A0A061IJD4_CRIGR Loading...

Lymphotoxin-beta

Cytokine that binds to LTBR/TNFRSF3. May play a specific role in immune response regulation. Provides the membrane anchor for the attachment of the heterotrimeric complex to the cell surface.

AlphaFold DB , UniProt , Accession A0A061IJD4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ltb, Length 306 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
1M40Very low39.6Very low256 Ų256145.9 Ų145.9100%1.26190%0.895SS**  01240-86.5172.5139.700108.1
2G41.2Very low40.1Very low85 Ų85153.9 Ų153.988%0.87690%0.896SS**  trans146.867.4176.800000113.9
3T40.3Very low40.8Very low131 Ų131152.1 Ų152.180%0.80489%0.892SS**  trans-103.7133.5165.847.80000109.5
4R41.2Very low41.2Very low253 Ų253154 Ų15496%0.95589%0.888SS**  165.2138127.8-93.7175173174.2-1.4112.1
5G38.1Very low41.9Very low82 Ų82148.8 Ų148.885%0.84588%0.881SS**  trans157.881.2164.800000113
6L44.8Very low42.6Very low169 Ų169154 Ų15489%0.88588%0.881SS**  trans-89.7165.4173.3-80.6168000111.7
7Q39.4Very low42.8Very low199 Ų199149.2 Ų149.293%0.9387%0.873SS**  trans87125.2158.4-126.7132.448.800115.8
8G34.6Very low43.1Very low69 Ų69148 Ų14871%0.71187%0.872SS**  cis154.6139.6-0.300000108.8
9Q39Very low43.3Very low203 Ų203148.1 Ų148.195%0.94987%0.868SS**  trans-174.3131.9146-119.9177.97.700111.4
10G39.8Very low43.5Very low84 Ų84148.7 Ų148.787%0.86687%0.866SS**  trans-75.7148.3176.700000113.1
11G37.8Very low43.6Very low74 Ų74149.6 Ų149.676%0.76387%0.867SS**  trans-143.3117165.900000108.9
12R45.7Very low44.1Very low242 Ų242141.2 Ų141.291%0.91384%0.838SS**  trans-53142.9177.5-73.1168165.8168.5-5.3112.1Q14R12-Q14 PolarHBondContact O-N 3.44Å
13P48Very low44.5Very low130 Ų130142.2 Ų142.284%0.84483%0.827SS**  trans-74121.315928.9-28.6000109.3G15P13-G15 PolarHBondContact O-N 3.49Å
14Q47.1Very low45Very low179 Ų179139.2 Ų139.284%0.83682%0.816SS**  trans-70.993177.3-134.416213.500108.9R12 R16R12-Q14 PolarHBondContact O-N 3.44Å; Q14-R16 PolarHBondContact O-N 3.32Å; Q14-R16 VanDerWaalsContact O-N 3.08Å
15G51.3Low45.2Very low76 Ų76129.5 Ų129.578%0.78479%0.794SS**  trans-68.896.3168.500000110.6P13P13-G15 PolarHBondContact O-N 3.49Å
16R54.1Low45.7Very low232 Ų232128.5 Ų128.588%0.87578%0.778SS**  trans-145.486.7167.5-77.5-171.4165.3169-5.7109.2Q14Q14-R16 PolarHBondContact O-N 3.32Å; Q14-R16 VanDerWaalsContact O-N 3.08Å
17G46Very low45.9Very low72 Ų72124.8 Ų124.874%0.74276%0.762SS**SBendtrans-173.624.3177.300000116.4
18C48Very low46.6Very low128 Ų128118.9 Ų118.987%0.86574%0.743SS**SBendtrans-143.824.6179.5-690000115.2
19L45.6Very low47.4Very low149 Ų149120.8 Ų120.878%0.7874%0.736SS**SBendtrans-118.11.2-177.5-117.6140000115.6
20L47.3Very low48.2Very low160 Ų160115 Ų11584%0.83872%0.715SS**SBendtrans-101.6-11.5177.5-68.3176.6000114.8
21L45.7Very low49.1Very low169 Ų169115.4 Ų115.489%0.88570%0.7SS**SBendtrans-85.2-12.9176.8-120.685.6000114.1
22A50.5Low50Low79 Ų79117.4 Ų117.465%0.65369%0.693SS**SBendtrans-88.6-14.5-177.600000114.1
23V50.5Low50.6Low106 Ų106111.3 Ų111.364%0.64268%0.678SS**SBendtrans-99.3-16.3-176-179.70000113.2
24A50.2Low51.1Low69 Ų69110.2 Ų110.257%0.5766%0.664SS**Hα-helixtrans-89-11.6177.400000114.5
25G44.9Very low51.6Low48 Ų48104.2 Ų104.250%0.49565%0.645SS.*Hα-helixtrans-87.2-26.9179.700000114.5L29G25-L29 PolarHBondContact O-N 3.03Å
26A48.7Very low51.9Low61 Ų61104.4 Ų104.450%0.50463%0.631SS.*Hα-helixtrans-78.4-34.5-178.600000112.6V30A26-V30 WeakPolarHBondContact O-CB 3.11Å; A26-V30 WeakPolarHBondContact O-CG2 3.26Å; A26-V30 PolarHBondContact O-N 3.34Å
27T50.6Low52.2Low92 Ų9296.2 Ų96.256%0.56461%0.608SS**Hα-helixtrans-73.3-33.417952.70000112.4T31T27-T31 PolarHBondContact O-N 2.84Å; T27-T31 VanDerWaalsContact O-N 3.11Å; T27-T31 PolarHBondContact O-OG1 2.81Å
28S53Low53Low75 Ų7598.1 Ų98.152%0.52460%0.6SS.*Hα-helixtrans-73-38.2178.4-178.70000112.7T31 L32S28-T31 WeakPolarHBondContact CA-OG1 3.34Å; S28-T31 PolarHBondContact O-OG1 3.41Å; S28-L32 WeakPolarHBondContact O-CB 3.34Å; S28-L32 PolarHBondContact O-N 2.88Å; S28-L32 VanDerWaalsContact O-N 3.12Å
29L51.5Low53.8Low108 Ų10896.1 Ų96.157%0.56558%0.584SS**Hα-helixtrans-69.3-40176.1-161.982.2000111.4G25 L32 L33G25-L29 PolarHBondContact O-N 3.03Å; L29-L32 PolarHBondContact O-N 2.74Å; L29-L33 HydrophobicContact CD2-CD1 4.21Å; L29-L33 HydrophobicContact CG-CD1 4.04Å; L29-L33 WeakPolarHBondContact O-CB 3.06Å; L29-L33 PolarHBondContact O-N 3.45Å
30V56.1Low54.9Low83 Ų8392.7 Ų92.750%0.50357%0.569SS.*Hα-helixtrans-67.6-37.7178.9171.30000112A26 L34A26-V30 WeakPolarHBondContact O-CB 3.11Å; A26-V30 WeakPolarHBondContact O-CG2 3.26Å; A26-V30 PolarHBondContact O-N 3.34Å; V30-L34 HydrophobicContact CG1-CD1 4.13Å; V30-L34 WeakPolarHBondContact O-CG 3.42Å; V30-L34 PolarHBondContact O-N 2.95Å
31T58.9Low55.6Low91 Ų9190.8 Ų90.856%0.55856%0.559SS**Hα-helixtrans-69.4-39.6174.133.70000112.5T27 S28 L34 A35T27-T31 PolarHBondContact O-N 2.84Å; T27-T31 VanDerWaalsContact O-N 3.11Å; T27-T31 PolarHBondContact O-OG1 2.81Å; S28-T31 WeakPolarHBondContact CA-OG1 3.34Å; S28-T31 PolarHBondContact O-OG1 3.41Å; T31-L34 PolarHBondContact O-N 2.8Å; T31-A35 WeakPolarHBondContact O-CB 3.44Å; T31-A35 PolarHBondContact O-N 2.93Å
32L56.2Low56.6Low116 Ų11684.9 Ų84.961%0.60754%0.535SS*.Hα-helixtrans-66.1-41.8175.5-163.976.5000112S28 L29 L34 V36S28-L32 WeakPolarHBondContact O-CB 3.34Å; S28-L32 PolarHBondContact O-N 2.88Å; S28-L32 VanDerWaalsContact O-N 3.12Å; L29-L32 PolarHBondContact O-N 2.74Å; L32-L34 VanDerWaalsContact C-N 3.3Å; L32-L34 PolarHBondContact O-N 2.88Å; L32-V36 VanDerWaalsContact O-CG2 3.31Å; L32-V36 WeakPolarHBondContact O-CG2 3.43Å; L32-V36 PolarHBondContact O-N 2.99Å
33L58.9Low57.4Low115 Ų11585.6 Ų85.660%0.60253%0.531SS*.Hα-helixtrans-65.3-28.2177.8-96.1153.6000113.7L29 P37L29-L33 HydrophobicContact CD2-CD1 4.21Å; L29-L33 HydrophobicContact CG-CD1 4.04Å; L29-L33 WeakPolarHBondContact O-CB 3.06Å; L29-L33 PolarHBondContact O-N 3.45Å; L33-P37 WeakPolarHBondContact O-CD 3.21Å; L33-P37 WeakPolarHBondContact O-CG 3.27Å
34L58.1Low58.1Low106 Ų10686.1 Ų86.156%0.55553%0.529SS*.Hα-helixtrans-92.6-33.8177.6-69.3173.9000113V30 T31 L32 P37 I38V30-L34 HydrophobicContact CG1-CD1 4.13Å; V30-L34 WeakPolarHBondContact O-CG 3.42Å; V30-L34 PolarHBondContact O-N 2.95Å; T31-L34 PolarHBondContact O-N 2.8Å; L32-L34 VanDerWaalsContact C-N 3.3Å; L32-L34 PolarHBondContact O-N 2.88Å; L34-P37 WeakPolarHBondContact O-CD 3.32Å; L34-P37 WeakPolarHBondContact O-CG 3.43Å; L34-I38 WeakPolarHBondContact O-CD1 3.3Å; L34-I38 VanDerWaalsContact O-CG1 3.23Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 3.31Å
35A57.2Low58.8Low53 Ų5386.8 Ų86.844%0.43854%0.535SS..Hα-helixtrans-71.8-36.4-176.800000113.2T31 T39T31-A35 WeakPolarHBondContact O-CB 3.44Å; T31-A35 PolarHBondContact O-N 2.93Å; A35-T39 PolarHBondContact O-N 2.93Å; A35-T39 VanDerWaalsContact O-N 3.11Å; A35-T39 PolarHBondContact O-OG1 3.22Å
36V58.5Low59.7Low80 Ų8091.4 Ų91.449%0.48555%0.548SS..Hα-helixtrans-66-48.9179.3177.60000112.6L32 I38 T39 V40L32-V36 VanDerWaalsContact O-CG2 3.31Å; L32-V36 WeakPolarHBondContact O-CG2 3.43Å; L32-V36 PolarHBondContact O-N 2.99Å; V36-I38 PolarHBondContact O-N 3.06Å; V36-T39 PolarHBondContact O-N 3.13Å; V36-T39 PolarHBondContact O-OG1 2.83Å; V36-V40 VanDerWaalsContact O-CG2 3.31Å; V36-V40 WeakPolarHBondContact O-CG2 3.23Å; V36-V40 PolarHBondContact O-N 2.59Å; V36-V40 VanDerWaalsContact O-N 3.08Å
37P59.9Low60Low61 Ų6192.3 Ų92.340%0.39655%0.547SS..Hα-helixtrans-67.7-32.5178.721.6-30.6000113.2L33 L34 L41L33-P37 WeakPolarHBondContact O-CD 3.21Å; L33-P37 WeakPolarHBondContact O-CG 3.27Å; L34-P37 WeakPolarHBondContact O-CD 3.32Å; L34-P37 WeakPolarHBondContact O-CG 3.43Å; P37-L41 WeakPolarHBondContact O-CB 3.33Å; P37-L41 VanDerWaalsContact O-CG 3.3Å; P37-L41 WeakPolarHBondContact O-CG 3.49Å; P37-L41 PolarHBondContact O-N 3.48Å
38I63.1Low59.9Low111 Ų11193.5 Ų93.557%0.56956%0.556SS**Hα-helixtrans-69.5-40.9178-64169.7000111.1L34 V36 L41 A42L34-I38 WeakPolarHBondContact O-CD1 3.3Å; L34-I38 VanDerWaalsContact O-CG1 3.23Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 3.31Å; V36-I38 PolarHBondContact O-N 3.06Å; I38-L41 PolarHBondContact O-N 3.27Å; I38-A42 WeakPolarHBondContact O-CB 3.12Å; I38-A42 PolarHBondContact O-N 2.82Å
39T64.8Low59.8Low86 Ų8697.1 Ų97.153%0.52857%0.565SS.*Hα-helixtrans-68.3-38.2176.740.90000112.3A35 V36 A42 V43A35-T39 PolarHBondContact O-N 2.93Å; A35-T39 VanDerWaalsContact O-N 3.11Å; A35-T39 PolarHBondContact O-OG1 3.22Å; V36-T39 PolarHBondContact O-N 3.13Å; V36-T39 PolarHBondContact O-OG1 2.83Å; T39-A42 PolarHBondContact O-N 2.8Å; T39-V43 VanDerWaalsContact O-CG2 3.3Å; T39-V43 WeakPolarHBondContact O-CG2 3.49Å; T39-V43 PolarHBondContact O-N 2.81Å
40V67.7Low59.7Low78 Ų7899.5 Ų99.547%0.47358%0.578SS.*Hα-helixtrans-63.8-43.6173.1172.80000111.4V36 V43 L44V36-V40 VanDerWaalsContact O-CG2 3.31Å; V36-V40 WeakPolarHBondContact O-CG2 3.23Å; V36-V40 PolarHBondContact O-N 2.59Å; V36-V40 VanDerWaalsContact O-N 3.08Å; V40-V43 PolarHBondContact O-N 2.76Å; V40-L44 HydrophobicContact CG1-CD1 3.93Å; V40-L44 HydrophobicContact CG1-CG 4.45Å; V40-L44 WeakPolarHBondContact O-CB 3.25Å; V40-L44 VanDerWaalsContact O-CG 3.3Å; V40-L44 WeakPolarHBondContact O-CG 3.47Å; V40-L44 PolarHBondContact O-N 3.08Å
41L63.6Low59.1Low119 Ų119103.2 Ų103.262%0.62359%0.59SS**Hα-helixtrans-64-40.1175.9-76.9168.1000112.5P37 I38 L44 A45P37-L41 WeakPolarHBondContact O-CB 3.33Å; P37-L41 VanDerWaalsContact O-CG 3.3Å; P37-L41 WeakPolarHBondContact O-CG 3.49Å; P37-L41 PolarHBondContact O-N 3.48Å; I38-L41 PolarHBondContact O-N 3.27Å; L41-L44 PolarHBondContact O-N 3.25Å; L41-A45 VanDerWaalsContact O-CB 3.31Å; L41-A45 WeakPolarHBondContact O-CB 3.26Å; L41-A45 PolarHBondContact O-N 3.34Å
42A66Low58.5Low46 Ų46102.5 Ų102.538%0.3860%0.601SS.*Hα-helixtrans-66.1-41.4176.900000112.1I38 T39 A45 L46I38-A42 WeakPolarHBondContact O-CB 3.12Å; I38-A42 PolarHBondContact O-N 2.82Å; T39-A42 PolarHBondContact O-N 2.8Å; A42-A45 PolarHBondContact O-N 2.96Å; A42-L46 WeakPolarHBondContact O-CB 3.43Å; A42-L46 VanDerWaalsContact O-CG 3.24Å; A42-L46 WeakPolarHBondContact O-CG 3.25Å; A42-L46 PolarHBondContact O-N 2.68Å
43V66.3Low57.4Low93 Ų93108.5 Ų108.556%0.56462%0.615SS**Hα-helixtrans-66.4-42.1176.1171.90000111T39 V40 A45 L46 V47T39-V43 VanDerWaalsContact O-CG2 3.3Å; T39-V43 WeakPolarHBondContact O-CG2 3.49Å; T39-V43 PolarHBondContact O-N 2.81Å; V40-V43 PolarHBondContact O-N 2.76Å; V43-A45 VanDerWaalsContact C-N 3.3Å; V43-A45 PolarHBondContact O-N 3.11Å; V43-L46 PolarHBondContact O-N 2.92Å; V43-V47 WeakPolarHBondContact O-CG2 3.37Å; V43-V47 PolarHBondContact O-N 2.81Å; V43-V47 VanDerWaalsContact O-N 3.1Å
44L66.6Low56.3Low117 Ų117114 Ų11461%0.61363%0.628SS**Hα-helixtrans-66.3-30.8176.4-71173.3000113V40 L41V40-L44 HydrophobicContact CG1-CD1 3.93Å; V40-L44 HydrophobicContact CG1-CG 4.45Å; V40-L44 WeakPolarHBondContact O-CB 3.25Å; V40-L44 VanDerWaalsContact O-CG 3.3Å; V40-L44 WeakPolarHBondContact O-CG 3.47Å; V40-L44 PolarHBondContact O-N 3.08Å; L41-L44 PolarHBondContact O-N 3.25Å
45A64.5Low55.6Low84 Ų84115.4 Ų115.469%0.69464%0.64SS**Hα-helixtrans-79.6-25.3176.600000113.6L41 A42 V43L41-A45 VanDerWaalsContact O-CB 3.31Å; L41-A45 WeakPolarHBondContact O-CB 3.26Å; L41-A45 PolarHBondContact O-N 3.34Å; A42-A45 PolarHBondContact O-N 2.96Å; V43-A45 VanDerWaalsContact C-N 3.3Å; V43-A45 PolarHBondContact O-N 3.11Å
46L63.8Low54.6Low145 Ų145121.3 Ų121.376%0.75966%0.659SS**Hα-helixtrans-91.3-12179-69.8171.1000113.5A42 V43 P48A42-L46 WeakPolarHBondContact O-CB 3.43Å; A42-L46 VanDerWaalsContact O-CG 3.24Å; A42-L46 WeakPolarHBondContact O-CG 3.25Å; A42-L46 PolarHBondContact O-N 2.68Å; V43-L46 PolarHBondContact O-N 2.92Å; L46-P48 WeakPolarHBondContact O-CD 3.5Å
47V53.7Low53.6Low79 Ų79126.3 Ų126.348%0.47967%0.674SS.*SBendtrans-78.8117.1168.9170.60000108.4V43 Q49V43-V47 WeakPolarHBondContact O-CG2 3.37Å; V43-V47 PolarHBondContact O-N 2.81Å; V43-V47 VanDerWaalsContact O-N 3.1Å; V47-Q49 PolarHBondContact O-N 2.71Å
48P50.1Low52.5Low118 Ų118130.8 Ų130.877%0.76669%0.693SS**  trans-60.7113172.7-17.831.3000108.7L46 D50L46-P48 WeakPolarHBondContact O-CD 3.5Å; P48-D50 PolarHBondContact O-N 3.41Å
49Q51Low51.3Low151 Ų151130.7 Ų130.771%0.70670%0.703SS**  trans-66.298.3165.6-81.8-80.4-56.100107.4V47 Q51V47-Q49 PolarHBondContact O-N 2.71Å; Q49-Q51 HydrophobicContact CB-CG 4.46Å; Q49-Q51 PolarHBondContact O-N 3.3Å
50D49Very low49.8Very low158 Ų158130 Ų13085%0.84571%0.713SS**  trans-7076.4169.3-166.929.4000108.6P48 G52P48-D50 PolarHBondContact O-N 3.41Å; D50-G52 PolarHBondContact O-N 3.38Å
51Q42.4Very low48.3Very low160 Ų160132.5 Ų132.575%0.74873%0.733SS**  trans-75.9113.2167.7-70.5-154.85.100108.3Q49 R53Q49-Q51 HydrophobicContact CB-CG 4.46Å; Q49-Q51 PolarHBondContact O-N 3.3Å; Q51-R53 PolarHBondContact O-N 2.89Å
52G47.7Very low46.8Very low76 Ų76131.2 Ų131.278%0.78474%0.74SS**  trans-44120.8-176.100000113.9D50 R54D50-G52 PolarHBondContact O-N 3.38Å; G52-R54 PolarHBondContact O-N 2.86Å
53R32.8Very low45.2Very low243 Ų243133.5 Ų133.592%0.91776%0.759SS**  trans-91.1105.1168.7-165.5173.1-171.7177.91.6110.1Q51Q51-R53 PolarHBondContact O-N 2.89Å
54R36.3Very low43.8Very low231 Ų231138.3 Ų138.387%0.87278%0.775SS**  trans-20132.3160-139.4175.9-167.3-151.64.1115.2G52 E56G52-R54 PolarHBondContact O-N 2.86Å; R54-E56 PolarHBondContact O-N 3.49Å
55V43.3Very low42.2Very low134 Ų134137.9 Ų137.981%0.81279%0.788SS**  trans-42.2121.2162.4174.50000111.6
56E34.6Very low41Very low177 Ų177142 Ų14283%0.82779%0.793SS**  trans-123117.7152.2-91.6-176.2166.200109.6R54R54-E56 PolarHBondContact O-N 3.49Å
57K37.9Very low39.6Very low185 Ų185144.9 Ų144.980%0.80480%0.8SS**  trans-75118.3174.4177.5-177.4-175.4177.50108.2
58I37.1Very low38.6Very low156 Ų156150.2 Ų150.280%0.881%0.811SS**  trans-126.2114.1162.4-58.7179.6000108.3
59S39.3Very low38Very low109 Ų109152 Ų15276%0.76281%0.814SS**  trans-68.7145.7166.2-76.70000111.2
60G32Very low37.1Very low72 Ų72149.8 Ų149.874%0.74281%0.807SS**  trans143.694.9163.700000110.1
61S36.4Very low36.6Very low129 Ų129149.4 Ų149.490%0.90281%0.805SS**  61.39174.7-172.70000115
62A31.3Very low36.1Very low93 Ų93149.7 Ų149.777%0.76981%0.811SS**  trans179.4106.1144.200000107.6
