A0A5K4F6E0_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A5K4F6E0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 84 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
1M47.5Very low52.1Low217 Ų217115.1 Ų115.1100%1.06964%0.636SS**  011.80-79.3165.365.600114.1
2N54.7Low51.7Low140 Ų140112.6 Ų112.675%0.74963%0.631SS**  trans-99.4-15-169.2-79.68.4000116.8
3T52.1Low51.2Low108 Ų108111.3 Ų111.366%0.66362%0.621SS**Hα-helixtrans-81.2-36.7-173.942.50000113.6L5 F6 L7T3-L5 VanDerWaalsContact C-N 3.34Å; T3-L5 PolarHBondContact O-N 3.27Å; T3-F6 PolarHBondContact O-N 3.49Å; T3-L7 PolarHBondContact O-N 3.43Å
4V55.9Low50.8Low113 Ų113110.9 Ų110.969%0.68562%0.616SS**Hα-helixtrans-66.4-36.7-176.6-172.90000111.9F6 S8V4-F6 VanDerWaalsContact C-N 3.33Å; V4-F6 PolarHBondContact O-N 3.19Å; V4-S8 PolarHBondContact O-N 3.32Å
5L54.8Low50Low117 Ų117109.3 Ų109.361%0.61361%0.614SS**Hα-helixtrans-64.7-35.5174.7-91.5150.5000112.5T3 S8 V9T3-L5 VanDerWaalsContact C-N 3.34Å; T3-L5 PolarHBondContact O-N 3.27Å; L5-S8 PolarHBondContact O-OG 3.46Å; L5-V9 VanDerWaalsContact O-CG2 3.31Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.13Å
6F52.3Low49.1Very low156 Ų156107.1 Ų107.168%0.68461%0.608SS**Hα-helixtrans-71.6-40.4-179.1-144.7-90.7000111.6T3 V4 V9 V10T3-F6 PolarHBondContact O-N 3.49Å; V4-F6 VanDerWaalsContact C-N 3.33Å; V4-F6 PolarHBondContact O-N 3.19Å; F6-V9 PolarHBondContact O-N 3.29Å; F6-V10 HydrophobicContact CD1-CG2 4.24Å; F6-V10 HydrophobicContact CE1-CG2 4.4Å; F6-V10 WeakPolarHBondContact O-CG2 3.31Å; F6-V10 PolarHBondContact O-N 3.01Å; F6-V10 VanDerWaalsContact O-N 3.13Å
7L50.5Low48.5Very low129 Ų129110.1 Ų110.168%0.67562%0.618SS**Hα-helixtrans-64.6-37.8175.7-90.5120.2000112.7T3 V10 S11T3-L7 PolarHBondContact O-N 3.43Å; L7-V10 PolarHBondContact O-N 3.42Å; L7-S11 WeakPolarHBondContact O-CB 3.36Å; L7-S11 PolarHBondContact O-N 2.9Å
8S53.9Low47.8Very low63 Ų63109.8 Ų109.844%0.44162%0.619SS.*Hα-helixtrans-67.5-38.917970.90000112.3V4 L5 S11 C12V4-S8 PolarHBondContact O-N 3.32Å; L5-S8 PolarHBondContact O-OG 3.46Å; S8-S11 PolarHBondContact O-N 3.45Å; S8-C12 WeakPolarHBondContact O-CB 3.23Å; S8-C12 PolarHBondContact O-N 3.36Å
9V54.4Low47.2Very low82 Ų82110.8 Ų110.850%0.49762%0.621SS.*Hα-helixtrans-65.6-42.7176.6176.10000110.8L5 F6 C12 L13L5-V9 VanDerWaalsContact O-CG2 3.31Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.13Å; F6-V9 PolarHBondContact O-N 3.29Å; V9-C12 PolarHBondContact O-N 2.89Å; V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 WeakPolarHBondContact O-CB 3.41Å; V9-L13 PolarHBondContact O-N 2.84Å
