A0A077ZFT3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZFT3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 113 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
1M53Low60.2Low230 Ų230153.9 Ų153.9100%1.13377%0.766SS**  048.90-66.2175.7166.700112.8
2R58.7Low60.4Low226 Ų226160.8 Ų160.885%0.85378%0.776SS**  trans-118.9-2.8-177.8-82-173.3175.4-178.9-1.1115.2
3V59Low60.9Low129 Ų129158.2 Ų158.278%0.78278%0.776SS**SBendtrans-90.3-14-172.8-166.50000112.7
4T61.7Low61.6Low110 Ų110152.9 Ų152.968%0.67577%0.769SS**SBendtrans-81.4-20.6-175.632.90000114.7
5I63.8Low62.3Low115 Ų115148.2 Ų148.259%0.5976%0.764SS**SBendtrans-76.9-30.5-174.9-60.4175.6000111.9R7 L8I5-R7 VanDerWaalsContact C-N 3.27Å; I5-R7 PolarHBondContact O-N 2.86Å; I5-L8 PolarHBondContact O-N 3.02Å
6I61.8Low62.9Low128 Ų128146.1 Ų146.166%0.65676%0.762SS**G310 helixtrans-69.3-23.7-174.6-61.4175.2000112.3L8I6-L8 VanDerWaalsContact C-N 3.3Å; I6-L8 PolarHBondContact O-N 3.25Å
7R57.6Low63.3Low229 Ų229144.4 Ų144.486%0.86476%0.762SS**G310 helixtrans-73.1-16.1177.9-80.1-167174.7-179.2-0.5114.7I5I5-R7 VanDerWaalsContact C-N 3.27Å; I5-R7 PolarHBondContact O-N 2.86Å
8L59.5Low63.8Low155 Ų155140.7 Ų140.781%0.81276%0.756SS**G310 helixtrans-84.3-19.2-180-90.5152.8000113.6I5 I6I5-L8 PolarHBondContact O-N 3.02Å; I6-L8 VanDerWaalsContact C-N 3.3Å; I6-L8 PolarHBondContact O-N 3.25Å
9I64.2Low64.1Low133 Ų133140 Ų14068%0.68276%0.76SS**THydrogen-bonded Turntrans-98-9.3-173.9-56.9174.1000112P11I9-P11 WeakPolarHBondContact O-CD 3.17Å
10L58.4Low64.2Low135 Ų135137.6 Ų137.671%0.70775%0.75SS**SBendtrans-67.6109.5172.8-133.779000107.4R12L10-R12 PolarHBondContact O-N 3.04Å
11P64.1Low64.6Low103 Ų103136.3 Ų136.367%0.66974%0.742SS**  trans-56.5118.9171.525.7-31.6000104.1I9 V13I9-P11 WeakPolarHBondContact O-CD 3.17Å; P11-V13 PolarHBondContact O-N 2.78Å
12R62.7Low65.7Low237 Ų237131.7 Ų131.789%0.89472%0.721SS**  trans-49.299.3171.6-170.5179.9-168.9-169.53.2104.7L10 A14L10-R12 PolarHBondContact O-N 3.04Å; R12-A14 VanDerWaalsContact C-N 3.27Å; R12-A14 PolarHBondContact O-N 2.78Å
13V67.5Low66.6Low127 Ų127127.6 Ų127.677%0.7771%0.712SS**  trans-54.2107.2176.31730000102.2P11 A15P11-V13 PolarHBondContact O-N 2.78Å; V13-A15 PolarHBondContact O-N 2.67Å
14A70.7Confident67.6Low83 Ų83126.1 Ų126.169%0.68670%0.696SS**PPolyproline II helixtrans-51.2122.5-173.800000105.2R12R12-A14 VanDerWaalsContact C-N 3.27Å; R12-A14 PolarHBondContact O-N 2.78Å
15A72Confident68.5Low83 Ų83128.6 Ų128.669%0.68669%0.693SS**PPolyproline II helixtrans-47.4138177.200000107.1V13V13-A15 PolarHBondContact O-N 2.67Å
16P71.2Confident69.5Low114 Ų114127 Ų12774%0.7469%0.689SS**PPolyproline II helixtrans-49.2137.3177.421.1-31.7000107.7A18P16-A18 PolarHBondContact O-N 2.85Å
17P71Confident70.6Confident117 Ų117125.5 Ų125.576%0.7668%0.681SS**PPolyproline II helixtrans-48.7133.4176.821-31.7000107.6
18A71.8Confident72Confident78 Ų78118.8 Ų118.865%0.64566%0.663SS**  trans-45141.5-179.800000109P16 V20P16-A18 PolarHBondContact O-N 2.85Å; A18-V20 PolarHBondContact O-N 2.76Å
19P68.4Low73.5Confident128 Ų128118.8 Ų118.883%0.83165%0.653SS**  trans-53.6105.6-178.522.2-32.4000107.7N21P19-N21 PolarHBondContact O-N 3.47Å
20V67.2Low74.9Confident92 Ų92121 Ų12156%0.55865%0.654SS**  trans-58.3120.8175.7179.80000104.2A18 L22A18-V20 PolarHBondContact O-N 2.76Å; V20-L22 PolarHBondContact O-N 2.64Å
21N72.3Confident76.6Confident110 Ų110122.4 Ų122.459%0.58865%0.651SS**  trans-56105.7-169.5-150.8-27.4000108.1P19 Q23 Q24 R25P19-N21 PolarHBondContact O-N 3.47Å; N21-Q23 PolarHBondContact O-N 3.29Å; N21-Q23 VanDerWaalsContact O-N 3.08Å; N21-Q24 HydrophobicContact CB-CB 4.31Å; N21-Q24 WeakPolarHBondContact O-CB 3.24Å; N21-Q24 PolarHBondContact O-N 3.16Å; N21-R25 PolarHBondContact O-N 3.45Å
22L75.9Confident78Confident133 Ų133124.8 Ų124.870%0.69665%0.648SS**Hα-helixtrans-57.6-31.1-170.5-73.4169.8000110.9V20 R25 T26V20-L22 PolarHBondContact O-N 2.64Å; L22-R25 PolarHBondContact O-N 3.04Å; L22-T26 PolarHBondContact O-N 2.87Å; L22-T26 PolarHBondContact O-OG1 3.32Å
23Q77.4Confident79.5Confident140 Ų140119.9 Ų119.965%0.65463%0.63SS**Hα-helixtrans-59.7-43.6173-69.9-168-18.900112.8N21 R25 T26 I27N21-Q23 PolarHBondContact O-N 3.29Å; N21-Q23 VanDerWaalsContact O-N 3.08Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 3.34Å; Q23-T26 WeakPolarHBondContact CA-OG1 3.33Å; Q23-T26 PolarHBondContact O-N 3.47Å; Q23-T26 PolarHBondContact O-OG1 3.25Å; Q23-I27 WeakPolarHBondContact O-CD1 3.35Å; Q23-I27 VanDerWaalsContact O-CG1 3.23Å; Q23-I27 WeakPolarHBondContact O-CG1 3Å; Q23-I27 PolarHBondContact O-N 3.17Å