63A34.2Very low35.6Very low94 Ų94154.1 Ų154.178%0.77781%0.809SS**  73.3116.481.400000115.2
64Q35.6Very low35.8Very low194 Ų194147.8 Ų147.891%0.90780%0.799SS**  trans65.1116.5150.3-88.9177.2-46.100121.5
65A34.2Very low35.7Very low107 Ų107140.8 Ų140.888%0.88479%0.786SS**  -157.6109123.200000110.7
66Q38.4Very low35.1Very low171 Ų171140.4 Ų140.480%0.79979%0.787SS**  trans-74.5132.4169.3-17484.9-13.500109.4
67K34.3Very low35Very low205 Ų205139.8 Ų139.889%0.89179%0.789SS**  trans-152.4109.5144.7-149.5-177.6179.9-162.90111.8
68R32.6Very low34.8Very low191 Ų191138.7 Ų138.772%0.72179%0.791SS**  trans-54.3142.1160.3-86.7175.2156.5-101.93.1110.7D70R68-D70 IonicContact NH1-OD1 3.3Å
69L37.3Very low34.6Very low157 Ų157137.1 Ų137.182%0.82279%0.791SS**  trans-163.498.1132.7-156.567.2000111.4
70D32.8Very low34.4Very low104 Ų104137 Ų13756%0.55679%0.79SS**  trans40.5119.4131.8-48.8-22.3000122.1R68R68-D70 IonicContact NH1-OD1 3.3Å
71D38.8Very low34.9Very low150 Ų150139.7 Ų139.780%0.80280%0.795SS**  32.2110.4128.4-63.2-30.6000120.4
72N31.4Very low34.6Very low166 Ų166145.1 Ų145.189%0.88880%0.796SS**  trans-161.4118.9131.2-120.5-43.4000113.1
73K37.6Very low34.6Very low168 Ų168146 Ų14673%0.7380%0.796SS**  trans-97.7139171.2174.5-173.8-179.4-171.80108.9S75K73-S75 VanDerWaalsContact CE-OG 3.3Å; K73-S75 WeakPolarHBondContact CE-OG 3.5Å
74P36.7Very low34.5Very low111 Ų111150 Ų15072%0.72180%0.803SS**  trans-115.7126.1145.210.59.1000111
75S34.1Very low34.5Very low83 Ų83146.3 Ų146.358%0.5880%0.799SS**  trans-67127.4161-60.80000109.1K73K73-S75 VanDerWaalsContact CE-OG 3.3Å; K73-S75 WeakPolarHBondContact CE-OG 3.5Å
76C30.8Very low34.2Very low126 Ų126145 Ų14585%0.85180%0.795SS**  trans-113.2111.4164.4-71.20000109
77L31.8Very low34.2Very low164 Ų164143.2 Ų143.286%0.85980%0.797SS**PPolyproline II helixtrans-74.9140.4180-69.9159.2000110.5
78L34Very low34.6Very low162 Ų162139.6 Ų139.685%0.84879%0.794SS**PPolyproline II helixtrans-58.1145.3164.1-67.2159.5000111
79P33.2Very low34.8Very low123 Ų123137.2 Ų137.280%0.79980%0.796SS**PPolyproline II helixtrans-97.3117.115324.7-12.4000110.7
80S34.6Very low35.2Very low106 Ų106135.7 Ų135.774%0.74180%0.795SS**PPolyproline II helixtrans-76.5140.5158.3-60.10000109.8
81P43.7Very low35Very low130 Ų130133.8 Ų133.884%0.84480%0.8SS**PPolyproline II helixtrans-76.5133.6172.528.1-30.1000111.5
82R30Very low34.7Very low243 Ų243134.6 Ų134.692%0.91780%0.803SS**PPolyproline II helixtrans-78140.2169.6-83.7-176180176.10.3111.3
83S30.2Very low34.6Very low112 Ų112137.4 Ų137.478%0.78380%0.802SS**  trans-36.7139.3163.114.40000116.4
84L33Very low34.3Very low177 Ų177135.1 Ų135.193%0.92780%0.804SS**  trans-126.5118.2144.9-89.8165.6000108.7
85S34.3Very low34Very low117 Ų117138.5 Ų138.582%0.81881%0.81SS**  trans-72.7140.6171.747.60000111.6
86G29.3Very low34Very low78 Ų78140.8 Ų140.880%0.80482%0.82SS**  trans-178.993166.200000112.6
87T36.9Very low34.6Very low135 Ų135140 Ų14083%0.82881%0.814SS**  trans-131.7147.6160.65.50000105.9
88P43.8Very low34.7Very low128 Ų128138.2 Ų138.283%0.83181%0.812SS**  -141.8160.360.231-8.7000117.8
89D37.4Very low34.5Very low142 Ų142135.7 Ų135.776%0.75981%0.808SS**  trans-43.9172.4160.1-124.3-6.1000114.3
90P44.1Very low34.5Very low124 Ų124135.7 Ų135.781%0.80581%0.811SS**  cis-149.8166.832.336.4-12.4000119.3
91G28.5Very low34.4Very low64 Ų64140 Ų14066%0.6682%0.816SS**  trans124132.715400000113.3
92L32.3Very low34.1Very low167 Ų167141.2 Ų141.287%0.87482%0.816SS**  cis-153.8138.516-78.4160.9000108.5
93R30.6Very low34.7Very low226 Ų226135.7 Ų135.785%0.85381%0.811SS**  trans33.1137.6150.9-69.5-170.6173.2-148.7-1.4122.7
94P31.5Very low34.6Very low120 Ų120133.5 Ų133.578%0.77981%0.806SS**  trans-82.9139.7166.934.5-30.2000111.5
95E30.1Very low34.4Very low182 Ų182131.4 Ų131.485%0.8581%0.807SS**  trans-117.8111.5171.5-84.1-86.6137.500109.8
96T34.6Very low34.2Very low130 Ų130130.3 Ų130.380%0.79881%0.805SS**  trans-158.5156.5151.590000105.9
97P41.8Very low34.3Very low110 Ų110131.9 Ų131.971%0.71480%0.803SS**  cis-128.4-158.7-18.234.8-14.5000110.2
98P35.8Very low34.1Very low127 Ų127134.7 Ų134.783%0.82581%0.807SS**  -134.1144.1123.833.7-22.6000115.7
99S28.8Very low33.2Very low108 Ų108132.2 Ų132.276%0.75581%0.805SS**  trans-52.9145.2161.2600000112.7
100S33Very low33.3Very low124 Ų124131.1 Ų131.187%0.86781%0.806SS**  trans-118.1138.8151.286.70000109.8
101K32.6Very low32.7Very low196 Ų196131.5 Ų131.585%0.85281%0.805SS**  trans-80.6145.8-169.9-77.4168.5165.9174.70111.9
102N36.9Very low32.8Very low155 Ų155133.2 Ų133.283%0.82981%0.813SS**  trans-61.9157.9152.4-91.7-17.9000111.5
103P42.8Very low32.6Very low127 Ų127134 Ų13483%0.82581%0.812SS**  -134.3142.6101.532.6-18.6000110.2
104G28.4Very low32.5Very low66 Ų66129 Ų12968%0.6881%0.813SS**  cis103.4107.248.900000109
105S28.8Very low32.6Very low133 Ų133128.6 Ų128.693%0.9381%0.812SS**  trans179.2137136.1-81.20000113
106A30.4Very low32.7Very low94 Ų94128.8 Ų128.878%0.77781%0.813SS**  trans-85.2164.9179.800000112.6
107S32.1Very low32.5Very low111 Ų111131.7 Ų131.778%0.77682%0.818SS**  trans174.8102.7143.1-71.30000107.7
108Q31.1Very low31.9Very low194 Ų194130.8 Ų130.891%0.90782%0.819SS**  70.6106.197.2-81.7-168.9-21.400116
109G26.5Very low31.8Very low77 Ų77129.5 Ų129.579%0.79481%0.814SS**  trans48.4171.213900000121.4
110P37.9Very low31.8Very low119 Ų119128.7 Ų128.777%0.77381%0.813SS**  cis-118.2149.411.424.2-1.9000113.5
111V31.7Very low31.7Very low131 Ų131134.3 Ų134.379%0.79482%0.816SS**  42.1104.799.2-174.30000114.4
112A31.1Very low31.6Very low100 Ų100131 Ų13183%0.82681%0.812SS**  trans-143.9110.6148.700000108.2
113Q28.7Very low31.4Very low183 Ų183128.1 Ų128.186%0.85581%0.81SS**  trans-66.2131.4170.3-64.7166.4-70.100108.2
114S29.1Very low30.9Very low123 Ų123128 Ų12886%0.8681%0.807SS**  trans-120.7112.6163.21790000107.8
115S33.2Very low31.3Very low110 Ų110132.8 Ų132.877%0.76982%0.816SS**  trans-63.4138.5-172.5-54.90000112.5E117S115-E117 PolarHBondContact O-N 2.95Å
116Q32.4Very low31.7Very low186 Ų186131.8 Ų131.887%0.86981%0.806SS**  trans-78.1102170.2-172.7174.3-19.300107.8A118Q116-A118 PolarHBondContact O-N 3.38Å
117E29.1Very low32.3Very low192 Ų192133.2 Ų133.290%0.89781%0.807SS**  trans-81.4102166.7-89.5-167.4124.100109.3S115S115-E117 PolarHBondContact O-N 2.95Å
118A28.7Very low32.5Very low90 Ų90132.7 Ų132.774%0.74481%0.81SS**  trans-90.1102.5163.900000108.2Q116 A120Q116-A118 PolarHBondContact O-N 3.38Å; A118-A120 PolarHBondContact O-N 2.8Å
119S34.8Very low32.8Very low101 Ų101132 Ų13271%0.70681%0.811SS**  trans-84.597.5166.449.20000109.1W121S119-W121 PolarHBondContact O-N 2.95Å
120A28.3Very low33.1Very low91 Ų91135.3 Ų135.375%0.75281%0.811SS**  trans-69.6118.1170.600000110.2A118 V122A118-A120 PolarHBondContact O-N 2.8Å; A120-V122 PolarHBondContact O-N 2.87Å
121W31.5Very low32.9Very low242 Ų242135.3 Ų135.392%0.91781%0.814SS**  trans-85.9104.1163.9-75.489.3000108.6S119S119-W121 PolarHBondContact O-N 2.95Å
122V30.2Very low33.1Very low126 Ų126134.7 Ų134.776%0.76482%0.815SS**  trans-77.1115.81631720000107.1A120A120-V122 PolarHBondContact O-N 2.87Å
123A33Very low33.7Very low95 Ų95135.5 Ų135.579%0.78581%0.812SS**  trans-126.7112.5164.800000109
124T31Very low33.9Very low125 Ų125134.3 Ų134.377%0.76781%0.811SS**  trans-64.5129.3-176.6-450000112
125L38.6Very low34.6Very low166 Ų166134 Ų13487%0.86981%0.806SS**  trans-81.7144.6163.4-79.4162.3000110.4
126P36.6Very low35.2Very low111 Ų111132.2 Ų132.272%0.72181%0.806SS**  trans-140.517814044.1-29.6000111.4
127P43Very low35.6Very low125 Ų125129.7 Ų129.781%0.81280%0.803SS**  -109168.4-98.818.83.9000113.1
128A36.6Very low36.2Very low100 Ų100129.3 Ų129.383%0.82680%0.801SS**  trans-64135.9170.400000112
129L36.1Very low36.8Very low179 Ų179136.2 Ų136.294%0.93781%0.808SS**  trans-145.9138.8153.8-97.8168000109.8
130D33.3Very low36.8Very low146 Ų146141.9 Ų141.978%0.78181%0.814SS**  trans-84147.7-168.3-169.910.6000112.1
131S34.2Very low37.3Very low119 Ų119143.5 Ų143.583%0.83282%0.817SS**  trans175.4102.8153.6-77.80000113.5
132S35.4Very low37.7Very low118 Ų118140.7 Ų140.783%0.82581%0.811SS**  trans42.7155.2139.2-1120000124.5
133P43.4Very low38.3Very low118 Ų118137.9 Ų137.977%0.76681%0.808SS**PPolyproline II helixtrans-95.4145.1-153.137.9-33.9000114.9
134D33.4Very low38.7Very low157 Ų157140.5 Ų140.584%0.8480%0.804SS**PPolyproline II helixtrans-100.1129.1166.3-168.537.4000109.7
135P43.5Very low39.3Very low116 Ų116141.8 Ų141.875%0.75381%0.805SS**PPolyproline II helixtrans-91.4131.6-174.133.8-28.4000111.5
136G46.8Very low39.6Very low74 Ų74141.8 Ų141.876%0.76380%0.8SS**  trans102.769.6152.600000116.5
137V39.6Very low40Very low132 Ų132141.9 Ų141.980%0.880%0.799SS**  trans-134.2101.5140.9179.90000107.4R139V137-R139 PolarHBondContact O-N 3.02Å
138Q42.4Very low40.1Very low185 Ų185143.5 Ų143.586%0.86480%0.796SS**  trans-61.599.3167.8-75-162.143.700108.6R140Q138-R140 VanDerWaalsContact C-N 3.33Å; Q138-R140 PolarHBondContact O-N 3.36Å
139R41.9Very low41Very low235 Ų235143.8 Ų143.889%0.88779%0.789SS**  trans-67.2100.4156.8-79.9-175-162.8172.46.7106.6V137V137-R139 PolarHBondContact O-N 3.02Å
140R34.3Very low42.1Very low219 Ų219139.9 Ų139.983%0.82678%0.777SS**  trans-51.1127.3159.8-71.4-175.9174.3-178.5-1.6107Q138 K142Q138-R140 VanDerWaalsContact C-N 3.33Å; Q138-R140 PolarHBondContact O-N 3.36Å; R140-K142 PolarHBondContact O-N 2.81Å
141P38.8Very low43.8Very low126 Ų126138.6 Ų138.682%0.81878%0.777SS**  trans-61.9110161.5-6.321000104.9G143P141-G143 PolarHBondContact O-N 2.64Å
142K38.7Very low46.4Very low183 Ų183138.3 Ų138.380%0.79676%0.762SS**  trans-68.186.5158.9-173.6172.5179.8-169.40104R140 E144R140-K142 PolarHBondContact O-N 2.81Å; K142-E144 PolarHBondContact O-N 2.97Å
143G43.4Very low49.2Very low67 Ų67136 Ų13669%0.69174%0.74SS**  trans-61.784.716100000105.8P141 L145P141-G143 PolarHBondContact O-N 2.64Å; G143-L145 PolarHBondContact O-N 2.93Å
144E40.8Very low51.7Low150 Ų150130.6 Ų130.670%0.70171%0.705SS**  trans-61.695.2151.9-164.9150.9-168.500103.2K142 E146K142-E144 PolarHBondContact O-N 2.97Å; E144-E146 PolarHBondContact O-N 3.25Å
145L43.8Very low54.8Low152 Ų152123.4 Ų123.480%0.79667%0.668SS**  trans-57.495.8161.1-154.8107.6000102.4G143 T147G143-L145 PolarHBondContact O-N 2.93Å; L145-T147 PolarHBondContact O-N 2.87Å
146E45.3Very low57.4Low165 Ų165117.9 Ų117.977%0.77163%0.632SS**  trans-53.7101.9168.3-69.2-158.716100104E144 E148E144-E146 PolarHBondContact O-N 3.25Å; E146-E148 PolarHBondContact O-N 2.89Å
147T45.9Very low59.8Low114 Ų114115.8 Ų115.870%0.69960%0.602SS**  trans-6797.1167.4-60.10000101.6L145L145-T147 PolarHBondContact O-N 2.87Å
148E43.9Very low62.6Low158 Ų158109.5 Ų109.574%0.73856%0.564SS**  trans-36.6115.5166.7-84.7-74.1160.900106.1E146 S150E146-E148 PolarHBondContact O-N 2.89Å; E148-S150 PolarHBondContact O-N 2.8Å
149P56.7Low65.2Low106 Ų106101.4 Ų101.469%0.68853%0.527SS*.  trans-55.2122.5-176.621.3-30.5000106P151P149-P151 VanDerWaalsContact O-N 3.1Å
150S58.8Low67.8Low97 Ų9790.6 Ų90.668%0.67849%0.488SS*.  trans-43.6126.7173.6-33.70000106.7E148 E152E148-S150 PolarHBondContact O-N 2.8Å; S150-E152 PolarHBondContact O-N 3.22Å
151P69.4Low70.5Confident120 Ų12081.6 Ų81.678%0.77946%0.461SS*.PPolyproline II helixtrans-52.6119.5-175.617.9-29.6000107.7P149 L153P149-P151 VanDerWaalsContact O-N 3.1Å; P151-L153 PolarHBondContact O-N 2.7Å
152E87.8Confident72.9Confident113 Ų11381.5 Ų81.553%0.52844%0.444SS..PPolyproline II helixtrans-58.2130.6-177.2-72.4-165.3147.900107.8S150 R180 S181S150-E152 PolarHBondContact O-N 3.22Å; E152-R180 HydrophobicContact CB-CG 4.35Å; E152-R180 IonicContact OE1-NH1 3.51Å; E152-R180 WeakPolarHBondContact OE2-CD 3.16Å; E152-R180 WeakPolarHBondContact OE2-CG 3.16Å; E152-R180 IonicContact OE2-CZ 3.74Å; E152-R180 IonicContact OE2-NE 3.45Å; E152-R180 PolarHBondContact OE2-NE 2.78Å; E152-R180 IonicContact OE2-NH1 3.69Å; E152-S181 VanDerWaalsContact C-OG 3.32Å; E152-S181 WeakPolarHBondContact CB-OG 3.26Å; E152-S181 WeakPolarHBondContact O-CB 3.25Å; E152-S181 PolarHBondContact O-OG 2.9Å
153L94.2Very high75Confident70 Ų7075.8 Ų75.837%0.36642%0.424SS..PPolyproline II helixtrans-64.9144.8179.8-70.6178.8000110.7P151 A155 M304P151-L153 PolarHBondContact O-N 2.7Å; L153-A155 PolarHBondContact O-N 3.14Å; L153-M304 HydrophobicContact CB-CB 4.21Å; L153-M304 HydrophobicContact CD2-SD 4.34Å
154P97Very high76.6Confident3 Ų377.9 Ų77.92%0.01943%0.428CS..PPolyproline II helixtrans-55.5129.8175.7-23.431.9000112.4L193 P194 L195 Y199 M304P154-L193 HydrophobicContact CB-CD2 4.5Å; P154-P194 HydrophobicContact CB-CG 4.18Å; P154-P194 HydrophobicContact CG-CG 4.01Å; P154-L195 HydrophobicContact CG-CB 4.33Å; P154-L195 HydrophobicContact CG-CD1 3.66Å; P154-L195 HydrophobicContact CG-CG 3.89Å; P154-Y199 HydrophobicContact CB-CE1 4.21Å; P154-M304 HydrophobicContact CG-SD 4.1Å; P154-M304 WeakPolarHBondContact O-CB 3.45Å; P154-M304 PolarHBondContact O-N 2.85Å
155A97.6Very high78.2Confident7 Ų775 Ų756%0.05844%0.439CS..EExtended strand (participates in β ladder)trans-151.2151.8-18000000111.2L153 F178 R180 A183 A302 V303L153-A155 PolarHBondContact O-N 3.14Å; A155-F178 HydrophobicContact CB-CE2 3.9Å; A155-R180 HydrophobicContact CB-CB 4.27Å; A155-R180 WeakPolarHBondContact O-CB 3.4Å; A155-R180 PolarHBondContact O-N 3.42Å; A155-A183 WeakPolarHBondContact O-CB 3.24Å; A155-A302 CarbonylContact C-O 3.58Å; A155-A302 VanDerWaalsContact CA-O 3.26Å; A155-A302 WeakPolarHBondContact CA-O 3.22Å; A155-V303 HydrophobicContact CB-CB 4.47Å; A155-V303 HydrophobicContact CB-CG1 4.26Å; A155-V303 HydrophobicContact CB-CG2 4.17Å
156A98.3Very high79.9Confident0 Ų078.3 Ų78.30%044%0.441CS..EExtended strand (participates in β ladder)trans-147.4143.4175.400000110.9L158 F178 L179 A183 L191 Y202 G301 A302A156-L158 HydrophobicContact CB-CD1 4.14Å; A156-F178 CarbonylContact C-O 3.43Å; A156-F178 WeakPolarHBondContact CA-O 3.09Å; A156-L179 HydrophobicContact CB-CD2 3.74Å; A156-A183 HydrophobicContact CB-CB 4.24Å; A156-L191 HydrophobicContact CB-CD1 3.53Å; A156-L191 HydrophobicContact CB-CD2 3.95Å; A156-L191 HydrophobicContact CB-CG 4.4Å; A156-Y202 PolarHBondContact O-OH 2.89Å; A156-G301 CarbonylContact O-C 3.51Å; A156-G301 WeakPolarHBondContact O-CA 3.49Å; A156-A302 PolarHBondContact N-O 3.27Å; A156-A302 PolarHBondContact O-N 3.04Å