10V52.6Low46.6Very low67 Ų67109.8 Ų109.841%0.40662%0.619SS.*Hα-helixtrans-65.9-41.9176.71760000111.2F6 L7 L13 I14F6-V10 HydrophobicContact CD1-CG2 4.24Å; F6-V10 HydrophobicContact CE1-CG2 4.4Å; F6-V10 WeakPolarHBondContact O-CG2 3.31Å; F6-V10 PolarHBondContact O-N 3.01Å; F6-V10 VanDerWaalsContact O-N 3.13Å; L7-V10 PolarHBondContact O-N 3.42Å; V10-L13 PolarHBondContact O-N 3.44Å; V10-I14 HydrophobicContact CG1-CD1 3.88Å; V10-I14 WeakPolarHBondContact O-CD1 3.48Å; V10-I14 VanDerWaalsContact O-CG1 3.23Å; V10-I14 WeakPolarHBondContact O-CG1 3.47Å; V10-I14 PolarHBondContact O-N 3.23Å
11S44.9Very low45.9Very low74 Ų74109.2 Ų109.252%0.51762%0.615SS.*Hα-helixtrans-63.4-40.7174.6-1150000112.4L7 S8 I14 C15L7-S11 WeakPolarHBondContact O-CB 3.36Å; L7-S11 PolarHBondContact O-N 2.9Å; S8-S11 PolarHBondContact O-N 3.45Å; S11-I14 PolarHBondContact O-N 2.93Å; S11-C15 PolarHBondContact O-N 2.95Å; S11-C15 PolarHBondContact O-SG 3.33Å; S11-C15 VanDerWaalsContact O-SG 3.35Å
12C47.4Very low45.3Very low85 Ų85104.7 Ų104.757%0.57460%0.599SS**Hα-helixtrans-65.6-38.8175-102.40000112.6S8 V9 I14 C15 S16S8-C12 WeakPolarHBondContact O-CB 3.23Å; S8-C12 PolarHBondContact O-N 3.36Å; V9-C12 PolarHBondContact O-N 2.89Å; C12-I14 VanDerWaalsContact C-N 3.35Å; C12-C15 PolarHBondContact O-N 2.7Å; C12-S16 WeakPolarHBondContact O-CB 3.39Å; C12-S16 PolarHBondContact O-N 3.36Å; C12-S16 PolarHBondContact O-OG 3.22Å
13L44.5Very low44.2Very low96 Ų96107.1 Ų107.150%0.50361%0.606SS.*Hα-helixtrans-64.3-40.5174.2-86.9159.2000111.3V9 V10 S16 M17V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 WeakPolarHBondContact O-CB 3.41Å; V9-L13 PolarHBondContact O-N 2.84Å; V10-L13 PolarHBondContact O-N 3.44Å; L13-S16 PolarHBondContact O-N 3.35Å; L13-M17 WeakPolarHBondContact O-CG 3.48Å; L13-M17 PolarHBondContact O-N 3.28Å
14I46.3Very low43.1Very low106 Ų106103.7 Ų103.754%0.54459%0.592SS.*Hα-helixtrans-64.6-44.2175.2-64.4162.5000110.2V10 S11 C12 S16 M17 V18V10-I14 HydrophobicContact CG1-CD1 3.88Å; V10-I14 WeakPolarHBondContact O-CD1 3.48Å; V10-I14 VanDerWaalsContact O-CG1 3.23Å; V10-I14 WeakPolarHBondContact O-CG1 3.47Å; V10-I14 PolarHBondContact O-N 3.23Å; S11-I14 PolarHBondContact O-N 2.93Å; C12-I14 VanDerWaalsContact C-N 3.35Å; I14-S16 VanDerWaalsContact C-N 3.33Å; I14-S16 PolarHBondContact O-N 2.91Å; I14-M17 PolarHBondContact O-N 2.94Å; I14-V18 WeakPolarHBondContact O-CG2 3.45Å; I14-V18 PolarHBondContact O-N 3.49Å