24Q80Confident80.9Confident98 Ų98121.4 Ų121.446%0.45862%0.623SS.*Hα-helixtrans-62.7-44.5177.6-171.762.436.400110.5N21 T26 I27 D28N21-Q24 HydrophobicContact CB-CB 4.31Å; N21-Q24 WeakPolarHBondContact O-CB 3.24Å; N21-Q24 PolarHBondContact O-N 3.16Å; Q24-T26 VanDerWaalsContact C-N 3.3Å; Q24-T26 PolarHBondContact O-N 3.44Å; Q24-I27 PolarHBondContact O-N 3.27Å; Q24-I27 VanDerWaalsContact O-N 3.14Å; Q24-D28 PolarHBondContact NE2-OD1 2.9Å; Q24-D28 PolarHBondContact O-N 3.44Å
25R80.3Confident82Confident163 Ų163124 Ų12462%0.61562%0.616SS**Hα-helixtrans-61.3-39.4177.4-171.1-175.6-74.2-162.4-2.2111.9N21 L22 Q23 Y29N21-R25 PolarHBondContact O-N 3.45Å; L22-R25 PolarHBondContact O-N 3.04Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 3.34Å; R25-Y29 WeakPolarHBondContact O-CB 3.37Å; R25-Y29 PolarHBondContact O-N 3.21Å
26T84.9Confident83.1Confident82 Ų82126.9 Ų126.950%0.50361%0.61SS.*Hα-helixtrans-66.8-37.7176.149.70000112.6L22 Q23 Q24 Y30L22-T26 PolarHBondContact O-N 2.87Å; L22-T26 PolarHBondContact O-OG1 3.32Å; Q23-T26 WeakPolarHBondContact CA-OG1 3.33Å; Q23-T26 PolarHBondContact O-N 3.47Å; Q23-T26 PolarHBondContact O-OG1 3.25Å; Q24-T26 VanDerWaalsContact C-N 3.3Å; Q24-T26 PolarHBondContact O-N 3.44Å; T26-Y30 WeakPolarHBondContact O-CB 3.27Å; T26-Y30 PolarHBondContact O-N 3.35Å
27I84.8Confident84.3Confident96 Ų96127.5 Ų127.549%0.49260%0.599SS.*Hα-helixtrans-66.5-47.7177-66.3161.8000110Q23 Q24 Y29 Y30 Y31Q23-I27 WeakPolarHBondContact O-CD1 3.35Å; Q23-I27 VanDerWaalsContact O-CG1 3.23Å; Q23-I27 WeakPolarHBondContact O-CG1 3Å; Q23-I27 PolarHBondContact O-N 3.17Å; Q24-I27 PolarHBondContact O-N 3.27Å; Q24-I27 VanDerWaalsContact O-N 3.14Å; I27-Y29 VanDerWaalsContact C-N 3.3Å; I27-Y29 PolarHBondContact O-N 2.9Å; I27-Y30 PolarHBondContact O-N 3.06Å; I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 3.12Å
28D88Confident85.5Confident88 Ų88128.7 Ų128.747%0.47159%0.589SS.*Hα-helixtrans-60.7-40.9179.4-63.4-21.1000111.2Q24 Y31 Y32Q24-D28 PolarHBondContact NE2-OD1 2.9Å; Q24-D28 PolarHBondContact O-N 3.44Å; D28-Y31 PolarHBondContact O-N 3.45Å; D28-Y32 WeakPolarHBondContact O-CB 3.1Å; D28-Y32 PolarHBondContact O-N 3Å
29Y91.4Very high86.7Confident155 Ų155131.3 Ų131.361%0.60858%0.583SS**Hα-helixtrans-64.4-45.3176.2-177.3-95.6000112.3R25 I27 Y31 Y32 Y33R25-Y29 WeakPolarHBondContact O-CB 3.37Å; R25-Y29 PolarHBondContact O-N 3.21Å; I27-Y29 VanDerWaalsContact C-N 3.3Å; I27-Y29 PolarHBondContact O-N 2.9Å; Y29-Y31 VanDerWaalsContact C-N 3.34Å; Y29-Y31 PolarHBondContact O-N 3.46Å; Y29-Y32 PolarHBondContact O-N 3.33Å; Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.33Å
30Y93.5Very high88Confident180 Ų180131.7 Ų131.771%0.70657%0.569SS**Hα-helixtrans-63.1-41.8177.2-110.1-84.3000111.9T26 I27 Y33 Y34T26-Y30 WeakPolarHBondContact O-CB 3.27Å; T26-Y30 PolarHBondContact O-N 3.35Å; I27-Y30 PolarHBondContact O-N 3.06Å; Y30-Y33 PolarHBondContact O-N 3.21Å; Y30-Y34 WeakPolarHBondContact O-CB 3.39Å; Y30-Y34 PolarHBondContact O-N 3.26Å
31Y94.1Very high89.3Confident163 Ų163133.9 Ų133.964%0.63957%0.568SS**Hα-helixtrans-64.9-44.6178.3-169.3-94.6000111.5I27 D28 Y29 Y33 Y34 Y35I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 3.12Å; D28-Y31 PolarHBondContact O-N 3.45Å; Y29-Y31 VanDerWaalsContact C-N 3.34Å; Y29-Y31 PolarHBondContact O-N 3.46Å; Y31-Y33 PolarHBondContact O-N 3.27Å; Y31-Y34 PolarHBondContact O-N 3.5Å; Y31-Y35 WeakPolarHBondContact O-CB 3.41Å; Y31-Y35 PolarHBondContact O-N 2.91Å
32Y93.2Very high90.4Very high154 Ų154135.3 Ų135.360%0.60457%0.566SS**Hα-helixtrans-60-46.1174.6178.5-97.1000111.9D28 Y29 Y34 Y35 Y36D28-Y32 WeakPolarHBondContact O-CB 3.1Å; D28-Y32 PolarHBondContact O-N 3Å; Y29-Y32 PolarHBondContact O-N 3.33Å; Y32-Y34 PolarHBondContact O-N 3.48Å; Y32-Y35 PolarHBondContact O-N 2.85Å; Y32-Y36 WeakPolarHBondContact O-CB 3.29Å; Y32-Y36 PolarHBondContact O-N 3.32Å
33Y94.9Very high91.4Very high134 Ų134136 Ų13653%0.52556%0.561SS.*Hα-helixtrans-62.9-43.6178.5-173.9-94.5000112.1Y29 Y30 Y31 Y36 Y37Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.33Å; Y30-Y33 PolarHBondContact O-N 3.21Å; Y31-Y33 PolarHBondContact O-N 3.27Å; Y33-Y36 PolarHBondContact O-N 2.84Å; Y33-Y37 WeakPolarHBondContact O-CB 3.33Å; Y33-Y37 PolarHBondContact O-N 3.42Å
34Y95.4Very high92.2Very high159 Ų159134.4 Ų134.462%0.62455%0.55SS*.Hα-helixtrans-62.4-45.9177-178-95.8000111.9Y30 Y31 Y32 Y36 Y37 Y38Y30-Y34 WeakPolarHBondContact O-CB 3.39Å; Y30-Y34 PolarHBondContact O-N 3.26Å; Y31-Y34 PolarHBondContact O-N 3.5Å; Y32-Y34 PolarHBondContact O-N 3.48Å; Y34-Y36 PolarHBondContact O-N 3.44Å; Y34-Y37 PolarHBondContact O-N 2.89Å; Y34-Y38 WeakPolarHBondContact O-CB 3.12Å; Y34-Y38 PolarHBondContact O-N 2.84Å
