A0A087WYD4_HUMAN Loading...

Transmembrane protein 106C

AlphaFold DB , UniProt , Accession A0A087WYD4, Species HUMAN (Homo sapiens, Human), Gene TMEM106C, Length 181 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.1Very low38.7Very low249 Ų249135.4 Ų135.4100%1.22782%0.818SS**  086.60-60.317797.300105.6
2G35.7Very low38.4Very low79 Ų79134 Ų13481%0.81482%0.819SS**  99.8141.190.100000108.1
3S38.4Very low38.6Very low88 Ų88132.4 Ų132.462%0.61582%0.817SS**  cis179.4124.4-6.4163.90000105.8
4Q44.7Very low38.1Very low154 Ų154131.5 Ų131.572%0.7282%0.816SS**  trans56.8148.3136.5-47176.579.800119.5
5H36.8Very low38.1Very low144 Ų144135.3 Ų135.367%0.66781%0.809SS**  cis-174.1148.445.8-90.9-77.3000111.9
6S39.7Very low38.2Very low113 Ų113138.4 Ų138.479%0.7980%0.802SS**  56.1150129.6-58.90000122.2
7A35.6Very low38Very low92 Ų92140.8 Ų140.876%0.7680%0.801SS**  cis-170.3154.4-1.100000111.7
8A36.4Very low38.2Very low101 Ų101141.4 Ų141.484%0.83580%0.796SS**  trans41.2129.2142.100000124.1
9A32.4Very low38.3Very low105 Ų105144.1 Ų144.187%0.86880%0.801SS**  168.4133.7111.700000113.6
10R35.8Very low38.6Very low245 Ų245143.6 Ų143.693%0.92580%0.797SS**  trans-100.4178153.5-76.7-177.5172.4179.6-2.1107.5
11P53.3Low39Very low119 Ų119142.8 Ų142.877%0.77379%0.791SS**  cis-137.2-174.2-5.131.7-8.2000114.1
12S34.5Very low39.6Very low119 Ų119141.3 Ų141.383%0.83277%0.772SS**  trans154.6147.814557.90000109.2
13S41.9Very low40.2Very low113 Ų113143.2 Ų143.279%0.7976%0.763SS**  cis-157.9157.3-8.365.90000107.3
14C31.4Very low40.8Very low120 Ų120141 Ų14181%0.81175%0.754SS**  trans-71.1138.7169.4-70.80000111.9
15R38.6Very low41.3Very low189 Ų189140 Ų14071%0.71375%0.753SS**  161.2131114.9-103.4-176.1163.5170.50.1114.1
16R39Very low42.2Very low184 Ų184139.1 Ų139.169%0.69475%0.753SS**  trans68.5134.4136.2-75.5174.9178.4165.9-3.7116.6
17K34.2Very low42.7Very low179 Ų179136.5 Ų136.578%0.77874%0.738SS**  cis-166.8129.445-120.2157.7174.8-171.20106
18Q42.3Very low43.5Very low153 Ų153138.4 Ų138.472%0.71573%0.731SS**  63.575.3103.1-166123.253.500113.5D21Q18-D21 PolarHBondContact NE2-OD2 3.08Å
19E40.7Very low44.3Very low192 Ų192143 Ų14390%0.89773%0.727SS**  trans-158.328.2165.3-123.8172-171.900112.1
20D42.7Very low45.2Very low133 Ų133145.9 Ų145.971%0.71172%0.722SS**  trans-121.88.9-175.8-156.112000112.4
21D47.5Very low45.9Very low127 Ų127141.7 Ų141.768%0.67971%0.713SS**SBendtrans-88.8-1.4-174.6-77.4-49.1000113.5Q18Q18-D21 PolarHBondContact NE2-OD2 3.08Å
22R50.2Low45.8Very low218 Ų218142.7 Ų142.782%0.82371%0.708SS**SBendtrans-112.7-15.9-171.1-156.3163.7160.8-112.4-4.5114.6
23D48.9Very low46.5Very low119 Ų119145.7 Ų145.764%0.63671%0.709SS**SBendtrans-96.3-17.7177.9-62-26.3000112.4L25D23-L25 VanDerWaalsContact C-N 3.35Å; D23-L25 PolarHBondContact O-N 3.37Å
24G50.2Low47Very low41 Ų41144.1 Ų144.142%0.42370%0.703SS.*Hα-helixtrans-69.3-27.6173.800000114.3L26 A27 E28G24-L26 VanDerWaalsContact C-N 3.31Å; G24-L26 PolarHBondContact O-N 3.17Å; G24-A27 PolarHBondContact O-N 3.13Å; G24-E28 PolarHBondContact O-N 3.13Å
25L55.4Low48.4Very low133 Ų133145.1 Ų145.170%0.69670%0.698SS**Hα-helixtrans-73.8-21.3-175.7-154.478.1000113.3D23D23-L25 VanDerWaalsContact C-N 3.35Å; D23-L25 PolarHBondContact O-N 3.37Å
26L54.5Low49.5Very low127 Ų127139 Ų13967%0.66569%0.688SS**Hα-helixtrans-89-28.6177-69.3174.7000112.4G24G24-L26 VanDerWaalsContact C-N 3.31Å; G24-L26 PolarHBondContact O-N 3.17Å
27A51.8Low50.5Low58 Ų58139 Ų13948%0.47970%0.696SS.*Hα-helixtrans-73-29.3173.900000112.5G24 R29G24-A27 PolarHBondContact O-N 3.13Å; A27-R29 VanDerWaalsContact C-N 3.34Å
28E52.2Low51.3Low131 Ų131139 Ų13961%0.61270%0.697SS**Hα-helixtrans-67.8-35.3178.2-142.9175.3108.100111.9G24 E30 Q31 E32G24-E28 PolarHBondContact O-N 3.13Å; E28-E30 PolarHBondContact O-N 3.27Å; E28-Q31 PolarHBondContact O-N 3.06Å; E28-E32 PolarHBondContact O-N 2.68Å
29R52.9Low52Low197 Ų197136.7 Ų136.774%0.74370%0.695SS**Hα-helixtrans-74.1-25.1-177.3-159178.1-177.4-178.40.8113.8A27A27-R29 VanDerWaalsContact C-N 3.34Å
30E51.4Low52.7Low166 Ų166136.7 Ų136.778%0.77669%0.688SS**Hα-helixtrans-84-17.5174.7-64.8-173134.700112.4E28E28-E30 PolarHBondContact O-N 3.27Å
31Q49.9Very low53.7Low157 Ų157134.7 Ų134.773%0.73468%0.68SS**Hα-helixtrans-88.6-16.8179.4-159.4159.318.200113.2E28 E33E28-Q31 PolarHBondContact O-N 3.06Å; Q31-E33 VanDerWaalsContact C-N 3.31Å; Q31-E33 PolarHBondContact O-N 2.99Å
32E50.4Low54.4Low140 Ų140135.4 Ų135.465%0.65468%0.68SS**THydrogen-bonded Turntrans-74.8-15.7178.5-128.4173.8140.200113.7E28E28-E32 PolarHBondContact O-N 2.68Å
33E51.2Low54.7Low182 Ų182133.5 Ų133.585%0.8568%0.678SS**THydrogen-bonded Turntrans-92.32.3179.3-68.4-167.8163.900114.5Q31Q31-E33 VanDerWaalsContact C-N 3.31Å; Q31-E33 PolarHBondContact O-N 2.99Å
34A52.5Low55.2Low81 Ų81133.9 Ų133.967%0.66968%0.684SS**  trans-10232-179.800000113.8A36A34-A36 PolarHBondContact O-N 2.74Å; A34-A36 VanDerWaalsContact O-N 3.07Å
35I59.7Low55.4Low140 Ų140133.9 Ų133.972%0.71869%0.685SS**  trans-70.7106170.8-56.5172.9000107Q37I35-Q37 PolarHBondContact O-N 2.84Å
36A62.5Low55.4Low61 Ų61139.6 Ų139.650%0.50470%0.697SS.*  trans-52.1108177.300000110.3A34 F38A34-A36 PolarHBondContact O-N 2.74Å; A34-A36 VanDerWaalsContact O-N 3.07Å; A36-F38 HydrophobicContact CB-CD2 3.89Å; A36-F38 HydrophobicContact CB-CE2 3.44Å; A36-F38 VanDerWaalsContact CB-CE2 3.44Å; A36-F38 HydrophobicContact CB-CZ 3.99Å; A36-F38 VanDerWaalsContact O-CD2 3.28Å; A36-F38 WeakPolarHBondContact O-CD2 3.27Å; A36-F38 PolarHBondContact O-N 3.25Å
37Q59.8Low55.5Low183 Ų183141.1 Ų141.186%0.85571%0.706SS**  trans-6984.9172.9-168.688.94.100108I35 P39I35-Q37 PolarHBondContact O-N 2.84Å; Q37-P39 WeakPolarHBondContact O-CD 3.01Å
38F51.3Low56Low180 Ų180142 Ų14279%0.78971%0.709SS**PPolyproline II helixtrans-72121.3173.8-75-78.8000109A36 Y40A36-F38 HydrophobicContact CB-CD2 3.89Å; A36-F38 HydrophobicContact CB-CE2 3.44Å; A36-F38 VanDerWaalsContact CB-CE2 3.44Å; A36-F38 HydrophobicContact CB-CZ 3.99Å; A36-F38 VanDerWaalsContact O-CD2 3.28Å; A36-F38 WeakPolarHBondContact O-CD2 3.27Å; A36-F38 PolarHBondContact O-N 3.25Å; F38-Y40 PolarHBondContact O-N 3.34Å
39P57Low56.5Low104 Ų104143.5 Ų143.568%0.67572%0.719SS**PPolyproline II helixtrans-62.1129.6175.6-15.728.4000109.3Q37 V41Q37-P39 WeakPolarHBondContact O-CD 3.01Å; P39-V41 PolarHBondContact O-N 3.16Å
40Y54.7Low57.2Low192 Ų192138.5 Ų138.575%0.75371%0.711SS**PPolyproline II helixtrans-63.2127.2169.3-179.7-106.5000109F38 E42F38-Y40 PolarHBondContact O-N 3.34Å; Y40-E42 HydrophobicContact CD1-CG 4.1Å; Y40-E42 HydrophobicContact CE1-CG 3.25Å; Y40-E42 WeakPolarHBondContact CE1-OE1 3.42Å
41V62.7Low57.7Low91 Ų91133.7 Ų133.755%0.55269%0.694SS**  trans-127.7115.9-179.9-75.30000109.2P39 F43P39-V41 PolarHBondContact O-N 3.16Å; V41-F43 HydrophobicContact CB-CD2 4.29Å; V41-F43 HydrophobicContact CB-CE2 4.08Å; V41-F43 HydrophobicContact CG2-CD2 3.84Å; V41-F43 HydrophobicContact CG2-CE2 3.45Å; V41-F43 VanDerWaalsContact CG2-CE2 3.45Å; V41-F43 HydrophobicContact CG2-CZ 4.48Å; V41-F43 PolarHBondContact O-N 3.25Å
42E63.1Low58.5Low143 Ų143133.8 Ų133.867%0.66870%0.699SS**  trans-79.596.4174.4-65.5-175161.900109.2Y40 T44Y40-E42 HydrophobicContact CD1-CG 4.1Å; Y40-E42 HydrophobicContact CE1-CG 3.25Å; Y40-E42 WeakPolarHBondContact CE1-OE1 3.42Å; E42-T44 VanDerWaalsContact C-N 3.27Å; E42-T44 PolarHBondContact O-N 3.35Å