157H98.1Very high81.8Confident29 Ų2971.2 Ų71.213%0.13441%0.412CS..EExtended strand (participates in β ladder)trans-135.4121.7168.6-175.385.3000108.2E176 A177 F178 Y202 F299H157-E176 PolarHBondContact CD2-O 3.02Å; H157-A177 CarbonylContact O-C 3.41Å; H157-A177 WeakPolarHBondContact O-CA 3.27Å; H157-A177 WeakPolarHBondContact O-CB 3.24Å; H157-F178 HydrophobicContact CB-CD1 3.6Å; H157-F178 HydrophobicContact CB-CE1 3.28Å; H157-F178 HydrophobicContact CB-CE2 4.33Å; H157-F178 HydrophobicContact CB-CG 4.25Å; H157-F178 HydrophobicContact CB-CZ 3.7Å; H157-F178 PolarHBondContact N-O 3.12Å; H157-F178 PolarHBondContact O-N 2.85Å; H157-Y202 AromaticContact ND1-CE2 3.59Å; H157-Y202 AromaticContact ND1-CZ 3.7Å; H157-Y202 PolarHBondContact ND1-OH 2.83Å; H157-F299 AromaticContact CE1-CD2 3.59Å; H157-F299 AromaticContact CE1-CG 3.65Å
158L97.7Very high84Confident0 Ų067.5 Ų67.50%039%0.388CS..EExtended strand (participates in β ladder)trans-117.2139.5179.8-61.393000109.4A156 W170 E171 A172 F185 L191 F299 F300A156-L158 HydrophobicContact CB-CD1 4.14Å; L158-W170 HydrophobicContact CB-CB 4.42Å; L158-W170 HydrophobicContact CB-CE3 4.32Å; L158-W170 HydrophobicContact CD2-CB 4.12Å; L158-E171 VanDerWaalsContact CA-O 3.25Å; L158-E171 WeakPolarHBondContact CA-O 3.25Å; L158-A172 HydrophobicContact CD2-CB 4Å; L158-A172 HydrophobicContact CG-CB 4.3Å; L158-F185 HydrophobicContact CD2-CB 3.91Å; L158-F185 HydrophobicContact CD2-CD1 3.61Å; L158-F185 HydrophobicContact CD2-CD2 3.26Å; L158-F185 HydrophobicContact CD2-CE1 3.9Å; L158-F185 HydrophobicContact CD2-CE2 3.59Å; L158-F185 HydrophobicContact CD2-CG 3.28Å; L158-F185 HydrophobicContact CD2-CZ 3.91Å; L158-L191 HydrophobicContact CD1-CD1 4.26Å; L158-L191 HydrophobicContact CD1-CD2 4.09Å; L158-F299 CarbonylContact O-C 3.58Å; L158-F299 WeakPolarHBondContact O-CA 3.41Å; L158-F299 VanDerWaalsContact O-CB 3.24Å; L158-F299 WeakPolarHBondContact O-CB 3.49Å; L158-F300 HydrophobicContact CB-CD1 3.84Å; L158-F300 HydrophobicContact CB-CE1 3.58Å; L158-F300 HydrophobicContact CB-CZ 4.27Å; L158-F300 HydrophobicContact CD1-CD1 4.41Å; L158-F300 HydrophobicContact CD1-CE1 3.92Å; L158-F300 HydrophobicContact CD1-CE2 4.06Å; L158-F300 HydrophobicContact CD1-CZ 3.72Å; L158-F300 HydrophobicContact CD2-CE1 3.84Å; L158-F300 HydrophobicContact CD2-CZ 3.89Å; L158-F300 HydrophobicContact CG-CE1 3.99Å; L158-F300 HydrophobicContact CG-CZ 4.19Å; L158-F300 PolarHBondContact N-O 3.47Å; L158-F300 PolarHBondContact O-N 3.18Å
159I97Very high86.3Confident16 Ų1660.7 Ų60.78%0.08236%0.36CS..EExtended strand (participates in β ladder)trans-110144.2-179.667.3-174.9000110.2A161 W170 E171 E175 A177 F299I159-A161 PolarHBondContact O-N 3.21Å; I159-W170 WeakPolarHBondContact O-CA 3.43Å; I159-E171 HydrophobicContact CD1-CB 4.4Å; I159-E171 HydrophobicContact CD1-CG 4.32Å; I159-E171 HydrophobicContact CG1-CB 3.79Å; I159-E171 HydrophobicContact CG1-CG 4.2Å; I159-E171 PolarHBondContact N-O 2.9Å; I159-E171 PolarHBondContact O-N 2.84Å; I159-E175 HydrophobicContact CD1-CB 3.87Å; I159-E175 HydrophobicContact CD1-CG 4.4Å; I159-A177 HydrophobicContact CD1-CB 4.23Å; I159-A177 HydrophobicContact CG1-CB 4.08Å; I159-A177 HydrophobicContact CG2-CB 4.31Å; I159-F299 HydrophobicContact CG2-CB 4.44Å
160G95.4Very high88.1Confident8 Ų858.1 Ų58.18%0.08234%0.337CS..EExtended strand (participates in β ladder)trans-68.4122.9177.900000110.7T298G160-T298 PolarHBondContact N-O 3.42Å
161A92.2Very high89.8Confident30 Ų3055.4 Ų55.425%0.24831%0.313CS..EExtended strand (participates in β ladder)trans-118.9139.9179.400000110.3I159 G169 E171I159-A161 PolarHBondContact O-N 3.21Å; A161-G169 PolarHBondContact N-O 3.46Å; A161-G169 CarbonylContact O-C 3.49Å; A161-G169 PolarHBondContact O-N 3.03Å; A161-E171 HydrophobicContact CB-CB 4.1Å
162W88.6Confident91.1Very high123 Ų12350.2 Ų50.247%0.46628%0.281SS..EExtended strand (participates in β ladder)trans-90.5116.1175-165.7-91.7000110.4
163V82.6Confident91.3Very high64 Ų6449.5 Ų49.539%0.38829%0.288SS..EExtended strand (participates in β ladder)trans-101.4114.2179.4-173.70000108.8G165 R166 G167V163-G165 PolarHBondContact O-N 3.34Å; V163-R166 HydrophobicContact CB-CB 4.09Å; V163-R166 HydrophobicContact CG1-CB 3.96Å; V163-R166 HydrophobicContact CG1-CG 4.44Å; V163-R166 PolarHBondContact O-N 3.32Å; V163-G167 PolarHBondContact N-O 3.15Å; V163-G167 PolarHBondContact O-N 3.03Å
164S77.6Confident91.1Very high110 Ų11052 Ų5277%0.76930%0.298SS*.THydrogen-bonded Turntrans-49.8126.3177.7-66.30000111.6R166S164-R166 PolarHBondContact O-N 3.31Å
165G74.7Confident90.9Very high90 Ų9058.8 Ų58.893%0.92833%0.329SS*.THydrogen-bonded Turntrans76-7.2179.900000115.9V163V163-G165 PolarHBondContact O-N 3.34Å
166R78.6Confident90.7Very high221 Ų22162.3 Ų62.383%0.83435%0.345SS*.THydrogen-bonded Turntrans-118.8-14.9177.3-73.8-176.1167.4-138-1.1114.2V163 S164V163-R166 HydrophobicContact CB-CB 4.09Å; V163-R166 HydrophobicContact CG1-CB 3.96Å; V163-R166 HydrophobicContact CG1-CG 4.44Å; V163-R166 PolarHBondContact O-N 3.32Å; S164-R166 PolarHBondContact O-N 3.31Å
167G85.8Confident90.6Very high16 Ų1662.8 Ų62.817%0.16535%0.349CS..EExtended strand (participates in β ladder)trans84.8-147.818000000112.2V163 G169V163-G167 PolarHBondContact N-O 3.15Å; V163-G167 PolarHBondContact O-N 3.03Å; G167-G169 PolarHBondContact O-N 3.43Å
168L91.6Very high90.5Very high36 Ų3665 Ų6519%0.18836%0.358CS..EExtended strand (participates in β ladder)trans-65.5127.4178.6-17967.4000111.2I285 P288 V291L168-I285 HydrophobicContact CD2-CD1 3.43Å; L168-I285 VanDerWaalsContact CD2-CD1 3.43Å; L168-P288 HydrophobicContact CB-CB 4.24Å; L168-P288 HydrophobicContact CD2-CB 4.49Å; L168-V291 HydrophobicContact CD1-CB 4.36Å; L168-V291 HydrophobicContact CD1-CG1 3.79Å; L168-V291 HydrophobicContact CD2-CB 4.11Å; L168-V291 HydrophobicContact CD2-CG1 4Å; L168-V291 HydrophobicContact CD2-CG2 3.87Å
169G93Very high90.5Very high16 Ų1668.2 Ų68.217%0.16538%0.375CS..EExtended strand (participates in β ladder)trans-127.4-173.6168.400000111.3A161 G167A161-G169 PolarHBondContact N-O 3.46Å; A161-G169 CarbonylContact O-C 3.49Å; A161-G169 PolarHBondContact O-N 3.03Å; G167-G169 PolarHBondContact O-N 3.43Å
170W94.7Very high90.5Very high52 Ų5272.5 Ų72.520%0.19739%0.39CS..EExtended strand (participates in β ladder)trans-126.4134.7-179.7-60.3103.9000110.1L158 I159 F185 V283 I285 T298 F300L158-W170 HydrophobicContact CB-CB 4.42Å; L158-W170 HydrophobicContact CB-CE3 4.32Å; L158-W170 HydrophobicContact CD2-CB 4.12Å; I159-W170 WeakPolarHBondContact O-CA 3.43Å; W170-F185 HydrophobicContact CB-CE1 3.84Å; W170-F185 HydrophobicContact CB-CE2 4.34Å; W170-F185 HydrophobicContact CB-CZ 3.55Å; W170-F185 HydrophobicContact CG-CZ 4.16Å; W170-V283 HydrophobicContact CH2-CG1 4.41Å; W170-V283 HydrophobicContact CH2-CG2 4.2Å; W170-V283 HydrophobicContact CZ2-CB 3.63Å; W170-V283 HydrophobicContact CZ2-CG1 3.85Å; W170-V283 HydrophobicContact CZ2-CG2 3.57Å; W170-I285 HydrophobicContact CH2-CD1 4.38Å; W170-I285 HydrophobicContact CZ2-CD1 4.01Å; W170-T298 HydrophobicContact CH2-CG2 3.91Å; W170-T298 HydrophobicContact CZ3-CG2 3.97Å; W170-F300 HydrophobicContact CB-CE1 4.35Å; W170-F300 AromaticContact CD2-CD1 3.67Å; W170-F300 HydrophobicContact CD2-CD1 3.67Å; W170-F300 AromaticContact CD2-CE1 3.41Å; W170-F300 HydrophobicContact CD2-CE1 3.41Å; W170-F300 VanDerWaalsContact CD2-CE1 3.41Å; W170-F300 AromaticContact CE2-CD1 3.86Å; W170-F300 AromaticContact CE2-CE1 3.71Å; W170-F300 AromaticContact CE3-CD1 3.46Å; W170-F300 HydrophobicContact CE3-CD1 3.46Å; W170-F300 VanDerWaalsContact CE3-CD1 3.46Å; W170-F300 AromaticContact CE3-CE1 3.65Å; W170-F300 HydrophobicContact CE3-CE1 3.65Å; W170-F300 HydrophobicContact CG-CD1 4.45Å; W170-F300 AromaticContact CG-CE1 3.74Å; W170-F300 HydrophobicContact CG-CE1 3.74Å; W170-F300 AromaticContact CH2-CD1 3.69Å; W170-F300 HydrophobicContact CH2-CD1 3.69Å; W170-F300 HydrophobicContact CH2-CE1 4.39Å; W170-F300 HydrophobicContact CH2-CG 4.49Å; W170-F300 AromaticContact CZ2-CD1 3.89Å; W170-F300 HydrophobicContact CZ2-CD1 3.89Å; W170-F300 HydrophobicContact CZ2-CE1 4.21Å; W170-F300 AromaticContact CZ3-CD1 3.49Å; W170-F300 HydrophobicContact CZ3-CD1 3.49Å; W170-F300 VanDerWaalsContact CZ3-CD1 3.49Å; W170-F300 HydrophobicContact CZ3-CE1 4.14Å
171E95Very high90.5Very high39 Ų3974.6 Ų74.618%0.18240%0.404CS..EExtended strand (participates in β ladder)trans-103.6139.1173173.557.9-107.300109.2L158 I159 A161 S173 Q174 A177L158-E171 VanDerWaalsContact CA-O 3.25Å; L158-E171 WeakPolarHBondContact CA-O 3.25Å; I159-E171 HydrophobicContact CD1-CB 4.4Å; I159-E171 HydrophobicContact CD1-CG 4.32Å; I159-E171 HydrophobicContact CG1-CB 3.79Å; I159-E171 HydrophobicContact CG1-CG 4.2Å; I159-E171 PolarHBondContact N-O 2.9Å; I159-E171 PolarHBondContact O-N 2.84Å; A161-E171 HydrophobicContact CB-CB 4.1Å; E171-S173 WeakPolarHBondContact OE1-CA 3.3Å; E171-S173 PolarHBondContact OE1-N 3.02Å; E171-S173 PolarHBondContact OE1-OG 2.82Å; E171-Q174 HydrophobicContact CG-CB 3.82Å; E171-Q174 HydrophobicContact CG-CG 4.45Å; E171-Q174 PolarHBondContact OE1-N 2.84Å; E171-Q174 VanDerWaalsContact OE1-N 3.13Å; E171-Q174 PolarHBondContact OE2-NE2 2.93Å; E171-A177 HydrophobicContact CG-CB 4.37Å; E171-A177 VanDerWaalsContact O-CB 3.27Å; E171-A177 WeakPolarHBondContact O-CB 3.34Å
172A95.3Very high90.6Very high12 Ų1275.4 Ų75.410%0.09941%0.414CS..SBendtrans-127-8-17000000113.8L158 F178 L179 F185L158-A172 HydrophobicContact CD2-CB 4Å; L158-A172 HydrophobicContact CG-CB 4.3Å; A172-F178 CarbonylContact O-C 3.57Å; A172-F178 WeakPolarHBondContact O-CA 3.32Å; A172-F178 PolarHBondContact O-N 2.9Å; A172-L179 HydrophobicContact CB-CD1 3.96Å; A172-L179 HydrophobicContact CB-CD2 4.33Å; A172-L179 HydrophobicContact CB-CG 4.05Å; A172-F185 HydrophobicContact CB-CB 3.99Å; A172-F185 HydrophobicContact CB-CD1 3.84Å; A172-F185 HydrophobicContact CB-CG 4.21Å
173S92.5Very high91Very high98 Ų9870 Ų7069%0.68540%0.396SS*.SBendtrans-133.2-16.1-16963.70000114.7E171E171-S173 WeakPolarHBondContact OE1-CA 3.3Å; E171-S173 PolarHBondContact OE1-N 3.02Å; E171-S173 PolarHBondContact OE1-OG 2.82Å
174Q90.5Very high91.7Very high123 Ų12373 Ų7358%0.57541%0.406SS*.SBendtrans-110.3158.9-177.2-58.6-177.272.600111.8E171 E176 A177E171-Q174 HydrophobicContact CG-CB 3.82Å; E171-Q174 HydrophobicContact CG-CG 4.45Å; E171-Q174 PolarHBondContact OE1-N 2.84Å; E171-Q174 VanDerWaalsContact OE1-N 3.13Å; E171-Q174 PolarHBondContact OE2-NE2 2.93Å; Q174-E176 PolarHBondContact O-N 2.92Å; Q174-A177 VanDerWaalsContact O-CB 3.26Å; Q174-A177 WeakPolarHBondContact O-CB 3.44Å; Q174-A177 PolarHBondContact O-N 2.87Å
175E91.9Very high92.6Very high144 Ų14470 Ų7067%0.67338%0.379SS*.THydrogen-bonded Turntrans56.8-118.1-180-53.7-174.2-177.200113.5I159I159-E175 HydrophobicContact CD1-CB 3.87Å; I159-E175 HydrophobicContact CD1-CG 4.4Å
176E93.2Very high93.4Very high82 Ų8267.6 Ų67.638%0.38335%0.348SS..THydrogen-bonded Turntrans-93.8-1.7179.5-66.1172.5152.200112H157 Q174 R295H157-E176 PolarHBondContact CD2-O 3.02Å; Q174-E176 PolarHBondContact O-N 2.92Å; E176-R295 VanDerWaalsContact CD-NH1 3.28Å; E176-R295 VanDerWaalsContact CG-NH2 3.29Å; E176-R295 IonicContact OE1-CZ 2.95Å; E176-R295 IonicContact OE1-NH1 2.71Å; E176-R295 PolarHBondContact OE1-NH1 3.12Å; E176-R295 IonicContact OE1-NH2 2.68Å; E176-R295 PolarHBondContact OE1-NH2 3.49Å; E176-R295 IonicContact OE2-CZ 3.52Å; E176-R295 IonicContact OE2-NE 3.98Å; E176-R295 IonicContact OE2-NH1 3.41Å; E176-R295 PolarHBondContact OE2-NH1 3.46Å; E176-R295 IonicContact OE2-NH2 3.78Å
177A96.6Very high93.7Very high10 Ų1060.7 Ų60.78%0.08335%0.345CS..  trans-76.3143.7177.100000111.3H157 I159 E171 Q174H157-A177 CarbonylContact O-C 3.41Å; H157-A177 WeakPolarHBondContact O-CA 3.27Å; H157-A177 WeakPolarHBondContact O-CB 3.24Å; I159-A177 HydrophobicContact CD1-CB 4.23Å; I159-A177 HydrophobicContact CG1-CB 4.08Å; I159-A177 HydrophobicContact CG2-CB 4.31Å; E171-A177 HydrophobicContact CG-CB 4.37Å; E171-A177 VanDerWaalsContact O-CB 3.27Å; E171-A177 WeakPolarHBondContact O-CB 3.34Å; Q174-A177 VanDerWaalsContact O-CB 3.26Å; Q174-A177 WeakPolarHBondContact O-CB 3.44Å; Q174-A177 PolarHBondContact O-N 2.87Å
178F97.1Very high93.6Very high76 Ų7665.2 Ų65.233%0.33337%0.37SS..EExtended strand (participates in β ladder)trans-150.5153.4176.367.2-97.9000112.4A155 A156 H157 A172 R180A155-F178 HydrophobicContact CB-CE2 3.9Å; A156-F178 CarbonylContact C-O 3.43Å; A156-F178 WeakPolarHBondContact CA-O 3.09Å; H157-F178 HydrophobicContact CB-CD1 3.6Å; H157-F178 HydrophobicContact CB-CE1 3.28Å; H157-F178 HydrophobicContact CB-CE2 4.33Å; H157-F178 HydrophobicContact CB-CG 4.25Å; H157-F178 HydrophobicContact CB-CZ 3.7Å; H157-F178 PolarHBondContact N-O 3.12Å; H157-F178 PolarHBondContact O-N 2.85Å; A172-F178 CarbonylContact O-C 3.57Å; A172-F178 WeakPolarHBondContact O-CA 3.32Å; A172-F178 PolarHBondContact O-N 2.9Å; F178-R180 HydrophobicContact CD2-CB 4.32Å
179L97.7Very high93.3Very high67 Ų6767.2 Ų67.235%0.35138%0.381SS..EExtended strand (participates in β ladder)trans-123.5133.4164.5-62173.7000107.7A156 A172 A183 F185 L191A156-L179 HydrophobicContact CB-CD2 3.74Å; A172-L179 HydrophobicContact CB-CD1 3.96Å; A172-L179 HydrophobicContact CB-CD2 4.33Å; A172-L179 HydrophobicContact CB-CG 4.05Å; L179-A183 HydrophobicContact CB-CB 4.32Å; L179-A183 HydrophobicContact CD2-CB 4.2Å; L179-F185 HydrophobicContact CD1-CB 4.13Å; L179-F185 HydrophobicContact CD2-CB 4.17Å; L179-L191 HydrophobicContact CD2-CD1 4.15Å
180R96.4Very high93.3Very high106 Ų10666.7 Ų66.740%0.438%0.375SS..EExtended strand (participates in β ladder)trans-131146.5-174.7-173.1-179.1-69.5-158.11.4111.2E152 A155 F178 G182 A183E152-R180 HydrophobicContact CB-CG 4.35Å; E152-R180 IonicContact OE1-NH1 3.51Å; E152-R180 WeakPolarHBondContact OE2-CD 3.16Å; E152-R180 WeakPolarHBondContact OE2-CG 3.16Å; E152-R180 IonicContact OE2-CZ 3.74Å; E152-R180 IonicContact OE2-NE 3.45Å; E152-R180 PolarHBondContact OE2-NE 2.78Å; E152-R180 IonicContact OE2-NH1 3.69Å; A155-R180 HydrophobicContact CB-CB 4.27Å; A155-R180 WeakPolarHBondContact O-CB 3.4Å; A155-R180 PolarHBondContact O-N 3.42Å; F178-R180 HydrophobicContact CD2-CB 4.32Å; R180-G182 PolarHBondContact O-N 2.97Å; R180-A183 VanDerWaalsContact O-CB 3.3Å; R180-A183 WeakPolarHBondContact O-CB 3.39Å; R180-A183 PolarHBondContact O-N 2.89Å; R180-A183 VanDerWaalsContact O-N 3.08Å