35Y95.1Very high92.9Very high138 Ų138137.5 Ų137.554%0.54156%0.558SS.*Hα-helixtrans-61.6-44.1177.8-173.3-94.9000111.8Y31 Y32 Y37 Y38 Y39Y31-Y35 WeakPolarHBondContact O-CB 3.41Å; Y31-Y35 PolarHBondContact O-N 2.91Å; Y32-Y35 PolarHBondContact O-N 2.85Å; Y35-Y37 PolarHBondContact O-N 3.48Å; Y35-Y38 PolarHBondContact O-N 2.9Å; Y35-Y39 WeakPolarHBondContact O-CB 3.29Å; Y35-Y39 PolarHBondContact O-N 2.94Å
36Y95.3Very high93.5Very high143 Ų143134.9 Ų134.956%0.56155%0.549SS*.Hα-helixtrans-61-45.4176.5-176.5-93.8000112Y32 Y33 Y34 Y38 Y39 Y40Y32-Y36 WeakPolarHBondContact O-CB 3.29Å; Y32-Y36 PolarHBondContact O-N 3.32Å; Y33-Y36 PolarHBondContact O-N 2.84Å; Y34-Y36 PolarHBondContact O-N 3.44Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y36-Y39 PolarHBondContact O-N 3.49Å; Y36-Y40 WeakPolarHBondContact O-CB 3.28Å; Y36-Y40 PolarHBondContact O-N 3.34Å
37Y95.7Very high93.9Very high127 Ų127137.5 Ų137.550%0.49855%0.551SS.*Hα-helixtrans-63.1-43.1178.7-169.3-93.1000112Y33 Y34 Y35 Y39 Y40 Y41Y33-Y37 WeakPolarHBondContact O-CB 3.33Å; Y33-Y37 PolarHBondContact O-N 3.42Å; Y34-Y37 PolarHBondContact O-N 2.89Å; Y35-Y37 PolarHBondContact O-N 3.48Å; Y37-Y39 PolarHBondContact O-N 3.17Å; Y37-Y40 PolarHBondContact O-N 3.5Å; Y37-Y41 HydrophobicContact CE1-CD2 4.04Å; Y37-Y41 PolarHBondContact O-N 3.48Å
38Y96.2Very high94.2Very high142 Ų142137.8 Ų137.856%0.55755%0.546SS*.Hα-helixtrans-60.9-45.5176.5-175.5-94.6000111.8Y34 Y35 Y36 Y40 Y41 Y42Y34-Y38 WeakPolarHBondContact O-CB 3.12Å; Y34-Y38 PolarHBondContact O-N 2.84Å; Y35-Y38 PolarHBondContact O-N 2.9Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y38-Y40 PolarHBondContact O-N 3.38Å; Y38-Y41 PolarHBondContact O-N 2.97Å; Y38-Y42 WeakPolarHBondContact O-CB 3.38Å; Y38-Y42 PolarHBondContact O-N 3.33Å
39Y96.1Very high94.2Very high133 Ų133140.1 Ų140.152%0.52255%0.55SS..Hα-helixtrans-63.9-41.8179.3-159.6-90.4000112Y35 Y36 Y37 Y41 Y42 Y43Y35-Y39 WeakPolarHBondContact O-CB 3.29Å; Y35-Y39 PolarHBondContact O-N 2.94Å; Y36-Y39 PolarHBondContact O-N 3.49Å; Y37-Y39 PolarHBondContact O-N 3.17Å; Y39-Y41 PolarHBondContact O-N 3.47Å; Y39-Y42 PolarHBondContact O-N 2.92Å; Y39-Y43 WeakPolarHBondContact O-CB 3.18Å; Y39-Y43 PolarHBondContact O-N 2.86Å
40Y96Very high94Very high136 Ų136137.6 Ų137.653%0.53354%0.539SS..Hα-helixtrans-60.3-45.6175.4-178.1-94.8000111.9Y36 Y37 Y38 Y42 Y43 Y44Y36-Y40 WeakPolarHBondContact O-CB 3.28Å; Y36-Y40 PolarHBondContact O-N 3.34Å; Y37-Y40 PolarHBondContact O-N 3.5Å; Y38-Y40 PolarHBondContact O-N 3.38Å; Y40-Y42 PolarHBondContact O-N 2.97Å; Y40-Y43 PolarHBondContact O-N 3.5Å; Y40-Y44 WeakPolarHBondContact O-CB 3.38Å; Y40-Y44 PolarHBondContact O-N 3.41Å
41Y95.1Very high93.7Very high137 Ų137134.3 Ų134.354%0.53753%0.527SS..Hα-helixtrans-64.9-41.6-179.8-140.9-87.7000112Y37 Y38 Y39 Y44 Y45Y37-Y41 HydrophobicContact CE1-CD2 4.04Å; Y37-Y41 PolarHBondContact O-N 3.48Å; Y38-Y41 PolarHBondContact O-N 2.97Å; Y39-Y41 PolarHBondContact O-N 3.47Å; Y41-Y44 PolarHBondContact O-N 3.37Å; Y41-Y45 WeakPolarHBondContact O-CB 3.42Å; Y41-Y45 PolarHBondContact O-N 2.88Å
42Y95.5Very high93.2Very high140 Ų140133.5 Ų133.555%0.54952%0.524SS..Hα-helixtrans-61.3-46.1175.4-176-96.1000111.5Y38 Y39 Y40 Y44 Y45 Y46Y38-Y42 WeakPolarHBondContact O-CB 3.38Å; Y38-Y42 PolarHBondContact O-N 3.33Å; Y39-Y42 PolarHBondContact O-N 2.92Å; Y40-Y42 PolarHBondContact O-N 2.97Å; Y42-Y44 PolarHBondContact O-N 3.41Å; Y42-Y45 PolarHBondContact O-N 2.88Å; Y42-Y46 WeakPolarHBondContact O-CB 3.33Å; Y42-Y46 PolarHBondContact O-N 2.92Å
43Y95.6Very high92.7Very high147 Ų147131.1 Ų131.158%0.57651%0.514SS*.Hα-helixtrans-64.7-41.3179-159.4-90.5000112Y39 Y40 Y46 Y47Y39-Y43 WeakPolarHBondContact O-CB 3.18Å; Y39-Y43 PolarHBondContact O-N 2.86Å; Y40-Y43 PolarHBondContact O-N 3.5Å; Y43-Y46 PolarHBondContact O-N 2.89Å; Y43-Y47 WeakPolarHBondContact O-CB 3.35Å; Y43-Y47 PolarHBondContact O-N 2.83Å
44Y94.9Very high92Very high108 Ų108131 Ų13142%0.42452%0.517SS..Hα-helixtrans-61.4-46176-175.7-94.7000111.8Y40 Y41 Y42 Y47 Y48Y40-Y44 WeakPolarHBondContact O-CB 3.38Å; Y40-Y44 PolarHBondContact O-N 3.41Å; Y41-Y44 PolarHBondContact O-N 3.37Å; Y42-Y44 PolarHBondContact O-N 3.41Å; Y44-Y47 PolarHBondContact O-N 3.49Å; Y44-Y48 HydrophobicContact CD1-CD2 4.3Å; Y44-Y48 AromaticContact CE1-CD2 3.73Å; Y44-Y48 HydrophobicContact CE1-CD2 3.73Å; Y44-Y48 AromaticContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE2-CD2 4.05Å; Y44-Y48 AromaticContact CE2-CE2 3.89Å; Y44-Y48 HydrophobicContact CE2-CE2 3.89Å; Y44-Y48 AromaticContact CZ-CD2 3.6Å; Y44-Y48 AromaticContact CZ-CE2 3.37Å; Y44-Y48 WeakPolarHBondContact O-CB 3.49Å; Y44-Y48 PolarHBondContact O-N 3.42Å; Y44-Y48 WeakPolarHBondContact OH-CE2 3.44Å
