeakPolarHBondContact O-CB 3.36Å; L118-Q122 PolarHBondContact O-N 2.92Å; K119-Q122 PolarHBondContact O-N 2.87Å; K120-Q122 VanDerWaalsContact C-N 3.34Å; Q122-Q125 PolarHBondContact O-N 3.18Å; Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.47Å; Q122-M126 PolarHBondContact O-N 3.48Å
123G81.4Confident73.5Confident29 Ų29105.5 Ų105.530%0.29953%0.532SS..Hα-helixtrans-60-45173.700000113K119 K120 M126 W127K119-G123 PolarHBondContact O-N 3.43Å; K120-G123 PolarHBondContact O-N 3.42Å; G123-M126 PolarHBondContact O-N 3.36Å; G123-W127 WeakPolarHBondContact O-CB 3.31Å; G123-W127 PolarHBondContact O-N 2.83Å
124L82.4Confident73.3Confident101 Ų101103.6 Ų103.653%0.52953%0.531SS..Hα-helixtrans-63.1-43175.2-75.7165000112K120 K121 M126 W127 Q128K120-L124 HydrophobicContact CG-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CG 3.05Å; K120-L124 PolarHBondContact O-N 2.73Å; K121-L124 PolarHBondContact O-N 2.92Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 2.04Å; L124-W127 PolarHBondContact O-N 3.38Å; L124-Q128 VanDerWaalsContact O-CB 3.32Å; L124-Q128 WeakPolarHBondContact O-CB 3.47Å; L124-Q128 PolarHBondContact O-N 2.96Å
125Q82.4Confident72.7Confident121 Ų121103 Ų10357%0.56553%0.53SS*.Hα-helixtrans-65.7-35175.9-74.3-1805.900112.5K121 Q122 K129K121-Q125 WeakPolarHBondContact O-CB 3.18Å; K121-Q125 VanDerWaalsContact O-CG 3.31Å; K121-Q125 WeakPolarHBondContact O-CG 3.27Å; K121-Q125 PolarHBondContact O-N 3Å; Q122-Q125 PolarHBondContact O-N 3.18Å; Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 VanDerWaalsContact O-CG 3.22Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å; Q125-K129 PolarHBondContact O-N 3.04Å
126M81.6Confident72.5Confident115 Ų115108.4 Ų108.457%0.56755%0.553SS**Hα-helixtrans-67.2-43.3173-72.9-170.8-5800111.4Q122 G123 L124 K129 V130Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.47Å; Q122-M126 PolarHBondContact O-N 3.48Å; G123-M126 PolarHBondContact O-N 3.36Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 2.04Å; M126-K129 PolarHBondContact O-N 2.83Å; M126-V130 WeakPolarHBondContact O-CG2 3.25Å; M126-V130 PolarHBondContact O-N 2.83Å
127W74.8Confident72Confident157 Ų157111 Ų11160%0.59556%0.563SS**Hα-helixtrans-64.6-45.8177.4-171.480000111.8G123 L124 K129 V130 M131G123-W127 WeakPolarHBondContact O-CB 3.31Å; G123-W127 PolarHBondContact O-N 2.83Å; L124-W127 PolarHBondContact O-N 3.38Å; W127-K129 VanDerWaalsContact C-N 3.31Å; W127-K129 PolarHBondContact O-N 2.68Å; W127-V130 WeakPolarHBondContact O-CA 3.47Å; W127-V130 WeakPolarHBondContact O-CB 3.33Å; W127-V130 PolarHBondContact O-N 3.17Å; W127-M131 HydrophobicContact CD2-CG 4.07Å; W127-M131 HydrophobicContact CE3-CG 4.12Å; W127-M131 HydrophobicContact CH2-CE 4.38Å; W127-M131 HydrophobicContact CH2-CG 4.06Å; W127-M131 HydrophobicContact CZ2-CE 4.31Å; W127-M131 HydrophobicContact CZ2-CG 3.99Å; W127-M131 HydrophobicContact CZ2-SD 4.08Å; W127-M131 HydrophobicContact CZ3-CG 4.12Å; W127-M131 WeakPolarHBondContact O-CG 3.29Å; W127-M131 PolarHBondContact O-N 3.25Å
128Q77.9Confident71.4Confident91 Ų91111.9 Ų111.943%0.42558%0.575SS.*Hα-helixtrans-59.3-42.6175-166.666.143.400111.2L124 V130 M131 D132L124-Q128 VanDerWaalsContact O-CB 3.32Å; L124-Q128 WeakPolarHBondContact O-CB 3.47Å; L124-Q128 PolarHBondContact O-N 2.96Å; Q128-V130 VanDerWaalsContact C-N 3.25Å; Q128-V130 PolarHBondContact O-N 2.72Å; Q128-M131 PolarHBondContact O-N 3.33Å; Q128-D132 WeakPolarHBondContact CG-OD2 3.45Å; Q128-D132 PolarHBondContact NE2-OD1 2.04Å; Q128-D132 PolarHBondContact NE2-OD2 3.46Å; Q128-D132 VanDerWaalsContact O-CB 3.29Å; Q128-D132 WeakPolarHBondContact O-CB 3.31Å; Q128-D132 PolarHBondContact O-N 3.18Å
129K77.6Confident70.8Confident144 Ų144110.2 Ų110.263%0.62657%0.567SS**Hα-helixtrans-62.6-27.9173.2-79.3174.8-178.7177.30113.4Q125 M126 W127 K133Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 VanDerWaalsContact O-CG 3.22Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å; Q125-K129 PolarHBondContact O-N 3.04Å; M126-K129 PolarHBondContact O-N 2.83Å; W127-K129 VanDerWaalsContact C-N 3.31Å; W127-K129 PolarHBondContact O-N 2.68Å; K129-K133 WeakPolarHBondContact O-CB 3.39Å; K129-K133 PolarHBondContact O-N 3.39Å
130V71.4Confident70.4Confident100 Ų100112.2 Ų112.261%0.60659%0.589SS**Hα-helixtrans-76.7-39.7175.8171.40000110.8M126 W127 Q128M126-V130 WeakPolarHBondContact O-CG2 3.25Å; M126-V130 PolarHBondContact O-N 2.83Å; W127-V130 WeakPolarHBondContact O-CA 3.47Å; W127-V130 WeakPolarHBondContact O-CB 3.33Å; W127-V130 PolarHBondContact O-N 3.17Å; Q128-V130 VanDerWaalsContact C-N 3.25Å; Q128-V130 PolarHBondContact O-N 2.72Å
131M68.4Low69.9Low78 Ų78109.9 Ų109.938%0.38459%0.587SS.*Hα-helixtrans-69.7-44.4177.1-61.8-61-7400111.9W127 Q128 K133 V137W127-M131 HydrophobicContact CD2-CG 4.07Å; W127-M131 HydrophobicContact CE3-CG 4.12Å; W127-M131 HydrophobicContact CH2-CE 4.38Å; W127-M131 HydrophobicContact CH2-CG 4.06Å; W127-M131 HydrophobicContact CZ2-CE 4.31Å; W127-M131 HydrophobicContact CZ2-CG 3.99Å; W127-M131 HydrophobicContact CZ2-SD 4.08Å; W127-M131 HydrophobicContact CZ3-CG 4.12Å; W127-M131 WeakPolarHBondContact O-CG 3.29Å; W127-M131 PolarHBondContact O-N 3.25Å; Q128-M131 PolarHBondContact O-N 3.33Å; M131-K133 PolarHBondContact O-N 3.37Å; M131-V137 HydrophobicContact CE-CG2 3.97Å; M131-V137 HydrophobicContact SD-CG2 4.15Å
132D64.2Low69.2Low113 Ų113107.5 Ų107.560%0.60458%0.581SS**Hα-helixtrans-73.6-25-178.1-67.8-11.1000113Q128 G134Q128-D132 WeakPolarHBondContact CG-OD2 3.45Å; Q128-D132 PolarHBondContact NE2-OD1 2.04Å; Q128-D132 PolarHBondContact NE2-OD2 3.46Å; Q128-D132 VanDerWaalsContact O-CB 3.29Å; Q128-D132 WeakPolarHBondContact O-CB 3.31Å; Q128-D132 PolarHBondContact O-N 3.18Å; D132-G134 PolarHBondContact O-N 3.24Å
133K61.5Low68.4Low185 Ų185104.3 Ų104.380%0.80457%0.567SS**THydrogen-bonded Turntrans-75.419.4179.3-159.5175.3-170.3-170.40113K129 M131 G135K129-K133 WeakPolarHBondContact O-CB 3.39Å; K129-K133 PolarHBondContact O-N 3.39Å; M131-K133 PolarHBondContact O-N 3.37Å; K133-G135 PolarHBondContact O-N 3.03Å; K133-G135 VanDerWaalsContact O-N 3.17Å
134G51.3Low67.7Low61 Ų61111.9 Ų111.963%0.62959%0.592SS**THydrogen-bonded Turntrans65.823.3167.600000113.5D132 K136D132-G134 PolarHBondContact O-N 3.24Å; G134-K136 VanDerWaalsContact C-N 3.25Å; G134-K136 PolarHBondContact O-N 2.84Å