15C37.8Very low42Very low87 Ų87104.2 Ų104.259%0.58858%0.583SS**Hα-helixtrans-66.9-31.5176.9-69.30000113.2S11 C12 V18S11-C15 PolarHBondContact O-N 2.95Å; S11-C15 PolarHBondContact O-SG 3.33Å; S11-C15 VanDerWaalsContact O-SG 3.35Å; C12-C15 PolarHBondContact O-N 2.7Å; C15-V18 CarbonylContact O-C 3.53Å; C15-V18 WeakPolarHBondContact O-CA 3.27Å; C15-V18 WeakPolarHBondContact O-CB 3.33Å; C15-V18 PolarHBondContact O-N 3.35Å
16S36.3Very low40.7Very low74 Ų74101 Ų10152%0.51758%0.578SS.*Hα-helixtrans-79.6-21.4176.7-51.10000112.6C12 L13 I14 V18 I19C12-S16 WeakPolarHBondContact O-CB 3.39Å; C12-S16 PolarHBondContact O-N 3.36Å; C12-S16 PolarHBondContact O-OG 3.22Å; L13-S16 PolarHBondContact O-N 3.35Å; I14-S16 VanDerWaalsContact C-N 3.33Å; I14-S16 PolarHBondContact O-N 2.91Å; S16-V18 VanDerWaalsContact C-N 3.25Å; S16-I19 WeakPolarHBondContact O-CD1 3.29Å; S16-I19 VanDerWaalsContact O-CG1 3.27Å; S16-I19 WeakPolarHBondContact O-CG1 2.92Å; S16-I19 PolarHBondContact O-N 3.32Å
17M38.1Very low39.8Very low157 Ų157100 Ų10077%0.77357%0.571SS**Hα-helixtrans-78.2-13166.1-70.5-166.4-163.800112.3L13 I14 I19L13-M17 WeakPolarHBondContact O-CG 3.48Å; L13-M17 PolarHBondContact O-N 3.28Å; I14-M17 PolarHBondContact O-N 2.94Å; M17-I19 PolarHBondContact O-N 2.94Å; M17-I19 VanDerWaalsContact O-N 3.16Å
18V37.2Very low38.9Very low105 Ų105105.3 Ų105.364%0.63658%0.581SS**  trans-8249.5157.2-162.60000109I14 C15 S16 P20I14-V18 WeakPolarHBondContact O-CG2 3.45Å; I14-V18 PolarHBondContact O-N 3.49Å; C15-V18 CarbonylContact O-C 3.53Å; C15-V18 WeakPolarHBondContact O-CA 3.27Å; C15-V18 WeakPolarHBondContact O-CB 3.33Å; C15-V18 PolarHBondContact O-N 3.35Å; S16-V18 VanDerWaalsContact C-N 3.25Å; V18-P20 VanDerWaalsContact O-CD 3.29Å; V18-P20 WeakPolarHBondContact O-CD 3.39Å
19I36.6Very low38.1Very low130 Ų130108.3 Ų108.367%0.66759%0.587SS**  trans-72.1113150.8-73.4160.1000104S16 M17 N21S16-I19 WeakPolarHBondContact O-CD1 3.29Å; S16-I19 VanDerWaalsContact O-CG1 3.27Å; S16-I19 WeakPolarHBondContact O-CG1 2.92Å; S16-I19 PolarHBondContact O-N 3.32Å; M17-I19 PolarHBondContact O-N 2.94Å; M17-I19 VanDerWaalsContact O-N 3.16Å; I19-N21 PolarHBondContact O-N 2.81Å
20P34.5Very low37.1Very low90 Ų90107.9 Ų107.958%0.58460%0.599SS**  trans-63.9104.3-174.528.2-32.7000106.4V18 V22V18-P20 VanDerWaalsContact O-CD 3.29Å; V18-P20 WeakPolarHBondContact O-CD 3.39Å; P20-V22 HydrophobicContact CB-CG2 3.8Å; P20-V22 PolarHBondContact O-N 3.16Å