45Y94.4Very high91.1Very high163 Ų163127.2 Ų127.264%0.63950%0.504SS*.Hα-helixtrans-63.9-44.4177.9-168.2-91.2000111.7Y41 Y42 Y47 Y48 Y49Y41-Y45 WeakPolarHBondContact O-CB 3.42Å; Y41-Y45 PolarHBondContact O-N 2.88Å; Y42-Y45 PolarHBondContact O-N 2.88Å; Y45-Y47 PolarHBondContact O-N 2.96Å; Y45-Y48 PolarHBondContact O-N 2.9Å; Y45-Y49 WeakPolarHBondContact O-CB 3.44Å; Y45-Y49 PolarHBondContact O-N 3.33Å
46Y93.5Very high90Very high108 Ų108126.7 Ų126.742%0.42451%0.505SS..Hα-helixtrans-61.4-44.9177-171-91.9000111.8Y42 Y43 Y49 Y50Y42-Y46 WeakPolarHBondContact O-CB 3.33Å; Y42-Y46 PolarHBondContact O-N 2.92Å; Y43-Y46 PolarHBondContact O-N 2.89Å; Y46-Y49 PolarHBondContact O-N 2.89Å; Y46-Y50 AromaticContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CE2 4.13Å; Y46-Y50 HydrophobicContact CD2-CD2 4.32Å; Y46-Y50 HydrophobicContact CD2-CE2 4.14Å; Y46-Y50 AromaticContact CE1-CD2 3.5Å; Y46-Y50 HydrophobicContact CE1-CD2 3.5Å; Y46-Y50 VanDerWaalsContact CE1-CD2 3.5Å; Y46-Y50 AromaticContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CE2 3.42Å; Y46-Y50 VanDerWaalsContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CG 4.27Å; Y46-Y50 HydrophobicContact CE2-CD2 4.05Å; Y46-Y50 AromaticContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CE2-CE2 3.45Å; Y46-Y50 VanDerWaalsContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CG-CD2 4.24Å; Y46-Y50 HydrophobicContact CG-CE2 4.45Å; Y46-Y50 AromaticContact CZ-CD2 3.65Å; Y46-Y50 AromaticContact CZ-CE2 3.05Å; Y46-Y50 AromaticContact CZ-CZ 3.68Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.36Å; Y46-Y50 WeakPolarHBondContact OH-CE2 3.1Å; Y46-Y50 VanDerWaalsContact OH-CZ 3.28Å; Y46-Y50 PolarHBondContact OH-OH 3.48Å; Y46-Y50 VanDerWaalsContact OH-OH 3.1Å
47Y92.9Very high89Confident136 Ų136126.7 Ų126.753%0.53350%0.504SS..Hα-helixtrans-60.5-46.6176.1-179-94000111.8Y43 Y44 Y45 Y49 Y50 Y51Y43-Y47 WeakPolarHBondContact O-CB 3.35Å; Y43-Y47 PolarHBondContact O-N 2.83Å; Y44-Y47 PolarHBondContact O-N 3.49Å; Y45-Y47 PolarHBondContact O-N 2.96Å; Y47-Y49 PolarHBondContact O-N 3.41Å; Y47-Y50 PolarHBondContact O-N 3.5Å; Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.49Å; Y47-Y51 PolarHBondContact O-N 3.39Å
48Y91.3Very high87.9Confident102 Ų102128.9 Ų128.940%0.451%0.512SS..Hα-helixtrans-61.9-44.8177.6-112.3-96.7000112Y44 Y45 Y50 Y51 Y52Y44-Y48 HydrophobicContact CD1-CD2 4.3Å; Y44-Y48 AromaticContact CE1-CD2 3.73Å; Y44-Y48 HydrophobicContact CE1-CD2 3.73Å; Y44-Y48 AromaticContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE2-CD2 4.05Å; Y44-Y48 AromaticContact CE2-CE2 3.89Å; Y44-Y48 HydrophobicContact CE2-CE2 3.89Å; Y44-Y48 AromaticContact CZ-CD2 3.6Å; Y44-Y48 AromaticContact CZ-CE2 3.37Å; Y44-Y48 WeakPolarHBondContact O-CB 3.49Å; Y44-Y48 PolarHBondContact O-N 3.42Å; Y44-Y48 WeakPolarHBondContact OH-CE2 3.44Å; Y45-Y48 PolarHBondContact O-N 2.9Å; Y48-Y50 PolarHBondContact O-N 3.49Å; Y48-Y51 PolarHBondContact O-N 3.35Å; Y48-Y52 AromaticContact CD1-CD2 3.83Å; Y48-Y52 HydrophobicContact CD1-CD2 3.83Å; Y48-Y52 AromaticContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CE1-CD2 4.4Å; Y48-Y52 AromaticContact CE1-CE2 3.69Å; Y48-Y52 HydrophobicContact CE1-CE2 3.69Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.39Å; Y48-Y52 PolarHBondContact O-N 3.49Å
49Y89Confident86.5Confident138 Ų138128.1 Ų128.154%0.54152%0.516SS..Hα-helixtrans-59.1-47.7177.4-178.2-93.6000111.6Y45 Y46 Y47 Y52 Y53Y45-Y49 WeakPolarHBondContact O-CB 3.44Å; Y45-Y49 PolarHBondContact O-N 3.33Å; Y46-Y49 PolarHBondContact O-N 2.89Å; Y47-Y49 PolarHBondContact O-N 3.41Å; Y49-Y52 PolarHBondContact O-N 3.5Å; Y49-Y53 VanDerWaalsContact O-CB 3.28Å; Y49-Y53 WeakPolarHBondContact O-CB 3.47Å; Y49-Y53 PolarHBondContact O-N 3.38Å