43F56.1Low59.1Low177 Ų177130.8 Ų130.878%0.77669%0.69SS**  trans-78.576.6170.2-79.8-85.8000110V41 G45V41-F43 HydrophobicContact CB-CD2 4.29Å; V41-F43 HydrophobicContact CB-CE2 4.08Å; V41-F43 HydrophobicContact CG2-CD2 3.84Å; V41-F43 HydrophobicContact CG2-CE2 3.45Å; V41-F43 VanDerWaalsContact CG2-CE2 3.45Å; V41-F43 HydrophobicContact CG2-CZ 4.48Å; V41-F43 PolarHBondContact O-N 3.25Å; F43-G45 PolarHBondContact O-N 3.46Å
44T60.8Low59.7Low127 Ų127123.4 Ų123.478%0.77966%0.659SS**  trans-77.168.9165.959.90000109.7E42E42-T44 VanDerWaalsContact C-N 3.27Å; E42-T44 PolarHBondContact O-N 3.35Å
45G53.3Low60.4Low42 Ų42126.9 Ų126.943%0.43366%0.661SS.*  trans-81.2144.4168.900000110.3F43 D47 S48F43-G45 PolarHBondContact O-N 3.46Å; G45-D47 PolarHBondContact O-N 3.36Å; G45-S48 PolarHBondContact O-N 3.03Å; G45-S48 PolarHBondContact O-OG 3.01Å
46R56.3Low60.9Low253 Ų253122.9 Ų122.996%0.95565%0.654SS**THydrogen-bonded Turntrans-62.12.8-173.1-69.2180-158.5151.17.3116.2
47D55.2Low61.2Low159 Ų159125 Ų12585%0.8566%0.661SS**THydrogen-bonded Turntrans-128.827.4175.8-58.6-49.3000111.9G45 I49G45-D47 PolarHBondContact O-N 3.36Å; D47-I49 PolarHBondContact O-N 2.84Å
48S63.1Low61.5Low76 Ų76119.6 Ų119.653%0.53166%0.655SS.*  trans-72.5110.7178.162.20000110.7G45 T50G45-S48 PolarHBondContact O-N 3.03Å; G45-S48 PolarHBondContact O-OG 3.01Å; S48-T50 PolarHBondContact O-N 3.29Å
49I63.3Low62.1Low163 Ų163118.1 Ų118.184%0.83665%0.645SS**PPolyproline II helixtrans-71.4120.3173-35.5171.1000106.9D47 C51D47-I49 PolarHBondContact O-N 2.84Å; I49-C51 PolarHBondContact O-N 2.88Å
50T66.8Low62.4Low92 Ų92116.3 Ų116.356%0.56463%0.629SS**PPolyproline II helixtrans-68.4132.5178.451.70000109.8S48 L52S48-T50 PolarHBondContact O-N 3.29Å; T50-L52 PolarHBondContact O-N 3.31Å
51C61.3Low62.8Low64 Ų64110.6 Ų110.643%0.43262%0.615SS.*PPolyproline II helixtrans-61.3124.1176.2173.40000109.3I49 T53 C54 Q55I49-C51 PolarHBondContact O-N 2.88Å; C51-T53 PolarHBondContact O-N 2.88Å; C51-T53 VanDerWaalsContact O-N 3.16Å; C51-C54 VanDerWaalsContact CB-SG 3.55Å; C51-Q55 WeakPolarHBondContact O-CA 3.08Å; C51-Q55 PolarHBondContact O-N 2.91Å
52L66.3Low62.6Low159 Ų159110.8 Ų110.883%0.83262%0.617SS**THydrogen-bonded Turntrans-62.7-23.3-178.9-87.782000113.2T50T50-L52 PolarHBondContact O-N 3.31Å
53T64.2Low62.4Low77 Ų77113.1 Ų113.147%0.47263%0.628SS.*THydrogen-bonded Turntrans-82.4-43-176-48.30000112.7C51 I60 L68C51-T53 PolarHBondContact O-N 2.88Å; C51-T53 VanDerWaalsContact O-N 3.16Å; T53-I60 HydrophobicContact CG2-CD1 3.97Å; T53-I60 HydrophobicContact CG2-CG1 4.36Å; T53-L68 HydrophobicContact CG2-CD2 4.34Å
54C63.8Low62.3Low27 Ų27110.5 Ų110.518%0.18262%0.618CS.*THydrogen-bonded Turntrans-108.1-0.6179.565.90000113.2C51 G56 T57 I60C51-C54 VanDerWaalsContact CB-SG 3.55Å; C54-G56 PolarHBondContact O-N 3.18Å; C54-T57 WeakPolarHBondContact O-CB 3.49Å; C54-T57 PolarHBondContact O-N 3.17Å; C54-T57 PolarHBondContact O-OG1 3.32Å; C54-I60 HydrophobicContact CB-CG1 4.35Å
55Q67.8Low61.9Low154 Ų154108 Ų10872%0.7260%0.602SS**THydrogen-bonded Turntrans50.325.5-176-59.6-178.22300114.1C51 T57C51-Q55 WeakPolarHBondContact O-CA 3.08Å; C51-Q55 PolarHBondContact O-N 2.91Å; Q55-T57 VanDerWaalsContact C-N 3.34Å
56G68.9Low61.6Low56 Ų56113.7 Ų113.758%0.57762%0.622SS**THydrogen-bonded Turntrans824.3-17600000115.2C54C54-G56 PolarHBondContact O-N 3.18Å
57T69.2Low61.3Low105 Ų105109.7 Ų109.764%0.64462%0.615SS**SBendtrans-87.3-10.3179.767.40000113.9C54 Q55 Y59C54-T57 WeakPolarHBondContact O-CB 3.49Å; C54-T57 PolarHBondContact O-N 3.17Å; C54-T57 PolarHBondContact O-OG1 3.32Å; Q55-T57 VanDerWaalsContact C-N 3.34Å; T57-Y59 PolarHBondContact O-N 2.85Å; T57-Y59 PolarHBondContact OG1-O 3.34Å
58G66.1Low61.2Low70 Ų70105 Ų10572%0.72259%0.59SS**SBendtrans68.4-0.3-178.500000114.9
59Y64Low60.6Low150 Ų150108 Ų10859%0.58860%0.604SS**  trans-124139.1-179.3-170.8-100.9000110.8T57T57-Y59 PolarHBondContact O-N 2.85Å; T57-Y59 PolarHBondContact OG1-O 3.34Å
60I63.8Low60.3Low66 Ų66104 Ų10434%0.33860%0.595SS.*  trans-113.7115.8178.4-61.6164.3000106.7T53 C54 T62 V65 L68T53-I60 HydrophobicContact CG2-CD1 3.97Å; T53-I60 HydrophobicContact CG2-CG1 4.36Å; C54-I60 HydrophobicContact CB-CG1 4.35Å; I60-T62 PolarHBondContact O-N 2.91Å; I60-V65 HydrophobicContact CG2-CG1 4.25Å; I60-L68 HydrophobicContact CG2-CD2 4.43Å
61P63.5Low59.9Low71 Ų71105.4 Ų105.446%0.46160%0.599SS.*  trans-61.4131.1-176.521.5-29.7000111.3E63 Q64P61-E63 PolarHBondContact O-N 3.09Å; P61-E63 VanDerWaalsContact O-N 3.13Å; P61-Q64 PolarHBondContact O-N 3.46Å; P61-Q64 VanDerWaalsContact O-N 3.13Å
62T57.1Low59.6Low96 Ų96107.4 Ų107.459%0.58960%0.604SS**THydrogen-bonded Turntrans-72.3-1.6-17348.80000114.4I60 Q64 V65I60-T62 PolarHBondContact O-N 2.91Å; T62-Q64 VanDerWaalsContact C-N 3.25Å; T62-V65 HydrophobicContact CG2-CG2 4.29Å; T62-V65 VanDerWaalsContact O-CG2 3.27Å; T62-V65 WeakPolarHBondContact O-CG2 3.39Å
63E59Low58.6Low192 Ų192103.4 Ų103.490%0.89759%0.588SS**THydrogen-bonded Turntrans-76.2-13.6168.2-72.9-167.8156.400112.7P61P61-E63 PolarHBondContact O-N 3.09Å; P61-E63 VanDerWaalsContact O-N 3.13Å
64Q54.7Low57.7Low122 Ų122109.1 Ų109.157%0.5761%0.608SS**THydrogen-bonded Turntrans-112-9.7176.8-76.5169.616.700114.1P61 T62 N66 E67 L68P61-Q64 PolarHBondContact O-N 3.46Å; P61-Q64 VanDerWaalsContact O-N 3.13Å; T62-Q64 VanDerWaalsContact C-N 3.25Å; Q64-N66 PolarHBondContact O-N 3.07Å; Q64-E67 PolarHBondContact O-N 2.91Å; Q64-E67 VanDerWaalsContact O-N 3.08Å; Q64-L68 HydrophobicContact CB-CD1 4.16Å; Q64-L68 WeakPolarHBondContact O-CD1 3.44Å
65V52.3Low57.2Low73 Ų73113 Ų11344%0.44264%0.636SS.*G310 helixtrans-64-23.6-178.1-70.10000114.2I60 T62 E67 L68I60-V65 HydrophobicContact CG2-CG1 4.25Å; T62-V65 HydrophobicContact CG2-CG2 4.29Å; T62-V65 VanDerWaalsContact O-CG2 3.27Å; T62-V65 WeakPolarHBondContact O-CG2 3.39Å; V65-E67 PolarHBondContact O-N 3.37Å; V65-L68 PolarHBondContact O-N 2.85Å
66N46.8Very low56.6Low162 Ų162108.1 Ų108.187%0.86662%0.615SS**G310 helixtrans-75.3-8.9177.7-127.228.3000113.3Q64Q64-N66 PolarHBondContact O-N 3.07Å
67E50.3Low55.8Low170 Ų170113.9 Ų113.979%0.79463%0.627SS**G310 helixtrans-114.914.5173-155.5-175.5162.600111.5Q64 V65Q64-E67 PolarHBondContact O-N 2.91Å; Q64-E67 VanDerWaalsContact O-N 3.08Å; V65-E67 PolarHBondContact O-N 3.37Å
68L53.2Low54.9Low61 Ų61119.6 Ų119.632%0.31964%0.636SS.*  trans-110.554.2175.9-89.382.9000110.9T53 I60 Q64 V65 A70 L71T53-L68 HydrophobicContact CG2-CD2 4.34Å; I60-L68 HydrophobicContact CG2-CD2 4.43Å; Q64-L68 HydrophobicContact CB-CD1 4.16Å; Q64-L68 WeakPolarHBondContact O-CD1 3.44Å; V65-L68 PolarHBondContact O-N 2.85Å; L68-A70 PolarHBondContact O-N 3.14Å; L68-L71 HydrophobicContact CD1-CD1 4.36Å; L68-L71 HydrophobicContact CD2-CD1 3.66Å; L68-L71 HydrophobicContact CG-CD1 3.66Å; L68-L71 HydrophobicContact CG-CG 4.25Å
69V51Low54.2Low138 Ų138122.3 Ų122.384%0.83663%0.634SS**SBendtrans-84.990.5161.8-177.50000107.2
70A57Low53.7Low78 Ų78124.6 Ų124.665%0.64564%0.641SS**  trans56.685.8176.300000115.7L68 I72L68-A70 PolarHBondContact O-N 3.14Å; A70-I72 PolarHBondContact O-N 2.9Å