21N32Very low36.3Very low98 Ų98109 Ų10952%0.52461%0.606SS.*THydrogen-bonded Turntrans-76.949.1-179.5-148.7-2.2000110.4I19 E23 G24 Y25I19-N21 PolarHBondContact O-N 2.81Å; N21-E23 VanDerWaalsContact C-N 3.25Å; N21-G24 WeakPolarHBondContact OD1-CA 3.5Å; N21-G24 PolarHBondContact OD1-N 3.22Å; N21-Y25 HydrophobicContact CB-CD2 4.27Å
22V34.2Very low36Very low122 Ų122112 Ų11274%0.73962%0.616SS**THydrogen-bonded Turntrans-79.2-12.3175.2-171.10000109.8P20P20-V22 HydrophobicContact CB-CG2 3.8Å; P20-V22 PolarHBondContact O-N 3.16Å
23E31.8Very low35.6Very low190 Ų190115.3 Ų115.389%0.88862%0.623SS**THydrogen-bonded Turntrans-104.3-21.7176.4-77.1-174.4142.100114.9N21N21-E23 VanDerWaalsContact C-N 3.25Å
24G29.1Very low35.8Very low37 Ų37118.8 Ų118.838%0.38164%0.642SS.*THydrogen-bonded Turntrans-93.3-26.9-177.100000115.5N21 G26N21-G24 WeakPolarHBondContact OD1-CA 3.5Å; N21-G24 PolarHBondContact OD1-N 3.22Å; G24-G26 VanDerWaalsContact C-N 3.29Å
25Y31.9Very low35.8Very low123 Ų123118.8 Ų118.848%0.48264%0.64SS.*SBendtrans-91.29.5173.5-76.6-94.3000112.8N21 Y27N21-Y25 HydrophobicContact CB-CD2 4.27Å; Y25-Y27 AromaticContact CD1-CD2 3.89Å; Y25-Y27 HydrophobicContact CD1-CD2 3.89Å; Y25-Y27 AromaticContact CD1-CE2 3.18Å; Y25-Y27 HydrophobicContact CD1-CE2 3.18Å; Y25-Y27 AromaticContact CE1-CE2 3.49Å; Y25-Y27 HydrophobicContact CE1-CE2 3.49Å; Y25-Y27 VanDerWaalsContact CE1-CE2 3.49Å; Y25-Y27 HydrophobicContact CG-CD2 4.49Å; Y25-Y27 AromaticContact CG-CE2 3.96Å; Y25-Y27 HydrophobicContact CG-CE2 3.96Å; Y25-Y27 PolarHBondContact O-N 2.87Å
26G28.5Very low36.2Very low49 Ų49117.9 Ų117.951%0.50563%0.627SS.*  trans-68.260.8149.800000109.1G24 W28G24-G26 VanDerWaalsContact C-N 3.29Å; G26-W28 VanDerWaalsContact C-N 3.26Å; G26-W28 PolarHBondContact O-N 3.33Å
27Y34.4Very low36.8Very low137 Ų137118.9 Ų118.954%0.53763%0.63SS.*  trans-61.797.6169-71.3-69.8000106.9Y25 F29Y25-Y27 AromaticContact CD1-CD2 3.89Å; Y25-Y27 HydrophobicContact CD1-CD2 3.89Å; Y25-Y27 AromaticContact CD1-CE2 3.18Å; Y25-Y27 HydrophobicContact CD1-CE2 3.18Å; Y25-Y27 AromaticContact CE1-CE2 3.49Å; Y25-Y27 HydrophobicContact CE1-CE2 3.49Å; Y25-Y27 VanDerWaalsContact CE1-CE2 3.49Å; Y25-Y27 HydrophobicContact CG-CD2 4.49Å; Y25-Y27 AromaticContact CG-CE2 3.96Å; Y25-Y27 HydrophobicContact CG-CE2 3.96Å; Y25-Y27 PolarHBondContact O-N 2.87Å; Y27-F29 WeakPolarHBondContact O-CD2 3.46Å; Y27-F29 PolarHBondContact O-N 2.93Å
28W30Very low37.4Very low239 Ų239115.5 Ų115.591%0.90562%0.618SS**  23.862.7126.4-59.171.6000114G26 G30G26-W28 VanDerWaalsContact C-N 3.26Å; G26-W28 PolarHBondContact O-N 3.33Å; W28-G30 PolarHBondContact O-N 2.89Å