50Y87.3Confident84.9Confident101 Ų101127.9 Ų127.940%0.39652%0.519SS..Hα-helixtrans-64.1-44.3177.2-95-99.2000112.4Y46 Y47 Y48 Y52 Y53 F54Y46-Y50 AromaticContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CE2 4.13Å; Y46-Y50 HydrophobicContact CD2-CD2 4.32Å; Y46-Y50 HydrophobicContact CD2-CE2 4.14Å; Y46-Y50 AromaticContact CE1-CD2 3.5Å; Y46-Y50 HydrophobicContact CE1-CD2 3.5Å; Y46-Y50 VanDerWaalsContact CE1-CD2 3.5Å; Y46-Y50 AromaticContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CE2 3.42Å; Y46-Y50 VanDerWaalsContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CG 4.27Å; Y46-Y50 HydrophobicContact CE2-CD2 4.05Å; Y46-Y50 AromaticContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CE2-CE2 3.45Å; Y46-Y50 VanDerWaalsContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CG-CD2 4.24Å; Y46-Y50 HydrophobicContact CG-CE2 4.45Å; Y46-Y50 AromaticContact CZ-CD2 3.65Å; Y46-Y50 AromaticContact CZ-CE2 3.05Å; Y46-Y50 AromaticContact CZ-CZ 3.68Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.36Å; Y46-Y50 WeakPolarHBondContact OH-CE2 3.1Å; Y46-Y50 VanDerWaalsContact OH-CZ 3.28Å; Y46-Y50 PolarHBondContact OH-OH 3.48Å; Y46-Y50 VanDerWaalsContact OH-OH 3.1Å; Y47-Y50 PolarHBondContact O-N 3.5Å; Y48-Y50 PolarHBondContact O-N 3.49Å; Y50-Y52 PolarHBondContact O-N 2.98Å; Y50-Y53 PolarHBondContact O-N 2.97Å; Y50-F54 AromaticContact CD1-CD2 3.98Å; Y50-F54 HydrophobicContact CD1-CD2 3.98Å; Y50-F54 AromaticContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CE1-CE2 4.02Å; Y50-F54 WeakPolarHBondContact O-CB 3.39Å; Y50-F54 WeakPolarHBondContact O-CD2 3.38Å; Y50-F54 PolarHBondContact O-N 2.98Å
51Y85.3Confident83Confident112 Ų112127.4 Ų127.444%0.43953%0.525SS..Hα-helixtrans-57.9-50.2177.5-177.7-91.6000110.9Y47 Y48 F54 H55Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.49Å; Y47-Y51 PolarHBondContact O-N 3.39Å; Y48-Y51 PolarHBondContact O-N 3.35Å; Y51-F54 PolarHBondContact O-N 2.99Å; Y51-H55 AromaticContact CD1-CD2 3.98Å; Y51-H55 AromaticContact CD2-CD2 3.55Å; Y51-H55 AromaticContact CD2-NE2 3.71Å; Y51-H55 AromaticContact CE1-CD2 3.77Å; Y51-H55 AromaticContact CE2-CD2 3.33Å; Y51-H55 WeakPolarHBondContact CE2-CD2 3.35Å; Y51-H55 AromaticContact CE2-NE2 3.1Å; Y51-H55 WeakPolarHBondContact CE2-NE2 3.34Å; Y51-H55 AromaticContact CG-CD2 3.88Å; Y51-H55 AromaticContact CZ-CD2 3.43Å; Y51-H55 VanDerWaalsContact CZ-CD2 3.43Å; Y51-H55 AromaticContact CZ-CE1 3.92Å; Y51-H55 AromaticContact CZ-NE2 3.39Å; Y51-H55 VanDerWaalsContact O-CB 3.29Å; Y51-H55 WeakPolarHBondContact O-CB 3.49Å; Y51-H55 PolarHBondContact O-CD2 2.96Å; Y51-H55 VanDerWaalsContact O-CD2 3.26Å; Y51-H55 PolarHBondContact O-N 3.5Å
52Y83.6Confident81.1Confident146 Ų146125.4 Ų125.457%0.57352%0.522SS*.Hα-helixtrans-62-46.8176.8-91.7-79.2000112.1Y48 Y49 Y50 F54 H55 F56Y48-Y52 AromaticContact CD1-CD2 3.83Å; Y48-Y52 HydrophobicContact CD1-CD2 3.83Å; Y48-Y52 AromaticContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CE1-CD2 4.4Å; Y48-Y52 AromaticContact CE1-CE2 3.69Å; Y48-Y52 HydrophobicContact CE1-CE2 3.69Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.39Å; Y48-Y52 PolarHBondContact O-N 3.49Å; Y49-Y52 PolarHBondContact O-N 3.5Å; Y50-Y52 PolarHBondContact O-N 2.98Å; Y52-F54 PolarHBondContact O-N 3.02Å; Y52-H55 PolarHBondContact O-N 2.95Å; Y52-F56 WeakPolarHBondContact O-CB 3.39Å; Y52-F56 PolarHBondContact O-N 3.32Å
53Y83.5Confident79.1Confident103 Ų103123 Ų12340%0.40452%0.524SS..Hα-helixtrans-59.6-46.2-179.3-173.6-95.2000112.1Y49 Y50 R57Y49-Y53 VanDerWaalsContact O-CB 3.28Å; Y49-Y53 WeakPolarHBondContact O-CB 3.47Å; Y49-Y53 PolarHBondContact O-N 3.38Å; Y50-Y53 PolarHBondContact O-N 2.97Å; Y53-R57 HydrophobicContact CE1-CG 4.46Å; Y53-R57 WeakPolarHBondContact O-CB 3.36Å; Y53-R57 PolarHBondContact O-N 2.94Å; Y53-R57 PolarHBondContact OH-NE 3.5Å; Y53-R57 VanDerWaalsContact OH-NE 3.12Å; Y53-R57 PolarHBondContact OH-NH2 3.39Å
54F80.2Confident77.2Confident132 Ų132120.9 Ų120.958%0.57953%0.528SS*.Hα-helixtrans-70.3-43.9179.3-90.2-83.3000112.6Y50 Y51 Y52 R58Y50-F54 AromaticContact CD1-CD2 3.98Å; Y50-F54 HydrophobicContact CD1-CD2 3.98Å; Y50-F54 AromaticContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CE1-CE2 4.02Å; Y50-F54 WeakPolarHBondContact O-CB 3.39Å; Y50-F54 WeakPolarHBondContact O-CD2 3.38Å; Y50-F54 PolarHBondContact O-N 2.98Å; Y51-F54 PolarHBondContact O-N 2.99Å; Y52-F54 PolarHBondContact O-N 3.02Å; F54-R58 VanDerWaalsContact O-CB 3.27Å; F54-R58 WeakPolarHBondContact O-CB 3.44Å; F54-R58 PolarHBondContact O-N 3.3Å
55H76.3Confident75.3Confident79 Ų79121.7 Ų121.737%0.36654%0.539SS..Hα-helixtrans-67.1-42.1179.5-86.9-88.7000112Y51 Y52 R58 L59Y51-H55 AromaticContact CD1-CD2 3.98Å; Y51-H55 AromaticContact CD2-CD2 3.55Å; Y51-H55 AromaticContact CD2-NE2 3.71Å; Y51-H55 AromaticContact CE1-CD2 3.77Å; Y51-H55 AromaticContact CE2-CD2 3.33Å; Y51-H55 WeakPolarHBondContact CE2-CD2 3.35Å; Y51-H55 AromaticContact CE2-NE2 3.1Å; Y51-H55 WeakPolarHBondContact CE2-NE2 3.34Å; Y51-H55 AromaticContact CG-CD2 3.88Å; Y51-H55 AromaticContact CZ-CD2 3.43Å; Y51-H55 VanDerWaalsContact CZ-CD2 3.43Å; Y51-H55 AromaticContact CZ-CE1 3.92Å; Y51-H55 AromaticContact CZ-NE2 3.39Å; Y51-H55 VanDerWaalsContact O-CB 3.29Å; Y51-H55 WeakPolarHBondContact O-CB 3.49Å; Y51-H55 PolarHBondContact O-CD2 2.96Å; Y51-H55 VanDerWaalsContact O-CD2 3.26Å; Y51-H55 PolarHBondContact O-N 3.5Å; Y52-H55 PolarHBondContact O-N 2.95Å; H55-R58 PolarHBondContact O-N 2.93Å; H55-L59 WeakPolarHBondContact O-CB 3.49Å; H55-L59 WeakPolarHBondContact O-CG 3.4Å; H55-L59 PolarHBondContact O-N 2.93Å