181S95.1Very high93.4Very high52 Ų5264.3 Ų64.336%0.36437%0.366SS..THydrogen-bonded Turntrans4851.9171.8-55.70000114.4E152 A183 P194E152-S181 VanDerWaalsContact C-OG 3.32Å; E152-S181 WeakPolarHBondContact CB-OG 3.26Å; E152-S181 WeakPolarHBondContact O-CB 3.25Å; E152-S181 PolarHBondContact O-OG 2.9Å; S181-A183 VanDerWaalsContact C-N 3.34Å; S181-A183 PolarHBondContact O-N 2.94Å; S181-P194 VanDerWaalsContact O-CG 3.23Å; S181-P194 WeakPolarHBondContact O-CG 3.24Å
182G94.9Very high93.5Very high46 Ų4662.7 Ų62.747%0.47436%0.36SS..THydrogen-bonded Turntrans82.54175.600000115.3R180R180-G182 PolarHBondContact O-N 2.97Å
183A96.8Very high93.5Very high9 Ų962.6 Ų62.67%0.07436%0.358CS..  trans-58.4137.2165.900000110.3A155 A156 L179 R180 S181 A192 L193A155-A183 WeakPolarHBondContact O-CB 3.24Å; A156-A183 HydrophobicContact CB-CB 4.24Å; L179-A183 HydrophobicContact CB-CB 4.32Å; L179-A183 HydrophobicContact CD2-CB 4.2Å; R180-A183 VanDerWaalsContact O-CB 3.3Å; R180-A183 WeakPolarHBondContact O-CB 3.39Å; R180-A183 PolarHBondContact O-N 2.89Å; R180-A183 VanDerWaalsContact O-N 3.08Å; S181-A183 VanDerWaalsContact C-N 3.34Å; S181-A183 PolarHBondContact O-N 2.94Å; A183-A192 WeakPolarHBondContact CA-O 3.47Å; A183-L193 HydrophobicContact CB-CD2 3.97Å
184Q96.4Very high93.6Very high127 Ų12760 Ų6059%0.59334%0.338SS*.EExtended strand (participates in β ladder)trans-130.4146-179-65174.43200109.9A192Q184-A192 HydrophobicContact CB-CB 4.25Å; Q184-A192 PolarHBondContact N-O 2.8Å; Q184-A192 PolarHBondContact O-N 2.73Å
185F96.2Very high93.8Very high48 Ų4858.2 Ų58.221%0.21133%0.332CS..EExtended strand (participates in β ladder)trans-132.8138.5174176.3-106000110.9L158 W170 A172 L179 L191 F300L158-F185 HydrophobicContact CD2-CB 3.91Å; L158-F185 HydrophobicContact CD2-CD1 3.61Å; L158-F185 HydrophobicContact CD2-CD2 3.26Å; L158-F185 HydrophobicContact CD2-CE1 3.9Å; L158-F185 HydrophobicContact CD2-CE2 3.59Å; L158-F185 HydrophobicContact CD2-CG 3.28Å; L158-F185 HydrophobicContact CD2-CZ 3.91Å; W170-F185 HydrophobicContact CB-CE1 3.84Å; W170-F185 HydrophobicContact CB-CE2 4.34Å; W170-F185 HydrophobicContact CB-CZ 3.55Å; W170-F185 HydrophobicContact CG-CZ 4.16Å; A172-F185 HydrophobicContact CB-CB 3.99Å; A172-F185 HydrophobicContact CB-CD1 3.84Å; A172-F185 HydrophobicContact CB-CG 4.21Å; L179-F185 HydrophobicContact CD1-CB 4.13Å; L179-F185 HydrophobicContact CD2-CB 4.17Å; F185-L191 HydrophobicContact CD2-CB 4.36Å; F185-F300 HydrophobicContact CE2-CZ 4.41Å
186S91.4Very high94Very high40 Ų4056 Ų5628%0.2833%0.325SS..EExtended strand (participates in β ladder)trans-133.8139.1168.5167.50000108.7T188 D189 G190S186-T188 PolarHBondContact O-N 3.27Å; S186-T188 VanDerWaalsContact O-N 3.14Å; S186-T188 PolarHBondContact OG-N 3.37Å; S186-T188 PolarHBondContact OG-OG1 2.89Å; S186-D189 PolarHBondContact O-N 3.14Å; S186-D189 PolarHBondContact OG-OD2 3.47Å; S186-D189 VanDerWaalsContact OG-OD2 3.11Å; S186-G190 PolarHBondContact N-O 3.24Å; S186-G190 WeakPolarHBondContact O-CA 3.31Å; S186-G190 PolarHBondContact O-N 3.39Å
187G85Confident94.1Very high75 Ų7552.5 Ų52.577%0.77331%0.312SS*.THydrogen-bonded Turntrans-60.2-23.717700000113.6
188T83.6Confident94.2Very high111 Ų11154.5 Ų54.568%0.68132%0.323SS*.THydrogen-bonded Turntrans-91.3-38.917649.60000112.7S186S186-T188 PolarHBondContact O-N 3.27Å; S186-T188 VanDerWaalsContact O-N 3.14Å; S186-T188 PolarHBondContact OG-N 3.37Å; S186-T188 PolarHBondContact OG-OG1 2.89Å
189D85.6Confident94.2Very high79 Ų7950.9 Ų50.942%0.42231%0.307SS..THydrogen-bonded Turntrans-101.7-4.8-168.7-51.9-67.3000113.7S186 R280 Y282S186-D189 PolarHBondContact O-N 3.14Å; S186-D189 PolarHBondContact OG-OD2 3.47Å; S186-D189 VanDerWaalsContact OG-OD2 3.11Å; D189-R280 WeakPolarHBondContact O-CB 3.27Å; D189-R280 WeakPolarHBondContact O-CD 3.39Å; D189-R280 WeakPolarHBondContact O-CG 3.45Å; D189-Y282 VanDerWaalsContact O-CE1 3.26Å; D189-Y282 WeakPolarHBondContact O-CE1 3.21Å; D189-Y282 PolarHBondContact O-OH 3.4Å
190G93.1Very high94.3Very high5 Ų552.7 Ų52.75%0.05231%0.309CS..EExtended strand (participates in β ladder)trans77.6-169.5179.300000113.5S186S186-G190 PolarHBondContact N-O 3.24Å; S186-G190 WeakPolarHBondContact O-CA 3.31Å; S186-G190 PolarHBondContact O-N 3.39Å
191L97.4Very high94.4Very high1 Ų147.7 Ų47.71%0.00529%0.291CS..EExtended strand (participates in β ladder)trans-82.7129.4178.5172.263.4000110.3A156 L158 L179 F185 R280 V281 F300 A302A156-L191 HydrophobicContact CB-CD1 3.53Å; A156-L191 HydrophobicContact CB-CD2 3.95Å; A156-L191 HydrophobicContact CB-CG 4.4Å; L158-L191 HydrophobicContact CD1-CD1 4.26Å; L158-L191 HydrophobicContact CD1-CD2 4.09Å; L179-L191 HydrophobicContact CD2-CD1 4.15Å; F185-L191 HydrophobicContact CD2-CB 4.36Å; L191-R280 CarbonylContact O-C 3.59Å; L191-R280 WeakPolarHBondContact O-CA 3.16Å; L191-V281 HydrophobicContact CB-CB 4.32Å; L191-V281 PolarHBondContact N-O 2.68Å; L191-V281 PolarHBondContact O-N 3.18Å; L191-F300 HydrophobicContact CB-CE2 4.09Å; L191-F300 HydrophobicContact CB-CZ 4.31Å; L191-F300 HydrophobicContact CD2-CE2 4.07Å; L191-A302 HydrophobicContact CD2-CB 3.93Å
192A96Very high94.6Very high6 Ų647 Ų475%0.0528%0.281CS..EExtended strand (participates in β ladder)trans-118.2130.317900000110.6A183 Q184A183-A192 WeakPolarHBondContact CA-O 3.47Å; Q184-A192 HydrophobicContact CB-CB 4.25Å; Q184-A192 PolarHBondContact N-O 2.8Å; Q184-A192 PolarHBondContact O-N 2.73Å
193L96.3Very high94.7Very high10 Ų1045 Ų455%0.05226%0.259CS..  trans-111.8136.4176.4-62163.2000109P154 A183 Y199 L275 A302P154-L193 HydrophobicContact CB-CD2 4.5Å; A183-L193 HydrophobicContact CB-CD2 3.97Å; L193-Y199 HydrophobicContact CB-CE1 3.92Å; L193-Y199 HydrophobicContact CB-CE2 4.5Å; L193-Y199 HydrophobicContact CD1-CD1 3.44Å; L193-Y199 VanDerWaalsContact CD1-CD1 3.44Å; L193-Y199 HydrophobicContact CD1-CD2 4.31Å; L193-Y199 HydrophobicContact CD1-CE1 3.48Å; L193-Y199 VanDerWaalsContact CD1-CE1 3.48Å; L193-Y199 HydrophobicContact CD1-CE2 4.36Å; L193-Y199 HydrophobicContact CD1-CG 3.86Å; L193-Y199 HydrophobicContact CD2-CE1 4.11Å; L193-Y199 HydrophobicContact CG-CD1 4.43Å; L193-Y199 HydrophobicContact CG-CE1 4.02Å; L193-L275 HydrophobicContact CD1-CD1 3.7Å; L193-A302 HydrophobicContact CD1-CB 3.55Å; L193-A302 HydrophobicContact CD2-CB 4.32Å; L193-A302 HydrophobicContact CG-CB 4.49Å
194P95.1Very high94.8Very high42 Ų4246.9 Ų46.927%0.27327%0.266SS..SBendtrans-79.6-20.2-166.728.8-33.6000113.8P154 S181 S277P154-P194 HydrophobicContact CB-CG 4.18Å; P154-P194 HydrophobicContact CG-CG 4.01Å; S181-P194 VanDerWaalsContact O-CG 3.23Å; S181-P194 WeakPolarHBondContact O-CG 3.24Å; P194-S277 WeakPolarHBondContact O-CB 3.47Å; P194-S277 PolarHBondContact O-OG 2.82Å
195L95Very high94.9Very high87 Ų8740.8 Ų40.846%0.45524%0.238SC..SBendtrans-114144.5-172.9-57.2-177000112.1P154 Y199 M304P154-L195 HydrophobicContact CG-CB 4.33Å; P154-L195 HydrophobicContact CG-CD1 3.66Å; P154-L195 HydrophobicContact CG-CG 3.89Å; L195-Y199 WeakPolarHBondContact O-CE2 3.38Å; L195-Y199 PolarHBondContact O-OH 3.39Å; L195-M304 HydrophobicContact CB-CE 4.5Å; L195-M304 HydrophobicContact CB-SD 4.16Å; L195-M304 HydrophobicContact CD1-SD 4.1Å
196D95.5Very high95Very high96 Ų9638.8 Ų38.851%0.51323%0.23SC..  trans-68.8131.4165.9-7019000109L275 R276 S277D196-L275 WeakPolarHBondContact CA-O 3.24Å; D196-R276 WeakPolarHBondContact OD1-CA 3.33Å; D196-S277 VanDerWaalsContact OD1-CB 3.25Å; D196-S277 WeakPolarHBondContact OD1-CB 3.28Å; D196-S277 PolarHBondContact OD1-N 2.98Å
197G95.5Very high95.2Very high10 Ų1036.9 Ų36.910%0.10322%0.217CC..EExtended strand (participates in β ladder)trans173.2177.9-177.600000114.7Y199 Q274 L275G197-Y199 VanDerWaalsContact O-CD2 3.31Å; G197-Y199 WeakPolarHBondContact O-CD2 3.27Å; G197-Q274 VanDerWaalsContact C-NE2 3.26Å; G197-Q274 PolarHBondContact O-NE2 3.36Å; G197-Q274 VanDerWaalsContact O-NE2 3.12Å; G197-L275 PolarHBondContact N-O 3.01Å; G197-L275 PolarHBondContact O-N 2.89Å
198V97.6Very high95.6Very high52 Ų5238.7 Ų38.732%0.31520%0.2SC..EExtended strand (participates in β ladder)trans-88.1127.8170.4-178.90000108L272 V305V198-L272 HydrophobicContact CG1-CB 4.05Å; V198-L272 HydrophobicContact CG1-CD2 4.07Å; V198-L272 HydrophobicContact CG1-CG 4.5Å; V198-V305 PolarHBondContact O-N 3Å
199Y98.4Very high96Very high0 Ų034 Ų340%017%0.174CC..EExtended strand (participates in β ladder)trans-120.5138.1178.6-68.2-96.1000110P154 L193 L195 G197 L201 L272 V273 L275 V303 M304P154-Y199 HydrophobicContact CB-CE1 4.21Å; L193-Y199 HydrophobicContact CB-CE1 3.92Å; L193-Y199 HydrophobicContact CB-CE2 4.5Å; L193-Y199 HydrophobicContact CD1-CD1 3.44Å; L193-Y199 VanDerWaalsContact CD1-CD1 3.44Å; L193-Y199 HydrophobicContact CD1-CD2 4.31Å; L193-Y199 HydrophobicContact CD1-CE1 3.48Å; L193-Y199 VanDerWaalsContact CD1-CE1 3.48Å; L193-Y199 HydrophobicContact CD1-CE2 4.36Å; L193-Y199 HydrophobicContact CD1-CG 3.86Å; L193-Y199 HydrophobicContact CD2-CE1 4.11Å; L193-Y199 HydrophobicContact CG-CD1 4.43Å; L193-Y199 HydrophobicContact CG-CE1 4.02Å; L195-Y199 WeakPolarHBondContact O-CE2 3.38Å; L195-Y199 PolarHBondContact O-OH 3.39Å; G197-Y199 VanDerWaalsContact O-CD2 3.31Å; G197-Y199 WeakPolarHBondContact O-CD2 3.27Å; Y199-L201 PolarHBondContact O-N 2.8Å; Y199-L272 CarbonylContact O-C 3.54Å; Y199-L272 WeakPolarHBondContact O-CA 3.32Å; Y199-V273 PolarHBondContact N-O 2.87Å; Y199-V273 PolarHBondContact O-N 2.95Å; Y199-L275 HydrophobicContact CD2-CB 3.73Å; Y199-L275 HydrophobicContact CD2-CD1 3.95Å; Y199-L275 HydrophobicContact CD2-CG 4.11Å; Y199-L275 HydrophobicContact CE2-CB 4Å; Y199-L275 HydrophobicContact CG-CD1 4.11Å; Y199-V303 CarbonylContact C-O 3.54Å; Y199-V303 WeakPolarHBondContact CA-O 3.44Å; Y199-M304 VanDerWaalsContact CD1-CA 3.42Å; Y199-M304 HydrophobicContact CD1-CB 3.73Å; Y199-M304 HydrophobicContact CD1-CG 4.34Å; Y199-M304 HydrophobicContact CE1-CB 3.45Å; Y199-M304 VanDerWaalsContact CE1-CB 3.45Å; Y199-M304 HydrophobicContact CE1-CG 3.95Å; Y199-M304 HydrophobicContact CE1-SD 4.37Å
200Y98.5Very high96.1Very high104 Ų10436.5 Ų36.541%0.40818%0.177SC..EExtended strand (participates in β ladder)trans-80.4109.1162.5-177.3-105.9000108.7Y202 L272 A302 V303Y200-Y202 AromaticContact CD1-CD1 3.89Å; Y200-Y202 HydrophobicContact CD1-CD1 3.89Å; Y200-Y202 AromaticContact CE1-CD1 3.93Å; Y200-Y202 HydrophobicContact CE1-CD1 3.93Å; Y200-Y202 HydrophobicContact CE1-CG 4.25Å; Y200-L272 HydrophobicContact CD2-CD2 4.2Å; Y200-A302 WeakPolarHBondContact O-CA 3.49Å; Y200-V303 PolarHBondContact N-O 3.4Å; Y200-V303 PolarHBondContact O-N 3.08Å
201L98.7Very high95.7Very high1 Ų136.9 Ų36.91%0.00518%0.18CC..EExtended strand (participates in β ladder)trans-93.1141.8172.7-61.1-170.8000109.9Y199 L228 L243 L244 G270 G271 V273 L275 V281 G301 A302Y199-L201 PolarHBondContact O-N 2.8Å; L201-L228 HydrophobicContact CB-CD1 3.92Å; L201-L228 HydrophobicContact CD1-CD1 4.4Å; L201-L243 HydrophobicContact CD1-CD1 3.62Å; L201-L244 HydrophobicContact CB-CD1 3.98Å; L201-G270 CarbonylContact O-C 3.54Å; L201-G270 WeakPolarHBondContact O-CA 3.35Å; L201-G271 PolarHBondContact N-O 2.8Å; L201-G271 PolarHBondContact O-N 3.22Å; L201-V273 HydrophobicContact CD1-CB 4.03Å; L201-V273 HydrophobicContact CD1-CG1 4.41Å; L201-V273 HydrophobicContact CD1-CG2 3.87Å; L201-V273 HydrophobicContact CG-CB 4.26Å; L201-V273 HydrophobicContact CG-CG2 4.19Å; L201-L275 HydrophobicContact CD1-CD1 4.39Å; L201-L275 HydrophobicContact CD2-CD1 4.09Å; L201-V281 HydrophobicContact CD1-CG1 4.35Å; L201-V281 HydrophobicContact CD1-CG2 4.48Å; L201-G301 WeakPolarHBondContact CA-O 3.23Å; L201-A302 HydrophobicContact CD2-CB 3.32Å
202Y98.7Very high95Very high39 Ų3938.4 Ų38.415%0.15319%0.19CC..EExtended strand (participates in β ladder)trans-144.3150.2176.360.1-85.9000111.2A156 H157 Y200 F269 F299 F300 G301 V303A156-Y202 PolarHBondContact O-OH 2.89Å; H157-Y202 AromaticContact ND1-CE2 3.59Å; H157-Y202 AromaticContact ND1-CZ 3.7Å; H157-Y202 PolarHBondContact ND1-OH 2.83Å; Y200-Y202 AromaticContact CD1-CD1 3.89Å; Y200-Y202 HydrophobicContact CD1-CD1 3.89Å; Y200-Y202 AromaticContact CE1-CD1 3.93Å; Y200-Y202 HydrophobicContact CE1-CD1 3.93Å; Y200-Y202 HydrophobicContact CE1-CG 4.25Å; Y202-F269 WeakPolarHBondContact CA-O 3.42Å; Y202-F299 HydrophobicContact CD2-CD2 4.08Å; Y202-F299 HydrophobicContact CD2-CE2 4.13Å; Y202-F299 AromaticContact CE2-CD2 3.94Å; Y202-F299 HydrophobicContact CE2-CD2 3.94Å; Y202-F299 HydrophobicContact CE2-CE2 4.25Å; Y202-F300 CarbonylContact O-C 3.58Å; Y202-F300 VanDerWaalsContact O-CA 3.25Å; Y202-F300 WeakPolarHBondContact O-CA 3.18Å; Y202-F300 WeakPolarHBondContact O-CB 3.32Å; Y202-G301 WeakPolarHBondContact CD1-O 3.42Å; Y202-G301 VanDerWaalsContact CE1-C 3.42Å; Y202-G301 PolarHBondContact N-O 2.71Å; Y202-G301 PolarHBondContact O-N 3.24Å; Y202-V303 HydrophobicContact CE1-CG2 4.35Å
203C98.5Very high94.1Very high2 Ų240.9 Ų40.91%0.01421%0.206CC..EExtended strand (participates in β ladder)trans-146.7136.2176.8-175.40000109.3L228 G268 F269 F300C203-L228 HydrophobicContact CB-CD1 4.13Å; C203-L228 HydrophobicContact CB-CD2 4.26Å; C203-L228 HydrophobicContact CB-CG 4.16Å; C203-G268 CarbonylContact O-C 3.57Å; C203-G268 VanDerWaalsContact O-CA 3.3Å; C203-G268 WeakPolarHBondContact O-CA 3.31Å; C203-F269 HydrophobicContact CB-CD2 4.32Å; C203-F269 HydrophobicContact CB-CE1 4.02Å; C203-F269 HydrophobicContact CB-CE2 3.72Å; C203-F269 HydrophobicContact CB-CZ 3.56Å; C203-F269 PolarHBondContact N-O 2.88Å; C203-F269 PolarHBondContact O-N 3.4Å; C203-F300 HydrophobicContact CB-CB 4.05Å