29F36.8Very low37.9Very low127 Ų127111.1 Ų111.156%0.55759%0.593SS**  trans-78.763.4150.6-65.4-77000106.7Y27 V31 V77Y27-F29 WeakPolarHBondContact O-CD2 3.46Å; Y27-F29 PolarHBondContact O-N 2.93Å; F29-V31 PolarHBondContact O-N 2.98Å; F29-V31 VanDerWaalsContact O-N 3.08Å; F29-V77 HydrophobicContact CD1-CG2 4.34Å; F29-V77 HydrophobicContact CD2-CG2 4.22Å; F29-V77 HydrophobicContact CE1-CB 4.09Å; F29-V77 HydrophobicContact CE1-CG1 4.27Å; F29-V77 HydrophobicContact CE1-CG2 3.63Å; F29-V77 HydrophobicContact CE2-CG2 3.48Å; F29-V77 VanDerWaalsContact CE2-CG2 3.48Å; F29-V77 HydrophobicContact CZ-CB 4.02Å; F29-V77 HydrophobicContact CZ-CG2 3.16Å
30G33.7Very low38.6Very low73 Ų73109.6 Ų109.675%0.75359%0.591SS**  trans-72.281.2149.800000105.7W28W28-G30 PolarHBondContact O-N 2.89Å
31V35.3Very low39.4Very low91 Ų91106.4 Ų106.455%0.55257%0.569SS**  trans-144.6107.3168.3-158.50000107F29F29-V31 PolarHBondContact O-N 2.98Å; F29-V31 VanDerWaalsContact O-N 3.08Å
32D40Very low40.3Very low136 Ų136108.8 Ų108.873%0.72758%0.577SS**  trans-46.8149.4173.8-76.2-65.7000113
33H39.5Very low41.1Very low155 Ų155105.4 Ų105.472%0.71856%0.556SS**SBendtrans91.886.7160.5-52-26.4000117.6E35H33-E35 VanDerWaalsContact C-N 3.3Å; H33-E35 PolarHBondContact O-N 2.83Å
34D47.4Very low42.2Very low169 Ų16999.8 Ų99.890%0.90454%0.535SS*.SBendtrans44.8-8.5139.1-66-27.1000123.6
35E47.5Very low43.3Very low106 Ų106106.8 Ų106.850%0.49555%0.55SS..  trans-137.331.9-172.8-68-159.8-161.900116.1H33 R80H33-E35 VanDerWaalsContact C-N 3.3Å; H33-E35 PolarHBondContact O-N 2.83Å; E35-R80 WeakPolarHBondContact OE2-CD 3.46Å; E35-R80 IonicContact OE2-CZ 3.96Å; E35-R80 IonicContact OE2-NH1 2.98Å; E35-R80 PolarHBondContact OE2-NH1 2.81Å
36Q46.3Very low44.3Very low67 Ų67108.3 Ų108.331%0.31356%0.559SS.*EExtended strand (participates in β ladder)trans-101.3112.4168.6-70.3-176.123.600111.3V77Q36-V77 HydrophobicContact CB-CG1 3.93Å; Q36-V77 HydrophobicContact CG-CG1 4.14Å
37T49.2Very low45.6Very low95 Ų95108.6 Ų108.658%0.58355%0.553SS**EExtended strand (participates in β ladder)trans-89.1118.3172.1-51.50000109.3N78T37-N78 PolarHBondContact O-N 2.75Å; T37-N78 VanDerWaalsContact O-N 3.12Å
38V49Very low46.7Very low86 Ų86108.2 Ų108.252%0.52157%0.568SS.*EExtended strand (participates in β ladder)trans-79.1119.4169.1-174.80000108.1F75 V77V38-F75 HydrophobicContact CG1-CB 3.84Å; V38-F75 HydrophobicContact CG1-CD1 4.19Å; V38-F75 HydrophobicContact CG1-CG 4.22Å; V38-V77 HydrophobicContact CG2-CG2 4.28Å