56F72.9Confident73.1Confident128 Ų128120.7 Ų120.756%0.56154%0.54SS*.Hα-helixtrans-66.5-46.4178.1-154.1-98000110.5Y52 R58 L59 F60Y52-F56 WeakPolarHBondContact O-CB 3.39Å; Y52-F56 PolarHBondContact O-N 3.32Å; F56-R58 VanDerWaalsContact C-N 3.3Å; F56-R58 PolarHBondContact O-N 3.42Å; F56-L59 PolarHBondContact O-N 2.9Å; F56-F60 AromaticContact CD1-CD2 3.7Å; F56-F60 HydrophobicContact CD1-CD2 3.7Å; F56-F60 AromaticContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD2-CE2 4.34Å; F56-F60 AromaticContact CE1-CD2 3.64Å; F56-F60 HydrophobicContact CE1-CD2 3.64Å; F56-F60 AromaticContact CE1-CE2 3.1Å; F56-F60 HydrophobicContact CE1-CE2 3.1Å; F56-F60 AromaticContact CE1-CZ 3.82Å; F56-F60 HydrophobicContact CE1-CZ 3.82Å; F56-F60 AromaticContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CG-CD2 4.3Å; F56-F60 HydrophobicContact CG-CE2 4.24Å; F56-F60 HydrophobicContact CZ-CD2 4.19Å; F56-F60 AromaticContact CZ-CE2 3.27Å; F56-F60 HydrophobicContact CZ-CE2 3.27Å; F56-F60 AromaticContact CZ-CZ 3.88Å; F56-F60 HydrophobicContact CZ-CZ 3.88Å; F56-F60 WeakPolarHBondContact O-CD2 3.42Å; F56-F60 PolarHBondContact O-N 3.41Å
57R74.1Confident70.9Confident142 Ų142123.1 Ų123.154%0.53656%0.555SS.*Hα-helixtrans-58.4-42173.4-91.2-165.4164.8-142.9-1.6112.7Y53 F60 L61Y53-R57 HydrophobicContact CE1-CG 4.46Å; Y53-R57 WeakPolarHBondContact O-CB 3.36Å; Y53-R57 PolarHBondContact O-N 2.94Å; Y53-R57 PolarHBondContact OH-NE 3.5Å; Y53-R57 VanDerWaalsContact OH-NE 3.12Å; Y53-R57 PolarHBondContact OH-NH2 3.39Å; R57-F60 PolarHBondContact O-N 3.48Å; R57-L61 VanDerWaalsContact O-CB 3.24Å; R57-L61 WeakPolarHBondContact O-CB 3.32Å; R57-L61 PolarHBondContact O-N 3.38Å
58R72.2Confident68.7Low173 Ų173125.9 Ų125.965%0.65357%0.565SS**Hα-helixtrans-64.8-40.8178.7-171.4175.4-179.1-173.10.2111.6F54 H55 F56 F60 L61 L62F54-R58 VanDerWaalsContact O-CB 3.27Å; F54-R58 WeakPolarHBondContact O-CB 3.44Å; F54-R58 PolarHBondContact O-N 3.3Å; H55-R58 PolarHBondContact O-N 2.93Å; F56-R58 VanDerWaalsContact C-N 3.3Å; F56-R58 PolarHBondContact O-N 3.42Å; R58-F60 VanDerWaalsContact C-N 3.32Å; R58-F60 PolarHBondContact O-N 3.5Å; R58-L61 PolarHBondContact O-N 3.4Å; R58-L62 HydrophobicContact CG-CD1 3.94Å; R58-L62 WeakPolarHBondContact O-CD1 3.45Å; R58-L62 PolarHBondContact O-N 3.5Å
59L66.4Low66.6Low126 Ų126127 Ų12766%0.6658%0.578SS**Hα-helixtrans-62.6-37.3176.6-79.9161.1000112.5H55 F56H55-L59 WeakPolarHBondContact O-CB 3.49Å; H55-L59 WeakPolarHBondContact O-CG 3.4Å; H55-L59 PolarHBondContact O-N 2.93Å; F56-L59 PolarHBondContact O-N 2.9Å
60F61.9Low64.7Low129 Ų129126.8 Ų126.857%0.56659%0.593SS**Hα-helixtrans-81.4-25.9176.7-82.3-94000113.8F56 R57 R58F56-F60 AromaticContact CD1-CD2 3.7Å; F56-F60 HydrophobicContact CD1-CD2 3.7Å; F56-F60 AromaticContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD2-CE2 4.34Å; F56-F60 AromaticContact CE1-CD2 3.64Å; F56-F60 HydrophobicContact CE1-CD2 3.64Å; F56-F60 AromaticContact CE1-CE2 3.1Å; F56-F60 HydrophobicContact CE1-CE2 3.1Å; F56-F60 AromaticContact CE1-CZ 3.82Å; F56-F60 HydrophobicContact CE1-CZ 3.82Å; F56-F60 AromaticContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CG-CD2 4.3Å; F56-F60 HydrophobicContact CG-CE2 4.24Å; F56-F60 HydrophobicContact CZ-CD2 4.19Å; F56-F60 AromaticContact CZ-CE2 3.27Å; F56-F60 HydrophobicContact CZ-CE2 3.27Å; F56-F60 AromaticContact CZ-CZ 3.88Å; F56-F60 HydrophobicContact CZ-CZ 3.88Å; F56-F60 WeakPolarHBondContact O-CD2 3.42Å; F56-F60 PolarHBondContact O-N 3.41Å; R57-F60 PolarHBondContact O-N 3.48Å; R58-F60 VanDerWaalsContact C-N 3.32Å; R58-F60 PolarHBondContact O-N 3.5Å
61L57.6Low63.1Low126 Ų126125.6 Ų125.666%0.6661%0.611SS**Hα-helixtrans-84.2-18.3178.5-88.1161.4000114R57 R58 P63R57-L61 VanDerWaalsContact O-CB 3.24Å; R57-L61 WeakPolarHBondContact O-CB 3.32Å; R57-L61 PolarHBondContact O-N 3.38Å; R58-L61 PolarHBondContact O-N 3.4Å; L61-P63 WeakPolarHBondContact O-CD 3.23Å; L61-P63 VanDerWaalsContact O-N 3.14Å
62L54.2Low61.5Low94 Ų94124.5 Ų124.549%0.49262%0.62SS.*SBendtrans-69.5106.8164.6-94.5113.8000106.2R58R58-L62 HydrophobicContact CG-CD1 3.94Å; R58-L62 WeakPolarHBondContact O-CD1 3.45Å; R58-L62 PolarHBondContact O-N 3.5Å