135G51.9Low66.8Low47 Ų47113.3 Ų113.349%0.48560%0.6SS.*  trans-68.593.416300000106.7K133 V137K133-G135 PolarHBondContact O-N 3.03Å; K133-G135 VanDerWaalsContact O-N 3.17Å; G135-V137 PolarHBondContact O-N 3.04Å
136K59Low66.4Low194 Ų194110.4 Ų110.484%0.84359%0.591SS**  trans-43113.7165.1-67.9178-177.8-179.40105.5G134 S138G134-K136 VanDerWaalsContact C-N 3.25Å; G134-K136 PolarHBondContact O-N 2.84Å; K136-S138 PolarHBondContact O-N 3.38Å
137V55.8Low66.4Low105 Ų105114 Ų11464%0.63660%0.603SS**  trans-61.792.2168.2174.30000104.1M131 G135 L139M131-V137 HydrophobicContact CE-CG2 3.97Å; M131-V137 HydrophobicContact SD-CG2 4.15Å; G135-V137 PolarHBondContact O-N 3.04Å; V137-L139 PolarHBondContact O-N 3.26Å; V137-L139 VanDerWaalsContact O-N 3.1Å
138S60.3Low67Low99 Ų99110.2 Ų110.269%0.69259%0.592SS**  trans-71.8109.7179.353.80000104.6K136K136-S138 PolarHBondContact O-N 3.38Å
139L64.6Low67.8Low83 Ų83108.7 Ų108.744%0.43559%0.589SS.*  trans-52.6139.2168.3-64.2167.1000107.3V137 V141 L181 V183V137-L139 PolarHBondContact O-N 3.26Å; V137-L139 VanDerWaalsContact O-N 3.1Å; L139-V141 PolarHBondContact O-N 2.91Å; L139-L181 HydrophobicContact CD1-CD1 4.34Å; L139-V183 HydrophobicContact CD1-CG2 3.51Å; L139-V183 HydrophobicContact CD2-CG2 4.38Å
140P67.8Low68.7Low138 Ų138103.2 Ų103.290%0.89657%0.569SS**SBendtrans-62.9-3.7176.525.9-33.6000112.7
141V67.3Low70Confident96 Ų96102.1 Ų102.158%0.58256%0.562SS**  trans-99.4113.5176.3-176.50000109.5L139 L143L139-V141 PolarHBondContact O-N 2.91Å; V141-L143 HydrophobicContact CG1-CD1 4.2Å
142N66.8Low71.4Confident84 Ų8499.9 Ų99.945%0.44956%0.556SS.*  trans-99116.8169.2-176.6-18.8000109.4K144 D145N142-K144 PolarHBondContact O-N 2.84Å; N142-K144 WeakPolarHBondContact OD1-CA 3.27Å; N142-K144 WeakPolarHBondContact OD1-CB 3.06Å; N142-K144 PolarHBondContact OD1-N 3.4Å; N142-D145 WeakPolarHBondContact CB-OD2 3.1Å; N142-D145 WeakPolarHBondContact O-CB 3.49Å; N142-D145 PolarHBondContact O-N 3.26Å
143L67.9Low73Confident50 Ų5097.1 Ų97.126%0.26254%0.544SS..THydrogen-bonded Turntrans-66.3-18-179.5-90.668.7000113.1V141 D145 T146 L181V141-L143 HydrophobicContact CG1-CD1 4.2Å; L143-D145 PolarHBondContact O-N 2.95Å; L143-T146 PolarHBondContact O-OG1 2.04Å; L143-L181 HydrophobicContact CD1-CB 4.21Å; L143-L181 HydrophobicContact CD1-CD2 3.25Å; L143-L181 HydrophobicContact CD1-CG 4.32Å; L143-L181 HydrophobicContact CD2-CD2 3.73Å; L143-L181 HydrophobicContact CG-CD2 4.12Å
144K66.2Low74.7Confident187 Ų18793.2 Ų93.281%0.81354%0.537SS*.THydrogen-bonded Turntrans-70.9-24.2174.6-160.2174.2-179.4-178.40112.3N142N142-K144 PolarHBondContact O-N 2.84Å; N142-K144 WeakPolarHBondContact OD1-CA 3.27Å; N142-K144 WeakPolarHBondContact OD1-CB 3.06Å; N142-K144 PolarHBondContact OD1-N 3.4Å
145D64.8Low77Confident131 Ų13193.8 Ų93.870%0.70152%0.522SS*.THydrogen-bonded Turntrans-84.2-19.6-178.9-59.6-17.6000111.8N142 L143 K147N142-D145 WeakPolarHBondContact CB-OD2 3.1Å; N142-D145 WeakPolarHBondContact O-CB 3.49Å; N142-D145 PolarHBondContact O-N 3.26Å; L143-D145 PolarHBondContact O-N 2.95Å; D145-K147 PolarHBondContact O-N 3.47Å
146T73.2Confident79.2Confident61 Ų6195.3 Ų95.337%0.37452%0.522SS..SBendtrans-72.9123.1168.3450000110.2L143 Q148 S179L143-T146 PolarHBondContact O-OG1 2.04Å; T146-Q148 VanDerWaalsContact C-N 3.35Å; T146-Q148 PolarHBondContact O-N 3.22Å; T146-S179 VanDerWaalsContact CB-OG 3.25Å; T146-S179 WeakPolarHBondContact CB-OG 3.42Å; T146-S179 WeakPolarHBondContact OG1-CB 3.5Å; T146-S179 PolarHBondContact OG1-OG 3.19Å
147K80.9Confident81Confident189 Ų18988.7 Ų88.782%0.82249%0.494SS*.  trans-64.291.1176.9-174.3-179179.4-177.70110.4D145D145-K147 PolarHBondContact O-N 3.47Å
148Q89.1Confident83Confident79 Ų7989.4 Ų89.437%0.36949%0.491SS..  trans-79.7142.4172.2-63.5-170.7-1300110.2T146 Q177 S179T146-Q148 VanDerWaalsContact C-N 3.35Å; T146-Q148 PolarHBondContact O-N 3.22Å; Q148-Q177 WeakPolarHBondContact CA-O 3.49Å; Q148-S179 VanDerWaalsContact CG-OG 3.31Å; Q148-S179 WeakPolarHBondContact CG-OG 3.43Å; Q148-S179 PolarHBondContact NE2-OG 2.89Å
149T93.9Very high84.7Confident59 Ų5984.9 Ų84.936%0.36246%0.459SS..EExtended strand (participates in β ladder)trans-128.8132.4172.456.60000107.9G176 Q177T149-G176 CarbonylContact O-C 3.47Å; T149-G176 VanDerWaalsContact O-C 3.28Å; T149-G176 WeakPolarHBondContact O-CA 3.46Å; T149-Q177 PolarHBondContact N-O 3.01Å; T149-Q177 CarbonylContact O-C 3.28Å; T149-Q177 PolarHBondContact O-N 3.37Å; T149-Q177 VanDerWaalsContact O-O 3.06Å; T149-Q177 PolarHBondContact OG1-N 2.97Å
150C96.7Very high86.2Confident29 Ų2984.4 Ų84.420%0.19646%0.459CS..EExtended strand (participates in β ladder)trans-154.8118170.4-179.80000107.9C208 K238C150-C208 WeakPolarHBondContact CA-SG 3Å; C150-C208 HydrophobicContact CB-CB 3.89Å; C150-C208 WeakPolarHBondContact CB-SG 3.11Å; C150-C208 WeakPolarHBondContact SG-CA 3.35Å; C150-C208 WeakPolarHBondContact SG-CB 3.4Å; C150-C208 CovalentContact SG-SG 2.04Å; C150-C208 PolarHBondContact SG-SG 3.5Å; C150-K238 VanDerWaalsContact SG-CA 3.53Å; C150-K238 PolarHBondContact SG-N 2.81Å; C150-K238 PolarHBondContact SG-O 3.32Å
151T97.4Very high87.4Confident76 Ų7679.6 Ų79.647%0.46643%0.431SS..EExtended strand (participates in β ladder)trans-133150.3-171.958.20000110.9C174 F175T151-C174 WeakPolarHBondContact O-CA 3.31Å; T151-F175 PolarHBondContact N-O 2.85Å; T151-F175 PolarHBondContact O-N 3.15Å; T151-F175 PolarHBondContact OG1-O 3.45Å
152A98.1Very high88.6Confident32 Ų3283 Ų8326%0.26445%0.446SS..EExtended strand (participates in β ladder)trans-92.4110170.900000108.5K172 L173 C237A152-K172 HydrophobicContact CB-CB 4.04Å; A152-K172 HydrophobicContact CB-CD 3.64Å; A152-K172 HydrophobicContact CB-CG 4.47Å; A152-L173 CarbonylContact C-O 3.55Å; A152-L173 WeakPolarHBondContact CA-O 3.25Å; A152-C237 HydrophobicContact CB-CB 4.37Å
153V98.2Very high89.9Confident55 Ų5582.5 Ų82.533%0.33346%0.461SS..EExtended strand (participates in β ladder)trans-96.7121-177.2-178.50000108.9K172 L173 F175V153-K172 CarbonylContact O-C 3.53Å; V153-K172 WeakPolarHBondContact O-CA 3.48Å; V153-L173 HydrophobicContact CB-CD1 3.93Å; V153-L173 HydrophobicContact CB-CG 4.11Å; V153-L173 HydrophobicContact CG2-CD1 4.31Å; V153-L173 PolarHBondContact N-O 3.26Å; V153-L173 PolarHBondContact O-N 2.99Å; V153-F175 HydrophobicContact CG2-CB 3.98Å