39A48.9Very low47.9Very low13 Ų13102.3 Ų102.311%0.10755%0.554CS.*EExtended strand (participates in β ladder)trans-109.5142.3174.400000110.3M41 T57 C76A39-M41 PolarHBondContact O-N 2.78Å; A39-T57 HydrophobicContact CB-CG2 3.72Å; A39-C76 PolarHBondContact N-O 2.99Å; A39-C76 PolarHBondContact O-N 3.15Å; A39-C76 PolarHBondContact O-SG 3Å
40P50Low48.6Very low98 Ų9899.3 Ų99.364%0.63654%0.543SS*.EExtended strand (participates in β ladder)trans-67.6132172.228.6-32.5000109.7F75P40-F75 HydrophobicContact CB-CD1 4.49Å
41M52.1Low49.4Very low24 Ų2496.2 Ų96.212%0.11851%0.51CS..EExtended strand (participates in β ladder)trans-77.9139.6166.7-65.1-176.7179.400109.8A39 C53 I54 C55 Q64 C73 P74 C76A39-M41 PolarHBondContact O-N 2.78Å; M41-C53 HydrophobicContact CB-CB 4.19Å; M41-C53 HydrophobicContact SD-CB 3.67Å; M41-I54 WeakPolarHBondContact CA-O 2.94Å; M41-C55 HydrophobicContact CG-CB 4.01Å; M41-Q64 HydrophobicContact CE-CB 4.44Å; M41-C73 HydrophobicContact CB-CB 3.78Å; M41-P74 WeakPolarHBondContact CB-O 3.25Å; M41-P74 HydrophobicContact CE-CG 4.47Å; M41-P74 WeakPolarHBondContact CG-O 3.42Å; M41-P74 HydrophobicContact SD-CG 4.07Å; M41-C76 HydrophobicContact CE-CB 3.56Å; M41-C76 HydrophobicContact CG-CB 3.89Å
42Q50.6Low50.5Low147 Ų14794 Ų9469%0.68750%0.495SS*.EExtended strand (participates in β ladder)trans-98.8139172.9-171.41762.300110.1V44 C53 I54Q42-V44 PolarHBondContact O-N 2.87Å; Q42-C53 WeakPolarHBondContact O-CA 2.9Å; Q42-I54 PolarHBondContact N-O 3.06Å; Q42-I54 PolarHBondContact O-N 2.02Å
43V51.9Low51.1Low51 Ų5187.6 Ų87.631%0.30946%0.46SS..EExtended strand (participates in β ladder)trans-69.9120168.7-170.20000108.4F46 L51 C73V43-F46 HydrophobicContact CB-CE2 4.46Å; V43-F46 HydrophobicContact CB-CZ 4.45Å; V43-F46 HydrophobicContact CG1-CD2 4.06Å; V43-F46 HydrophobicContact CG1-CE1 4.16Å; V43-F46 HydrophobicContact CG1-CE2 3.58Å; V43-F46 HydrophobicContact CG1-CZ 3.65Å; V43-F46 HydrophobicContact CG2-CZ 4.46Å; V43-L51 HydrophobicContact CG1-CD2 4.06Å; V43-L51 HydrophobicContact CG1-CG 4.18Å; V43-L51 HydrophobicContact CG2-CD2 4.22Å; V43-C73 HydrophobicContact CG2-CB 4.37Å; V43-C73 VanDerWaalsContact CG2-SG 3.51Å
44V54.6Low51.9Low72 Ų7282.3 Ų82.344%0.43644%0.437SS..EExtended strand (participates in β ladder)trans-102.7-35.6-179.5179.70000111.7Q42 I52 I54Q42-V44 PolarHBondContact O-N 2.87Å; V44-I52 PolarHBondContact N-O 2.91Å; V44-I54 HydrophobicContact CB-CD1 3.85Å; V44-I54 HydrophobicContact CB-CG1 3.85Å; V44-I54 HydrophobicContact CG1-CD1 3.83Å; V44-I54 HydrophobicContact CG1-CG1 4.4Å; V44-I54 HydrophobicContact CG2-CB 3.57Å; V44-I54 HydrophobicContact CG2-CD1 3.56Å; V44-I54 HydrophobicContact CG2-CG1 3.37Å