63P54.9Low59.7Low91 Ų91122 Ų12259%0.59163%0.629SS**  trans-52.7134.9168.824.5-32.3000105.4L61 I65L61-P63 WeakPolarHBondContact O-CD 3.23Å; L61-P63 VanDerWaalsContact O-N 3.14Å; P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 3.46Å
64P54.7Low58.2Low101 Ų101121.9 Ų121.966%0.65664%0.635SS**  trans-51.1114.1169.223.1-31.4000104.1H66P64-H66 PolarHBondContact O-N 2.94Å
65I56Low56.7Low126 Ų126122.1 Ų122.165%0.64664%0.641SS**  trans-7169.2171.5-53.5174.2000102.5P63 H67P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 3.46Å; I65-H67 PolarHBondContact O-N 2.89Å
66H46.4Very low55.4Low142 Ų142124.6 Ų124.666%0.65766%0.664SS**  trans-56.2103158.3-97.1-80.7000101.3P64 Y68P64-H66 PolarHBondContact O-N 2.94Å; H66-Y68 PolarHBondContact O-N 3.03Å
67H48.4Very low54.4Low159 Ų159121.2 Ų121.274%0.73667%0.666SS**  trans-43.993.2154-73-60000105.6I65 L69I65-H67 PolarHBondContact O-N 2.89Å; H67-L69 HydrophobicContact CB-CD1 4.36Å; H67-L69 PolarHBondContact O-N 3.37Å
68Y47.4Very low53.1Low193 Ų193121.3 Ų121.376%0.75767%0.672SS**  trans-62.586.3164.8-103.3-98.9000103.1H66 P70H66-Y68 PolarHBondContact O-N 3.03Å; Y68-P70 WeakPolarHBondContact O-CD 2.99Å
69L46.9Very low51.9Low127 Ų127120.1 Ų120.167%0.66568%0.678SS**  trans-61.6113.9155.3-89.794.7000104.5H67 G71H67-L69 HydrophobicContact CB-CD1 4.36Å; H67-L69 PolarHBondContact O-N 3.37Å; L69-G71 VanDerWaalsContact C-N 3.31Å; L69-G71 PolarHBondContact O-N 3.23Å
70P49.5Very low50.7Low133 Ų133118.6 Ų118.686%0.86468%0.677SS**THydrogen-bonded Turntrans-66.896.7174.728.7-31.4000106.9Y68Y68-P70 WeakPolarHBondContact O-CD 2.99Å
71G52.7Low50Low75 Ų75118 Ų11877%0.77368%0.678SS**THydrogen-bonded Turntrans161.3-20.9177.700000116.5L69 A73L69-G71 VanDerWaalsContact C-N 3.31Å; L69-G71 PolarHBondContact O-N 3.23Å; G71-A73 PolarHBondContact O-N 2.92Å
72S52.2Low49.5Very low89 Ų89117.5 Ų117.562%0.62268%0.68SS**  trans-86.199.9175.253.30000110I74S72-I74 PolarHBondContact O-N 3.01Å
73A46.4Very low49.2Very low93 Ų93116.2 Ų116.277%0.76968%0.683SS**  trans-51.6109.2166.300000109.2G71 L75G71-A73 PolarHBondContact O-N 2.92Å; A73-L75 PolarHBondContact O-N 2.88Å
74I51Low48.9Very low102 Ų102116 Ų11652%0.52368%0.684SS.*  trans-71.6101.7175.6-60.6172.7000106.3S72S72-I74 PolarHBondContact O-N 3.01Å
75L48.3Very low48.6Very low137 Ų137119.4 Ų119.472%0.71769%0.689SS**  trans-60.5131.8166.9-78.8157.5000108.1A73 G77A73-L75 PolarHBondContact O-N 2.88Å; L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.14Å
76P49.5Very low47.8Very low131 Ų131117.1 Ų117.185%0.85168%0.683SS**THydrogen-bonded Turntrans-6789177.628.3-33.1000108.8
77G51.3Low47.4Very low57 Ų57117.8 Ų117.859%0.58869%0.686SS**THydrogen-bonded Turntrans-177-26.3-178.200000113.4L75L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.14Å
78Q48.2Very low47.2Very low144 Ų144116.3 Ų116.367%0.67369%0.688SS**THydrogen-bonded Turntrans-84.5-12.5-179.4-78.2-176.7-2000115C80Q78-C80 PolarHBondContact O-N 2.97Å
79L45.3Very low46.9Very low148 Ų148112.3 Ų112.378%0.77568%0.68SS**THydrogen-bonded Turntrans-69.2-16.8176.8-82.6162.9000113.6I81L79-I81 PolarHBondContact O-N 3.32Å
80C41.8Very low46.4Very low94 Ų94114.8 Ų114.864%0.63569%0.688SS**Hα-helixtrans-71-26.7179.3-95.80000113.9Q78 V82 A83 S84Q78-C80 PolarHBondContact O-N 2.97Å; C80-V82 VanDerWaalsContact C-N 3.31Å; C80-V82 PolarHBondContact O-N 3.46Å; C80-A83 PolarHBondContact O-N 3.25Å; C80-S84 PolarHBondContact O-N 3Å; C80-S84 PolarHBondContact O-OG 3.35Å
81I47.7Very low46Very low115 Ų115117.9 Ų117.959%0.5969%0.688SS**Hα-helixtrans-69.5-30.9-169.7-57.9178000111.7L79L79-I81 PolarHBondContact O-N 3.32Å
82V46.4Very low45.2Very low116 Ų116122.2 Ų122.270%0.70369%0.688SS**Hα-helixtrans-81.9-33.1-177.3-173.60000111.8C80 S84 F85C80-V82 VanDerWaalsContact C-N 3.31Å; C80-V82 PolarHBondContact O-N 3.46Å; V82-S84 VanDerWaalsContact C-N 3.33Å; V82-S84 PolarHBondContact O-N 3.31Å; V82-F85 PolarHBondContact O-N 2.86Å
83A47.4Very low44.6Very low68 Ų68126 Ų12656%0.56270%0.701SS**Hα-helixtrans-69.8-29.9179.200000112.8C80 F85 C86C80-A83 PolarHBondContact O-N 3.25Å; A83-F85 PolarHBondContact O-N 3.08Å; A83-C86 PolarHBondContact O-N 3.05Å; A83-C86 VanDerWaalsContact O-N 3.17Å
84S50Low44.2Very low86 Ų86130.5 Ų130.560%0.60171%0.706SS**G310 helixtrans-66.5-20.8-179.7-60.50000114C80 V82C80-S84 PolarHBondContact O-N 3Å; C80-S84 PolarHBondContact O-OG 3.35Å; V82-S84 VanDerWaalsContact C-N 3.33Å; V82-S84 PolarHBondContact O-N 3.31Å
85F47.3Very low43.8Very low172 Ų172129.6 Ų129.675%0.75471%0.708SS**G310 helixtrans-82.4-13.2175.8-85.6-81000114.1V82 A83V82-F85 PolarHBondContact O-N 2.86Å; A83-F85 PolarHBondContact O-N 3.08Å