154P98.2Very high91.2Very high103 Ų10381.3 Ų81.367%0.66946%0.457SS*.EExtended strand (participates in β ladder)trans-68.8142.4-178.629.2-34.5000111.6N171P154-N171 CarbonylContact C-O 3.59Å; P154-N171 WeakPolarHBondContact CA-O 3.04Å
155F98.1Very high92.6Very high73 Ų7378.3 Ų78.332%0.3245%0.446SS..EExtended strand (participates in β ladder)trans-146.4159.1171.777-83.1000111.2Q157 N171 K172 L173F155-Q157 HydrophobicContact CD2-CB 4.29Å; F155-Q157 HydrophobicContact CE2-CB 3.61Å; F155-Q157 HydrophobicContact CE2-CG 4.11Å; F155-Q157 HydrophobicContact CZ-CB 4.24Å; F155-N171 HydrophobicContact CD1-CB 4.29Å; F155-N171 HydrophobicContact CE1-CB 3.68Å; F155-N171 HydrophobicContact CE2-CB 4.36Å; F155-N171 HydrophobicContact CZ-CB 3.71Å; F155-N171 PolarHBondContact N-O 2.64Å; F155-N171 PolarHBondContact O-N 3.19Å; F155-N171 VanDerWaalsContact O-O 3.07Å; F155-K172 VanDerWaalsContact CE1-C 3.45Å; F155-L173 HydrophobicContact CD1-CB 4.18Å; F155-L173 HydrophobicContact CD1-CD2 4.26Å; F155-L173 HydrophobicContact CD1-CG 4.4Å; F155-L173 HydrophobicContact CE1-CB 4.18Å
156T98Very high94.1Very high79 Ų7975.9 Ų75.949%0.48544%0.436SS..EExtended strand (participates in β ladder)trans-92.8116.2176-53.60000109.1T168T156-T168 HydrophobicContact CG2-CG2 3.28Å
157Q97.6Very high95.2Very high54 Ų5475.1 Ų75.125%0.25243%0.431SS..EExtended strand (participates in β ladder)trans-99.8128.8177.4-172.9176-3.100109.9F155 V169 N171F155-Q157 HydrophobicContact CD2-CB 4.29Å; F155-Q157 HydrophobicContact CE2-CB 3.61Å; F155-Q157 HydrophobicContact CE2-CG 4.11Å; F155-Q157 HydrophobicContact CZ-CB 4.24Å; Q157-V169 WeakPolarHBondContact CA-O 2.98Å; Q157-V169 HydrophobicContact CB-CB 4.46Å; Q157-V169 WeakPolarHBondContact CB-O 3.13Å; Q157-V169 PolarHBondContact N-O 3.07Å; Q157-V169 PolarHBondContact O-N 2.83Å; Q157-N171 HydrophobicContact CB-CB 4.38Å; Q157-N171 PolarHBondContact OE1-ND2 2.88Å
158H97.7Very high96Very high121 Ų12169.6 Ų69.656%0.5641%0.413SS*.EExtended strand (participates in β ladder)trans-96.5118.4172.6-68.1-167.9000108.6T166H158-T166 HydrophobicContact CB-CG2 3.8Å
159V96.8Very high96.4Very high3 Ų366.8 Ų66.82%0.01840%0.401CS..EExtended strand (participates in β ladder)trans-96112.8179.6-174.80000108.1T166 V167 V169 V218 L220 K229 V231V159-T166 WeakPolarHBondContact O-CA 3.15Å; V159-V167 PolarHBondContact N-O 2.67Å; V159-V167 PolarHBondContact O-N 3.43Å; V159-V169 HydrophobicContact CG2-CB 4.18Å; V159-V169 HydrophobicContact CG2-CG2 3.6Å; V159-V218 HydrophobicContact CB-CG1 4.38Å; V159-V218 HydrophobicContact CG1-CG1 4.33Å; V159-V218 HydrophobicContact CG2-CG1 4.49Å; V159-L220 HydrophobicContact CB-CD2 4.42Å; V159-L220 HydrophobicContact CG1-CD1 4.3Å; V159-L220 HydrophobicContact CG1-CD2 4.07Å; V159-K229 HydrophobicContact CG1-CB 4.24Å; V159-K229 HydrophobicContact CG1-CD 3.66Å; V159-K229 HydrophobicContact CG1-CG 4.05Å; V159-V231 HydrophobicContact CG1-CG2 4.06Å; V159-V231 HydrophobicContact CG2-CG2 3.92Å
160T94.8Very high96.6Very high74 Ų7472.6 Ų72.645%0.45442%0.418SS..  trans-117.1154.9-177.7600000111.5T166 K229T160-T166 HydrophobicContact CG2-CG2 3.77Å; T160-T166 WeakPolarHBondContact CG2-OG1 3.38Å; T160-K229 PolarHBondContact O-NZ 3.39Å
161A93.9Very high96.7Very high37 Ų3771.8 Ų71.831%0.30641%0.411SS..  trans-153.2152.9168.100000108.7G163 C164 L220A161-G163 PolarHBondContact O-N 3.01Å; A161-C164 HydrophobicContact CB-CB 4.04Å; A161-C164 WeakPolarHBondContact O-CB 3.38Å; A161-C164 PolarHBondContact O-N 3.48Å; A161-C164 VanDerWaalsContact O-N 3.07Å; A161-L220 HydrophobicContact CB-CD1 3.63Å
162D92.9Very high96.7Very high166 Ų16672 Ų7289%0.88841%0.406SS*.THydrogen-bonded Turntrans-61.7133.3-177.2-62.1-32.9000111.4C164D162-C164 PolarHBondContact O-N 3.46Å; D162-C164 PolarHBondContact O-SG 2.96Å; D162-C164 VanDerWaalsContact O-SG 3.41Å
163G93.2Very high96.6Very high75 Ų7574.2 Ų74.277%0.77341%0.413SS*.THydrogen-bonded Turntrans69.87.8-177.100000114.8A161 C222A161-G163 PolarHBondContact O-N 3.01Å; G163-C222 WeakPolarHBondContact O-CA 3.01Å
164C96.1Very high96.6Very high25 Ų2573.3 Ų73.317%0.16941%0.408CS..SBendtrans-116.1149.1-177.4-52.60000113A161 D162 L220 R221 C222A161-C164 HydrophobicContact CB-CB 4.04Å; A161-C164 WeakPolarHBondContact O-CB 3.38Å; A161-C164 PolarHBondContact O-N 3.48Å; A161-C164 VanDerWaalsContact O-N 3.07Å; D162-C164 PolarHBondContact O-N 3.46Å; D162-C164 PolarHBondContact O-SG 2.96Å; D162-C164 VanDerWaalsContact O-SG 3.41Å; C164-L220 HydrophobicContact CB-CB 4.06Å; C164-R221 CarbonylContact C-O 3.58Å; C164-R221 WeakPolarHBondContact CA-O 3.43Å; C164-C222 HydrophobicContact CB-CB 3.99Å; C164-C222 WeakPolarHBondContact CB-SG 3.42Å; C164-C222 WeakPolarHBondContact SG-CB 3.43Å; C164-C222 CovalentContact SG-SG 2.02Å; C164-C222 PolarHBondContact SG-SG 3Å
165Q95.4Very high96.6Very high124 Ų12473.8 Ų73.858%0.57940%0.4SS*.  trans-67.1137.2172.1-65.7178.23.700110.5R221Q165-R221 HydrophobicContact CB-CB 4.49Å; Q165-R221 HydrophobicContact CG-CB 4.49Å; Q165-R221 PolarHBondContact N-O 3.18Å
166T96.1Very high96.4Very high80 Ų8071.8 Ų71.849%0.49140%0.4SS..  trans-70.4133.6177.4-59.20000110.5H158 V159 T160H158-T166 HydrophobicContact CB-CG2 3.8Å; V159-T166 WeakPolarHBondContact O-CA 3.15Å; T160-T166 HydrophobicContact CG2-CG2 3.77Å; T160-T166 WeakPolarHBondContact CG2-OG1 3.38Å
167V97Very high96.2Very high45 Ų4574.9 Ų74.927%0.27341%0.409SS..EExtended strand (participates in β ladder)trans-114.4136.3175.51760000110.2V159 V218 L220V159-V167 PolarHBondContact N-O 2.67Å; V159-V167 PolarHBondContact O-N 3.43Å; V167-V218 HydrophobicContact CB-CG1 3.98Å; V167-V218 HydrophobicContact CG1-CG1 3.71Å; V167-L220 HydrophobicContact CB-CD2 3.82Å; V167-L220 HydrophobicContact CG2-CD2 3.6Å
168T97.4Very high96Very high72 Ų7273.6 Ų73.644%0.44241%0.406SS..EExtended strand (participates in β ladder)trans-89127.7178.1-59.50000111.1T156T156-T168 HydrophobicContact CG2-CG2 3.28Å