71L56.7Low53.5Low123 Ų123123.5 Ų123.564%0.64464%0.638SS**  trans-71.782161.7-74.5165.9000109.7L68 P73L68-L71 HydrophobicContact CD1-CD1 4.36Å; L68-L71 HydrophobicContact CD2-CD1 3.66Å; L68-L71 HydrophobicContact CG-CD1 3.66Å; L68-L71 HydrophobicContact CG-CG 4.25Å; L71-P73 WeakPolarHBondContact O-CD 3.26Å
72I55.4Low53.3Low106 Ų106127 Ų12754%0.54465%0.648SS.*  trans-70115.4156-61.2167.2000104.9A70 H74 D76 L79A70-I72 PolarHBondContact O-N 2.9Å; I72-H74 PolarHBondContact O-N 3.42Å; I72-D76 HydrophobicContact CG2-CB 4.3Å; I72-D76 VanDerWaalsContact CG2-OD2 3.26Å; I72-D76 WeakPolarHBondContact CG2-OD2 3.28Å; I72-L79 HydrophobicContact CG2-CD1 4.24Å; I72-L79 HydrophobicContact CG2-CD2 4.49Å
73P45.4Very low53.9Low75 Ų75130.6 Ų130.649%0.48765%0.651SS.*  trans-54.5134.4-174.516-26.4000110.8L71 S75 D76L71-P73 WeakPolarHBondContact O-CD 3.26Å; P73-S75 PolarHBondContact O-N 3.29Å; P73-D76 HydrophobicContact CG-CB 4.24Å; P73-D76 WeakPolarHBondContact O-CB 3.46Å; P73-D76 PolarHBondContact O-N 3.34Å
74H46.6Very low54.8Low196 Ų196125.1 Ų125.191%0.90763%0.631SS**THydrogen-bonded Turntrans-58.3-10.6179.3-176.1-86.2000113.5I72I72-H74 PolarHBondContact O-N 3.42Å
75S52.5Low55.9Low109 Ų109126.9 Ų126.976%0.76264%0.637SS**THydrogen-bonded Turntrans-121.638.5174.6-61.10000112.1P73 Q77P73-S75 PolarHBondContact O-N 3.29Å; S75-Q77 PolarHBondContact O-N 3.48Å; S75-Q77 VanDerWaalsContact O-N 3.09Å
76D56Low57.4Low51 Ų51129.2 Ų129.227%0.27364%0.643SS.*  trans-63.8112.6174.3-129.7-23.5000109.8I72 P73 R78 L79 R80I72-D76 HydrophobicContact CG2-CB 4.3Å; I72-D76 VanDerWaalsContact CG2-OD2 3.26Å; I72-D76 WeakPolarHBondContact CG2-OD2 3.28Å; P73-D76 HydrophobicContact CG-CB 4.24Å; P73-D76 WeakPolarHBondContact O-CB 3.46Å; P73-D76 PolarHBondContact O-N 3.34Å; D76-R78 PolarHBondContact O-N 3.07Å; D76-R78 VanDerWaalsContact O-N 3.14Å; D76-L79 HydrophobicContact CB-CB 4.11Å; D76-L79 HydrophobicContact CB-CD1 4.09Å; D76-L79 WeakPolarHBondContact O-CA 2.94Å; D76-L79 WeakPolarHBondContact O-CB 3.42Å; D76-L79 PolarHBondContact O-N 3.2Å; D76-R80 PolarHBondContact O-N 3.25Å
77Q50.6Low59.3Low177 Ų177129 Ų12983%0.82763%0.631SS**THydrogen-bonded Turntrans-69.3-11.4-178-162.3145.24.700112.3S75S75-Q77 PolarHBondContact O-N 3.48Å; S75-Q77 VanDerWaalsContact O-N 3.09Å
78R51.1Low61.2Low226 Ų226124.4 Ų124.485%0.85361%0.614SS**THydrogen-bonded Turntrans-74.5-30.7164.6-67.7-17273.7-158.72.8113.3D76 R80D76-R78 PolarHBondContact O-N 3.07Å; D76-R78 VanDerWaalsContact O-N 3.14Å; R78-R80 VanDerWaalsContact C-N 3.3Å
79L52.3Low63Low126 Ų126127.1 Ų127.166%0.6663%0.628SS**THydrogen-bonded Turntrans-82-7.2175.8-100.574.2000113.4I72 D76 P81I72-L79 HydrophobicContact CG2-CD1 4.24Å; I72-L79 HydrophobicContact CG2-CD2 4.49Å; D76-L79 HydrophobicContact CB-CB 4.11Å; D76-L79 HydrophobicContact CB-CD1 4.09Å; D76-L79 WeakPolarHBondContact O-CA 2.94Å; D76-L79 WeakPolarHBondContact O-CB 3.42Å; D76-L79 PolarHBondContact O-N 3.2Å; L79-P81 WeakPolarHBondContact O-CD 3.14Å
80R51.7Low65Low198 Ų198125.1 Ų125.175%0.74761%0.612SS**  trans-106.468.2177.2-137.2-177-158.8-158.46.7111.1D76 R78 Q82D76-R80 PolarHBondContact O-N 3.25Å; R78-R80 VanDerWaalsContact C-N 3.3Å; R80-Q82 VanDerWaalsContact C-N 3.31Å; R80-Q82 PolarHBondContact O-N 3.49Å
81P60.1Low66.8Low43 Ų43124.4 Ų124.428%0.27960%0.603SS.*  trans-83.384.5-178.937.5-35.8000108.9L79 R83 T84 K85L79-P81 WeakPolarHBondContact O-CD 3.14Å; P81-R83 PolarHBondContact O-N 3.43Å; P81-T84 WeakPolarHBondContact CB-OG1 3.44Å; P81-T84 PolarHBondContact O-N 3.26Å; P81-K85 PolarHBondContact O-N 3.39Å
82Q59.9Low68.7Low144 Ų144123 Ų12367%0.67360%0.595SS**Hα-helixtrans-54.9-33.8170.2-77.6-176.1-18.200111.1R80R80-Q82 VanDerWaalsContact C-N 3.31Å; R80-Q82 PolarHBondContact O-N 3.49Å
83R70Confident70.7Confident173 Ų173122.2 Ų122.265%0.65359%0.591SS**Hα-helixtrans-76.3-43.7176.1-57.3-63.8-177.21651.5112.8P81 K85 Q86 Y87P81-R83 PolarHBondContact O-N 3.43Å; R83-K85 VanDerWaalsContact C-N 3.31Å; R83-K85 PolarHBondContact O-N 3.03Å; R83-Q86 WeakPolarHBondContact O-CB 3.24Å; R83-Q86 PolarHBondContact O-N 2.89Å; R83-Y87 HydrophobicContact CB-CD2 4.34Å; R83-Y87 HydrophobicContact CB-CE2 3.92Å; R83-Y87 WeakPolarHBondContact O-CD2 3.46Å; R83-Y87 PolarHBondContact O-N 3.4Å
84T76.4Confident73.1Confident76 Ų76123.7 Ų123.747%0.46660%0.595SS.*Hα-helixtrans-64.3-32.6178.4-45.40000112.6P81 Q86 Y87 V88P81-T84 WeakPolarHBondContact CB-OG1 3.44Å; P81-T84 PolarHBondContact O-N 3.26Å; T84-Q86 VanDerWaalsContact C-N 3.33Å; T84-Q86 PolarHBondContact O-N 3.39Å; T84-Y87 PolarHBondContact O-N 3Å; T84-V88 HydrophobicContact CG2-CG2 4.18Å; T84-V88 WeakPolarHBondContact O-CB 3.46Å; T84-V88 VanDerWaalsContact O-CG2 3.25Å; T84-V88 WeakPolarHBondContact O-CG2 3.39Å; T84-V88 PolarHBondContact O-N 3.32Å
85K79.1Confident75.4Confident159 Ų159118.3 Ų118.369%0.69158%0.578SS**Hα-helixtrans-59.2-42.9170.3-73-173.3178.7-173.20112.3P81 R83 L89P81-K85 PolarHBondContact O-N 3.39Å; R83-K85 VanDerWaalsContact C-N 3.31Å; R83-K85 PolarHBondContact O-N 3.03Å; K85-L89 VanDerWaalsContact O-CB 3.32Å; K85-L89 WeakPolarHBondContact O-CB 3.32Å; K85-L89 PolarHBondContact O-N 3.05Å
86Q83.8Confident77.5Confident122 Ų122118.4 Ų118.457%0.5757%0.569SS**Hα-helixtrans-66.7-42.6176-69.2178.7-1600111.8R83 T84 L89 L90R83-Q86 WeakPolarHBondContact O-CB 3.24Å; R83-Q86 PolarHBondContact O-N 2.89Å; T84-Q86 VanDerWaalsContact C-N 3.33Å; T84-Q86 PolarHBondContact O-N 3.39Å; Q86-L89 PolarHBondContact O-N 3.05Å; Q86-L90 VanDerWaalsContact O-CB 3.24Å; Q86-L90 WeakPolarHBondContact O-CB 3.25Å; Q86-L90 PolarHBondContact O-N 3.36Å
87Y86.3Confident79.3Confident159 Ų159120.8 Ų120.862%0.62458%0.582SS**Hα-helixtrans-63.5-41.9177.4-69.7-65.7000112.8R83 T84 L90 S91R83-Y87 HydrophobicContact CB-CD2 4.34Å; R83-Y87 HydrophobicContact CB-CE2 3.92Å; R83-Y87 WeakPolarHBondContact O-CD2 3.46Å; R83-Y87 PolarHBondContact O-N 3.4Å; T84-Y87 PolarHBondContact O-N 3Å; Y87-L90 PolarHBondContact O-N 2.91Å; Y87-S91 WeakPolarHBondContact O-CB 3.44Å; Y87-S91 PolarHBondContact O-N 2.84Å; Y87-S91 PolarHBondContact O-OG 2.88Å
88V90.4Very high81.4Confident73 Ų73114.9 Ų114.944%0.44256%0.564SS.*Hα-helixtrans-67.3-41.6176.9173.70000110.9T84 S91 I92T84-V88 HydrophobicContact CG2-CG2 4.18Å; T84-V88 WeakPolarHBondContact O-CB 3.46Å; T84-V88 VanDerWaalsContact O-CG2 3.25Å; T84-V88 WeakPolarHBondContact O-CG2 3.39Å; T84-V88 PolarHBondContact O-N 3.32Å; V88-S91 PolarHBondContact O-N 3.45Å; V88-S91 PolarHBondContact O-OG 2.83Å; V88-I92 HydrophobicContact CG1-CD1 3.92Å; V88-I92 WeakPolarHBondContact O-CD1 3.28Å; V88-I92 VanDerWaalsContact O-CG1 3.24Å; V88-I92 WeakPolarHBondContact O-CG1 3.02Å; V88-I92 PolarHBondContact O-N 2.98Å
89L91.1Very high83.4Confident117 Ų117106.7 Ų106.761%0.61354%0.541SS*.Hα-helixtrans-64.5-43.4175.7-167.3156.1000111.1K85 Q86 S91 I92 L93K85-L89 VanDerWaalsContact O-CB 3.32Å; K85-L89 WeakPolarHBondContact O-CB 3.32Å; K85-L89 PolarHBondContact O-N 3.05Å; Q86-L89 PolarHBondContact O-N 3.05Å; L89-S91 VanDerWaalsContact C-N 3.35Å; L89-S91 PolarHBondContact O-N 2.86Å; L89-I92 PolarHBondContact O-N 3.46Å; L89-L93 WeakPolarHBondContact O-CB 3.24Å; L89-L93 PolarHBondContact O-N 2.91Å