204H98.4Very high93Very high49 Ų4943.1 Ų43.123%0.22723%0.226CC..EExtended strand (participates in β ladder)trans-135.9123.6171.9-177.2-80.5000108.9S266 V267 K297 T298 F299H204-S266 VanDerWaalsContact CE1-CB 3.46Å; H204-S266 WeakPolarHBondContact CE1-CB 3.49Å; H204-S266 VanDerWaalsContact NE2-CB 3.33Å; H204-S266 WeakPolarHBondContact NE2-CB 3.3Å; H204-V267 CarbonylContact C-O 3.59Å; H204-V267 WeakPolarHBondContact CA-O 3.37Å; H204-K297 PolarHBondContact CE1-O 3.12Å; H204-K297 PolarHBondContact ND1-O 3.16Å; H204-T298 CarbonylContact O-C 3.58Å; H204-T298 VanDerWaalsContact O-CA 3.28Å; H204-T298 WeakPolarHBondContact O-CA 3.46Å; H204-F299 HydrophobicContact CB-CD1 4.36Å; H204-F299 HydrophobicContact CB-CD2 4.09Å; H204-F299 HydrophobicContact CB-CE1 3.9Å; H204-F299 HydrophobicContact CB-CE2 3.62Å; H204-F299 HydrophobicContact CB-CG 4.45Å; H204-F299 HydrophobicContact CB-CZ 3.51Å; H204-F299 AromaticContact CG-CZ 3.94Å; H204-F299 PolarHBondContact N-O 3.11Å; H204-F299 PolarHBondContact O-N 3.44Å; H204-F299 VanDerWaalsContact O-O 3.05Å
205V98.4Very high91.8Very high0 Ų045.2 Ų45.20%026%0.255CS..EExtended strand (participates in β ladder)trans-121.3115178.1-1730000109Y207 S266 V267 I285 V291 T298V205-Y207 HydrophobicContact CB-CE2 3.81Å; V205-Y207 HydrophobicContact CG1-CD1 4.48Å; V205-Y207 HydrophobicContact CG1-CD2 4.31Å; V205-Y207 HydrophobicContact CG1-CE1 3.87Å; V205-Y207 HydrophobicContact CG1-CE2 3.65Å; V205-Y207 VanDerWaalsContact CG1-CZ 3.41Å; V205-Y207 WeakPolarHBondContact O-CD2 3.39Å; V205-Y207 VanDerWaalsContact O-CE2 3.32Å; V205-Y207 WeakPolarHBondContact O-CE2 3.4Å; V205-S266 CarbonylContact O-C 3.51Å; V205-S266 VanDerWaalsContact O-CA 3.25Å; V205-S266 WeakPolarHBondContact O-CA 2.81Å; V205-V267 PolarHBondContact N-O 3.47Å; V205-V267 PolarHBondContact O-N 2.87Å; V205-I285 HydrophobicContact CG1-CD1 4.01Å; V205-I285 HydrophobicContact CG1-CG1 4.49Å; V205-I285 HydrophobicContact CG1-CG2 4.46Å; V205-I285 HydrophobicContact CG2-CD1 3.83Å; V205-I285 HydrophobicContact CG2-CG1 4.11Å; V205-V291 HydrophobicContact CG1-CG1 4.19Å; V205-V291 HydrophobicContact CG1-CG2 3.7Å; V205-T298 HydrophobicContact CG1-CG2 4.18Å; V205-T298 HydrophobicContact CG2-CG2 4.42Å
206G97.7Very high90.3Very high5 Ų550.6 Ų50.65%0.05227%0.269CS..EExtended strand (participates in β ladder)trans-81.9137.6171.100000110.2V291 D292 K297 T298G206-V291 CarbonylContact O-C 3.58Å; G206-V291 WeakPolarHBondContact O-CA 3.4Å; G206-D292 PolarHBondContact O-N 2.91Å; G206-K297 PolarHBondContact N-O 2.92Å; G206-T298 PolarHBondContact N-OG1 2.91Å
207Y96.3Very high88.6Confident1 Ų149 Ų490%0.00428%0.276CS..EExtended strand (participates in β ladder)trans-121.9145.7176.7-60.6-89000110.5V205 L224 R225 Y264 T265 V267 I285 M290 V291V205-Y207 HydrophobicContact CB-CE2 3.81Å; V205-Y207 HydrophobicContact CG1-CD1 4.48Å; V205-Y207 HydrophobicContact CG1-CD2 4.31Å; V205-Y207 HydrophobicContact CG1-CE1 3.87Å; V205-Y207 HydrophobicContact CG1-CE2 3.65Å; V205-Y207 VanDerWaalsContact CG1-CZ 3.41Å; V205-Y207 WeakPolarHBondContact O-CD2 3.39Å; V205-Y207 VanDerWaalsContact O-CE2 3.32Å; V205-Y207 WeakPolarHBondContact O-CE2 3.4Å; Y207-L224 HydrophobicContact CD1-CD1 4.28Å; Y207-L224 HydrophobicContact CD1-CD2 3.9Å; Y207-L224 HydrophobicContact CD1-CG 4.47Å; Y207-L224 HydrophobicContact CD2-CB 4.17Å; Y207-L224 HydrophobicContact CD2-CD1 3.87Å; Y207-L224 HydrophobicContact CD2-CG 4.49Å; Y207-L224 HydrophobicContact CE1-CB 4.37Å; Y207-L224 HydrophobicContact CE1-CD2 4.14Å; Y207-L224 HydrophobicContact CE2-CB 3.97Å; Y207-L224 HydrophobicContact CG-CB 4.45Å; Y207-L224 HydrophobicContact CG-CD1 3.73Å; Y207-L224 HydrophobicContact CG-CD2 4.22Å; Y207-L224 HydrophobicContact CG-CG 4.35Å; Y207-R225 PolarHBondContact OH-O 3.41Å; Y207-Y264 WeakPolarHBondContact O-CA 3.38Å; Y207-T265 HydrophobicContact CD2-CG2 4.34Å; Y207-T265 PolarHBondContact N-O 3.41Å; Y207-T265 PolarHBondContact O-N 2.89Å; Y207-V267 HydrophobicContact CD2-CG2 4.43Å; Y207-V267 HydrophobicContact CE2-CB 4.12Å; Y207-V267 HydrophobicContact CE2-CG2 3.76Å; Y207-I285 HydrophobicContact CE1-CG2 3.99Å; Y207-M290 CarbonylContact C-O 3.59Å; Y207-M290 WeakPolarHBondContact CA-O 3.38Å; Y207-M290 HydrophobicContact CD1-CB 4.29Å; Y207-V291 HydrophobicContact CD1-CG2 4.22Å; Y207-V291 HydrophobicContact CE1-CG2 3.97Å
208R94.1Very high87.1Confident113 Ų11359.5 Ų59.543%0.42631%0.313SS..EExtended strand (participates in β ladder)trans-137.7144.1171.966-178.7-175.3133.20.1110.5W263 Y264 M290 D292R208-W263 WeakPolarHBondContact CA-O 3.41Å; R208-Y264 HydrophobicContact CB-CD1 3.58Å; R208-Y264 HydrophobicContact CB-CE1 3.53Å; R208-M290 PolarHBondContact N-O 3.41Å; R208-D292 HydrophobicContact CG-CB 4.24Å
209G91.3Very high85.7Confident12 Ų1257.8 Ų57.812%0.12430%0.304CS..EExtended strand (participates in β ladder)trans-150.7176.217600000111.8L262 W263G209-L262 WeakPolarHBondContact O-CA 3.36Å; G209-L262 WeakPolarHBondContact O-CD2 3.18Å; G209-W263 VanDerWaalsContact CA-CE2 3.48Å; G209-W263 PolarHBondContact N-O 2.96Å; G209-W263 VanDerWaalsContact N-O 3.08Å; G209-W263 PolarHBondContact O-N 2.93Å
210R88.4Confident84.9Confident131 Ų13167.8 Ų67.849%0.49434%0.342SS..EExtended strand (participates in β ladder)trans-103.9141.5173-70.3179.8-176.3-80.83.7109.7R260 S261 L262 W263R210-R260 VanDerWaalsContact NH1-CB 3.32Å; R210-R260 PolarHBondContact NH1-O 3.36Å; R210-R260 VanDerWaalsContact NH1-O 3.14Å; R210-S261 CarbonylContact C-O 3.54Å; R210-S261 WeakPolarHBondContact CA-O 3.34Å; R210-L262 HydrophobicContact CG-CD2 3.65Å; R210-W263 PolarHBondContact O-NE1 3.37Å
211A84.8Confident84.4Confident13 Ų1366.8 Ų66.811%0.10735%0.346CS..PPolyproline II helixtrans-62.6142.5167.800000110A253 D255 S261A211-A253 WeakPolarHBondContact CB-O 3.12Å; A211-D255 HydrophobicContact CB-CB 3.95Å; A211-S261 WeakPolarHBondContact CB-O 3.36Å; A211-S261 PolarHBondContact N-O 2.81Å
212P81.9Confident84.1Confident33 Ų3368.8 Ų68.821%0.21436%0.357CS..PPolyproline II helixtrans-67.8141.5172.528.3-31.9000110.1A219 D255P212-A219 HydrophobicContact CG-CB 4.41Å; P212-D255 PolarHBondContact O-N 3.42Å
213P77.9Confident84Confident58 Ų5870.7 Ų70.738%0.37737%0.372SS..BIsolated β-bridgetrans-68.1148.2175.928.7-33.4000111.2G215 R216P213-G215 PolarHBondContact O-N 2.84Å; P213-R216 HydrophobicContact CG-CB 4.22Å; P213-R216 HydrophobicContact CG-CG 4.23Å; P213-R216 PolarHBondContact O-N 3.23Å
214A73.3Confident84Confident58 Ų5870.6 Ų70.648%0.47937%0.372SS..THydrogen-bonded Turntrans-52.6136.6171.500000111.6V254 D255A214-V254 HydrophobicContact CB-CG1 4.19Å; A214-D255 WeakPolarHBondContact CB-O 3.26Å; A214-D255 PolarHBondContact N-O 2.66Å
215G68.6Low84Confident86 Ų8673.5 Ų73.589%0.88738%0.381SS*.THydrogen-bonded Turntrans88.9-11.7179.900000115.6P213 G217P213-G215 PolarHBondContact O-N 2.84Å; G215-G217 PolarHBondContact O-N 3.18Å
216R64.5Low83.9Confident199 Ų19973.5 Ų73.575%0.75138%0.381SS*.SBendtrans-97.379.8168.9-77.3-163.4-176.3-173.61.9111.5P213P213-R216 HydrophobicContact CG-CB 4.22Å; P213-R216 HydrophobicContact CG-CG 4.23Å; P213-R216 PolarHBondContact O-N 3.23Å
217G59.2Low83.9Confident64 Ų6473.3 Ų73.366%0.6638%0.379SS*.SBendtrans61.3179.6169.800000115.2G215G215-G217 PolarHBondContact O-N 3.18Å
218R63.2Low84Confident230 Ų23073.3 Ų73.387%0.86838%0.379SS*.SBendtrans-70.5145176.5-171.3174.8-179.9174.30.1110R220R218-R220 PolarHBondContact O-N 2.83Å; R218-R220 VanDerWaalsContact O-N 3.12Å
219A69.6Low84.1Confident16 Ų1670.6 Ų70.613%0.13237%0.369CS..PPolyproline II helixtrans-50.4119.916800000110P212 T221 T251 P252 V254P212-A219 HydrophobicContact CG-CB 4.41Å; A219-T221 PolarHBondContact O-N 3.14Å; A219-T251 HydrophobicContact CB-CG2 4.23Å; A219-P252 WeakPolarHBondContact CB-O 3.48Å; A219-V254 HydrophobicContact CB-CG2 4.04Å
220R80.4Confident84.3Confident210 Ų21071.3 Ų71.379%0.79237%0.368SS*.PPolyproline II helixtrans-78.8121.2178.5-64.1-178.5106.8158.53.7108.1R218 P252R218-R220 PolarHBondContact O-N 2.83Å; R218-R220 VanDerWaalsContact O-N 3.12Å; R220-P252 WeakPolarHBondContact O-CD 3.38Å
221T89.6Confident84.4Confident83 Ų8365.8 Ų65.851%0.50935%0.35SS..PPolyproline II helixtrans-69133.1167.9-580000108.9A219 T249 V250 T251A219-T221 PolarHBondContact O-N 3.14Å; T221-T249 HydrophobicContact CG2-CG2 3.18Å; T221-V250 CarbonylContact C-O 3.6Å; T221-V250 WeakPolarHBondContact CA-O 3.35Å; T221-T251 WeakPolarHBondContact CG2-OG1 3.19Å; T221-T251 PolarHBondContact OG1-OG1 2.92Å
222L92.3Very high84.6Confident43 Ų4366 Ų6623%0.22535%0.354CS..EExtended strand (participates in β ladder)trans-120.5127.8-178.2-64.3172000109.2T249 V250 W263 M290L222-T249 CarbonylContact O-C 3.57Å; L222-T249 WeakPolarHBondContact O-CA 3.32Å; L222-V250 PolarHBondContact N-O 2.79Å; L222-V250 PolarHBondContact O-N 2.91Å; L222-W263 HydrophobicContact CD1-CH2 4.29Å; L222-W263 HydrophobicContact CD1-CZ2 3.86Å; L222-M290 HydrophobicContact CD1-CE 3.91Å; L222-M290 HydrophobicContact CD1-SD 4.42Å
223T96.8Very high84.5Confident78 Ų7866.2 Ų66.248%0.47936%0.362SS..EExtended strand (participates in β ladder)trans-98.5109.4170.1-57.30000109A247 T249 H287T223-A247 HydrophobicContact CG2-CB 4.31Å; T223-T249 PolarHBondContact OG1-OG1 3.42Å; T223-H287 PolarHBondContact O-CE1 3.39Å
224L97.3Very high84Confident0 Ų067.3 Ų67.30%038%0.376CS..EExtended strand (participates in β ladder)trans-91.3127.1178.8-58.1168.8000107.4Y207 A247 E248 V250 W263 T265 V267 H287Y207-L224 HydrophobicContact CD1-CD1 4.28Å; Y207-L224 HydrophobicContact CD1-CD2 3.9Å; Y207-L224 HydrophobicContact CD1-CG 4.47Å; Y207-L224 HydrophobicContact CD2-CB 4.17Å; Y207-L224 HydrophobicContact CD2-CD1 3.87Å; Y207-L224 HydrophobicContact CD2-CG 4.49Å; Y207-L224 HydrophobicContact CE1-CB 4.37Å; Y207-L224 HydrophobicContact CE1-CD2 4.14Å; Y207-L224 HydrophobicContact CE2-CB 3.97Å; Y207-L224 HydrophobicContact CG-CB 4.45Å; Y207-L224 HydrophobicContact CG-CD1 3.73Å; Y207-L224 HydrophobicContact CG-CD2 4.22Å; Y207-L224 HydrophobicContact CG-CG 4.35Å; L224-A247 CarbonylContact O-C 3.55Å; L224-A247 WeakPolarHBondContact O-CA 3.36Å; L224-E248 PolarHBondContact N-O 2.82Å; L224-E248 PolarHBondContact O-N 3.01Å; L224-V250 HydrophobicContact CD1-CG2 3.87Å; L224-W263 HydrophobicContact CD1-CH2 4.14Å; L224-W263 HydrophobicContact CD1-CZ3 4.07Å; L224-T265 HydrophobicContact CD1-CG2 3.27Å; L224-V267 HydrophobicContact CB-CG2 4.31Å; L224-H287 HydrophobicContact CD2-CB 4.06Å
225R98Very high83.5Confident110 Ų11069.6 Ų69.642%0.41537%0.373SS..EExtended strand (participates in β ladder)trans-133.8138.9-174.6176.5176.762.4-161.88.8109.8Y207 E245 G246 A247 S286Y207-R225 PolarHBondContact OH-O 3.41Å; R225-E245 WeakPolarHBondContact CD-OE1 3.32Å; R225-E245 HydrophobicContact CG-CG 4.02Å; R225-E245 IonicContact NE-OE1 2.72Å; R225-E245 IonicContact NH1-OE1 3.16Å; R225-G246 WeakPolarHBondContact CA-O 3.01Å; R225-A247 HydrophobicContact CB-CB 4.36Å; R225-S286 PolarHBondContact N-OG 3.04Å; R225-S286 PolarHBondContact O-N 2.88Å; R225-S286 PolarHBondContact O-OG 2.86Å
226S97.6Very high83.4Confident0 Ų067.3 Ų67.30%035%0.349CS..EExtended strand (participates in β ladder)trans-133.2140.1168.337.10000109.6G246 V267 F269 N284S226-G246 PolarHBondContact N-O 3.48Å; S226-G246 PolarHBondContact O-N 2.72Å; S226-V267 WeakPolarHBondContact OG-CG1 3.42Å; S226-F269 WeakPolarHBondContact O-CE1 3.32Å; S226-F269 WeakPolarHBondContact O-CZ 3.34Å; S226-F269 WeakPolarHBondContact OG-CE1 3.17Å; S226-N284 CarbonylContact C-O 3.56Å; S226-N284 VanDerWaalsContact CA-O 3.26Å; S226-N284 WeakPolarHBondContact CA-O 3.31Å
227A97.9Very high83.5Confident1 Ų170.4 Ų70.41%0.00836%0.361CS..EExtended strand (participates in β ladder)trans-141.4143-176.600000111Y229 L242 L244 E245 V283 N284A227-Y229 HydrophobicContact CB-CD2 4.25Å; A227-Y229 HydrophobicContact CB-CE2 3.52Å; A227-L242 HydrophobicContact CB-CD1 3.64Å; A227-L244 CarbonylContact C-O 3.52Å; A227-L244 VanDerWaalsContact CA-O 3.25Å; A227-L244 WeakPolarHBondContact CA-O 3.25Å; A227-E245 HydrophobicContact CB-CB 4.3Å; A227-E245 HydrophobicContact CB-CG 4.25Å; A227-V283 CarbonylContact O-C 3.49Å; A227-V283 WeakPolarHBondContact O-CA 3.47Å; A227-N284 PolarHBondContact N-O 3.45Å; A227-N284 PolarHBondContact O-N 2.8Å
228L97.9Very high83.8Confident1 Ų169.3 Ų69.31%0.00535%0.35CS..EExtended strand (participates in β ladder)trans-99.3130.4170.6-68.1177.8000109.4L201 C203 L243 L244 F269 V281 Y282 V283 F300L201-L228 HydrophobicContact CB-CD1 3.92Å; L201-L228 HydrophobicContact CD1-CD1 4.4Å; C203-L228 HydrophobicContact CB-CD1 4.13Å; C203-L228 HydrophobicContact CB-CD2 4.26Å; C203-L228 HydrophobicContact CB-CG 4.16Å; L228-L243 HydrophobicContact CB-CB 4.47Å; L228-L243 WeakPolarHBondContact O-CB 3.46Å; L228-L243 PolarHBondContact O-N 3.19Å; L228-L244 HydrophobicContact CB-CB 4.44Å; L228-L244 HydrophobicContact CD1-CD1 4.27Å; L228-L244 PolarHBondContact N-O 2.9Å; L228-L244 PolarHBondContact O-N 2.77Å; L228-F269 HydrophobicContact CB-CE2 4.39Å; L228-F269 HydrophobicContact CD1-CE2 3.91Å; L228-F269 HydrophobicContact CG-CE2 3.77Å; L228-F269 HydrophobicContact CG-CZ 4.17Å; L228-V281 HydrophobicContact CD2-CG1 4.26Å; L228-Y282 CarbonylContact C-O 3.49Å; L228-Y282 WeakPolarHBondContact CA-O 3.38Å; L228-V283 HydrophobicContact CD2-CB 4.31Å; L228-V283 HydrophobicContact CD2-CG1 4.37Å; L228-V283 HydrophobicContact CD2-CG2 3.69Å; L228-F300 HydrophobicContact CD2-CD2 4.09Å
229Y95.8Very high84.4Confident56 Ų5663.5 Ų63.522%0.2234%0.344CS..EExtended strand (participates in β ladder)trans-118.9151.7177-68.5-93.6000110.6A227 P240 E241 L242 V281 Y282 N284A227-Y229 HydrophobicContact CB-CD2 4.25Å; A227-Y229 HydrophobicContact CB-CE2 3.52Å; Y229-P240 HydrophobicContact CD1-CB 3.83Å; Y229-P240 HydrophobicContact CG-CB 4.19Å; Y229-E241 CarbonylContact C-O 3.55Å; Y229-E241 WeakPolarHBondContact CA-O 3.33Å; Y229-L242 HydrophobicContact CD1-CB 4.17Å; Y229-L242 HydrophobicContact CD1-CD1 4.39Å; Y229-L242 HydrophobicContact CE1-CB 3.81Å; Y229-L242 HydrophobicContact CE1-CD1 3.89Å; Y229-L242 HydrophobicContact CE1-CG 4.46Å; Y229-L242 HydrophobicContact CE2-CD1 4.16Å; Y229-V281 CarbonylContact O-C 3.49Å; Y229-V281 VanDerWaalsContact O-CA 3.27Å; Y229-V281 WeakPolarHBondContact O-CA 3.41Å; Y229-Y282 PolarHBondContact N-O 3.08Å; Y229-Y282 PolarHBondContact O-N 3.02Å; Y229-N284 HydrophobicContact CD2-CB 3.96Å; Y229-N284 HydrophobicContact CE2-CB 3.55Å