169V97.4Very high95.6Very high20 Ų2069 Ų6912%0.12139%0.387CS..EExtended strand (participates in β ladder)trans-121.4129.6175.7176.30000109.2Q157 V159 V218 V233Q157-V169 WeakPolarHBondContact CA-O 2.98Å; Q157-V169 HydrophobicContact CB-CB 4.46Å; Q157-V169 WeakPolarHBondContact CB-O 3.13Å; Q157-V169 PolarHBondContact N-O 3.07Å; Q157-V169 PolarHBondContact O-N 2.83Å; V159-V169 HydrophobicContact CG2-CB 4.18Å; V159-V169 HydrophobicContact CG2-CG2 3.6Å; V169-V218 HydrophobicContact CG2-CG1 4.16Å; V169-V218 HydrophobicContact CG2-CG2 3.86Å; V169-V233 HydrophobicContact CG1-CG2 4.07Å
170Y97.7Very high95.1Very high182 Ų18272.1 Ų72.171%0.71441%0.409SS*.EExtended strand (participates in β ladder)trans-83.3117.6171.8-61.6-72.5000109.6
171N97.9Very high94.5Very high11 Ų1171.9 Ų71.96%0.05940%0.404CS..EExtended strand (participates in β ladder)trans-129.4178-175.8-159.3-7.9000110.3P154 F155 Q157 M232 V233 V234P154-N171 CarbonylContact C-O 3.59Å; P154-N171 WeakPolarHBondContact CA-O 3.04Å; F155-N171 HydrophobicContact CD1-CB 4.29Å; F155-N171 HydrophobicContact CE1-CB 3.68Å; F155-N171 HydrophobicContact CE2-CB 4.36Å; F155-N171 HydrophobicContact CZ-CB 3.71Å; F155-N171 PolarHBondContact N-O 2.64Å; F155-N171 PolarHBondContact O-N 3.19Å; F155-N171 VanDerWaalsContact O-O 3.07Å; Q157-N171 HydrophobicContact CB-CB 4.38Å; Q157-N171 PolarHBondContact OE1-ND2 2.88Å; N171-M232 PolarHBondContact ND2-O 3.47Å; N171-V233 VanDerWaalsContact OD1-CA 3.31Å; N171-V233 WeakPolarHBondContact OD1-CA 3.03Å; N171-V234 PolarHBondContact OD1-N 3.27Å
172K98.2Very high93.9Very high80 Ų8075.7 Ų75.735%0.34842%0.415SS..EExtended strand (participates in β ladder)trans-131.3146.2176.1-49-177.5-164.8176.40110.7A152 V153 F155 V234 E235A152-K172 HydrophobicContact CB-CB 4.04Å; A152-K172 HydrophobicContact CB-CD 3.64Å; A152-K172 HydrophobicContact CB-CG 4.47Å; V153-K172 CarbonylContact O-C 3.53Å; V153-K172 WeakPolarHBondContact O-CA 3.48Å; F155-K172 VanDerWaalsContact CE1-C 3.45Å; K172-V234 HydrophobicContact CB-CB 4.16Å; K172-V234 HydrophobicContact CB-CG1 4.37Å; K172-V234 WeakPolarHBondContact CD-O 3.33Å; K172-V234 WeakPolarHBondContact CG-O 3.22Å; K172-V234 WeakPolarHBondContact O-CB 3.33Å; K172-V234 WeakPolarHBondContact O-CG2 3.36Å; K172-E235 PolarHBondContact NZ-O 2.99Å
173L96.9Very high93.2Very high80 Ų8071.4 Ų71.442%0.41939%0.394SS..EExtended strand (participates in β ladder)trans-108.3150.8169.965.584.8000109.7A152 V153 F155 F175A152-L173 CarbonylContact C-O 3.55Å; A152-L173 WeakPolarHBondContact CA-O 3.25Å; V153-L173 HydrophobicContact CB-CD1 3.93Å; V153-L173 HydrophobicContact CB-CG 4.11Å; V153-L173 HydrophobicContact CG2-CD1 4.31Å; V153-L173 PolarHBondContact N-O 3.26Å; V153-L173 PolarHBondContact O-N 2.99Å; F155-L173 HydrophobicContact CD1-CB 4.18Å; F155-L173 HydrophobicContact CD1-CD2 4.26Å; F155-L173 HydrophobicContact CD1-CG 4.4Å; F155-L173 HydrophobicContact CE1-CB 4.18Å; L173-F175 HydrophobicContact CD1-CB 3.96Å
174C97.9Very high92.5Very high35 Ų3571.6 Ų71.624%0.23638%0.382CS..EExtended strand (participates in β ladder)trans-89.8126.4175.9-61.70000110.6T151 P210 C237T151-C174 WeakPolarHBondContact O-CA 3.31Å; C174-P210 VanDerWaalsContact SG-N 3.36Å; C174-C237 WeakPolarHBondContact CA-SG 3.26Å; C174-C237 HydrophobicContact CB-CB 3.71Å; C174-C237 WeakPolarHBondContact CB-SG 3.28Å; C174-C237 WeakPolarHBondContact SG-CB 3.48Å; C174-C237 CovalentContact SG-SG 2.04Å; C174-C237 PolarHBondContact SG-SG 3.49Å
175F96.6Very high91.1Very high114 Ų11473.6 Ų73.650%0.540%0.396SS..EExtended strand (participates in β ladder)trans-134.3130.3179-177.9-101.2000110.6T151 V153 L173 C208T151-F175 PolarHBondContact N-O 2.85Å; T151-F175 PolarHBondContact O-N 3.15Å; T151-F175 PolarHBondContact OG1-O 3.45Å; V153-F175 HydrophobicContact CG2-CB 3.98Å; L173-F175 HydrophobicContact CD1-CB 3.96Å; F175-C208 VanDerWaalsContact C-SG 3.6Å
176G95.4Very high89.5Confident30 Ų3076.6 Ų76.631%0.30941%0.41SS..EExtended strand (participates in β ladder)trans173.8173.1-175.200000116.2T149T149-G176 CarbonylContact O-C 3.47Å; T149-G176 VanDerWaalsContact O-C 3.28Å; T149-G176 WeakPolarHBondContact O-CA 3.46Å
177Q93.8Very high87.5Confident145 Ų14575.5 Ų75.568%0.67842%0.415SS*.EExtended strand (participates in β ladder)trans-120.1120.5171.8-65.7179.7-19.900109.4Q148 T149Q148-Q177 WeakPolarHBondContact CA-O 3.49Å; T149-Q177 PolarHBondContact N-O 3.01Å; T149-Q177 CarbonylContact O-C 3.28Å; T149-Q177 PolarHBondContact O-N 3.37Å; T149-Q177 VanDerWaalsContact O-O 3.06Å; T149-Q177 PolarHBondContact OG1-N 2.97Å
178C92.9Very high85.5Confident27 Ų2777.8 Ų77.818%0.18242%0.422CS..  trans-114.5141178.1-59.30000109.9C208 C239C178-C208 PolarHBondContact SG-N 2.94Å; C178-C208 VanDerWaalsContact SG-N 3.38Å; C178-C239 VanDerWaalsContact CA-SG 3.52Å; C178-C239 HydrophobicContact CB-CB 3.74Å; C178-C239 WeakPolarHBondContact CB-SG 3.41Å; C178-C239 WeakPolarHBondContact SG-CA 3.31Å; C178-C239 WeakPolarHBondContact SG-CB 3.48Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 3.37Å
179S89.2Confident83.4Confident24 Ų2482.6 Ų82.617%0.16844%0.437CS..  trans-84136.3179.2-39.20000109.8T146 Q148 S206T146-S179 VanDerWaalsContact CB-OG 3.25Å; T146-S179 WeakPolarHBondContact CB-OG 3.42Å; T146-S179 WeakPolarHBondContact OG1-CB 3.5Å; T146-S179 PolarHBondContact OG1-OG 3.19Å; Q148-S179 VanDerWaalsContact CG-OG 3.31Å; Q148-S179 WeakPolarHBondContact CG-OG 3.43Å; Q148-S179 PolarHBondContact NE2-OG 2.89Å; S179-S206 WeakPolarHBondContact O-CB 3.5Å; S179-S206 PolarHBondContact O-OG 3Å
180S85.8Confident80.9Confident69 Ų6985.2 Ų85.248%0.48346%0.461SS..  trans-125.3157.4168.853.50000109.1
181L82Confident78.2Confident68 Ų6883.5 Ų83.536%0.35646%0.464SS..  trans-133.5139.9178.573.397.4000108.9L139 L143 V183L139-L181 HydrophobicContact CD1-CD1 4.34Å; L143-L181 HydrophobicContact CD1-CB 4.21Å; L143-L181 HydrophobicContact CD1-CD2 3.25Å; L143-L181 HydrophobicContact CD1-CG 4.32Å; L143-L181 HydrophobicContact CD2-CD2 3.73Å; L143-L181 HydrophobicContact CG-CD2 4.12Å; L181-V183 HydrophobicContact CD1-CB 4.46Å; L181-V183 HydrophobicContact CD1-CG2 3.41Å; L181-V183 VanDerWaalsContact CD1-CG2 3.41Å
182F81.5Confident75.9Confident118 Ų11888.4 Ų88.452%0.51850%0.497SS..  trans-115124.2169.3177.2-106.6000108P184 E188F182-P184 HydrophobicContact CD1-CG 4.21Å; F182-P184 HydrophobicContact CE1-CB 4.24Å; F182-P184 HydrophobicContact CE1-CG 3.79Å; F182-E188 WeakPolarHBondContact CE2-OE1 3.08Å; F182-E188 WeakPolarHBondContact CZ-OE1 3.5Å; F182-E188 WeakPolarHBondContact CZ-OE2 3.43Å