90L93.1Very high85.2Confident96 Ų96102.5 Ų102.550%0.50353%0.528SS..Hα-helixtrans-62.7-40.5177.2-164.485.2000111.6Q86 Y87 L93 L94Q86-L90 VanDerWaalsContact O-CB 3.24Å; Q86-L90 WeakPolarHBondContact O-CB 3.25Å; Q86-L90 PolarHBondContact O-N 3.36Å; Y87-L90 PolarHBondContact O-N 2.91Å; L90-L93 PolarHBondContact O-N 3.26Å; L90-L94 HydrophobicContact CD2-CD1 4.25Å; L90-L94 HydrophobicContact CG-CD1 4.14Å; L90-L94 WeakPolarHBondContact O-CB 3.4Å; L90-L94 PolarHBondContact O-N 2.87Å
91S94.9Very high86.8Confident63 Ų6397.7 Ų97.744%0.44152%0.517SS..Hα-helixtrans-67.7-41.2178.469.30000111.9Y87 V88 L89 L94 C95Y87-S91 WeakPolarHBondContact O-CB 3.44Å; Y87-S91 PolarHBondContact O-N 2.84Å; Y87-S91 PolarHBondContact O-OG 2.88Å; V88-S91 PolarHBondContact O-N 3.45Å; V88-S91 PolarHBondContact O-OG 2.83Å; L89-S91 VanDerWaalsContact C-N 3.35Å; L89-S91 PolarHBondContact O-N 2.86Å; S91-L94 PolarHBondContact O-N 3.48Å; S91-C95 WeakPolarHBondContact O-CB 3.2Å; S91-C95 PolarHBondContact O-N 3.47Å
92I96.5Very high88.1Confident93 Ų9399.6 Ų99.648%0.47753%0.527SS..Hα-helixtrans-61.1-47.3173.3-66.7164.6000109.8V88 L89 C95 L96V88-I92 HydrophobicContact CG1-CD1 3.92Å; V88-I92 WeakPolarHBondContact O-CD1 3.28Å; V88-I92 VanDerWaalsContact O-CG1 3.24Å; V88-I92 WeakPolarHBondContact O-CG1 3.02Å; V88-I92 PolarHBondContact O-N 2.98Å; L89-I92 PolarHBondContact O-N 3.46Å; I92-C95 PolarHBondContact O-N 3.39Å; I92-L96 HydrophobicContact CG2-CD1 3.89Å; I92-L96 HydrophobicContact CG2-CG 4.26Å; I92-L96 WeakPolarHBondContact O-CB 3.4Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.3Å; I92-L96 PolarHBondContact O-N 2.89Å
93L96.1Very high89.3Confident90 Ų9096.1 Ų96.147%0.47152%0.515SS..Hα-helixtrans-61-47.2179.2-173.272.1000111.9L89 L90 C95 L96 L97L89-L93 WeakPolarHBondContact O-CB 3.24Å; L89-L93 PolarHBondContact O-N 2.91Å; L90-L93 PolarHBondContact O-N 3.26Å; L93-C95 VanDerWaalsContact C-N 3.32Å; L93-C95 PolarHBondContact O-N 3.39Å; L93-L96 PolarHBondContact O-N 3.44Å; L93-L97 HydrophobicContact CG-CD1 4.15Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.27Å; L93-L97 PolarHBondContact O-N 3.4Å
94L96.3Very high89.8Confident107 Ų10794.6 Ų94.656%0.5651%0.514SS*.Hα-helixtrans-61-41.1175.9-90.4159.2000111.9L90 S91 L97 A98L90-L94 HydrophobicContact CD2-CD1 4.25Å; L90-L94 HydrophobicContact CG-CD1 4.14Å; L90-L94 WeakPolarHBondContact O-CB 3.4Å; L90-L94 PolarHBondContact O-N 2.87Å; S91-L94 PolarHBondContact O-N 3.48Å; L94-L97 PolarHBondContact O-N 3.15Å; L94-A98 VanDerWaalsContact O-CB 3.29Å; L94-A98 WeakPolarHBondContact O-CB 3.43Å; L94-A98 PolarHBondContact O-N 3.36Å
95C95.9Very high89.7Confident83 Ų8395.8 Ų95.856%0.56151%0.513SS*.Hα-helixtrans-66.5-43.9177.5-174.60000111.7S91 I92 L93 L97 A98 S99S91-C95 WeakPolarHBondContact O-CB 3.2Å; S91-C95 PolarHBondContact O-N 3.47Å; I92-C95 PolarHBondContact O-N 3.39Å; L93-C95 VanDerWaalsContact C-N 3.32Å; L93-C95 PolarHBondContact O-N 3.39Å; C95-L97 VanDerWaalsContact C-N 3.35Å; C95-A98 PolarHBondContact O-N 2.8Å; C95-S99 VanDerWaalsContact O-CB 3.3Å; C95-S99 WeakPolarHBondContact O-CB 3.39Å; C95-S99 PolarHBondContact O-N 2.86Å; C95-S99 PolarHBondContact O-OG 2.85Å
96L95Very high89.3Confident110 Ų11094.1 Ų94.158%0.57651%0.511SS*.Hα-helixtrans-62.9-40.7174.9-71.7175.6000111.8I92 L93 S99 G100I92-L96 HydrophobicContact CG2-CD1 3.89Å; I92-L96 HydrophobicContact CG2-CG 4.26Å; I92-L96 WeakPolarHBondContact O-CB 3.4Å; I92-L96 VanDerWaalsContact O-CG 3.28Å; I92-L96 WeakPolarHBondContact O-CG 3.3Å; I92-L96 PolarHBondContact O-N 2.89Å; L93-L96 PolarHBondContact O-N 3.44Å; L96-S99 WeakPolarHBondContact CA-OG 3.22Å; L96-S99 PolarHBondContact O-OG 3.45Å; L96-G100 WeakPolarHBondContact O-CA 3.29Å; L96-G100 PolarHBondContact O-N 2.7Å
97L94.9Very high88.5Confident101 Ų10195.3 Ų95.353%0.52951%0.514SS..Hα-helixtrans-65.8-48.3175.4-73.7170.5000111.4L93 L94 C95 G100 L101L93-L97 HydrophobicContact CG-CD1 4.15Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.27Å; L93-L97 PolarHBondContact O-N 3.4Å; L94-L97 PolarHBondContact O-N 3.15Å; C95-L97 VanDerWaalsContact C-N 3.35Å; L97-G100 PolarHBondContact O-N 3.33Å; L97-L101 WeakPolarHBondContact O-CB 3.21Å; L97-L101 WeakPolarHBondContact O-CG 3.42Å; L97-L101 PolarHBondContact O-N 2.71Å
98A94.6Very high87.4Confident54 Ų5491.8 Ų91.845%0.44651%0.511SS..Hα-helixtrans-62.6-46.8179.700000111.8L94 C95 L101 V102L94-A98 VanDerWaalsContact O-CB 3.29Å; L94-A98 WeakPolarHBondContact O-CB 3.43Å; L94-A98 PolarHBondContact O-N 3.36Å; C95-A98 PolarHBondContact O-N 2.8Å; A98-L101 PolarHBondContact O-N 2.82Å; A98-V102 VanDerWaalsContact O-CG2 3.29Å; A98-V102 WeakPolarHBondContact O-CG2 3.5Å; A98-V102 PolarHBondContact O-N 2.81Å
99S93.7Very high86.4Confident54 Ų5493.6 Ų93.638%0.37851%0.514SS..Hα-helixtrans-65.4-41.8175.756.40000111.9C95 L96 L101 V102 V103C95-S99 VanDerWaalsContact O-CB 3.3Å; C95-S99 WeakPolarHBondContact O-CB 3.39Å; C95-S99 PolarHBondContact O-N 2.86Å; C95-S99 PolarHBondContact O-OG 2.85Å; L96-S99 WeakPolarHBondContact CA-OG 3.22Å; L96-S99 PolarHBondContact O-OG 3.45Å; S99-L101 VanDerWaalsContact C-N 3.34Å; S99-L101 PolarHBondContact O-N 2.83Å; S99-V102 PolarHBondContact O-N 3.41Å; S99-V103 VanDerWaalsContact O-CB 3.27Å; S99-V103 WeakPolarHBondContact O-CB 3.27Å; S99-V103 WeakPolarHBondContact O-CG2 3.15Å; S99-V103 PolarHBondContact O-N 3.3Å
100G88.6Confident84.8Confident37 Ų3792.3 Ų92.338%0.38152%0.515SS..Hα-helixtrans-60.8-40.8174.800000112.7L96 L97 V103 F104L96-G100 WeakPolarHBondContact O-CA 3.29Å; L96-G100 PolarHBondContact O-N 2.7Å; L97-G100 PolarHBondContact O-N 3.33Å; G100-V103 PolarHBondContact O-N 3.46Å; G100-F104 WeakPolarHBondContact O-CB 3.2Å; G100-F104 PolarHBondContact O-N 2.96Å
101L86.8Confident83.3Confident98 Ų9890.4 Ų90.451%0.51351%0.508SS..Hα-helixtrans-64.7-48.8173.9-73.2170.6000111.1L97 A98 S99 V103 F104 F105L97-L101 WeakPolarHBondContact O-CB 3.21Å; L97-L101 WeakPolarHBondContact O-CG 3.42Å; L97-L101 PolarHBondContact O-N 2.71Å; A98-L101 PolarHBondContact O-N 2.82Å; S99-L101 VanDerWaalsContact C-N 3.34Å; S99-L101 PolarHBondContact O-N 2.83Å; L101-V103 VanDerWaalsContact C-N 3.29Å; L101-V103 PolarHBondContact O-N 2.77Å; L101-F104 PolarHBondContact O-N 2.84Å; L101-F104 VanDerWaalsContact O-N 3.17Å; L101-F105 HydrophobicContact CB-CD2 4.41Å; L101-F105 HydrophobicContact CB-CE2 4.4Å; L101-F105 HydrophobicContact CD2-CE2 4.33Å; L101-F105 WeakPolarHBondContact O-CD2 3.35Å; L101-F105 PolarHBondContact O-N 3.41Å
102V86.6Confident81.9Confident83 Ų8391.8 Ų91.850%0.50351%0.509SS..Hα-helixtrans-56.9-46.5176.8168.20000110.5A98 S99 F105 L106A98-V102 VanDerWaalsContact O-CG2 3.29Å; A98-V102 WeakPolarHBondContact O-CG2 3.5Å; A98-V102 PolarHBondContact O-N 2.81Å; S99-V102 PolarHBondContact O-N 3.41Å; V102-F105 PolarHBondContact O-N 3.38Å; V102-L106 HydrophobicContact CG1-CD1 3.45Å; V102-L106 VanDerWaalsContact CG1-CD1 3.45Å; V102-L106 HydrophobicContact CG1-CG 4.24Å; V102-L106 WeakPolarHBondContact O-CB 3.23Å; V102-L106 WeakPolarHBondContact O-CG 3.28Å; V102-L106 PolarHBondContact O-N 3.49Å