230R94.6Very high85.4Confident28 Ų2866.7 Ų66.711%0.10636%0.363CS..EExtended strand (participates in β ladder)trans-108.9148161.164.2173.7175.5-153-5112.2Y235 P240 E241 L243 Q274 R280R230-Y235 PolarHBondContact NH2-OH 3.07Å; R230-P240 CarbonylContact O-C 3.57Å; R230-P240 WeakPolarHBondContact O-CA 3.36Å; R230-E241 HydrophobicContact CG-CB 3.93Å; R230-E241 IonicContact CZ-OE1 3.76Å; R230-E241 IonicContact CZ-OE2 2.77Å; R230-E241 PolarHBondContact N-O 2.84Å; R230-E241 VanDerWaalsContact NE-CD 3.35Å; R230-E241 IonicContact NE-OE1 3.18Å; R230-E241 IonicContact NE-OE2 3.87Å; R230-E241 PolarHBondContact NE-OE2 3.09Å; R230-E241 IonicContact NH2-OE1 2.82Å; R230-E241 PolarHBondContact NH2-OE1 3.42Å; R230-E241 IonicContact NH2-OE2 3.97Å; R230-E241 PolarHBondContact NH2-OE2 3.37Å; R230-E241 PolarHBondContact O-N 2.86Å; R230-L243 HydrophobicContact CB-CD1 3.92Å; R230-L243 HydrophobicContact CB-CD2 4.39Å; R230-L243 HydrophobicContact CB-CG 4.23Å; R230-L243 HydrophobicContact CG-CD1 4.27Å; R230-L243 HydrophobicContact CG-CD2 3.8Å; R230-L243 HydrophobicContact CG-CG 4.08Å; R230-Q274 PolarHBondContact NH1-O 3.32Å; R230-R280 CarbonylContact C-O 3.55Å; R230-R280 WeakPolarHBondContact CA-O 2.98Å
231A92.2Very high86Confident15 Ų1560.3 Ų60.312%0.12434%0.343CS..EExtended strand (participates in β ladder)trans-146.5167.8165.500000110.7E279 R280 Y282A231-E279 WeakPolarHBondContact O-CA 3.39Å; A231-R280 PolarHBondContact N-O 3.34Å; A231-R280 PolarHBondContact O-N 3.39Å; A231-Y282 HydrophobicContact CB-CE2 3.9Å
232G87.7Confident86.3Confident18 Ų1860 Ų6019%0.18634%0.337CS..EExtended strand (participates in β ladder)trans84.4-164.3-18000000114Y235 G236G232-Y235 PolarHBondContact O-N 3.36Å; G232-G236 VanDerWaalsContact CA-O 3.24Å; G232-G236 WeakPolarHBondContact CA-O 3.42Å; G232-G236 PolarHBondContact N-O 2.85Å
233G79.6Confident86.6Confident36 Ų3659.5 Ų59.537%0.37134%0.335SS..G310 helixtrans59.2-137.8-17700000113.5Y235 G236 G278G233-Y235 PolarHBondContact O-N 2.82Å; G233-Y235 VanDerWaalsContact O-N 3.15Å; G233-G236 PolarHBondContact O-N 3.02Å; G233-G278 PolarHBondContact N-O 3.21Å
234A68.2Low86.7Confident81 Ų8157.6 Ų57.667%0.66932%0.321SS*.G310 helixtrans-66.8-12.2-17800000114.1G236A234-G236 VanDerWaalsContact C-N 3.27Å
235Y63.4Low86.7Confident107 Ų10762 Ų6242%0.4234%0.342SS..G310 helixtrans-86.20.7173.9-56.1-69.2000112.8R230 G232 G233 R276 E279R230-Y235 PolarHBondContact NH2-OH 3.07Å; G232-Y235 PolarHBondContact O-N 3.36Å; G233-Y235 PolarHBondContact O-N 2.82Å; G233-Y235 VanDerWaalsContact O-N 3.15Å; Y235-R276 PolarHBondContact OH-NH2 3.35Å; Y235-R276 VanDerWaalsContact OH-NH2 3.14Å; Y235-E279 WeakPolarHBondContact CD2-OE1 3.33Å; Y235-E279 WeakPolarHBondContact CE2-OE1 3.3Å
236G66.6Low86.7Confident38 Ų3857.3 Ų57.339%0.39233%0.328SS..THydrogen-bonded Turntrans67-166.1-176.800000112.4G232 G233 A234 G238G232-G236 VanDerWaalsContact CA-O 3.24Å; G232-G236 WeakPolarHBondContact CA-O 3.42Å; G232-G236 PolarHBondContact N-O 2.85Å; G233-G236 PolarHBondContact O-N 3.02Å; A234-G236 VanDerWaalsContact C-N 3.27Å; G236-G238 PolarHBondContact O-N 2.79Å
237R66.3Low86.7Confident264 Ų26460 Ų60100%0.99635%0.35SS*.THydrogen-bonded Turntrans-69.515.6174.6-129.8-172.6-160.1-1535.4113.4
238G65.4Low86.7Confident41 Ų4164.2 Ų64.242%0.42337%0.37SS..  trans-68.6-175.9-165.800000115.4G236G236-G238 PolarHBondContact O-N 2.79Å
239S76.4Confident86.6Confident108 Ų10867.8 Ų67.876%0.75539%0.392SS*.PPolyproline II helixtrans-57.8135.6-17953.20000111.8E241S239-E241 PolarHBondContact O-N 2.92Å
240P89.7Confident86.5Confident82 Ų8266.1 Ų66.153%0.53239%0.388SS..PPolyproline II helixtrans-56.3134.2174.9-23.833000112Y229 R230Y229-P240 HydrophobicContact CD1-CB 3.83Å; Y229-P240 HydrophobicContact CG-CB 4.19Å; R230-P240 CarbonylContact O-C 3.57Å; R230-P240 WeakPolarHBondContact O-CA 3.36Å
241E93.3Very high86.3Confident77 Ų7768.8 Ų68.836%0.3641%0.407SS..EExtended strand (participates in β ladder)trans-98.2130.4174.6-176.8-175.2165.100109.8Y229 R230 S239 L243Y229-E241 CarbonylContact C-O 3.55Å; Y229-E241 WeakPolarHBondContact CA-O 3.33Å; R230-E241 HydrophobicContact CG-CB 3.93Å; R230-E241 IonicContact CZ-OE1 3.76Å; R230-E241 IonicContact CZ-OE2 2.77Å; R230-E241 PolarHBondContact N-O 2.84Å; R230-E241 VanDerWaalsContact NE-CD 3.35Å; R230-E241 IonicContact NE-OE1 3.18Å; R230-E241 IonicContact NE-OE2 3.87Å; R230-E241 PolarHBondContact NE-OE2 3.09Å; R230-E241 IonicContact NH2-OE1 2.82Å; R230-E241 PolarHBondContact NH2-OE1 3.42Å; R230-E241 IonicContact NH2-OE2 3.97Å; R230-E241 PolarHBondContact NH2-OE2 3.37Å; R230-E241 PolarHBondContact O-N 2.86Å; S239-E241 PolarHBondContact O-N 2.92Å; E241-L243 PolarHBondContact O-N 2.91Å
242L96.1Very high86Confident76 Ų7668.6 Ų68.640%0.39840%0.404SS..EExtended strand (participates in β ladder)trans-71.5126.3176.6179.165.8000110.2A227 Y229 E245A227-L242 HydrophobicContact CB-CD1 3.64Å; Y229-L242 HydrophobicContact CD1-CB 4.17Å; Y229-L242 HydrophobicContact CD1-CD1 4.39Å; Y229-L242 HydrophobicContact CE1-CB 3.81Å; Y229-L242 HydrophobicContact CE1-CD1 3.89Å; Y229-L242 HydrophobicContact CE1-CG 4.46Å; Y229-L242 HydrophobicContact CE2-CD1 4.16Å; L242-E245 HydrophobicContact CD1-CB 4.23Å; L242-E245 HydrophobicContact CD2-CB 4.36Å; L242-E245 WeakPolarHBondContact CD2-OE2 3.3Å
243L97.4Very high85.8Confident33 Ų3371.6 Ų71.617%0.17343%0.427CS..EExtended strand (participates in β ladder)trans-98.7-54.1176.4-64.4178.9000111.9L201 L228 R230 E241 V273 L275L201-L243 HydrophobicContact CD1-CD1 3.62Å; L228-L243 HydrophobicContact CB-CB 4.47Å; L228-L243 WeakPolarHBondContact O-CB 3.46Å; L228-L243 PolarHBondContact O-N 3.19Å; R230-L243 HydrophobicContact CB-CD1 3.92Å; R230-L243 HydrophobicContact CB-CD2 4.39Å; R230-L243 HydrophobicContact CB-CG 4.23Å; R230-L243 HydrophobicContact CG-CD1 4.27Å; R230-L243 HydrophobicContact CG-CD2 3.8Å; R230-L243 HydrophobicContact CG-CG 4.08Å; E241-L243 PolarHBondContact O-N 2.91Å; L243-V273 HydrophobicContact CB-CG2 4.41Å; L243-V273 HydrophobicContact CD1-CG1 3.99Å; L243-V273 HydrophobicContact CD2-CG1 3.67Å; L243-V273 HydrophobicContact CG-CG1 4.36Å; L243-L275 HydrophobicContact CD1-CD2 4.29Å
244L98.4Very high85.9Confident38 Ų3873 Ų7320%0.19943%0.428CS..EExtended strand (participates in β ladder)trans-144.4142.1-174.5-62.1172.7000108.9L201 A227 L228 F269L201-L244 HydrophobicContact CB-CD1 3.98Å; A227-L244 CarbonylContact C-O 3.52Å; A227-L244 VanDerWaalsContact CA-O 3.25Å; A227-L244 WeakPolarHBondContact CA-O 3.25Å; L228-L244 HydrophobicContact CB-CB 4.44Å; L228-L244 HydrophobicContact CD1-CD1 4.27Å; L228-L244 PolarHBondContact N-O 2.9Å; L228-L244 PolarHBondContact O-N 2.77Å; L244-F269 HydrophobicContact CB-CD2 3.53Å; L244-F269 HydrophobicContact CB-CE2 3.51Å; L244-F269 HydrophobicContact CD1-CD2 4.25Å; L244-F269 HydrophobicContact CG-CD2 4.49Å
245E98.3Very high86.4Confident91 Ų9169.3 Ų69.343%0.42540%0.398SS..EExtended strand (participates in β ladder)trans-138.7141.9178.1-176.7176.9161.200109.9R225 A227 L242R225-E245 WeakPolarHBondContact CD-OE1 3.32Å; R225-E245 HydrophobicContact CG-CG 4.02Å; R225-E245 IonicContact NE-OE1 2.72Å; R225-E245 IonicContact NH1-OE1 3.16Å; A227-E245 HydrophobicContact CB-CB 4.3Å; A227-E245 HydrophobicContact CB-CG 4.25Å; L242-E245 HydrophobicContact CD1-CB 4.23Å; L242-E245 HydrophobicContact CD2-CB 4.36Å; L242-E245 WeakPolarHBondContact CD2-OE2 3.3Å
246G98.2Very high86.7Confident13 Ų1369.2 Ų69.213%0.13441%0.41CS..EExtended strand (participates in β ladder)trans-130.6148.4165.600000110.1R225 S226 V267R225-G246 WeakPolarHBondContact CA-O 3.01Å; S226-G246 PolarHBondContact N-O 3.48Å; S226-G246 PolarHBondContact O-N 2.72Å; G246-V267 WeakPolarHBondContact O-CG1 3.44Å
247A98Very high87Confident56 Ų5672 Ų7246%0.46342%0.42SS..EExtended strand (participates in β ladder)trans-142.4145.2173.800000111.2T223 L224 R225T223-A247 HydrophobicContact CG2-CB 4.31Å; L224-A247 CarbonylContact O-C 3.55Å; L224-A247 WeakPolarHBondContact O-CA 3.36Å; R225-A247 HydrophobicContact CB-CB 4.36Å
248E97.4Very high87.1Confident89 Ų8961.5 Ų61.542%0.41639%0.393SS..EExtended strand (participates in β ladder)trans-132.9138.7175.7-178.867.9-174.800108.6L224 V250 T265 V267L224-E248 PolarHBondContact N-O 2.82Å; L224-E248 PolarHBondContact O-N 3.01Å; E248-V250 HydrophobicContact CG-CG2 4.39Å; E248-T265 HydrophobicContact CG-CG2 4.39Å; E248-V267 HydrophobicContact CB-CG2 3.64Å
249T96.1Very high87.4Confident77 Ų7768.5 Ų68.547%0.47241%0.408SS..EExtended strand (participates in β ladder)trans-109.9116.7178.9-64.40000110.8T221 L222 T223T221-T249 HydrophobicContact CG2-CG2 3.18Å; L222-T249 CarbonylContact O-C 3.57Å; L222-T249 WeakPolarHBondContact O-CA 3.32Å; T223-T249 PolarHBondContact OG1-OG1 3.42Å
250V93.2Very high87.3Confident21 Ų2170.9 Ų70.913%0.12740%0.4CS..EExtended strand (participates in β ladder)trans-106.8132.6-179.2-1770000109.7T221 L222 L224 E248 P252 W263 T265T221-V250 CarbonylContact C-O 3.6Å; T221-V250 WeakPolarHBondContact CA-O 3.35Å; L222-V250 PolarHBondContact N-O 2.79Å; L222-V250 PolarHBondContact O-N 2.91Å; L224-V250 HydrophobicContact CD1-CG2 3.87Å; E248-V250 HydrophobicContact CG-CG2 4.39Å; V250-P252 HydrophobicContact CG1-CG 4.21Å; V250-W263 HydrophobicContact CG1-CD2 4.3Å; V250-W263 HydrophobicContact CG1-CE3 4.12Å; V250-W263 HydrophobicContact CG1-CZ3 4.34Å; V250-W263 HydrophobicContact CG2-CZ3 4.41Å; V250-T265 HydrophobicContact CG2-CG2 3.43Å; V250-T265 VanDerWaalsContact CG2-CG2 3.43Å
251T90.8Very high87.1Confident84 Ų8469.6 Ų69.652%0.51539%0.393SS..  trans-114.497.5165.2-57.50000108.1A219 T221 A253A219-T251 HydrophobicContact CB-CG2 4.23Å; T221-T251 WeakPolarHBondContact CG2-OG1 3.19Å; T221-T251 PolarHBondContact OG1-OG1 2.92Å; T251-A253 PolarHBondContact O-N 3Å
252P85.9Confident86.8Confident10 Ų1069.9 Ų69.97%0.06540%0.397CS..PPolyproline II helixtrans-59.6133.2-179.4-23.734.6000110.6A219 R220 V250 W263A219-P252 WeakPolarHBondContact CB-O 3.48Å; R220-P252 WeakPolarHBondContact O-CD 3.38Å; V250-P252 HydrophobicContact CG1-CG 4.21Å; P252-W263 HydrophobicContact CB-CG 4.41Å; P252-W263 HydrophobicContact CG-CD2 4.5Å; P252-W263 HydrophobicContact CG-CG 4.47Å; P252-W263 HydrophobicContact CG-CZ2 4.29Å
253A83Confident86.6Confident81 Ų8167.7 Ų67.767%0.66938%0.383SS*.PPolyproline II helixtrans-58.3142.2169.500000109.6A211 T251A211-A253 WeakPolarHBondContact CB-O 3.12Å; T251-A253 PolarHBondContact O-N 3Å
254V81.1Confident86.5Confident65 Ų6571.7 Ų71.739%0.39440%0.397SS..PPolyproline II helixtrans-66.3137.2172178.80000108.1A214 A219 P256A214-V254 HydrophobicContact CB-CG1 4.19Å; A219-V254 HydrophobicContact CB-CG2 4.04Å; V254-P256 WeakPolarHBondContact O-CD 3.43Å
255D80.1Confident86.4Confident5 Ų571.5 Ų71.53%0.02740%0.397CS..BIsolated β-bridgetrans-83.2106.6175.9-179.3-2.8000110.1A211 P212 A214 V257 G258 Y259 R260 S261A211-D255 HydrophobicContact CB-CB 3.95Å; P212-D255 PolarHBondContact O-N 3.42Å; A214-D255 WeakPolarHBondContact CB-O 3.26Å; A214-D255 PolarHBondContact N-O 2.66Å; D255-V257 VanDerWaalsContact C-N 3.31Å; D255-V257 PolarHBondContact O-N 3.49Å; D255-V257 PolarHBondContact OD1-N 3.08Å; D255-G258 PolarHBondContact OD1-N 3.43Å; D255-G258 WeakPolarHBondContact OD2-CA 3.25Å; D255-Y259 PolarHBondContact OD1-N 2.77Å; D255-Y259 PolarHBondContact OD2-N 3.27Å; D255-R260 WeakPolarHBondContact OD2-CA 3.41Å; D255-R260 PolarHBondContact OD2-N 3.08Å; D255-S261 PolarHBondContact OD2-N 2.87Å
256P69.8Low86.3Confident105 Ų10569.9 Ų69.968%0.68240%0.396SS*.SBendtrans-74.1-21.4-173.227-27.4000113.3V254V254-P256 WeakPolarHBondContact O-CD 3.43Å
257V72.1Confident86.3Confident97 Ų9769.5 Ų69.559%0.58839%0.391SS*.SBendtrans-115.4-6.6-172.6-164.10000112.1D255 Y259D255-V257 VanDerWaalsContact C-N 3.31Å; D255-V257 PolarHBondContact O-N 3.49Å; D255-V257 PolarHBondContact OD1-N 3.08Å; V257-Y259 HydrophobicContact CB-CD2 3.54Å; V257-Y259 HydrophobicContact CB-CE2 3.49Å; V257-Y259 VanDerWaalsContact CB-CE2 3.49Å; V257-Y259 HydrophobicContact CG1-CD2 3.76Å; V257-Y259 HydrophobicContact CG1-CE2 3.2Å; V257-Y259 HydrophobicContact CG2-CD2 4.35Å; V257-Y259 HydrophobicContact CG2-CE2 4.15Å
258G68.7Low86.3Confident42 Ų4269.2 Ų69.243%0.43339%0.393SS..  trans76.621.2177.800000113.8D255 R260D255-G258 PolarHBondContact OD1-N 3.43Å; D255-G258 WeakPolarHBondContact OD2-CA 3.25Å; G258-R260 PolarHBondContact O-N 2.97Å; G258-R260 VanDerWaalsContact O-N 3.08Å
259Y71.3Confident86.4Confident188 Ų18866.6 Ų66.674%0.73738%0.381SS*.SBendtrans-69.22.4175.7-72.8-60.9000114.2D255 V257 S261D255-Y259 PolarHBondContact OD1-N 2.77Å; D255-Y259 PolarHBondContact OD2-N 3.27Å; V257-Y259 HydrophobicContact CB-CD2 3.54Å; V257-Y259 HydrophobicContact CB-CE2 3.49Å; V257-Y259 VanDerWaalsContact CB-CE2 3.49Å; V257-Y259 HydrophobicContact CG1-CD2 3.76Å; V257-Y259 HydrophobicContact CG1-CE2 3.2Å; V257-Y259 HydrophobicContact CG2-CD2 4.35Å; V257-Y259 HydrophobicContact CG2-CE2 4.15Å; Y259-S261 VanDerWaalsContact C-N 3.32Å; Y259-S261 PolarHBondContact O-N 3.14Å
260R74Confident86.5Confident159 Ų15964.6 Ų64.660%0.638%0.375SS*.  trans57.245-176.8-46.7-177.688.9-1639.9111.5R210 D255 G258 L262R210-R260 VanDerWaalsContact NH1-CB 3.32Å; R210-R260 PolarHBondContact NH1-O 3.36Å; R210-R260 VanDerWaalsContact NH1-O 3.14Å; D255-R260 WeakPolarHBondContact OD2-CA 3.41Å; D255-R260 PolarHBondContact OD2-N 3.08Å; G258-R260 PolarHBondContact O-N 2.97Å; G258-R260 VanDerWaalsContact O-N 3.08Å; R260-L262 PolarHBondContact O-N 3.33Å
261S85.5Confident86.7Confident55 Ų5564.3 Ų64.339%0.38538%0.377SS..  trans-45.5133-177.5-630000111.6R210 A211 D255 Y259R210-S261 CarbonylContact C-O 3.54Å; R210-S261 WeakPolarHBondContact CA-O 3.34Å; A211-S261 WeakPolarHBondContact CB-O 3.36Å; A211-S261 PolarHBondContact N-O 2.81Å; D255-S261 PolarHBondContact OD2-N 2.87Å; Y259-S261 VanDerWaalsContact C-N 3.32Å; Y259-S261 PolarHBondContact O-N 3.14Å
262L88.5Confident87.1Confident82 Ų8266 Ų6643%0.42938%0.382SS..EExtended strand (participates in β ladder)trans-91.8147.1178.3-67.5169000109.9G209 R210 R260 Y264G209-L262 WeakPolarHBondContact O-CA 3.36Å; G209-L262 WeakPolarHBondContact O-CD2 3.18Å; R210-L262 HydrophobicContact CG-CD2 3.65Å; R260-L262 PolarHBondContact O-N 3.33Å; L262-Y264 HydrophobicContact CB-CE2 4.03Å