183V79.6Confident73.3Confident75 Ų7589.7 Ų89.746%0.45552%0.516SS..  trans-114.8110.9174.5174.50000105.8L139 L181 S185L139-V183 HydrophobicContact CD1-CG2 3.51Å; L139-V183 HydrophobicContact CD2-CG2 4.38Å; L181-V183 HydrophobicContact CD1-CB 4.46Å; L181-V183 HydrophobicContact CD1-CG2 3.41Å; L181-V183 VanDerWaalsContact CD1-CG2 3.41Å; V183-S185 PolarHBondContact O-N 2.91Å
184P76.8Confident71.1Confident80 Ų8092.2 Ų92.252%0.51954%0.537SS..  trans-55.6133.1173.7-21.130.1000109.8F182 E188F182-P184 HydrophobicContact CD1-CG 4.21Å; F182-P184 HydrophobicContact CE1-CB 4.24Å; F182-P184 HydrophobicContact CE1-CG 3.79Å; P184-E188 VanDerWaalsContact CA-OE2 3.28Å; P184-E188 WeakPolarHBondContact CA-OE2 3.45Å
185S67.7Low68.6Low66 Ų6694 Ų9446%0.46256%0.561SS.*  trans-108.6148.8176.371.80000110.6V183 G187 E188V183-S185 PolarHBondContact O-N 2.91Å; S185-G187 PolarHBondContact O-N 3.1Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact O-CB 3.36Å; S185-E188 PolarHBondContact O-N 2.68Å
186E61.2Low65.9Low188 Ų18894.4 Ų94.488%0.87957%0.573SS**G310 helixtrans-62.9-15.7-173.4-150.5156.3-165.300113
187G55.4Low63.6Low57 Ų5797 Ų9759%0.58860%0.6SS**G310 helixtrans-81.1-6.5173.200000115.7S185S185-G187 PolarHBondContact O-N 3.1Å
188E54.2Low61.5Low92 Ų9292.5 Ų92.543%0.4359%0.588SS.*G310 helixtrans-84.1-11.9178.7-70.8174.8144.200113.4F182 P184 S185F182-E188 WeakPolarHBondContact CE2-OE1 3.08Å; F182-E188 WeakPolarHBondContact CZ-OE1 3.5Å; F182-E188 WeakPolarHBondContact CZ-OE2 3.43Å; P184-E188 VanDerWaalsContact CA-OE2 3.28Å; P184-E188 WeakPolarHBondContact CA-OE2 3.45Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact O-CB 3.36Å; S185-E188 PolarHBondContact O-N 2.68Å
189F52.6Low59.3Low173 Ų173100.8 Ų100.876%0.75962%0.621SS**SBendtrans-101.9-2.4176.9-59.5-79.8000113.1D191F189-D191 PolarHBondContact O-N 2.87Å
190A45.5Very low57.4Low75 Ų75107.9 Ų107.962%0.6265%0.651SS**SBendtrans-8996.3175.500000110.4
191D42.2Very low55.9Low146 Ų146115.4 Ų115.478%0.78167%0.669SS**  trans59.7121166.4-76.2-37.2000120.3F189 S193F189-D191 PolarHBondContact O-N 2.87Å; D191-S193 VanDerWaalsContact C-N 3.31Å; D191-S193 PolarHBondContact O-N 2.92Å
192P47.6Very low54.8Low115 Ų115121.8 Ų121.875%0.74769%0.689SS**  trans-73.887.9160.831.6-28000108.3P194P192-P194 VanDerWaalsContact O-CD 3.26Å; P192-P194 WeakPolarHBondContact O-CD 3.5Å
193S43.7Very low54Low107 Ų107117.2 Ų117.275%0.74867%0.674SS**  trans-63.6117.2167.8-146.50000108.5D191 G195D191-S193 VanDerWaalsContact C-N 3.31Å; D191-S193 PolarHBondContact O-N 2.92Å; S193-G195 PolarHBondContact O-N 3.49Å
194P50.6Low53.8Low132 Ų132117.4 Ų117.486%0.85768%0.677SS**THydrogen-bonded Turntrans-83.996.4-176.331.4-27.5000108.2P192P192-P194 VanDerWaalsContact O-CD 3.26Å; P192-P194 WeakPolarHBondContact O-CD 3.5Å
195G45.3Very low54.2Low73 Ų73116.7 Ų116.775%0.75367%0.674SS**THydrogen-bonded Turntrans-176.9-24.9176.400000117S193S193-G195 PolarHBondContact O-N 3.49Å
196T40.9Very low55.3Low122 Ų122114.8 Ų114.875%0.74866%0.66SS**  trans-128.679.9-179.18.80000109.1A198T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.88Å
197G46.4Very low56.7Low85 Ų85111.7 Ų111.788%0.87664%0.64SS**  trans-63.996162.400000108.3
198A50.3Low58.7Low51 Ų51110.3 Ų110.342%0.42162%0.621SS.*SBendtrans172.9153.5136.500000113T196 H200T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.88Å; A198-H200 PolarHBondContact O-N 2.81Å
199F47.1Very low60.6Low200 Ų200106.1 Ų106.188%0.87760%0.602SS**SBendtrans73.4-9.7154.8-57.2-64.4000123.2R201F199-R201 PolarHBondContact O-N 3.28Å
200H48.9Very low62.7Low173 Ų173100.7 Ų100.780%0.80159%0.585SS**  trans-78.216.3179.1-64.4-58.3000116.4A198A198-H200 PolarHBondContact O-N 2.81Å
201R54.3Low65.1Low228 Ų228102.9 Ų102.986%0.8658%0.58SS**  trans-12738.8-167.6-61-168.4-171.4-131.23.5115.5F199F199-R201 PolarHBondContact O-N 3.28Å
202R59.9Low67.7Low202 Ų202100.8 Ų100.876%0.76256%0.564SS**  trans-135.8113.2167.3-66.8-170.4-166.4-115.82.9109.4
203G64.8Low70Confident21 Ų2197.5 Ų97.522%0.21655%0.547CS..  trans-56.3164.2164.900000111.2C205G203-C205 PolarHBondContact O-N 3.38Å
204P74.6Confident72.5Confident79 Ų7997 Ų9751%0.51353%0.533SS..  trans-59.7113.1-178.423.3-32000111.2T241P204-T241 HydrophobicContact CB-CG2 3.51Å
205C85.3Confident74.8Confident66 Ų6694.9 Ų94.945%0.44652%0.518SS..  trans-93133.7173.9-68.40000110.5G203 G242G203-C205 PolarHBondContact O-N 3.38Å; C205-G242 PolarHBondContact O-N 2.89Å
206S89.4Confident77.2Confident25 Ų2594 Ų9418%0.17550%0.497CS..EExtended strand (participates in β ladder)trans-95.6138.6171.7-55.80000110.8S179 E240 T241S179-S206 WeakPolarHBondContact O-CB 3.5Å; S179-S206 PolarHBondContact O-OG 3Å; S206-E240 CarbonylContact C-O 3.58Å; S206-E240 WeakPolarHBondContact CA-O 3.31Å; S206-T241 PolarHBondContact OG-OG1 2.8Å
207R92.4Very high79.9Confident123 Ų12390.3 Ų90.346%0.46448%0.479SS..EExtended strand (participates in β ladder)trans-130.2151.7-179.562.8175.9-168.2153.81.9110.7A209 C239 E240R207-A209 HydrophobicContact CG-CB 4.27Å; R207-A209 PolarHBondContact O-N 3.39Å; R207-C239 WeakPolarHBondContact O-CA 3.3Å; R207-E240 HydrophobicContact CG-CG 4.04Å; R207-E240 IonicContact CZ-OE1 3.22Å; R207-E240 VanDerWaalsContact CZ-OE1 3.22Å; R207-E240 PolarHBondContact N-O 2.86Å; R207-E240 IonicContact NE-OE1 2.92Å; R207-E240 PolarHBondContact NE-OE1 2.97Å; R207-E240 IonicContact NH2-OE1 2.73Å; R207-E240 PolarHBondContact NH2-OE1 3.17Å; R207-E240 PolarHBondContact O-N 3.38Å
208C95.9Very high82.3Confident28 Ų2886.6 Ų86.619%0.18944%0.44CS..EExtended strand (participates in β ladder)trans-82.7112.4171.3-179.80000108.2C150 F175 C178C150-C208 WeakPolarHBondContact CA-SG 3Å; C150-C208 HydrophobicContact CB-CB 3.89Å; C150-C208 WeakPolarHBondContact CB-SG 3.11Å; C150-C208 WeakPolarHBondContact SG-CA 3.35Å; C150-C208 WeakPolarHBondContact SG-CB 3.4Å; C150-C208 CovalentContact SG-SG 2.04Å; C150-C208 PolarHBondContact SG-SG 3.5Å; F175-C208 VanDerWaalsContact C-SG 3.6Å; C178-C208 PolarHBondContact SG-N 2.94Å; C178-C208 VanDerWaalsContact SG-N 3.38Å