103V85.6Confident80.3Confident70 Ų7091.3 Ų91.342%0.42451%0.511SS..Hα-helixtrans-64.6-42177.1169.30000111S99 G100 L101 L106 F107S99-V103 VanDerWaalsContact O-CB 3.27Å; S99-V103 WeakPolarHBondContact O-CB 3.27Å; S99-V103 WeakPolarHBondContact O-CG2 3.15Å; S99-V103 PolarHBondContact O-N 3.3Å; G100-V103 PolarHBondContact O-N 3.46Å; L101-V103 VanDerWaalsContact C-N 3.29Å; L101-V103 PolarHBondContact O-N 2.77Å; V103-L106 CarbonylContact O-C 3.59Å; V103-L106 PolarHBondContact O-N 3.17Å; V103-F107 HydrophobicContact CG1-CD2 3.3Å; V103-F107 HydrophobicContact CG1-CE2 3.33Å; V103-F107 WeakPolarHBondContact O-CA 3.29Å; V103-F107 VanDerWaalsContact O-CB 3.28Å; V103-F107 WeakPolarHBondContact O-CB 3.18Å; V103-F107 VanDerWaalsContact O-CD2 3.23Å; V103-F107 WeakPolarHBondContact O-CD2 3.05Å; V103-F107 PolarHBondContact O-N 3.4Å
104F80.8Confident79Confident141 Ų14189.8 Ų89.862%0.61850%0.503SS*.Hα-helixtrans-63.5-41.3176.3177.6-96.8000112.8G100 L101G100-F104 WeakPolarHBondContact O-CB 3.2Å; G100-F104 PolarHBondContact O-N 2.96Å; L101-F104 PolarHBondContact O-N 2.84Å; L101-F104 VanDerWaalsContact O-N 3.17Å
105F73.8Confident77.4Confident101 Ų10189.3 Ų89.344%0.44350%0.501SS..Hα-helixtrans-72.7-33.5175.3-75.7-66.4000112.7L101 V102 F147L101-F105 HydrophobicContact CB-CD2 4.41Å; L101-F105 HydrophobicContact CB-CE2 4.4Å; L101-F105 HydrophobicContact CD2-CE2 4.33Å; L101-F105 WeakPolarHBondContact O-CD2 3.35Å; L101-F105 PolarHBondContact O-N 3.41Å; V102-F105 PolarHBondContact O-N 3.38Å; F105-F147 AromaticContact CD1-CD2 3.89Å; F105-F147 HydrophobicContact CD1-CD2 3.89Å; F105-F147 HydrophobicContact CD1-CE2 4.08Å; F105-F147 HydrophobicContact CD1-CG 4.37Å; F105-F147 HydrophobicContact CE1-CD2 4.09Å; F105-F147 HydrophobicContact CE1-CE1 4.49Å; F105-F147 AromaticContact CE1-CE2 3.93Å; F105-F147 HydrophobicContact CE1-CE2 3.93Å; F105-F147 HydrophobicContact CE1-CG 4.44Å; F105-F147 HydrophobicContact CE1-CZ 4.15Å
106L70.8Confident75.9Confident125 Ų12589.4 Ų89.465%0.65450%0.496SS*.Hα-helixtrans-80.2-27176.9-72.7171000112.7V102 V103 P108V102-L106 HydrophobicContact CG1-CD1 3.45Å; V102-L106 VanDerWaalsContact CG1-CD1 3.45Å; V102-L106 HydrophobicContact CG1-CG 4.24Å; V102-L106 WeakPolarHBondContact O-CB 3.23Å; V102-L106 WeakPolarHBondContact O-CG 3.28Å; V102-L106 PolarHBondContact O-N 3.49Å; V103-L106 CarbonylContact O-C 3.59Å; V103-L106 PolarHBondContact O-N 3.17Å; L106-P108 VanDerWaalsContact O-CD 3.25Å; L106-P108 WeakPolarHBondContact O-CD 3.4Å; L106-P108 VanDerWaalsContact O-N 3.15Å
107F67.7Low74.5Confident146 Ų14685.5 Ų85.564%0.6448%0.482SS*.SBendtrans-66.1114.9173.8-100.8-72.6000107.4V103 H109V103-F107 HydrophobicContact CG1-CD2 3.3Å; V103-F107 HydrophobicContact CG1-CE2 3.33Å; V103-F107 WeakPolarHBondContact O-CA 3.29Å; V103-F107 VanDerWaalsContact O-CB 3.28Å; V103-F107 WeakPolarHBondContact O-CB 3.18Å; V103-F107 VanDerWaalsContact O-CD2 3.23Å; V103-F107 WeakPolarHBondContact O-CD2 3.05Å; V103-F107 PolarHBondContact O-N 3.4Å; F107-H109 PolarHBondContact O-N 3.4Å
108P62.1Low73.3Confident86 Ų8686 Ų8656%0.55849%0.485SS*.  trans-62.4109.8-176.324.5-32.7000108.7L106 S110 Y148L106-P108 VanDerWaalsContact O-CD 3.25Å; L106-P108 WeakPolarHBondContact O-CD 3.4Å; L106-P108 VanDerWaalsContact O-N 3.15Å; P108-S110 PolarHBondContact O-N 3.37Å; P108-Y148 WeakPolarHBondContact CB-OH 3.25Å
109H68.7Low72.2Confident110 Ų11089 Ų8951%0.50949%0.488SS..PPolyproline II helixtrans-61.7132.3167.9-169.3-100.2000107.8F107 V111 S145F107-H109 PolarHBondContact O-N 3.4Å; H109-V111 PolarHBondContact O-N 2.93Å; H109-S145 PolarHBondContact CE1-OG 3.19Å; H109-S145 WeakPolarHBondContact ND1-CB 3.36Å; H109-S145 PolarHBondContact ND1-OG 3.04Å
110S58.8Low71Confident90 Ų9089.6 Ų89.663%0.62949%0.488SS*.PPolyproline II helixtrans-60.7125.3-174.354.10000110.3P108 L112 S145P108-S110 PolarHBondContact O-N 3.37Å; S110-L112 PolarHBondContact O-N 3.27Å; S110-S145 PolarHBondContact O-OG 2.78Å; S110-S145 VanDerWaalsContact O-OG 3.04Å
111V61.1Low70.3Confident57 Ų5791.5 Ų91.535%0.34549%0.492SS..PPolyproline II helixtrans-64120.7173.4179.40000107.9H109 V113 I142 V150H109-V111 PolarHBondContact O-N 2.93Å; V111-V113 PolarHBondContact O-N 2.88Å; V111-I142 HydrophobicContact CG1-CG2 3.83Å; V111-V150 HydrophobicContact CG2-CG2 4.47Å
112L66.1Low69.9Low91 Ų9193.3 Ų93.348%0.47650%0.496SS..EExtended strand (participates in β ladder)trans-88109-177-171130.2000108.6S110 D114 R143S110-L112 PolarHBondContact O-N 3.27Å; L112-D114 HydrophobicContact CD2-CB 4.35Å; L112-R143 PolarHBondContact N-O 3.24Å; L112-R143 VanDerWaalsContact N-O 3.07Å; L112-R143 WeakPolarHBondContact O-CA 3.33Å; L112-R143 PolarHBondContact O-N 2.83Å; L112-R143 VanDerWaalsContact O-O 3.12Å
113V62.3Low69.6Low83 Ų8392.6 Ų92.650%0.50349%0.492SS..EExtended strand (participates in β ladder)trans-89.9113.8173.2-176.10000107.5V111 L140 I142V111-V113 PolarHBondContact O-N 2.88Å; V113-L140 HydrophobicContact CG1-CD2 4.31Å; V113-I142 HydrophobicContact CG1-CG1 4.36Å
114D68.1Low69.5Low58 Ų5892.1 Ų92.131%0.3149%0.489SS..EExtended strand (participates in β ladder)trans-97.3116.6175.3-158.329.4000107.8L112 D116 K141 R143L112-D114 HydrophobicContact CD2-CB 4.35Å; D114-D116 PolarHBondContact O-N 3.25Å; D114-K141 HydrophobicContact CB-CB 4.31Å; D114-K141 WeakPolarHBondContact CB-O 3.49Å; D114-K141 PolarHBondContact N-O 2.79Å; D114-K141 CarbonylContact O-C 3.57Å; D114-K141 WeakPolarHBondContact O-CA 3.2Å; D114-K141 WeakPolarHBondContact O-CB 2.87Å; D114-K141 PolarHBondContact O-N 2.97Å; D114-K141 VanDerWaalsContact O-O 3.08Å; D114-R143 IonicContact OD1-NH2 3.78Å; D114-R143 IonicContact OD2-CZ 2.71Å; D114-R143 IonicContact OD2-NH1 3.43Å; D114-R143 IonicContact OD2-NH2 3.74Å; D114-R143 PolarHBondContact OD2-NH2 2.84Å
115D64.1Low69.5Low98 Ų9892.1 Ų92.152%0.52449%0.489SS..EExtended strand (participates in β ladder)trans-84.6112.5172.5-163.6-41.9000107.4G117D115-G117 PolarHBondContact O-N 3.01Å; D115-G117 WeakPolarHBondContact OD1-CA 2.98Å; D115-G117 PolarHBondContact OD1-N 2.89Å
116D63.7Low70Confident84 Ų8489.4 Ų89.445%0.44948%0.479SS..EExtended strand (participates in β ladder)trans-80.612.5177.4-157.929.3000111.2D114 K119 T139D114-D116 PolarHBondContact O-N 3.25Å; D116-K119 WeakPolarHBondContact OD2-CE 3.49Å; D116-K119 IonicContact OD2-NZ 2.71Å; D116-K119 PolarHBondContact OD2-NZ 3.42Å; D116-T139 PolarHBondContact N-O 3.49Å; D116-T139 VanDerWaalsContact N-O 3.13Å
117G66.4Low70.4Confident28 Ų2892.9 Ų92.929%0.28949%0.489SS..EExtended strand (participates in β ladder)trans78.9-175.6176.100000114.4D115 K119 T139D115-G117 PolarHBondContact O-N 3.01Å; D115-G117 WeakPolarHBondContact OD1-CA 2.98Å; D115-G117 PolarHBondContact OD1-N 2.89Å; G117-K119 PolarHBondContact O-N 3.02Å; G117-T139 PolarHBondContact O-N 3.48Å
118I68.6Low71.1Confident113 Ų11394.5 Ų94.558%0.57950%0.499SS*.EExtended strand (participates in β ladder)trans-79.7106.9172.8-58.6169.6000107.6V121 I136I118-V121 HydrophobicContact CG2-CG2 3.52Å; I118-I136 HydrophobicContact CD1-CG2 4.48Å; I118-I136 HydrophobicContact CG1-CG2 4.41Å; I118-I136 HydrophobicContact CG2-CG2 3.68Å
119K71.1Confident72Confident117 Ų11794.9 Ų94.951%0.50950%0.496SS..EExtended strand (participates in β ladder)trans-78.3-34.3-178.8-69.8-160.9177.1-174.20113D116 G117 M137 T139D116-K119 WeakPolarHBondContact OD2-CE 3.49Å; D116-K119 IonicContact OD2-NZ 2.71Å; D116-K119 PolarHBondContact OD2-NZ 3.42Å; G117-K119 PolarHBondContact O-N 3.02Å; K119-M137 PolarHBondContact N-O 2.93Å; K119-T139 WeakPolarHBondContact CD-OG1 3.39Å