86C39.1Very low43.3Very low78 Ų78127 Ų12753%0.52772%0.715SS.*G310 helixtrans-91.3-1.1-179.6-78.10000114.5A83A83-C86 PolarHBondContact O-N 3.05Å; A83-C86 VanDerWaalsContact O-N 3.17Å
87H39.1Very low42.9Very low156 Ų156129.6 Ų129.672%0.72271%0.713SS**G310 helixtrans-115.325.7179.8-140.7-56.3000114.3N89H87-N89 PolarHBondContact O-N 2.71Å
88V44.1Very low42.4Very low129 Ų129133.6 Ų133.678%0.78273%0.726SS**  trans-89.458.2157.5-167.40000107.8E90V88-E90 PolarHBondContact O-N 3.18Å
89N40Very low42.3Very low108 Ų108130.6 Ų130.658%0.57873%0.726SS**  trans-79.2113.8164.1-79.3-23.9000107.4H87 F91H87-N89 PolarHBondContact O-N 2.71Å; N89-F91 PolarHBondContact O-N 3.3Å; N89-F91 VanDerWaalsContact O-N 3.17Å
90E37.8Very low42Very low180 Ų180128.4 Ų128.484%0.84172%0.723SS**SBend65.737122.9-145.1161.9-148.100117.6V88V88-E90 PolarHBondContact O-N 3.18Å
91F39.8Very low42.1Very low198 Ų198128.7 Ų128.787%0.86872%0.724SS**  trans-131.1136.4155.3-98.2-94.8000107.8N89N89-F91 PolarHBondContact O-N 3.3Å; N89-F91 VanDerWaalsContact O-N 3.17Å
92Q37.5Very low41.8Very low165 Ų165134.4 Ų134.477%0.77174%0.738SS**  trans109.817.7172.1-49.1-113.2-19.600116.5
93L39.1Very low41.6Very low170 Ų170139.5 Ų139.589%0.8975%0.746SS**SBendtrans-81.5119144.8-147.878000106
94E37.5Very low41.4Very low187 Ų187140 Ų14087%0.87475%0.745SS**SBendtrans91.859.3-176.9-48.3-158167.800117.2
95S42.4Very low41Very low82 Ų82141 Ų14157%0.57375%0.753SS**  -161.4127.5122.4590000109.1F97S95-F97 VanDerWaalsContact C-N 3.28Å; S95-F97 PolarHBondContact O-N 2.73Å
96G37.9Very low40.7Very low83 Ų83141.4 Ų141.486%0.85676%0.756SS**  trans-7080.2-178.400000112.1
97F40.2Very low41Very low185 Ų185142 Ų14281%0.81177%0.767SS**  trans-118.6105.1164.6-112.9-93.8000110.2S95 A99S95-F97 VanDerWaalsContact C-N 3.28Å; S95-F97 PolarHBondContact O-N 2.73Å; F97-A99 PolarHBondContact O-N 2.83Å
98V42.6Very low41.1Very low141 Ų141143 Ų14386%0.85577%0.772SS**  trans-63.386.4164.3179.80000107.3
99A46.3Very low41Very low82 Ų82143.4 Ų143.468%0.67878%0.779SS**  trans-105.295.416800000107.6F97F97-A99 PolarHBondContact O-N 2.83Å
100S37.5Very low41.2Very low102 Ų102142.7 Ų142.771%0.71379%0.788SS**  trans-48.2124.7168.5-800000109.6R102S100-R102 PolarHBondContact O-N 2.93Å
101P45.3Very low41.4Very low100 Ų100143.1 Ų143.165%0.64979%0.787SS**  trans-68.39817525.9-30.4000108.4Y103P101-Y103 HydrophobicContact CB-CD2 4.01Å; P101-Y103 HydrophobicContact CB-CE2 4.06Å; P101-Y103 PolarHBondContact O-N 2.77Å
102R40.4Very low41.5Very low235 Ų235142.7 Ų142.789%0.88779%0.788SS**  trans-64.594.6155.8-78.8-173.2-161.5176.76105.9S100 S104S100-R102 PolarHBondContact O-N 2.93Å; R102-S104 PolarHBondContact O-N 2.99Å
103Y42.8Very low41.6Very low222 Ų222144.3 Ų144.387%0.87182%0.818SS**  trans-67.684.1161.9-92.3-89.4000107.7P101 S105P101-Y103 HydrophobicContact CB-CD2 4.01Å; P101-Y103 HydrophobicContact CB-CE2 4.06Å; P101-Y103 PolarHBondContact O-N 2.77Å; Y103-S105 PolarHBondContact O-N 2.67Å
104S42.1Very low41.7Very low79 Ų79143.1 Ų143.155%0.55281%0.814SS**  trans-71.1103.4164.657.50000107.9R102 H106R102-S104 PolarHBondContact O-N 2.99Å; S104-H106 PolarHBondContact O-N 3.37Å
105S42.1Very low41.9Very low108 Ų108140.7 Ų140.776%0.75581%0.811SS**  trans13.170.2139.560.50000117.1Y103 A107Y103-S105 PolarHBondContact O-N 2.67Å; S105-A107 VanDerWaalsContact C-N 3.28Å; S105-A107 PolarHBondContact O-N 3.27Å
106H41.7Very low41.9Very low179 Ų179144 Ų14483%0.82982%0.824SS**  trans-94.366.9156.6-90.1-79.7000108.3S104S104-H106 PolarHBondContact O-N 3.37Å
107A45.6Very low42.1Very low92 Ų92147.6 Ų147.676%0.7682%0.822SS**  trans-120.344.3164.800000109.2S105S105-A107 VanDerWaalsContact C-N 3.28Å; S105-A107 PolarHBondContact O-N 3.27Å
108E41.4Very low42.3Very low177 Ų177145.3 Ų145.383%0.82782%0.823SS**  trans-91.72.6167.8-94.1-175.3155.200112.8A110E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.26Å; E108-A110 VanDerWaalsContact O-N 3.16Å
109C41.5Very low42.3Very low137 Ų137145.5 Ų145.593%0.92682%0.821SS**THydrogen-bonded Turntrans-91.348.3-179.4-143.80000112.5
110A44.3Very low42Very low92 Ų92150.1 Ų150.176%0.7683%0.831SS**THydrogen-bonded Turntrans-126.315.6175.700000113.5E108E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.26Å; E108-A110 VanDerWaalsContact O-N 3.16Å
111K41.6Very low42.3Very low190 Ų190153.8 Ų153.883%0.82684%0.84SS**  trans-129.175.9175.1-71.7-175.2-179.21770110.5
112Q40.7Very low42.1Very low188 Ų188158.3 Ų158.388%0.87986%0.856SS**  trans-169128.9154.5-104.315440.500108.6
113S40.5Very low42.2Very low200 Ų200151.3 Ų151.3100%1.39985%0.853SS**  trans73.10-177.579.30000117.7

Retrieved 113 of 113 residues in 71.2 ms (Link to these results)