209A95.3Very high84.5Confident4 Ų487.7 Ų87.73%0.03344%0.442CS..EExtended strand (participates in β ladder)trans-137.4165.2-172.300000111.8R207 F211 C237 K238 E240R207-A209 HydrophobicContact CG-CB 4.27Å; R207-A209 PolarHBondContact O-N 3.39Å; A209-F211 PolarHBondContact O-N 3.5Å; A209-C237 VanDerWaalsContact O-CA 3.27Å; A209-C237 WeakPolarHBondContact O-CA 3.32Å; A209-K238 PolarHBondContact N-O 2.86Å; A209-K238 PolarHBondContact O-N 2.92Å; A209-E240 HydrophobicContact CB-CG 3.8Å; A209-E240 VanDerWaalsContact CB-OE1 3.29Å; A209-E240 WeakPolarHBondContact CB-OE1 3.22Å
210P96.8Very high86.8Confident60 Ų6078.2 Ų78.239%0.3940%0.401SS..EExtended strand (participates in β ladder)trans-59.4119.4175.9-23.334.6000110.8C174 A213 V234C174-P210 VanDerWaalsContact SG-N 3.36Å; P210-A213 HydrophobicContact CB-CB 4.3Å; P210-V234 HydrophobicContact CB-CG1 4.17Å; P210-V234 HydrophobicContact CB-CG2 4.23Å; P210-V234 HydrophobicContact CG-CG1 4.49Å; P210-V234 HydrophobicContact CG-CG2 4.03Å
211F95.6Very high89.1Confident121 Ų12177.8 Ų77.853%0.53139%0.392SS..EExtended strand (participates in β ladder)trans-88.7-35.2172.7177.5-105.9000111.3A209 E236 K238A209-F211 PolarHBondContact O-N 3.5Å; F211-E236 PolarHBondContact N-O 3.41Å; F211-K238 HydrophobicContact CB-CB 3.96Å; F211-K238 HydrophobicContact CB-CD 4.08Å; F211-K238 HydrophobicContact CB-CG 3.76Å; F211-K238 HydrophobicContact CD1-CD 3.83Å; F211-K238 HydrophobicContact CD1-CG 4.36Å; F211-K238 HydrophobicContact CD2-CB 4.35Å; F211-K238 HydrophobicContact CD2-CD 3.71Å; F211-K238 HydrophobicContact CD2-CG 4.25Å; F211-K238 HydrophobicContact CE1-CD 4.22Å; F211-K238 HydrophobicContact CE2-CD 4.08Å; F211-K238 HydrophobicContact CG-CB 4.28Å; F211-K238 HydrophobicContact CG-CD 3.57Å; F211-K238 HydrophobicContact CG-CG 3.85Å; F211-K238 HydrophobicContact CZ-CD 4.32Å
212K96.6Very high91.1Very high101 Ų10168 Ų6844%0.43936%0.358SS..EExtended strand (participates in β ladder)trans-136122.7176.1-166.7179.2-179.3-145.40108.6E235 E236K212-E235 HydrophobicContact CB-CB 4.24Å; K212-E235 HydrophobicContact CD-CB 4.37Å; K212-E235 WeakPolarHBondContact CD-OE2 3.16Å; K212-E235 WeakPolarHBondContact CE-OE2 3.26Å; K212-E235 HydrophobicContact CG-CB 4.26Å; K212-E235 IonicContact NZ-OE2 2.83Å; K212-E235 PolarHBondContact NZ-OE2 3.25Å; K212-E235 PolarHBondContact O-N 3.29Å; K212-E236 HydrophobicContact CB-CB 4.03Å; K212-E236 HydrophobicContact CB-CG 4.39Å; K212-E236 PolarHBondContact N-O 2.9Å; K212-E236 PolarHBondContact O-N 3.31Å
213A96.6Very high92.6Very high46 Ų4661.9 Ų61.938%0.3836%0.358SS..EExtended strand (participates in β ladder)trans-146.2152.517700000109.4P210 M232 V233P210-A213 HydrophobicContact CB-CB 4.3Å; A213-M232 HydrophobicContact CB-CG 4Å; A213-M232 HydrophobicContact CB-SD 4.24Å; A213-V233 CarbonylContact C-O 3.5Å; A213-V233 VanDerWaalsContact CA-O 3.27Å; A213-V233 WeakPolarHBondContact CA-O 3.32Å
214Q96.4Very high93.9Very high98 Ų9866.5 Ų66.546%0.45839%0.394SS..EExtended strand (participates in β ladder)trans-127.9146.9177.757.5176.11.800109.9V216 M232 V233Q214-V216 HydrophobicContact CG-CG2 3.93Å; Q214-M232 CarbonylContact O-C 3.5Å; Q214-M232 WeakPolarHBondContact O-CA 3.36Å; Q214-V233 HydrophobicContact CG-CB 4.19Å; Q214-V233 PolarHBondContact N-O 3.07Å; Q214-V233 PolarHBondContact O-N 2.99Å
215T97.1Very high94.8Very high87 Ų8768 Ų6853%0.53439%0.394SS..EExtended strand (participates in β ladder)trans-95.3118.6172.3-60.80000108.7R230T215-R230 HydrophobicContact CG2-CB 3.76Å; T215-R230 HydrophobicContact CG2-CG 4.21Å
216V95.9Very high95.2Very high53 Ų5368.9 Ų68.932%0.32140%0.398SS..EExtended strand (participates in β ladder)trans-108.3136.2-176.3-165.80000109.1Q214 R230 V231 V233Q214-V216 HydrophobicContact CG-CG2 3.93Å; V216-R230 WeakPolarHBondContact O-CA 3.36Å; V216-V231 PolarHBondContact N-O 3.3Å; V216-V231 PolarHBondContact O-N 3.36Å; V216-V233 HydrophobicContact CB-CG2 4.29Å; V216-V233 HydrophobicContact CG2-CB 4.04Å; V216-V233 HydrophobicContact CG2-CG2 3.6Å
217A97.3Very high95.4Very high45 Ų4574.5 Ų74.537%0.37242%0.415SS..EExtended strand (participates in β ladder)trans-81.9121.1171.600000109.5
218V97.1Very high95.5Very high8 Ų875.5 Ų75.55%0.04843%0.425CS..EExtended strand (participates in β ladder)trans-106.7111.7-179.2-176.50000108.4V159 V167 V169 L220 K229 V231V159-V218 HydrophobicContact CB-CG1 4.38Å; V159-V218 HydrophobicContact CG1-CG1 4.33Å; V159-V218 HydrophobicContact CG2-CG1 4.49Å; V167-V218 HydrophobicContact CB-CG1 3.98Å; V167-V218 HydrophobicContact CG1-CG1 3.71Å; V169-V218 HydrophobicContact CG2-CG1 4.16Å; V169-V218 HydrophobicContact CG2-CG2 3.86Å; V218-L220 HydrophobicContact CG1-CD2 4.13Å; V218-L220 PolarHBondContact O-N 2.82Å; V218-K229 WeakPolarHBondContact CB-O 3.29Å; V218-K229 PolarHBondContact N-O 3.29Å; V218-K229 PolarHBondContact O-N 2.83Å; V218-V231 HydrophobicContact CB-CG2 4.46Å; V218-V231 HydrophobicContact CG2-CB 4.04Å; V218-V231 HydrophobicContact CG2-CG2 3.74Å
219P96.7Very high95.5Very high73 Ų7378.4 Ų78.447%0.47443%0.434SS..EExtended strand (participates in β ladder)trans-76.1120.9178.129.6-32.9000110.5V226P219-V226 HydrophobicContact CB-CG1 3.72Å
220L96.8Very high95.5Very high2 Ų286.6 Ų86.61%0.0147%0.465CS..EExtended strand (participates in β ladder)trans-105131.4175.7-56.1-179.5000109.3V159 A161 C164 V167 V218 V226 W227 K229V159-L220 HydrophobicContact CB-CD2 4.42Å; V159-L220 HydrophobicContact CG1-CD1 4.3Å; V159-L220 HydrophobicContact CG1-CD2 4.07Å; A161-L220 HydrophobicContact CB-CD1 3.63Å; C164-L220 HydrophobicContact CB-CB 4.06Å; V167-L220 HydrophobicContact CB-CD2 3.82Å; V167-L220 HydrophobicContact CG2-CD2 3.6Å; V218-L220 HydrophobicContact CG1-CD2 4.13Å; V218-L220 PolarHBondContact O-N 2.82Å; L220-V226 CarbonylContact O-C 3.58Å; L220-V226 WeakPolarHBondContact O-CA 3.32Å; L220-W227 PolarHBondContact N-O 3.47Å; L220-W227 PolarHBondContact O-N 2.92Å; L220-K229 HydrophobicContact CD1-CB 3.94Å; L220-K229 HydrophobicContact CD1-CD 4.12Å; L220-K229 HydrophobicContact CG-CB 4.4Å
221R96.8Very high95.5Very high163 Ų16384.2 Ų84.262%0.61545%0.449SS*.EExtended strand (participates in β ladder)trans-89.2120.2177-67.7-176.6176.5-175.7-1.5110.1C164 Q165C164-R221 CarbonylContact C-O 3.58Å; C164-R221 WeakPolarHBondContact CA-O 3.43Å; Q165-R221 HydrophobicContact CB-CB 4.49Å; Q165-R221 HydrophobicContact CG-CB 4.49Å; Q165-R221 PolarHBondContact N-O 3.18Å