120V69.3Low72.7Confident65 Ų6595.1 Ų95.139%0.39451%0.51SS..EExtended strand (participates in β ladder)trans-146.2131.1-175.6-176.50000110.9M137V120-M137 HydrophobicContact CB-CB 4.31Å; V120-M137 HydrophobicContact CB-CE 3.63Å; V120-M137 HydrophobicContact CG1-CE 4.06Å; V120-M137 HydrophobicContact CG2-CE 3.64Å; V120-M137 PolarHBondContact N-O 3.38Å; V120-M137 PolarHBondContact O-N 2.89Å
121V73.2Confident73.8Confident77 Ų7795.8 Ų95.847%0.46751%0.506SS..EExtended strand (participates in β ladder)trans-120.6111.2166.3-177.10000107.7I118 V123 T135 I136I118-V121 HydrophobicContact CG2-CG2 3.52Å; V121-V123 HydrophobicContact CG1-CG2 4.19Å; V121-T135 CarbonylContact C-O 3.54Å; V121-T135 WeakPolarHBondContact CA-O 3.44Å; V121-I136 HydrophobicContact CG1-CG1 4.27Å; V121-I136 HydrophobicContact CG2-CG1 4.35Å; V121-I136 HydrophobicContact CG2-CG2 4.43Å
122K80Confident74.8Confident137 Ų13796.7 Ų96.760%0.59651%0.511SS*.EExtended strand (participates in β ladder)trans-100.7118.5174-173.5176.9-179.5177.90109T135K122-T135 PolarHBondContact N-O 2.93Å; K122-T135 PolarHBondContact O-N 3.03Å
123V79.9Confident75.5Confident67 Ų6796.6 Ų96.641%0.40651%0.511SS..EExtended strand (participates in β ladder)trans-100.9118.4177.4-171.20000108.7V121 F125 V132 L134V121-V123 HydrophobicContact CG1-CG2 4.19Å; V123-F125 HydrophobicContact CB-CE2 4.26Å; V123-F125 HydrophobicContact CG1-CD2 4.17Å; V123-F125 HydrophobicContact CG1-CE1 4.31Å; V123-F125 HydrophobicContact CG1-CE2 3.48Å; V123-F125 VanDerWaalsContact CG1-CE2 3.48Å; V123-F125 HydrophobicContact CG1-CZ 3.56Å; V123-V132 HydrophobicContact CG1-CG1 3.66Å; V123-L134 HydrophobicContact CG1-CG 4.48Å; V123-L134 HydrophobicContact CG2-CG 4.34Å
124T83.2Confident76.4Confident60 Ų6097.4 Ų97.437%0.36851%0.512SS..EExtended strand (participates in β ladder)trans-112.5121.4178.1-49.90000108.8I133T124-I133 PolarHBondContact N-O 3.1Å; T124-I133 PolarHBondContact O-N 2.98Å
125F80.4Confident77.1Confident141 Ų14198 Ų9862%0.61852%0.517SS*.EExtended strand (participates in β ladder)trans-97.8111.1176.8-65.5-87.2000109.3V123 V132V123-F125 HydrophobicContact CB-CE2 4.26Å; V123-F125 HydrophobicContact CG1-CD2 4.17Å; V123-F125 HydrophobicContact CG1-CE1 4.31Å; V123-F125 HydrophobicContact CG1-CE2 3.48Å; V123-F125 VanDerWaalsContact CG1-CE2 3.48Å; V123-F125 HydrophobicContact CG1-CZ 3.56Å; F125-V132 HydrophobicContact CD1-CB 4.38Å; F125-V132 HydrophobicContact CD1-CG1 3.95Å; F125-V132 HydrophobicContact CD1-CG2 3.7Å; F125-V132 HydrophobicContact CE1-CB 4.38Å; F125-V132 HydrophobicContact CE1-CG1 3.67Å; F125-V132 HydrophobicContact CE1-CG2 3.76Å; F125-V132 HydrophobicContact CZ-CG1 4.2Å
126N83.4Confident77.8Confident44 Ų4497.1 Ų97.124%0.23551%0.512CS..EExtended strand (participates in β ladder)trans-90.8105.3171.4-174.6-16.2000108.8Q128 D129 S130 L131N126-Q128 VanDerWaalsContact C-N 3.31Å; N126-Q128 PolarHBondContact O-N 3.07Å; N126-Q128 WeakPolarHBondContact OD1-CB 3Å; N126-Q128 PolarHBondContact OD1-N 3.47Å; N126-D129 PolarHBondContact ND2-OD2 2.93Å; N126-D129 PolarHBondContact OD1-N 3.44Å; N126-S130 WeakPolarHBondContact O-CA 3.49Å; N126-S130 PolarHBondContact O-N 3.34Å; N126-S130 VanDerWaalsContact O-N 3.09Å; N126-L131 PolarHBondContact N-O 3.36Å; N126-L131 PolarHBondContact O-N 2.71Å
127K80.8Confident78.5Confident199 Ų19998.3 Ų98.387%0.86552%0.516SS*.THydrogen-bonded Turntrans-71.9-22-179.2-68.8-174.1178.9-179.60113.5
128Q82.2Confident79.1Confident180 Ų18099.7 Ų99.784%0.84152%0.524SS*.THydrogen-bonded Turntrans-77-38.1-179-75.6151.3-19.600111.3N126N126-Q128 VanDerWaalsContact C-N 3.31Å; N126-Q128 PolarHBondContact O-N 3.07Å; N126-Q128 WeakPolarHBondContact OD1-CB 3Å; N126-Q128 PolarHBondContact OD1-N 3.47Å
129D81.1Confident79.4Confident94 Ų9497 Ų9750%0.50351%0.514SS..THydrogen-bonded Turntrans-101.8-0.1-178.4-56.6-45.2000113.1N126 L131N126-D129 PolarHBondContact ND2-OD2 2.93Å; N126-D129 PolarHBondContact OD1-N 3.44Å; D129-L131 HydrophobicContact CB-CB 4.34Å; D129-L131 HydrophobicContact CB-CD1 3.69Å; D129-L131 HydrophobicContact CB-CG 3.95Å; D129-L131 PolarHBondContact O-N 2.66Å; D129-L131 VanDerWaalsContact O-N 3.17Å
130S82.4Confident79.7Confident114 Ų11495.2 Ų95.280%0.79751%0.509SS*.THydrogen-bonded Turntrans5329.3-172.155.10000113.9N126N126-S130 WeakPolarHBondContact O-CA 3.49Å; N126-S130 PolarHBondContact O-N 3.34Å; N126-S130 VanDerWaalsContact O-N 3.09Å
131L82.3Confident80.1Confident104 Ų10497.1 Ų97.155%0.54551%0.512SS..EExtended strand (participates in β ladder)trans-102.7140.1-178.1-69.4168.2000111.3N126 D129N126-L131 PolarHBondContact N-O 3.36Å; N126-L131 PolarHBondContact O-N 2.71Å; D129-L131 HydrophobicContact CB-CB 4.34Å; D129-L131 HydrophobicContact CB-CD1 3.69Å; D129-L131 HydrophobicContact CB-CG 3.95Å; D129-L131 PolarHBondContact O-N 2.66Å; D129-L131 VanDerWaalsContact O-N 3.17Å
132V82.1Confident80.2Confident77 Ų7796.4 Ų96.447%0.46751%0.505SS..EExtended strand (participates in β ladder)trans-108.7115.1172.5-170.60000108.4V123 F125 L134V123-V132 HydrophobicContact CG1-CG1 3.66Å; F125-V132 HydrophobicContact CD1-CB 4.38Å; F125-V132 HydrophobicContact CD1-CG1 3.95Å; F125-V132 HydrophobicContact CD1-CG2 3.7Å; F125-V132 HydrophobicContact CE1-CB 4.38Å; F125-V132 HydrophobicContact CE1-CG1 3.67Å; F125-V132 HydrophobicContact CE1-CG2 3.76Å; F125-V132 HydrophobicContact CZ-CG1 4.2Å; V132-L134 HydrophobicContact CB-CD1 4.42Å; V132-L134 HydrophobicContact CG1-CD1 3.76Å
133I82Confident80Confident89 Ų8995.1 Ų95.146%0.45650%0.497SS..EExtended strand (participates in β ladder)trans-101117-180-58.4171.6000108.2T124T124-I133 PolarHBondContact N-O 3.1Å; T124-I133 PolarHBondContact O-N 2.98Å
134L81Confident79.9Confident100 Ų10093.7 Ų93.752%0.52449%0.487SS..EExtended strand (participates in β ladder)trans-102.4114.6174.9-7285.3000109.3V123 V132V123-L134 HydrophobicContact CG1-CG 4.48Å; V123-L134 HydrophobicContact CG2-CG 4.34Å; V132-L134 HydrophobicContact CB-CD1 4.42Å; V132-L134 HydrophobicContact CG1-CD1 3.76Å
135T82.5Confident79.5Confident71 Ų7193.2 Ų93.244%0.43649%0.486SS..EExtended strand (participates in β ladder)trans-99.4112.8172.6-52.40000108.9V121 K122V121-T135 CarbonylContact C-O 3.54Å; V121-T135 WeakPolarHBondContact CA-O 3.44Å; K122-T135 PolarHBondContact N-O 2.93Å; K122-T135 PolarHBondContact O-N 3.03Å
136I78.1Confident79.2Confident78 Ų7887.5 Ų87.540%0.446%0.462SS..EExtended strand (participates in β ladder)trans-109.1124.8-177.3-56.9173.7000108.3I118 V121I118-I136 HydrophobicContact CD1-CG2 4.48Å; I118-I136 HydrophobicContact CG1-CG2 4.41Å; I118-I136 HydrophobicContact CG2-CG2 3.68Å; V121-I136 HydrophobicContact CG1-CG1 4.27Å; V121-I136 HydrophobicContact CG2-CG1 4.35Å; V121-I136 HydrophobicContact CG2-CG2 4.43Å
137M78.8Confident78.6Confident109 Ų10993.3 Ų93.354%0.53749%0.485SS..EExtended strand (participates in β ladder)trans-110.5115.9171.8-63.8-163.5-6100109.9K119 V120K119-M137 PolarHBondContact N-O 2.93Å; V120-M137 HydrophobicContact CB-CB 4.31Å; V120-M137 HydrophobicContact CB-CE 3.63Å; V120-M137 HydrophobicContact CG1-CE 4.06Å; V120-M137 HydrophobicContact CG2-CE 3.64Å; V120-M137 PolarHBondContact N-O 3.38Å; V120-M137 PolarHBondContact O-N 2.89Å