263W91.8Very high87.6Confident30 Ų3066.2 Ų66.211%0.11438%0.383CS..EExtended strand (participates in β ladder)trans-124.4154.8167.158.4-97.6000109.5R208 G209 R210 L222 L224 V250 P252 T265 M290R208-W263 WeakPolarHBondContact CA-O 3.41Å; G209-W263 VanDerWaalsContact CA-CE2 3.48Å; G209-W263 PolarHBondContact N-O 2.96Å; G209-W263 VanDerWaalsContact N-O 3.08Å; G209-W263 PolarHBondContact O-N 2.93Å; R210-W263 PolarHBondContact O-NE1 3.37Å; L222-W263 HydrophobicContact CD1-CH2 4.29Å; L222-W263 HydrophobicContact CD1-CZ2 3.86Å; L224-W263 HydrophobicContact CD1-CH2 4.14Å; L224-W263 HydrophobicContact CD1-CZ3 4.07Å; V250-W263 HydrophobicContact CG1-CD2 4.3Å; V250-W263 HydrophobicContact CG1-CE3 4.12Å; V250-W263 HydrophobicContact CG1-CZ3 4.34Å; V250-W263 HydrophobicContact CG2-CZ3 4.41Å; P252-W263 HydrophobicContact CB-CG 4.41Å; P252-W263 HydrophobicContact CG-CD2 4.5Å; P252-W263 HydrophobicContact CG-CG 4.47Å; P252-W263 HydrophobicContact CG-CZ2 4.29Å; W263-T265 HydrophobicContact CZ3-CG2 4.16Å; W263-M290 HydrophobicContact CH2-CE 3.3Å; W263-M290 HydrophobicContact CZ2-CE 3.23Å
264Y94Very high88.3Confident118 Ų11867.3 Ų67.346%0.46337%0.374SS..EExtended strand (participates in β ladder)trans-134.2142.1179.7-60.9-81.9000109.1Y207 R208 L262Y207-Y264 WeakPolarHBondContact O-CA 3.38Å; R208-Y264 HydrophobicContact CB-CD1 3.58Å; R208-Y264 HydrophobicContact CB-CE1 3.53Å; L262-Y264 HydrophobicContact CB-CE2 4.03Å
265T96.4Very high88.9Confident33 Ų3364.4 Ų64.420%0.20236%0.357CS..EExtended strand (participates in β ladder)trans-150177.1165.2-163.30000109.5Y207 L224 E248 V250 W263Y207-T265 HydrophobicContact CD2-CG2 4.34Å; Y207-T265 PolarHBondContact N-O 3.41Å; Y207-T265 PolarHBondContact O-N 2.89Å; L224-T265 HydrophobicContact CD1-CG2 3.27Å; E248-T265 HydrophobicContact CG-CG2 4.39Å; V250-T265 HydrophobicContact CG2-CG2 3.43Å; V250-T265 VanDerWaalsContact CG2-CG2 3.43Å; W263-T265 HydrophobicContact CZ3-CG2 4.16Å
266S97.1Very high89.5Confident57 Ų5767.9 Ų67.940%0.39937%0.369SS..EExtended strand (participates in β ladder)trans-145.7150.7176.149.40000111.3H204 V205H204-S266 VanDerWaalsContact CE1-CB 3.46Å; H204-S266 WeakPolarHBondContact CE1-CB 3.49Å; H204-S266 VanDerWaalsContact NE2-CB 3.33Å; H204-S266 WeakPolarHBondContact NE2-CB 3.3Å; V205-S266 CarbonylContact O-C 3.51Å; V205-S266 VanDerWaalsContact O-CA 3.25Å; V205-S266 WeakPolarHBondContact O-CA 2.81Å
267V98.2Very high90.6Very high6 Ų665.8 Ų65.84%0.03636%0.357CS..EExtended strand (participates in β ladder)trans-117.5119.2169.21790000107.3H204 V205 Y207 L224 S226 G246 E248 F269H204-V267 CarbonylContact C-O 3.59Å; H204-V267 WeakPolarHBondContact CA-O 3.37Å; V205-V267 PolarHBondContact N-O 3.47Å; V205-V267 PolarHBondContact O-N 2.87Å; Y207-V267 HydrophobicContact CD2-CG2 4.43Å; Y207-V267 HydrophobicContact CE2-CB 4.12Å; Y207-V267 HydrophobicContact CE2-CG2 3.76Å; L224-V267 HydrophobicContact CB-CG2 4.31Å; S226-V267 WeakPolarHBondContact OG-CG1 3.42Å; G246-V267 WeakPolarHBondContact O-CG1 3.44Å; E248-V267 HydrophobicContact CB-CG2 3.64Å; V267-F269 HydrophobicContact CG1-CD1 4.26Å; V267-F269 HydrophobicContact CG1-CE1 4.44Å
268G97.9Very high91.5Very high49 Ų4962.9 Ų62.951%0.50535%0.347SS..EExtended strand (participates in β ladder)trans-130.7137.5-179.600000111.7C203C203-G268 CarbonylContact O-C 3.57Å; C203-G268 VanDerWaalsContact O-CA 3.3Å; C203-G268 WeakPolarHBondContact O-CA 3.31Å
269F98.5Very high92.6Very high35 Ų3561 Ų6115%0.15433%0.327CS..EExtended strand (participates in β ladder)trans-156160.1176.856.1-91.7000111Y202 C203 S226 L228 L244 V267Y202-F269 WeakPolarHBondContact CA-O 3.42Å; C203-F269 HydrophobicContact CB-CD2 4.32Å; C203-F269 HydrophobicContact CB-CE1 4.02Å; C203-F269 HydrophobicContact CB-CE2 3.72Å; C203-F269 HydrophobicContact CB-CZ 3.56Å; C203-F269 PolarHBondContact N-O 2.88Å; C203-F269 PolarHBondContact O-N 3.4Å; S226-F269 WeakPolarHBondContact O-CE1 3.32Å; S226-F269 WeakPolarHBondContact O-CZ 3.34Å; S226-F269 WeakPolarHBondContact OG-CE1 3.17Å; L228-F269 HydrophobicContact CB-CE2 4.39Å; L228-F269 HydrophobicContact CD1-CE2 3.91Å; L228-F269 HydrophobicContact CG-CE2 3.77Å; L228-F269 HydrophobicContact CG-CZ 4.17Å; L244-F269 HydrophobicContact CB-CD2 3.53Å; L244-F269 HydrophobicContact CB-CE2 3.51Å; L244-F269 HydrophobicContact CD1-CD2 4.25Å; L244-F269 HydrophobicContact CG-CD2 4.49Å; V267-F269 HydrophobicContact CG1-CD1 4.26Å; V267-F269 HydrophobicContact CG1-CE1 4.44Å
270G98.4Very high93.8Very high34 Ų3455.6 Ų55.635%0.35131%0.305SS..EExtended strand (participates in β ladder)trans-163.8158.3172.800000112L201L201-G270 CarbonylContact O-C 3.54Å; L201-G270 WeakPolarHBondContact O-CA 3.35Å
271G98.5Very high94.8Very high16 Ų1648.2 Ų48.217%0.16528%0.277CS..EExtended strand (participates in β ladder)trans-172.4162.9-174.400000112.9L201L201-G271 PolarHBondContact N-O 2.8Å; L201-G271 PolarHBondContact O-N 3.22Å
272L98.4Very high95.3Very high118 Ų11849 Ų4962%0.61827%0.273SS*.EExtended strand (participates in β ladder)trans-82.4131.3176.4-64173.5000110.2V198 Y199 Y200 V305V198-L272 HydrophobicContact CG1-CB 4.05Å; V198-L272 HydrophobicContact CG1-CD2 4.07Å; V198-L272 HydrophobicContact CG1-CG 4.5Å; Y199-L272 CarbonylContact O-C 3.54Å; Y199-L272 WeakPolarHBondContact O-CA 3.32Å; Y200-L272 HydrophobicContact CD2-CD2 4.2Å; L272-V305 HydrophobicContact CD2-CG2 3.81Å
273V97.3Very high95.6Very high15 Ų1546.3 Ų46.39%0.09126%0.259CS..EExtended strand (participates in β ladder)trans-135.2133.2-179.71800000109.5Y199 L201 L243 L275Y199-V273 PolarHBondContact N-O 2.87Å; Y199-V273 PolarHBondContact O-N 2.95Å; L201-V273 HydrophobicContact CD1-CB 4.03Å; L201-V273 HydrophobicContact CD1-CG1 4.41Å; L201-V273 HydrophobicContact CD1-CG2 3.87Å; L201-V273 HydrophobicContact CG-CB 4.26Å; L201-V273 HydrophobicContact CG-CG2 4.19Å; L243-V273 HydrophobicContact CB-CG2 4.41Å; L243-V273 HydrophobicContact CD1-CG1 3.99Å; L243-V273 HydrophobicContact CD2-CG1 3.67Å; L243-V273 HydrophobicContact CG-CG1 4.36Å; V273-L275 HydrophobicContact CG1-CD2 3.8Å; V273-L275 HydrophobicContact CG1-CG 4.11Å; V273-L275 PolarHBondContact O-N 3.1Å
274Q95.9Very high95.8Very high104 Ų10448.7 Ų48.749%0.48627%0.274SS..EExtended strand (participates in β ladder)trans-74.9117.5166.6-174.971.848.800109.1G197 R230G197-Q274 VanDerWaalsContact C-NE2 3.26Å; G197-Q274 PolarHBondContact O-NE2 3.36Å; G197-Q274 VanDerWaalsContact O-NE2 3.12Å; R230-Q274 PolarHBondContact NH1-O 3.32Å
275L94.9Very high95.9Very high5 Ų544.1 Ų44.13%0.02626%0.258CS..EExtended strand (participates in β ladder)trans-115.3151.4173.6-63176.3000110.3L193 D196 G197 Y199 L201 L243 V273 E279 V281L193-L275 HydrophobicContact CD1-CD1 3.7Å; D196-L275 WeakPolarHBondContact CA-O 3.24Å; G197-L275 PolarHBondContact N-O 3.01Å; G197-L275 PolarHBondContact O-N 2.89Å; Y199-L275 HydrophobicContact CD2-CB 3.73Å; Y199-L275 HydrophobicContact CD2-CD1 3.95Å; Y199-L275 HydrophobicContact CD2-CG 4.11Å; Y199-L275 HydrophobicContact CE2-CB 4Å; Y199-L275 HydrophobicContact CG-CD1 4.11Å; L201-L275 HydrophobicContact CD1-CD1 4.39Å; L201-L275 HydrophobicContact CD2-CD1 4.09Å; L243-L275 HydrophobicContact CD1-CD2 4.29Å; V273-L275 HydrophobicContact CG1-CD2 3.8Å; V273-L275 HydrophobicContact CG1-CG 4.11Å; V273-L275 PolarHBondContact O-N 3.1Å; L275-E279 WeakPolarHBondContact CA-OE2 3.2Å; L275-V281 HydrophobicContact CD1-CG2 3.9Å; L275-V281 HydrophobicContact CD2-CG2 4.26Å
276R93.4Very high95.9Very high77 Ų7744.5 Ų44.529%0.29126%0.262SS..  trans-113.4151.5170.9-68.2-177.7-65.3-103.8-10.3111.1D196 Y235 G278 E279D196-R276 WeakPolarHBondContact OD1-CA 3.33Å; Y235-R276 PolarHBondContact OH-NH2 3.35Å; Y235-R276 VanDerWaalsContact OH-NH2 3.14Å; R276-G278 PolarHBondContact O-N 2.91Å; R276-E279 HydrophobicContact CB-CG 4.21Å; R276-E279 IonicContact CZ-OE1 2.8Å; R276-E279 VanDerWaalsContact CZ-OE1 3.3Å; R276-E279 PolarHBondContact N-OE2 2.91Å; R276-E279 IonicContact NE-OE1 3.73Å; R276-E279 PolarHBondContact NE-OE1 2.82Å; R276-E279 IonicContact NH2-OE1 3.61Å; R276-E279 PolarHBondContact NH2-OE1 3.17Å; R276-E279 VanDerWaalsContact O-CB 3.25Å; R276-E279 WeakPolarHBondContact O-CB 3.36Å; R276-E279 WeakPolarHBondContact O-CG 3.35Å; R276-E279 PolarHBondContact O-N 2.93Å
277S92.3Very high95.8Very high61 Ų6144.5 Ų44.543%0.42726%0.255SS..THydrogen-bonded Turntrans-54.1136.2169.7-166.10000110P194 D196 E279P194-S277 WeakPolarHBondContact O-CB 3.47Å; P194-S277 PolarHBondContact O-OG 2.82Å; D196-S277 VanDerWaalsContact OD1-CB 3.25Å; D196-S277 WeakPolarHBondContact OD1-CB 3.28Å; D196-S277 PolarHBondContact OD1-N 2.98Å; S277-E279 VanDerWaalsContact C-N 3.29Å; S277-E279 PolarHBondContact O-N 2.83Å
278G89.6Confident95.6Very high36 Ų3646.7 Ų46.737%0.37127%0.27SS..THydrogen-bonded Turntrans84.5-8.4-174.700000115.2G233 R276G233-G278 PolarHBondContact N-O 3.21Å; R276-G278 PolarHBondContact O-N 2.91Å
279E93.8Very high95.4Very high4 Ų450.7 Ų50.72%0.01928%0.279CS..EExtended strand (participates in β ladder)trans-75.1155.6166.1-62.8177.3167.900110.7A231 Y235 L275 R276 S277A231-E279 WeakPolarHBondContact O-CA 3.39Å; Y235-E279 WeakPolarHBondContact CD2-OE1 3.33Å; Y235-E279 WeakPolarHBondContact CE2-OE1 3.3Å; L275-E279 WeakPolarHBondContact CA-OE2 3.2Å; R276-E279 HydrophobicContact CB-CG 4.21Å; R276-E279 IonicContact CZ-OE1 2.8Å; R276-E279 VanDerWaalsContact CZ-OE1 3.3Å; R276-E279 PolarHBondContact N-OE2 2.91Å; R276-E279 IonicContact NE-OE1 3.73Å; R276-E279 PolarHBondContact NE-OE1 2.82Å; R276-E279 IonicContact NH2-OE1 3.61Å; R276-E279 PolarHBondContact NH2-OE1 3.17Å; R276-E279 VanDerWaalsContact O-CB 3.25Å; R276-E279 WeakPolarHBondContact O-CB 3.36Å; R276-E279 WeakPolarHBondContact O-CG 3.35Å; R276-E279 PolarHBondContact O-N 2.93Å; S277-E279 VanDerWaalsContact C-N 3.29Å; S277-E279 PolarHBondContact O-N 2.83Å
280R94.6Very high95.2Very high74 Ų7451 Ų5128%0.27928%0.282SS..EExtended strand (participates in β ladder)trans-126.6131.3-178.1-63.9-58.2-167.4-121.28.9110D189 L191 R230 A231 Y282D189-R280 WeakPolarHBondContact O-CB 3.27Å; D189-R280 WeakPolarHBondContact O-CD 3.39Å; D189-R280 WeakPolarHBondContact O-CG 3.45Å; L191-R280 CarbonylContact O-C 3.59Å; L191-R280 WeakPolarHBondContact O-CA 3.16Å; R230-R280 CarbonylContact C-O 3.55Å; R230-R280 WeakPolarHBondContact CA-O 2.98Å; A231-R280 PolarHBondContact N-O 3.34Å; A231-R280 PolarHBondContact O-N 3.39Å; R280-Y282 HydrophobicContact CB-CD2 4.39Å; R280-Y282 HydrophobicContact CB-CE2 3.42Å; R280-Y282 VanDerWaalsContact CB-CE2 3.42Å; R280-Y282 VanDerWaalsContact CB-OH 3.24Å; R280-Y282 WeakPolarHBondContact CB-OH 3.31Å; R280-Y282 WeakPolarHBondContact O-CE2 3.05Å
281V96.6Very high95Very high3 Ų349.5 Ų49.52%0.01827%0.266CS..EExtended strand (participates in β ladder)trans-103130.4177.9-178.40000110.1L191 L201 L228 Y229 L275L191-V281 HydrophobicContact CB-CB 4.32Å; L191-V281 PolarHBondContact N-O 2.68Å; L191-V281 PolarHBondContact O-N 3.18Å; L201-V281 HydrophobicContact CD1-CG1 4.35Å; L201-V281 HydrophobicContact CD1-CG2 4.48Å; L228-V281 HydrophobicContact CD2-CG1 4.26Å; Y229-V281 CarbonylContact O-C 3.49Å; Y229-V281 VanDerWaalsContact O-CA 3.27Å; Y229-V281 WeakPolarHBondContact O-CA 3.41Å; L275-V281 HydrophobicContact CD1-CG2 3.9Å; L275-V281 HydrophobicContact CD2-CG2 4.26Å
282Y94.4Very high94.9Very high72 Ų7249 Ų4928%0.28226%0.259SS..EExtended strand (participates in β ladder)trans-126.6148.8-178.4-53.2-92.7000111.2D189 L228 Y229 A231 R280D189-Y282 VanDerWaalsContact O-CE1 3.26Å; D189-Y282 WeakPolarHBondContact O-CE1 3.21Å; D189-Y282 PolarHBondContact O-OH 3.4Å; L228-Y282 CarbonylContact C-O 3.49Å; L228-Y282 WeakPolarHBondContact CA-O 3.38Å; Y229-Y282 PolarHBondContact N-O 3.08Å; Y229-Y282 PolarHBondContact O-N 3.02Å; A231-Y282 HydrophobicContact CB-CE2 3.9Å; R280-Y282 HydrophobicContact CB-CD2 4.39Å; R280-Y282 HydrophobicContact CB-CE2 3.42Å; R280-Y282 VanDerWaalsContact CB-CE2 3.42Å; R280-Y282 VanDerWaalsContact CB-OH 3.24Å; R280-Y282 WeakPolarHBondContact CB-OH 3.31Å; R280-Y282 WeakPolarHBondContact O-CE2 3.05Å
283V95.9Very high94.6Very high25 Ų2545.2 Ų45.215%0.15224%0.243CC..EExtended strand (participates in β ladder)trans-102.7128.3170.7-162.80000109.4W170 A227 L228 I285 F300W170-V283 HydrophobicContact CH2-CG1 4.41Å; W170-V283 HydrophobicContact CH2-CG2 4.2Å; W170-V283 HydrophobicContact CZ2-CB 3.63Å; W170-V283 HydrophobicContact CZ2-CG1 3.85Å; W170-V283 HydrophobicContact CZ2-CG2 3.57Å; A227-V283 CarbonylContact O-C 3.49Å; A227-V283 WeakPolarHBondContact O-CA 3.47Å; L228-V283 HydrophobicContact CD2-CB 4.31Å; L228-V283 HydrophobicContact CD2-CG1 4.37Å; L228-V283 HydrophobicContact CD2-CG2 3.69Å; V283-I285 HydrophobicContact CG1-CD1 4.18Å; V283-I285 HydrophobicContact CG1-CG1 4Å; V283-F300 HydrophobicContact CG2-CB 3.99Å; V283-F300 HydrophobicContact CG2-CD1 3.46Å; V283-F300 VanDerWaalsContact CG2-CD1 3.46Å; V283-F300 HydrophobicContact CG2-CD2 3.57Å; V283-F300 HydrophobicContact CG2-CE1 3.68Å; V283-F300 HydrophobicContact CG2-CE2 3.8Å; V283-F300 HydrophobicContact CG2-CG 3.37Å; V283-F300 HydrophobicContact CG2-CZ 3.84Å
284N95.2Very high94.3Very high80 Ų8050.3 Ų50.343%0.42826%0.26SS..EExtended strand (participates in β ladder)trans-107.4130.9167.7-168-58.1000109.1S226 A227 Y229S226-N284 CarbonylContact C-O 3.56Å; S226-N284 VanDerWaalsContact CA-O 3.26Å; S226-N284 WeakPolarHBondContact CA-O 3.31Å; A227-N284 PolarHBondContact N-O 3.45Å; A227-N284 PolarHBondContact O-N 2.8Å; Y229-N284 HydrophobicContact CD2-CB 3.96Å; Y229-N284 HydrophobicContact CE2-CB 3.55Å
285I96.4Very high94Very high22 Ų2252.9 Ų52.911%0.11327%0.266CS..EExtended strand (participates in β ladder)trans-126.2129.1-178.8-67.7167.9000108.4L168 W170 V205 Y207 V283 V291L168-I285 HydrophobicContact CD2-CD1 3.43Å; L168-I285 VanDerWaalsContact CD2-CD1 3.43Å; W170-I285 HydrophobicContact CH2-CD1 4.38Å; W170-I285 HydrophobicContact CZ2-CD1 4.01Å; V205-I285 HydrophobicContact CG1-CD1 4.01Å; V205-I285 HydrophobicContact CG1-CG1 4.49Å; V205-I285 HydrophobicContact CG1-CG2 4.46Å; V205-I285 HydrophobicContact CG2-CD1 3.83Å; V205-I285 HydrophobicContact CG2-CG1 4.11Å; Y207-I285 HydrophobicContact CE1-CG2 3.99Å; V283-I285 HydrophobicContact CG1-CD1 4.18Å; V283-I285 HydrophobicContact CG1-CG1 4Å; I285-V291 HydrophobicContact CD1-CG2 4.48Å; I285-V291 HydrophobicContact CG2-CG2 3.89Å