222C95.6Very high95.6Very high23 Ų2383.5 Ų83.516%0.15545%0.448CS..EExtended strand (participates in β ladder)trans-121.875.5-177.5-38.20000108.5G163 C164 A224 Q225G163-C222 WeakPolarHBondContact O-CA 3.01Å; C164-C222 HydrophobicContact CB-CB 3.99Å; C164-C222 WeakPolarHBondContact CB-SG 3.42Å; C164-C222 WeakPolarHBondContact SG-CB 3.43Å; C164-C222 CovalentContact SG-SG 2.02Å; C164-C222 PolarHBondContact SG-SG 3Å; C222-A224 PolarHBondContact O-N 2.9Å; C222-Q225 PolarHBondContact N-O 3.34Å; C222-Q225 PolarHBondContact O-N 3Å
223G91.9Very high95.6Very high74 Ų7479.7 Ų79.776%0.76343%0.433SS*.THydrogen-bonded Turntrans69.5-120.1-168.500000111.9
224A91.4Very high95.7Very high117 Ų11778.1 Ų78.197%0.96742%0.419SS*.THydrogen-bonded Turntrans-84.7-11.6177.800000113.7C222C222-A224 PolarHBondContact O-N 2.9Å
225Q93.6Very high95.7Very high110 Ų11075.8 Ų75.851%0.51441%0.408SS..EExtended strand (participates in β ladder)trans-99.1149.1-178.9-167.3174.6-4.400111.2C222C222-Q225 PolarHBondContact N-O 3.34Å; C222-Q225 PolarHBondContact O-N 3Å
226V94.8Very high95.7Very high85 Ų8575.8 Ų75.852%0.51540%0.402SS..EExtended strand (participates in β ladder)trans-108.8128.9169.4-179.20000108.7P219 L220P219-V226 HydrophobicContact CB-CG1 3.72Å; L220-V226 CarbonylContact O-C 3.58Å; L220-V226 WeakPolarHBondContact O-CA 3.32Å
227W93.2Very high95.8Very high143 Ų14373.9 Ų73.954%0.54239%0.391SS..EExtended strand (participates in β ladder)trans-114.3136.2176.6-74.674.7000109.7L220L220-W227 PolarHBondContact N-O 3.47Å; L220-W227 PolarHBondContact O-N 2.92Å
228E95Very high95.7Very high145 Ų14576.2 Ų76.268%0.67839%0.393SS*.EExtended strand (participates in β ladder)trans-98125.9178.8-66.5-171.9164.300111.3
229K94.4Very high95.6Very high88 Ų8877.7 Ų77.738%0.38340%0.403SS..EExtended strand (participates in β ladder)trans-109.3123.9173.1-174.9157173.9171.70110V159 T160 V218 L220 V231V159-K229 HydrophobicContact CG1-CB 4.24Å; V159-K229 HydrophobicContact CG1-CD 3.66Å; V159-K229 HydrophobicContact CG1-CG 4.05Å; T160-K229 PolarHBondContact O-NZ 3.39Å; V218-K229 WeakPolarHBondContact CB-O 3.29Å; V218-K229 PolarHBondContact N-O 3.29Å; V218-K229 PolarHBondContact O-N 2.83Å; L220-K229 HydrophobicContact CD1-CB 3.94Å; L220-K229 HydrophobicContact CD1-CD 4.12Å; L220-K229 HydrophobicContact CG-CB 4.4Å; K229-V231 HydrophobicContact CG-CG2 4.34Å
230R96.5Very high95.3Very high177 Ų17777.6 Ų77.667%0.66840%0.396SS*.EExtended strand (participates in β ladder)trans-78.2126.8175.2-70.1-177-176.7-97.6-2.2110T215 V216T215-R230 HydrophobicContact CG2-CB 3.76Å; T215-R230 HydrophobicContact CG2-CG 4.21Å; V216-R230 WeakPolarHBondContact O-CA 3.36Å
231V96.3Very high94.8Very high9 Ų981.6 Ų81.66%0.05542%0.421CS..EExtended strand (participates in β ladder)trans-128.3129.6-179.6179.90000109.4V159 V216 V218 K229 V233V159-V231 HydrophobicContact CG1-CG2 4.06Å; V159-V231 HydrophobicContact CG2-CG2 3.92Å; V216-V231 PolarHBondContact N-O 3.3Å; V216-V231 PolarHBondContact O-N 3.36Å; V218-V231 HydrophobicContact CB-CG2 4.46Å; V218-V231 HydrophobicContact CG2-CB 4.04Å; V218-V231 HydrophobicContact CG2-CG2 3.74Å; K229-V231 HydrophobicContact CG-CG2 4.34Å; V231-V233 PolarHBondContact O-N 3.23Å
232M96.7Very high93.5Very high107 Ų10775.1 Ų75.153%0.52741%0.405SS..EExtended strand (participates in β ladder)trans-76.8121173-174.4-177-61.200110N171 A213 Q214N171-M232 PolarHBondContact ND2-O 3.47Å; A213-M232 HydrophobicContact CB-CG 4Å; A213-M232 HydrophobicContact CB-SD 4.24Å; Q214-M232 CarbonylContact O-C 3.5Å; Q214-M232 WeakPolarHBondContact O-CA 3.36Å
233V97.5Very high91.6Very high20 Ų2085.7 Ų85.712%0.12144%0.441CS..EExtended strand (participates in β ladder)trans-108119.7176.21800000109.2V169 N171 A213 Q214 V216 V231V169-V233 HydrophobicContact CG1-CG2 4.07Å; N171-V233 VanDerWaalsContact OD1-CA 3.31Å; N171-V233 WeakPolarHBondContact OD1-CA 3.03Å; A213-V233 CarbonylContact C-O 3.5Å; A213-V233 VanDerWaalsContact CA-O 3.27Å; A213-V233 WeakPolarHBondContact CA-O 3.32Å; Q214-V233 HydrophobicContact CG-CB 4.19Å; Q214-V233 PolarHBondContact N-O 3.07Å; Q214-V233 PolarHBondContact O-N 2.99Å; V216-V233 HydrophobicContact CB-CG2 4.29Å; V216-V233 HydrophobicContact CG2-CB 4.04Å; V216-V233 HydrophobicContact CG2-CG2 3.6Å; V231-V233 PolarHBondContact O-N 3.23Å
234V98.4Very high90.1Very high13 Ų1389 Ų898%0.07944%0.437CS..EExtended strand (participates in β ladder)trans-84.6130.7-179.8179.50000110N171 K172 P210N171-V234 PolarHBondContact OD1-N 3.27Å; K172-V234 HydrophobicContact CB-CB 4.16Å; K172-V234 HydrophobicContact CB-CG1 4.37Å; K172-V234 WeakPolarHBondContact CD-O 3.33Å; K172-V234 WeakPolarHBondContact CG-O 3.22Å; K172-V234 WeakPolarHBondContact O-CB 3.33Å; K172-V234 WeakPolarHBondContact O-CG2 3.36Å; P210-V234 HydrophobicContact CB-CG1 4.17Å; P210-V234 HydrophobicContact CB-CG2 4.23Å; P210-V234 HydrophobicContact CG-CG1 4.49Å; P210-V234 HydrophobicContact CG-CG2 4.03Å
235E97Very high88.1Confident50 Ų5091.1 Ų91.123%0.23443%0.427CS..EExtended strand (participates in β ladder)trans-100.2-46.8176.9-63.3-176.3-170.800111.6K172 K212K172-E235 PolarHBondContact NZ-O 2.99Å; K212-E235 HydrophobicContact CB-CB 4.24Å; K212-E235 HydrophobicContact CD-CB 4.37Å; K212-E235 WeakPolarHBondContact CD-OE2 3.16Å; K212-E235 WeakPolarHBondContact CE-OE2 3.26Å; K212-E235 HydrophobicContact CG-CB 4.26Å; K212-E235 IonicContact NZ-OE2 2.83Å; K212-E235 PolarHBondContact NZ-OE2 3.25Å; K212-E235 PolarHBondContact O-N 3.29Å
236E97.4Very high85.9Confident86 Ų8696.5 Ų96.540%0.40244%0.442SS..EExtended strand (participates in β ladder)trans-140.9149.4-174.4-63.4179.1-160.500111.5F211 K212F211-E236 PolarHBondContact N-O 3.41Å; K212-E236 HydrophobicContact CB-CB 4.03Å; K212-E236 HydrophobicContact CB-CG 4.39Å; K212-E236 PolarHBondContact N-O 2.9Å; K212-E236 PolarHBondContact O-N 3.31Å