138A78.6Confident78.2Confident57 Ų5789 Ų8947%0.47146%0.464SS..EExtended strand (participates in β ladder)trans-111.1138.9175.600000110.1
139T75.9Confident77.7Confident58 Ų5886.1 Ų86.136%0.35646%0.459SS..EExtended strand (participates in β ladder)trans-110.2112.4178.5-55.30000109.2D116 G117 K119D116-T139 PolarHBondContact N-O 3.49Å; D116-T139 VanDerWaalsContact N-O 3.13Å; G117-T139 PolarHBondContact O-N 3.48Å; K119-T139 WeakPolarHBondContact CD-OG1 3.39Å
140L77.1Confident77.4Confident78 Ų7883.8 Ų83.841%0.40845%0.448SS..EExtended strand (participates in β ladder)trans-96.1120.9172.7-78.887.9000109.9V113 L155V113-L140 HydrophobicContact CG1-CD2 4.31Å; L140-L155 HydrophobicContact CD2-CD1 4.37Å
141K77Confident77Confident106 Ų10680.9 Ų80.946%0.46143%0.431SS..EExtended strand (participates in β ladder)trans-102.9102.7178-175.9179-1771750109.7D114D114-K141 HydrophobicContact CB-CB 4.31Å; D114-K141 WeakPolarHBondContact CB-O 3.49Å; D114-K141 PolarHBondContact N-O 2.79Å; D114-K141 CarbonylContact O-C 3.57Å; D114-K141 WeakPolarHBondContact O-CA 3.2Å; D114-K141 WeakPolarHBondContact O-CB 2.87Å; D114-K141 PolarHBondContact O-N 2.97Å; D114-K141 VanDerWaalsContact O-O 3.08Å
142I76.1Confident76.7Confident62 Ų6277.6 Ų77.632%0.31842%0.415SS..EExtended strand (participates in β ladder)trans-86.8118.4179.3-57.1173.3000108.5V111 V113 V152V111-I142 HydrophobicContact CG1-CG2 3.83Å; V113-I142 HydrophobicContact CG1-CG1 4.36Å; I142-V152 HydrophobicContact CD1-CG2 3.92Å
143R75.8Confident76.5Confident110 Ų11079 Ų7942%0.41542%0.424SS..EExtended strand (participates in β ladder)trans-106.7115.6172.9-72.6-169.6-75.6-134.6-10.7109.9L112 D114 S145L112-R143 PolarHBondContact N-O 3.24Å; L112-R143 VanDerWaalsContact N-O 3.07Å; L112-R143 WeakPolarHBondContact O-CA 3.33Å; L112-R143 PolarHBondContact O-N 2.83Å; L112-R143 VanDerWaalsContact O-O 3.12Å; D114-R143 IonicContact OD1-NH2 3.78Å; D114-R143 IonicContact OD2-CZ 2.71Å; D114-R143 IonicContact OD2-NH1 3.43Å; D114-R143 IonicContact OD2-NH2 3.74Å; D114-R143 PolarHBondContact OD2-NH2 2.84Å; R143-S145 PolarHBondContact O-N 3.5Å
144N77.9Confident76.3Confident37 Ų3778.3 Ų78.320%0.19843%0.427CS..  trans-85.5109172.5-173.38000109.7N146 Y148 V150 Y180N144-N146 VanDerWaalsContact C-N 3.28Å; N144-N146 WeakPolarHBondContact OD1-CA 3.39Å; N144-N146 WeakPolarHBondContact OD1-CB 3.43Å; N144-N146 PolarHBondContact OD1-N 2.81Å; N144-Y148 PolarHBondContact ND2-O 2.71Å; N144-V150 PolarHBondContact ND2-N 3.2Å; N144-Y180 HydrophobicContact CB-CE2 4.42Å; N144-Y180 PolarHBondContact ND2-OH 2.75Å
145S75Confident76.2Confident50 Ų5075.6 Ų75.635%0.3541%0.413SS..  trans-905.5175.950.10000112.5H109 S110 R143H109-S145 PolarHBondContact CE1-OG 3.19Å; H109-S145 WeakPolarHBondContact ND1-CB 3.36Å; H109-S145 PolarHBondContact ND1-OG 3.04Å; S110-S145 PolarHBondContact O-OG 2.78Å; S110-S145 VanDerWaalsContact O-OG 3.04Å; R143-S145 PolarHBondContact O-N 3.5Å
146N74Confident76Confident21 Ų2177.1 Ų77.111%0.11243%0.427CS..SBendtrans-87.3152.6-177.6-147.4-43.6000111.7N144 Y148N144-N146 VanDerWaalsContact C-N 3.28Å; N144-N146 WeakPolarHBondContact OD1-CA 3.39Å; N144-N146 WeakPolarHBondContact OD1-CB 3.43Å; N144-N146 PolarHBondContact OD1-N 2.81Å; N146-Y148 VanDerWaalsContact CG-CZ 3.41Å; N146-Y148 VanDerWaalsContact ND2-CE1 3.33Å; N146-Y148 WeakPolarHBondContact ND2-CE1 3.36Å; N146-Y148 PolarHBondContact ND2-OH 3.41Å; N146-Y148 PolarHBondContact O-N 3.21Å; N146-Y148 WeakPolarHBondContact OD1-CD1 3.5Å; N146-Y148 WeakPolarHBondContact OD1-CE1 3.43Å
147F70.6Confident75.9Confident166 Ų16676 Ų7673%0.72843%0.425SS*.SBendtrans-77.5-3.6177.6-65.3-83.9000112.9F105F105-F147 AromaticContact CD1-CD2 3.89Å; F105-F147 HydrophobicContact CD1-CD2 3.89Å; F105-F147 HydrophobicContact CD1-CE2 4.08Å; F105-F147 HydrophobicContact CD1-CG 4.37Å; F105-F147 HydrophobicContact CE1-CD2 4.09Å; F105-F147 HydrophobicContact CE1-CE1 4.49Å; F105-F147 AromaticContact CE1-CE2 3.93Å; F105-F147 HydrophobicContact CE1-CE2 3.93Å; F105-F147 HydrophobicContact CE1-CG 4.44Å; F105-F147 HydrophobicContact CE1-CZ 4.15Å
148Y72.5Confident76Confident108 Ų10876.7 Ų76.742%0.42443%0.428SS..SBendtrans-123.2158.5175.556.5-100.2000112.8P108 N144 N146 V150P108-Y148 WeakPolarHBondContact CB-OH 3.25Å; N144-Y148 PolarHBondContact ND2-O 2.71Å; N146-Y148 VanDerWaalsContact CG-CZ 3.41Å; N146-Y148 VanDerWaalsContact ND2-CE1 3.33Å; N146-Y148 WeakPolarHBondContact ND2-CE1 3.36Å; N146-Y148 PolarHBondContact ND2-OH 3.41Å; N146-Y148 PolarHBondContact O-N 3.21Å; N146-Y148 WeakPolarHBondContact OD1-CD1 3.5Å; N146-Y148 WeakPolarHBondContact OD1-CE1 3.43Å; Y148-V150 HydrophobicContact CD2-CG2 3.86Å; Y148-V150 HydrophobicContact CE2-CG2 3.68Å; Y148-V150 PolarHBondContact O-N 3.23Å
149T71.5Confident76Confident120 Ų12077 Ų7774%0.73642%0.42SS*.  trans-70127.7177.446.30000110.5
150V74.7Confident76.3Confident45 Ų4579.5 Ų79.527%0.27343%0.428SS..  trans-113128.1176.2179.90000107.8V111 N144 Y148 Y180V111-V150 HydrophobicContact CG2-CG2 4.47Å; N144-V150 PolarHBondContact ND2-N 3.2Å; Y148-V150 HydrophobicContact CD2-CG2 3.86Å; Y148-V150 HydrophobicContact CE2-CG2 3.68Å; Y148-V150 PolarHBondContact O-N 3.23Å; V150-Y180 PolarHBondContact O-OH 3.27Å
151A74.4Confident76.4Confident53 Ų5383.2 Ų83.244%0.43844%0.438SS..  trans-93133.5171.800000109.5
152V75.3Confident76.6Confident34 Ų3485.4 Ų85.421%0.20645%0.451CS..  trans-80.9121171-178.70000107.2I142 M174 F178I142-V152 HydrophobicContact CD1-CG2 3.92Å; V152-M174 HydrophobicContact CB-CB 4.42Å; V152-M174 HydrophobicContact CB-SD 3.86Å; V152-M174 HydrophobicContact CG1-CB 4.49Å; V152-M174 HydrophobicContact CG1-SD 3.6Å; V152-M174 WeakPolarHBondContact O-CB 2.9Å; V152-F178 HydrophobicContact CB-CE2 4.32Å
153T77.8Confident76.8Confident108 Ų10889.7 Ų89.766%0.66348%0.475SS*.  trans-91.7-45.9-176.650.70000112.1M174T153-M174 PolarHBondContact O-N 3.38Å
154S78.5Confident77.1Confident74 Ų7488.6 Ų88.652%0.51748%0.481SS..EExtended strand (participates in β ladder)trans-145.2134.4-179.460.80000110.7
155L77.7Confident77.2Confident42 Ų4290 Ų9022%0.2249%0.49CS..EExtended strand (participates in β ladder)trans-113.4124.1170.6-173.7146.7000108.8L140 A172 M174L140-L155 HydrophobicContact CD2-CD1 4.37Å; L155-A172 HydrophobicContact CB-CB 4.42Å; L155-A172 PolarHBondContact N-O 3.01Å; L155-A172 PolarHBondContact O-N 3.13Å; L155-M174 HydrophobicContact CB-CE 4.49Å; L155-M174 HydrophobicContact CD1-CE 4.02Å
156S78.1Confident77.3Confident104 Ų10490.9 Ų90.973%0.72749%0.494SS*.EExtended strand (participates in β ladder)trans-111.6122.3174.159.60000109.8G170S156-G170 WeakPolarHBondContact CA-O 3.2Å
157S76.6Confident77Confident54 Ų5497.7 Ų97.738%0.37853%0.53SS..EExtended strand (participates in β ladder)trans-115.3135.4174.1-176.40000110.4G170S157-G170 PolarHBondContact N-O 3.34Å; S157-G170 PolarHBondContact O-N 3.33Å; S157-G170 VanDerWaalsContact O-N 3.1Å
158Q80.7Confident77Confident124 Ų12495 Ų9558%0.57952%0.518SS*.EExtended strand (participates in β ladder)trans-121.9133174.8-177.4176.481.100108.9V165Q158-V165 HydrophobicContact CG-CG1 3.68Å