286S95.7Very high93.8Very high41 Ų4154.6 Ų54.629%0.28729%0.285SS..SBendtrans-71.2-32.1-174.863.50000114.2R225R225-S286 PolarHBondContact N-OG 3.04Å; R225-S286 PolarHBondContact O-N 2.88Å; R225-S286 PolarHBondContact O-OG 2.86Å
287H95.1Very high93.9Very high58 Ų5855.7 Ų55.727%0.26929%0.291SS..  trans-130.570-177.8-61.478.1000110.9T223 L224 D289 M290T223-H287 PolarHBondContact O-CE1 3.39Å; L224-H287 HydrophobicContact CD2-CB 4.06Å; H287-D289 PolarHBondContact O-N 2.74Å; H287-M290 HydrophobicContact CB-CB 4.21Å; H287-M290 HydrophobicContact CB-CG 4.1Å; H287-M290 HydrophobicContact CB-SD 3.87Å; H287-M290 PolarHBondContact O-N 3.11Å; H287-M290 VanDerWaalsContact O-N 3.09Å
288P94.8Very high94.2Very high51 Ų5153 Ų5333%0.33127%0.272SS..G310 helixtrans-60.7-31-17624.9-34000112.9L168 M290 V291L168-P288 HydrophobicContact CB-CB 4.24Å; L168-P288 HydrophobicContact CD2-CB 4.49Å; P288-M290 PolarHBondContact O-N 3.43Å; P288-M290 VanDerWaalsContact O-N 3.14Å; P288-V291 WeakPolarHBondContact O-CB 3.3Å; P288-V291 PolarHBondContact O-N 2.96Å
289D93Very high94.6Very high133 Ų13353.7 Ų53.771%0.71127%0.265SS*.G310 helixtrans-67.1-14.1178.8-59.4-36.7000114.2H287H287-D289 PolarHBondContact O-N 2.74Å
290M94.1Very high94.8Very high41 Ų4153.6 Ų53.620%0.20227%0.265CS..G310 helixtrans-104.2-0.4-178.2-57.9-177.669.400112.4Y207 R208 L222 W263 H287 P288Y207-M290 CarbonylContact C-O 3.59Å; Y207-M290 WeakPolarHBondContact CA-O 3.38Å; Y207-M290 HydrophobicContact CD1-CB 4.29Å; R208-M290 PolarHBondContact N-O 3.41Å; L222-M290 HydrophobicContact CD1-CE 3.91Å; L222-M290 HydrophobicContact CD1-SD 4.42Å; W263-M290 HydrophobicContact CH2-CE 3.3Å; W263-M290 HydrophobicContact CZ2-CE 3.23Å; H287-M290 HydrophobicContact CB-CB 4.21Å; H287-M290 HydrophobicContact CB-CG 4.1Å; H287-M290 HydrophobicContact CB-SD 3.87Å; H287-M290 PolarHBondContact O-N 3.11Å; H287-M290 VanDerWaalsContact O-N 3.09Å; P288-M290 PolarHBondContact O-N 3.43Å; P288-M290 VanDerWaalsContact O-N 3.14Å
291V96.1Very high95Very high4 Ų450.1 Ų50.12%0.02425%0.252CS..BIsolated β-bridgetrans-68.5134.7-177.4171.90000110.4L168 V205 G206 Y207 I285 P288 S293 T298L168-V291 HydrophobicContact CD1-CB 4.36Å; L168-V291 HydrophobicContact CD1-CG1 3.79Å; L168-V291 HydrophobicContact CD2-CB 4.11Å; L168-V291 HydrophobicContact CD2-CG1 4Å; L168-V291 HydrophobicContact CD2-CG2 3.87Å; V205-V291 HydrophobicContact CG1-CG1 4.19Å; V205-V291 HydrophobicContact CG1-CG2 3.7Å; G206-V291 CarbonylContact O-C 3.58Å; G206-V291 WeakPolarHBondContact O-CA 3.4Å; Y207-V291 HydrophobicContact CD1-CG2 4.22Å; Y207-V291 HydrophobicContact CE1-CG2 3.97Å; I285-V291 HydrophobicContact CD1-CG2 4.48Å; I285-V291 HydrophobicContact CG2-CG2 3.89Å; P288-V291 WeakPolarHBondContact O-CB 3.3Å; P288-V291 PolarHBondContact O-N 2.96Å; V291-S293 PolarHBondContact O-N 3.39Å; V291-T298 HydrophobicContact CG1-CG2 3.81Å; V291-T298 WeakPolarHBondContact CG1-OG1 3.16Å
292D94.9Very high95.1Very high4 Ų450 Ų502%0.02125%0.251CS..  trans-85.998.5171.3-165-1.9000108.5G206 R208 R294 K297 T298G206-D292 PolarHBondContact O-N 2.91Å; R208-D292 HydrophobicContact CG-CB 4.24Å; D292-R294 PolarHBondContact O-N 2.96Å; D292-R294 WeakPolarHBondContact OD1-CB 3.24Å; D292-R294 VanDerWaalsContact OD1-CG 3.24Å; D292-R294 WeakPolarHBondContact OD1-CG 3.38Å; D292-R294 IonicContact OD1-CZ 3.24Å; D292-R294 PolarHBondContact OD1-N 3.44Å; D292-R294 IonicContact OD1-NE 2.68Å; D292-R294 PolarHBondContact OD1-NE 3.38Å; D292-R294 IonicContact OD1-NH2 3.34Å; D292-R294 IonicContact OD2-CZ 2.73Å; D292-R294 IonicContact OD2-NE 3.72Å; D292-R294 PolarHBondContact OD2-NE 2.91Å; D292-R294 IonicContact OD2-NH2 3.59Å; D292-R294 PolarHBondContact OD2-NH2 3.27Å; D292-K297 HydrophobicContact CB-CB 4.1Å; D292-K297 HydrophobicContact CB-CG 4.43Å; D292-K297 VanDerWaalsContact O-CB 3.27Å; D292-K297 WeakPolarHBondContact O-CB 3.16Å; D292-T298 PolarHBondContact O-OG1 3.45Å
293S92Very high95.2Very high39 Ų3949.2 Ų49.227%0.27325%0.254SS..  trans-83.910.217758.40000113.3V291V291-S293 PolarHBondContact O-N 3.39Å
294R91.3Very high95.3Very high122 Ų12249.3 Ų49.346%0.4625%0.253SS..SBendtrans-63.5147.5171.2-69.8-178.6-69.3174.33.4109.7D292 G296 K297D292-R294 PolarHBondContact O-N 2.96Å; D292-R294 WeakPolarHBondContact OD1-CB 3.24Å; D292-R294 VanDerWaalsContact OD1-CG 3.24Å; D292-R294 WeakPolarHBondContact OD1-CG 3.38Å; D292-R294 IonicContact OD1-CZ 3.24Å; D292-R294 PolarHBondContact OD1-N 3.44Å; D292-R294 IonicContact OD1-NE 2.68Å; D292-R294 PolarHBondContact OD1-NE 3.38Å; D292-R294 IonicContact OD1-NH2 3.34Å; D292-R294 IonicContact OD2-CZ 2.73Å; D292-R294 IonicContact OD2-NE 3.72Å; D292-R294 PolarHBondContact OD2-NE 2.91Å; D292-R294 IonicContact OD2-NH2 3.59Å; D292-R294 PolarHBondContact OD2-NH2 3.27Å; R294-G296 PolarHBondContact O-N 3.4Å; R294-K297 HydrophobicContact CB-CG 4.13Å; R294-K297 VanDerWaalsContact O-CB 3.27Å; R294-K297 WeakPolarHBondContact O-CB 3.38Å; R294-K297 WeakPolarHBondContact O-CG 3.21Å; R294-K297 PolarHBondContact O-N 2.93Å
295R89.8Confident95.3Very high159 Ų15949.1 Ų49.160%0.625%0.254SS*.THydrogen-bonded Turntrans-44.3129.2-179.1-165.6176.7-174.8-80.33.8112.1E176 K297E176-R295 VanDerWaalsContact CD-NH1 3.28Å; E176-R295 VanDerWaalsContact CG-NH2 3.29Å; E176-R295 IonicContact OE1-CZ 2.95Å; E176-R295 IonicContact OE1-NH1 2.71Å; E176-R295 PolarHBondContact OE1-NH1 3.12Å; E176-R295 IonicContact OE1-NH2 2.68Å; E176-R295 PolarHBondContact OE1-NH2 3.49Å; E176-R295 IonicContact OE2-CZ 3.52Å; E176-R295 IonicContact OE2-NE 3.98Å; E176-R295 IonicContact OE2-NH1 3.41Å; E176-R295 PolarHBondContact OE2-NH1 3.46Å; E176-R295 IonicContact OE2-NH2 3.78Å; R295-K297 VanDerWaalsContact C-N 3.28Å; R295-K297 PolarHBondContact O-N 3.45Å
296G91.2Very high94.6Very high41 Ų4153.1 Ų53.142%0.42330%0.301SS..THydrogen-bonded Turntrans72.95.517800000116.3R294R294-G296 PolarHBondContact O-N 3.4Å
297K95.9Very high94.5Very high99 Ų9953.7 Ų53.743%0.4330%0.301SS..THydrogen-bonded Turntrans-92.3-33179.2-63.7-60.1-172.8-177.60113.8H204 G206 D292 R294 R295H204-K297 PolarHBondContact CE1-O 3.12Å; H204-K297 PolarHBondContact ND1-O 3.16Å; G206-K297 PolarHBondContact N-O 2.92Å; D292-K297 HydrophobicContact CB-CB 4.1Å; D292-K297 HydrophobicContact CB-CG 4.43Å; D292-K297 VanDerWaalsContact O-CB 3.27Å; D292-K297 WeakPolarHBondContact O-CB 3.16Å; R294-K297 HydrophobicContact CB-CG 4.13Å; R294-K297 VanDerWaalsContact O-CB 3.27Å; R294-K297 WeakPolarHBondContact O-CB 3.38Å; R294-K297 WeakPolarHBondContact O-CG 3.21Å; R294-K297 PolarHBondContact O-N 2.93Å; R295-K297 VanDerWaalsContact C-N 3.28Å; R295-K297 PolarHBondContact O-N 3.45Å
298T97.8Very high94.5Very high4 Ų453.5 Ų53.53%0.02530%0.303CS..SBendtrans-135.4121.7-175.5-60.50000109.9G160 W170 H204 V205 G206 V291 D292G160-T298 PolarHBondContact N-O 3.42Å; W170-T298 HydrophobicContact CH2-CG2 3.91Å; W170-T298 HydrophobicContact CZ3-CG2 3.97Å; H204-T298 CarbonylContact O-C 3.58Å; H204-T298 VanDerWaalsContact O-CA 3.28Å; H204-T298 WeakPolarHBondContact O-CA 3.46Å; V205-T298 HydrophobicContact CG1-CG2 4.18Å; V205-T298 HydrophobicContact CG2-CG2 4.42Å; G206-T298 PolarHBondContact N-OG1 2.91Å; V291-T298 HydrophobicContact CG1-CG2 3.81Å; V291-T298 WeakPolarHBondContact CG1-OG1 3.16Å; D292-T298 PolarHBondContact O-OG1 3.45Å
299F97.8Very high94.4Very high51 Ų5153.6 Ų53.622%0.22430%0.301CS..EExtended strand (participates in β ladder)trans-159.1157-179.254.3-95.5000111.6H157 L158 I159 Y202 H204H157-F299 AromaticContact CE1-CD2 3.59Å; H157-F299 AromaticContact CE1-CG 3.65Å; L158-F299 CarbonylContact O-C 3.58Å; L158-F299 WeakPolarHBondContact O-CA 3.41Å; L158-F299 VanDerWaalsContact O-CB 3.24Å; L158-F299 WeakPolarHBondContact O-CB 3.49Å; I159-F299 HydrophobicContact CG2-CB 4.44Å; Y202-F299 HydrophobicContact CD2-CD2 4.08Å; Y202-F299 HydrophobicContact CD2-CE2 4.13Å; Y202-F299 AromaticContact CE2-CD2 3.94Å; Y202-F299 HydrophobicContact CE2-CD2 3.94Å; Y202-F299 HydrophobicContact CE2-CE2 4.25Å; H204-F299 HydrophobicContact CB-CD1 4.36Å; H204-F299 HydrophobicContact CB-CD2 4.09Å; H204-F299 HydrophobicContact CB-CE1 3.9Å; H204-F299 HydrophobicContact CB-CE2 3.62Å; H204-F299 HydrophobicContact CB-CG 4.45Å; H204-F299 HydrophobicContact CB-CZ 3.51Å; H204-F299 AromaticContact CG-CZ 3.94Å; H204-F299 PolarHBondContact N-O 3.11Å; H204-F299 PolarHBondContact O-N 3.44Å; H204-F299 VanDerWaalsContact O-O 3.05Å
300F98.1Very high94.5Very high3 Ų348.9 Ų48.91%0.01328%0.277CS..EExtended strand (participates in β ladder)trans-145.8159.4166.884.2-76.2000110L158 W170 F185 L191 Y202 C203 L228 V283L158-F300 HydrophobicContact CB-CD1 3.84Å; L158-F300 HydrophobicContact CB-CE1 3.58Å; L158-F300 HydrophobicContact CB-CZ 4.27Å; L158-F300 HydrophobicContact CD1-CD1 4.41Å; L158-F300 HydrophobicContact CD1-CE1 3.92Å; L158-F300 HydrophobicContact CD1-CE2 4.06Å; L158-F300 HydrophobicContact CD1-CZ 3.72Å; L158-F300 HydrophobicContact CD2-CE1 3.84Å; L158-F300 HydrophobicContact CD2-CZ 3.89Å; L158-F300 HydrophobicContact CG-CE1 3.99Å; L158-F300 HydrophobicContact CG-CZ 4.19Å; L158-F300 PolarHBondContact N-O 3.47Å; L158-F300 PolarHBondContact O-N 3.18Å; W170-F300 HydrophobicContact CB-CE1 4.35Å; W170-F300 AromaticContact CD2-CD1 3.67Å; W170-F300 HydrophobicContact CD2-CD1 3.67Å; W170-F300 AromaticContact CD2-CE1 3.41Å; W170-F300 HydrophobicContact CD2-CE1 3.41Å; W170-F300 VanDerWaalsContact CD2-CE1 3.41Å; W170-F300 AromaticContact CE2-CD1 3.86Å; W170-F300 AromaticContact CE2-CE1 3.71Å; W170-F300 AromaticContact CE3-CD1 3.46Å; W170-F300 HydrophobicContact CE3-CD1 3.46Å; W170-F300 VanDerWaalsContact CE3-CD1 3.46Å; W170-F300 AromaticContact CE3-CE1 3.65Å; W170-F300 HydrophobicContact CE3-CE1 3.65Å; W170-F300 HydrophobicContact CG-CD1 4.45Å; W170-F300 AromaticContact CG-CE1 3.74Å; W170-F300 HydrophobicContact CG-CE1 3.74Å; W170-F300 AromaticContact CH2-CD1 3.69Å; W170-F300 HydrophobicContact CH2-CD1 3.69Å; W170-F300 HydrophobicContact CH2-CE1 4.39Å; W170-F300 HydrophobicContact CH2-CG 4.49Å; W170-F300 AromaticContact CZ2-CD1 3.89Å; W170-F300 HydrophobicContact CZ2-CD1 3.89Å; W170-F300 HydrophobicContact CZ2-CE1 4.21Å; W170-F300 AromaticContact CZ3-CD1 3.49Å; W170-F300 HydrophobicContact CZ3-CD1 3.49Å; W170-F300 VanDerWaalsContact CZ3-CD1 3.49Å; W170-F300 HydrophobicContact CZ3-CE1 4.14Å; F185-F300 HydrophobicContact CE2-CZ 4.41Å; L191-F300 HydrophobicContact CB-CE2 4.09Å; L191-F300 HydrophobicContact CB-CZ 4.31Å; L191-F300 HydrophobicContact CD2-CE2 4.07Å; Y202-F300 CarbonylContact O-C 3.58Å; Y202-F300 VanDerWaalsContact O-CA 3.25Å; Y202-F300 WeakPolarHBondContact O-CA 3.18Å; Y202-F300 WeakPolarHBondContact O-CB 3.32Å; C203-F300 HydrophobicContact CB-CB 4.05Å; L228-F300 HydrophobicContact CD2-CD2 4.09Å; V283-F300 HydrophobicContact CG2-CB 3.99Å; V283-F300 HydrophobicContact CG2-CD1 3.46Å; V283-F300 VanDerWaalsContact CG2-CD1 3.46Å; V283-F300 HydrophobicContact CG2-CD2 3.57Å; V283-F300 HydrophobicContact CG2-CE1 3.68Å; V283-F300 HydrophobicContact CG2-CE2 3.8Å; V283-F300 HydrophobicContact CG2-CG 3.37Å; V283-F300 HydrophobicContact CG2-CZ 3.84Å
301G98.2Very high94.6Very high0 Ų049.4 Ų49.40%028%0.282CS..EExtended strand (participates in β ladder)trans-171-178.9-179.600000114A156 L201 Y202A156-G301 CarbonylContact O-C 3.51Å; A156-G301 WeakPolarHBondContact O-CA 3.49Å; L201-G301 WeakPolarHBondContact CA-O 3.23Å; Y202-G301 WeakPolarHBondContact CD1-O 3.42Å; Y202-G301 VanDerWaalsContact CE1-C 3.42Å; Y202-G301 PolarHBondContact N-O 2.71Å; Y202-G301 PolarHBondContact O-N 3.24Å
302A98.4Very high94.5Very high0 Ų052.5 Ų52.50%030%0.299CS..EExtended strand (participates in β ladder)trans-145139.7-17700000109.6A155 A156 L191 L193 Y200 L201A155-A302 CarbonylContact C-O 3.58Å; A155-A302 VanDerWaalsContact CA-O 3.26Å; A155-A302 WeakPolarHBondContact CA-O 3.22Å; A156-A302 PolarHBondContact N-O 3.27Å; A156-A302 PolarHBondContact O-N 3.04Å; L191-A302 HydrophobicContact CD2-CB 3.93Å; L193-A302 HydrophobicContact CD1-CB 3.55Å; L193-A302 HydrophobicContact CD2-CB 4.32Å; L193-A302 HydrophobicContact CG-CB 4.49Å; Y200-A302 WeakPolarHBondContact O-CA 3.49Å; L201-A302 HydrophobicContact CD2-CB 3.32Å
303V98.1Very high94.4Very high56 Ų5655.9 Ų55.934%0.33932%0.319SS..EExtended strand (participates in β ladder)trans-135.1128.9171.6-175.60000108.3A155 Y199 Y200 Y202A155-V303 HydrophobicContact CB-CB 4.47Å; A155-V303 HydrophobicContact CB-CG1 4.26Å; A155-V303 HydrophobicContact CB-CG2 4.17Å; Y199-V303 CarbonylContact C-O 3.54Å; Y199-V303 WeakPolarHBondContact CA-O 3.44Å; Y200-V303 PolarHBondContact N-O 3.4Å; Y200-V303 PolarHBondContact O-N 3.08Å; Y202-V303 HydrophobicContact CE1-CG2 4.35Å
304M97.6Very high94.6Very high28 Ų2857.2 Ų57.214%0.13832%0.323CS..EExtended strand (participates in β ladder)trans-66.7139.3175.7-169.6168.5171.700110.3L153 P154 L195 Y199L153-M304 HydrophobicContact CB-CB 4.21Å; L153-M304 HydrophobicContact CD2-SD 4.34Å; P154-M304 HydrophobicContact CG-SD 4.1Å; P154-M304 WeakPolarHBondContact O-CB 3.45Å; P154-M304 PolarHBondContact O-N 2.85Å; L195-M304 HydrophobicContact CB-CE 4.5Å; L195-M304 HydrophobicContact CB-SD 4.16Å; L195-M304 HydrophobicContact CD1-SD 4.1Å; Y199-M304 VanDerWaalsContact CD1-CA 3.42Å; Y199-M304 HydrophobicContact CD1-CB 3.73Å; Y199-M304 HydrophobicContact CD1-CG 4.34Å; Y199-M304 HydrophobicContact CE1-CB 3.45Å; Y199-M304 VanDerWaalsContact CE1-CB 3.45Å; Y199-M304 HydrophobicContact CE1-CG 3.95Å; Y199-M304 HydrophobicContact CE1-SD 4.37Å
305V95.3Very high94.9Very high76 Ų7651.8 Ų51.846%0.46131%0.311SS..EExtended strand (participates in β ladder)trans-111.7117178.2-176.60000108.1V198 L272V198-V305 PolarHBondContact O-N 3Å; L272-V305 HydrophobicContact CD2-CG2 3.81Å
306G80.5Confident95.3Very high105 Ų10542.1 Ų42.1100%1.08229%0.285SS*.  trans113.10179.300000112.4

Retrieved 306 of 306 residues in 181 ms (Link to these results)