237C97.4Very high83.5Confident13 Ų1396 Ų969%0.08844%0.443CS..EExtended strand (participates in β ladder)trans-124.3143.6177-57.90000110.5A152 C174 A209A152-C237 HydrophobicContact CB-CB 4.37Å; C174-C237 WeakPolarHBondContact CA-SG 3.26Å; C174-C237 HydrophobicContact CB-CB 3.71Å; C174-C237 WeakPolarHBondContact CB-SG 3.28Å; C174-C237 WeakPolarHBondContact SG-CB 3.48Å; C174-C237 CovalentContact SG-SG 2.04Å; C174-C237 PolarHBondContact SG-SG 3.49Å; A209-C237 VanDerWaalsContact O-CA 3.27Å; A209-C237 WeakPolarHBondContact O-CA 3.32Å
238K95.8Very high81Confident94 Ų9493 Ų9341%0.40945%0.449SS..EExtended strand (participates in β ladder)trans-142.4161.1173.4-66.4-174-1741630111.4C150 A209 F211 E240C150-K238 VanDerWaalsContact SG-CA 3.53Å; C150-K238 PolarHBondContact SG-N 2.81Å; C150-K238 PolarHBondContact SG-O 3.32Å; A209-K238 PolarHBondContact N-O 2.86Å; A209-K238 PolarHBondContact O-N 2.92Å; F211-K238 HydrophobicContact CB-CB 3.96Å; F211-K238 HydrophobicContact CB-CD 4.08Å; F211-K238 HydrophobicContact CB-CG 3.76Å; F211-K238 HydrophobicContact CD1-CD 3.83Å; F211-K238 HydrophobicContact CD1-CG 4.36Å; F211-K238 HydrophobicContact CD2-CB 4.35Å; F211-K238 HydrophobicContact CD2-CD 3.71Å; F211-K238 HydrophobicContact CD2-CG 4.25Å; F211-K238 HydrophobicContact CE1-CD 4.22Å; F211-K238 HydrophobicContact CE2-CD 4.08Å; F211-K238 HydrophobicContact CG-CB 4.28Å; F211-K238 HydrophobicContact CG-CD 3.57Å; F211-K238 HydrophobicContact CG-CG 3.85Å; F211-K238 HydrophobicContact CZ-CD 4.32Å; K238-E240 PolarHBondContact O-N 3.35Å
239C94.1Very high78.5Confident40 Ų4092.5 Ų92.527%0.2745%0.446SS..EExtended strand (participates in β ladder)trans-71.4119.8167.4-710000109.3C178 R207C178-C239 VanDerWaalsContact CA-SG 3.52Å; C178-C239 HydrophobicContact CB-CB 3.74Å; C178-C239 WeakPolarHBondContact CB-SG 3.41Å; C178-C239 WeakPolarHBondContact SG-CA 3.31Å; C178-C239 WeakPolarHBondContact SG-CB 3.48Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 3.37Å; R207-C239 WeakPolarHBondContact O-CA 3.3Å
240E90.3Very high75.9Confident71 Ų7191 Ų9133%0.33245%0.45SS..EExtended strand (participates in β ladder)trans-122146174.364.5172.8-158.100110.1S206 R207 A209 K238S206-E240 CarbonylContact C-O 3.58Å; S206-E240 WeakPolarHBondContact CA-O 3.31Å; R207-E240 HydrophobicContact CG-CG 4.04Å; R207-E240 IonicContact CZ-OE1 3.22Å; R207-E240 VanDerWaalsContact CZ-OE1 3.22Å; R207-E240 PolarHBondContact N-O 2.86Å; R207-E240 IonicContact NE-OE1 2.92Å; R207-E240 PolarHBondContact NE-OE1 2.97Å; R207-E240 IonicContact NH2-OE1 2.73Å; R207-E240 PolarHBondContact NH2-OE1 3.17Å; R207-E240 PolarHBondContact O-N 3.38Å; A209-E240 HydrophobicContact CB-CG 3.8Å; A209-E240 VanDerWaalsContact CB-OE1 3.29Å; A209-E240 WeakPolarHBondContact CB-OE1 3.22Å; K238-E240 PolarHBondContact O-N 3.35Å
241T86.1Confident73.5Confident86 Ų8685.1 Ų85.153%0.52844%0.439SS..EExtended strand (participates in β ladder)trans-87.4115.8173.7-56.60000108.7P204 S206 R243P204-T241 HydrophobicContact CB-CG2 3.51Å; S206-T241 PolarHBondContact OG-OG1 2.8Å; T241-R243 PolarHBondContact O-N 3.49Å
242G69.3Low71Confident26 Ų2687.9 Ų87.927%0.26846%0.464SS..  trans-66.2120.5178.100000110.4C205 E244C205-G242 PolarHBondContact O-N 2.89Å; G242-E244 VanDerWaalsContact C-N 3.26Å; G242-E244 PolarHBondContact O-N 3.42Å
243R56.8Low68.4Low246 Ų24691 Ų9193%0.92847%0.471SS*.  trans-79.293.7139.6-77-174.9179.4175.1-0.3104.8T241 E245T241-R243 PolarHBondContact O-N 3.49Å; R243-E245 VanDerWaalsContact C-N 3.28Å; R243-E245 PolarHBondContact O-N 3.36Å
244E59.7Low65.7Low143 Ų14395.5 Ų95.567%0.66850%0.498SS*.THydrogen-bonded Turntrans-60.990177.4-170.7168.1164.500108.6G242G242-E244 VanDerWaalsContact C-N 3.26Å; G242-E244 PolarHBondContact O-N 3.42Å
245E50.8Low63.1Low161 Ų161102.1 Ų102.175%0.75253%0.528SS*.THydrogen-bonded Turntrans-174.1-38.4154.8-119.2174.2154.500114.2R243R243-E245 VanDerWaalsContact C-N 3.28Å; R243-E245 PolarHBondContact O-N 3.36Å
246R45.9Very low60.3Low223 Ų223109.6 Ų109.684%0.84257%0.569SS**Hα-helixtrans-92.1-9.1-162.2-71.9-173.4178.7175.8-1.1118A250R246-A250 VanDerWaalsContact O-CB 3.25Å; R246-A250 WeakPolarHBondContact O-CB 3.21Å
247S44.1Very low58.5Low75 Ų75110.8 Ų110.852%0.52458%0.577SS.*Hα-helixtrans-97.6-31.2-172.7154.40000114.1A251S247-A251 WeakPolarHBondContact O-CB 3.47Å; S247-A251 PolarHBondContact O-N 2.85Å
248A41.9Very low56.4Low81 Ų81115.9 Ų115.967%0.66960%0.603SS**Hα-helixtrans-77.5-37.2179.200000111.5A252A248-A252 PolarHBondContact O-N 3.28Å
249E42.4Very low54.2Low133 Ų133117.2 Ų117.262%0.62161%0.613SS**Hα-helixtrans-75.4-37.3178.6-164172-179.200112.4A251 A252 Y253E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.86Å; E249-A252 PolarHBondContact O-N 2.83Å; E249-Y253 PolarHBondContact O-N 3.29Å
250A40.3Very low51.9Low57 Ų57121.7 Ų121.747%0.47163%0.634SS.*Hα-helixtrans-65.9-33.417400000112.7R246 T254R246-A250 VanDerWaalsContact O-CB 3.25Å; R246-A250 WeakPolarHBondContact O-CB 3.21Å; A250-T254 PolarHBondContact O-OG1 2.81Å
251A45.6Very low49.5Very low53 Ų53124.9 Ų124.944%0.43865%0.652SS.*Hα-helixtrans-71.6-33.2173.900000112.3S247 E249 H255S247-A251 WeakPolarHBondContact O-CB 3.47Å; S247-A251 PolarHBondContact O-N 2.85Å; E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.86Å; A251-H255 PolarHBondContact O-CD2 2.8Å
252A42.6Very low47Very low68 Ų68127.5 Ų127.556%0.56266%0.661SS**Hα-helixtrans-72.5-33.7175.500000112.7A248 E249 T254A248-A252 PolarHBondContact O-N 3.28Å; E249-A252 PolarHBondContact O-N 2.83Å; A252-T254 VanDerWaalsContact C-N 3.35Å; A252-T254 PolarHBondContact O-N 2.98Å
253Y42.1Very low45.4Very low172 Ų172134.7 Ų134.768%0.67569%0.689SS**Hα-helixtrans-80.5-10.6-177.6-129.7-88.6000114.7E249 H255E249-Y253 PolarHBondContact O-N 3.29Å; Y253-H255 PolarHBondContact O-N 3.45Å
254T42Very low44.6Very low114 Ų114126.2 Ų126.270%0.69967%0.67SS**THydrogen-bonded Turntrans-85.35.6175.6-27.10000112.8A250 A252A250-T254 PolarHBondContact O-OG1 2.81Å; A252-T254 VanDerWaalsContact C-N 3.35Å; A252-T254 PolarHBondContact O-N 2.98Å
255H44.5Very low43.3Very low153 Ų153124.8 Ų124.871%0.70867%0.671SS**THydrogen-bonded Turntrans-120.717.6-177.1-77.1-70.7000114A251 Y253A251-H255 PolarHBondContact O-CD2 2.8Å; Y253-H255 PolarHBondContact O-N 3.45Å
256L37.6Very low42.6Very low207 Ų207121.5 Ų121.5100%1.08466%0.663SS**  trans-101.50162.8-74.9172.8000110.5

Retrieved 256 of 256 residues in 385.8 ms (Link to these results)