159I79.3Confident76.9Confident62 Ų6295 Ų9532%0.31853%0.53SS..EExtended strand (participates in β ladder)trans-99.2119.5178.6-59.2174.2000108.5V166 F168I159-V166 WeakPolarHBondContact O-CB 3.4Å; I159-V166 PolarHBondContact O-N 2.82Å; I159-F168 HydrophobicContact CD1-CB 4.46Å; I159-F168 HydrophobicContact CD1-CD1 3.42Å; I159-F168 VanDerWaalsContact CD1-CD1 3.42Å; I159-F168 HydrophobicContact CD1-CE1 3.78Å; I159-F168 HydrophobicContact CD1-CG 4Å; I159-F168 HydrophobicContact CG1-CD1 3.77Å; I159-F168 HydrophobicContact CG1-CE1 4.39Å
160Q82.1Confident76.7Confident111 Ų11190.5 Ų90.552%0.51951%0.507SS..EExtended strand (participates in β ladder)trans-106.9131.1174.6-172.8175.97.200109.7M162Q160-M162 PolarHBondContact NE2-O 2.67Å
161Y78.9Confident76.5Confident156 Ų15695.2 Ų95.261%0.61252%0.523SS*.EExtended strand (participates in β ladder)trans-110114.9171.2-179-101.7000109N163 T164Y161-N163 PolarHBondContact O-N 3.43Å; Y161-T164 PolarHBondContact N-O 2.81Å; Y161-T164 PolarHBondContact O-N 2.84Å; Y161-T164 PolarHBondContact O-OG1 3.07Å
162M81Confident76.2Confident152 Ų15294.6 Ų94.675%0.74952%0.519SS*.THydrogen-bonded Turntrans52.5-107.3-173.4-60.6-65.6175.700111.4Q160Q160-M162 PolarHBondContact NE2-O 2.67Å
163N81.4Confident76Confident152 Ų15299.8 Ų99.881%0.81354%0.541SS*.THydrogen-bonded Turntrans-112.99.2178-127.517.8000113.4Y161Y161-N163 PolarHBondContact O-N 3.43Å
164T81.1Confident75.5Confident88 Ų8897.4 Ų97.454%0.5452%0.523SS..EExtended strand (participates in β ladder)trans-109.8122.4177.848.80000109.7Y161 V166Y161-T164 PolarHBondContact N-O 2.81Å; Y161-T164 PolarHBondContact O-N 2.84Å; Y161-T164 PolarHBondContact O-OG1 3.07Å; T164-V166 PolarHBondContact O-N 2.83Å
165V79.3Confident74.2Confident65 Ų6598.1 Ų98.139%0.39454%0.541SS..EExtended strand (participates in β ladder)trans-69116.8169176.50000107.2Q158 N167Q158-V165 HydrophobicContact CG-CG1 3.68Å; V165-N167 PolarHBondContact O-N 2.84Å
166V78.5Confident73.3Confident70 Ų7097.8 Ų97.842%0.42455%0.549SS..EExtended strand (participates in β ladder)trans-71.9122.5167.6-174.80000104.6I159 T164 F168I159-V166 WeakPolarHBondContact O-CB 3.4Å; I159-V166 PolarHBondContact O-N 2.82Å; T164-V166 PolarHBondContact O-N 2.83Å; V166-F168 PolarHBondContact O-N 3.17Å
167N67.6Low71.9Confident163 Ų16397.8 Ų97.887%0.87255%0.546SS*.EExtended strand (participates in β ladder)trans-64.580179-97-14.7000109.8V165V165-N167 PolarHBondContact O-N 2.84Å
168F69.9Low70.8Confident110 Ų110100 Ų10048%0.48255%0.549SS..EExtended strand (participates in β ladder)trans-138.3111.3177.2-178.3-93.6000106.2I159 V166I159-F168 HydrophobicContact CD1-CB 4.46Å; I159-F168 HydrophobicContact CD1-CD1 3.42Å; I159-F168 VanDerWaalsContact CD1-CD1 3.42Å; I159-F168 HydrophobicContact CD1-CE1 3.78Å; I159-F168 HydrophobicContact CD1-CG 4Å; I159-F168 HydrophobicContact CG1-CD1 3.77Å; I159-F168 HydrophobicContact CG1-CE1 4.39Å; V166-F168 PolarHBondContact O-N 3.17Å
169T70.2Confident68.9Low109 Ų10999.7 Ų99.767%0.66956%0.561SS**EExtended strand (participates in β ladder)trans-117.6102.3176.4-54.50000107.1
170G67.1Low67.4Low24 Ų24102.4 Ų102.425%0.24757%0.568CS.*EExtended strand (participates in β ladder)trans-85.9110.2171.300000109S156 S157S156-G170 WeakPolarHBondContact CA-O 3.2Å; S157-G170 PolarHBondContact N-O 3.34Å; S157-G170 PolarHBondContact O-N 3.33Å; S157-G170 VanDerWaalsContact O-N 3.1Å
171K70.2Confident65Low144 Ų144107.4 Ų107.463%0.62661%0.605SS**EExtended strand (participates in β ladder)trans-99.4114169.6-167.5-167.4-175.1-1560108E173K171-E173 WeakPolarHBondContact CE-OE1 3.47Å; K171-E173 IonicContact NZ-OE1 2.67Å; K171-E173 PolarHBondContact NZ-OE1 3.09Å
172A68.2Low64.3Low41 Ų41105 Ų10534%0.33961%0.605SS.*EExtended strand (participates in β ladder)trans-107.7122169.900000108.8L155L155-A172 HydrophobicContact CB-CB 4.42Å; L155-A172 PolarHBondContact N-O 3.01Å; L155-A172 PolarHBondContact O-N 3.13Å
173E71.8Confident63.4Low143 Ų143102.5 Ų102.567%0.66860%0.597SS**EExtended strand (participates in β ladder)trans-91.3114.3171.2-65.4-175.4167.200107.4K171 G175K171-E173 WeakPolarHBondContact CE-OE1 3.47Å; K171-E173 IonicContact NZ-OE1 2.67Å; K171-E173 PolarHBondContact NZ-OE1 3.09Å; E173-G175 PolarHBondContact O-N 3.25Å
174M67.8Low62.4Low58 Ų5899.7 Ų99.729%0.28659%0.586SS.*  trans-93.798.2179.3-72.3-179.6175.600108.3V152 T153 L155 G176 F178V152-M174 HydrophobicContact CB-CB 4.42Å; V152-M174 HydrophobicContact CB-SD 3.86Å; V152-M174 HydrophobicContact CG1-CB 4.49Å; V152-M174 HydrophobicContact CG1-SD 3.6Å; V152-M174 WeakPolarHBondContact O-CB 2.9Å; T153-M174 PolarHBondContact O-N 3.38Å; L155-M174 HydrophobicContact CB-CE 4.49Å; L155-M174 HydrophobicContact CD1-CE 4.02Å; M174-G176 PolarHBondContact O-N 2.91Å; M174-F178 HydrophobicContact CB-CE2 3.56Å; M174-F178 HydrophobicContact CB-CZ 3.81Å; M174-F178 HydrophobicContact CE-CZ 4.49Å; M174-F178 HydrophobicContact CG-CE2 3.85Å; M174-F178 HydrophobicContact CG-CZ 3.77Å; M174-F178 HydrophobicContact SD-CE2 3.43Å; M174-F178 WeakPolarHBondContact SD-CE2 3.48Å; M174-F178 HydrophobicContact SD-CZ 3.56Å; M174-F178 VanDerWaalsContact SD-CZ 3.56Å
175G50.2Low61.3Low88 Ų88100.4 Ų100.491%0.90759%0.588SS**  trans-76.7100.3179.300000111.7E173E173-G175 PolarHBondContact O-N 3.25Å
176G58.6Low60.2Low36 Ų36102.6 Ų102.637%0.37160%0.6SS.*SBendtrans118.8165.9162.800000115.5M174 F178M174-G176 PolarHBondContact O-N 2.91Å; G176-F178 PolarHBondContact O-N 3.38Å
177P49.8Very low59Low104 Ų104104.8 Ų104.868%0.67561%0.612SS**  trans-68.1116.3176.228-31.3000109.1S179P177-S179 PolarHBondContact O-N 3Å; P177-S179 VanDerWaalsContact O-N 3.07Å
178F53.1Low58.4Low99 Ų99100.6 Ų100.643%0.43459%0.594SS.*  trans-69105.2167.4-70.7-83.7000108.2V152 M174 G176 Y180V152-F178 HydrophobicContact CB-CE2 4.32Å; M174-F178 HydrophobicContact CB-CE2 3.56Å; M174-F178 HydrophobicContact CB-CZ 3.81Å; M174-F178 HydrophobicContact CE-CZ 4.49Å; M174-F178 HydrophobicContact CG-CE2 3.85Å; M174-F178 HydrophobicContact CG-CZ 3.77Å; M174-F178 HydrophobicContact SD-CE2 3.43Å; M174-F178 WeakPolarHBondContact SD-CE2 3.48Å; M174-F178 HydrophobicContact SD-CZ 3.56Å; M174-F178 VanDerWaalsContact SD-CZ 3.56Å; G176-F178 PolarHBondContact O-N 3.38Å; F178-Y180 HydrophobicContact CB-CD1 4.1Å; F178-Y180 HydrophobicContact CB-CE1 4.03Å; F178-Y180 WeakPolarHBondContact O-CD1 3.39Å; F178-Y180 WeakPolarHBondContact O-CE1 3.45Å; F178-Y180 PolarHBondContact O-N 3.48Å
179S40.2Very low57.5Low119 Ų11999.9 Ų99.983%0.83260%0.602SS**  trans-75.3102.4162.9-79.60000108.1P177P177-S179 PolarHBondContact O-N 3Å; P177-S179 VanDerWaalsContact O-N 3.07Å
180Y47.7Very low56.5Low118 Ų11899.2 Ų99.246%0.46360%0.597SS.*  trans-84.7122.5165.613.3-96.6000108N144 V150 F178N144-Y180 HydrophobicContact CB-CE2 4.42Å; N144-Y180 PolarHBondContact ND2-OH 2.75Å; V150-Y180 PolarHBondContact O-OH 3.27Å; F178-Y180 HydrophobicContact CB-CD1 4.1Å; F178-Y180 HydrophobicContact CB-CE1 4.03Å; F178-Y180 WeakPolarHBondContact O-CD1 3.39Å; F178-Y180 WeakPolarHBondContact O-CE1 3.45Å; F178-Y180 PolarHBondContact O-N 3.48Å
181V32.9Very low55.5Low216 Ų216106 Ų106100%1.30963%0.628SS**  trans-78.30165177.60000108.9

Retrieved 181 of 181 residues in 37.2 ms (Link to these results)