45R52.7Low52.2Low185 Ų18574.3 Ų74.370%0.69839%0.394SS*.EExtended strand (participates in β ladder)trans-148.6138.6173.8-71.5-171.1178.4-179.6-0.1112.4I52R45-I52 HydrophobicContact CB-CB 4.34Å; R45-I52 HydrophobicContact CB-CD1 4.21Å; R45-I52 PolarHBondContact N-O 3.08Å; R45-I52 PolarHBondContact O-N 3.46Å
46F52.4Low52.4Low154 Ų15475.3 Ų75.368%0.67540%0.403SS*.EExtended strand (participates in β ladder)trans-92.7109.9160.2-63.8-88.7000107.7V43 L51V43-F46 HydrophobicContact CB-CE2 4.46Å; V43-F46 HydrophobicContact CB-CZ 4.45Å; V43-F46 HydrophobicContact CG1-CD2 4.06Å; V43-F46 HydrophobicContact CG1-CE1 4.16Å; V43-F46 HydrophobicContact CG1-CE2 3.58Å; V43-F46 HydrophobicContact CG1-CZ 3.65Å; V43-F46 HydrophobicContact CG2-CZ 4.46Å; F46-L51 HydrophobicContact CD1-CD1 4.05Å; F46-L51 HydrophobicContact CD1-CG 4.25Å; F46-L51 HydrophobicContact CE1-CD1 3.56Å; F46-L51 HydrophobicContact CE1-CG 4.11Å; F46-L51 HydrophobicContact CZ-CD1 4.44Å
47S54.6Low52.6Low55 Ų5572.7 Ų72.739%0.38539%0.391SS..EExtended strand (participates in β ladder)trans-86.6147.1160.7178.90000107.5N49 N50S47-N49 PolarHBondContact O-N 2.92Å; S47-N50 WeakPolarHBondContact CA-O 3.49Å; S47-N50 WeakPolarHBondContact CB-O 3.21Å; S47-N50 PolarHBondContact N-O 2.92Å; S47-N50 PolarHBondContact O-N 2.96Å; S47-N50 VanDerWaalsContact O-O 3.04Å
48P57.9Low52.7Low129 Ų12974.1 Ų74.184%0.83841%0.405SS*.THydrogen-bonded Turntrans-48.4-25-175.311.2-27.5000114.9
49N55.8Low52.6Low115 Ų11575.9 Ų75.962%0.61541%0.407SS*.THydrogen-bonded Turntrans-125.49.3177.7-71.529.3000114.3S47 P68S47-N49 PolarHBondContact O-N 2.92Å; N49-P68 WeakPolarHBondContact O-CD 3.49Å
50N50.8Low52.5Low64 Ų6478.8 Ų78.834%0.34242%0.424SS..EExtended strand (participates in β ladder)trans-151.2136.6-175.5-71.9-55.5000111.7S47 T65S47-N50 WeakPolarHBondContact CA-O 3.49Å; S47-N50 WeakPolarHBondContact CB-O 3.21Å; S47-N50 PolarHBondContact N-O 2.92Å; S47-N50 PolarHBondContact O-N 2.96Å; S47-N50 VanDerWaalsContact O-O 3.04Å; N50-T65 HydrophobicContact CB-CG2 3.71Å
51L52.2Low52.3Low8 Ų879.5 Ų79.54%0.04242%0.422CS..EExtended strand (participates in β ladder)trans-98.7119.2173.5-161.6149.3000108.6V43 F46 C53 L66 S71 C73V43-L51 HydrophobicContact CG1-CD2 4.06Å; V43-L51 HydrophobicContact CG1-CG 4.18Å; V43-L51 HydrophobicContact CG2-CD2 4.22Å; F46-L51 HydrophobicContact CD1-CD1 4.05Å; F46-L51 HydrophobicContact CD1-CG 4.25Å; F46-L51 HydrophobicContact CE1-CD1 3.56Å; F46-L51 HydrophobicContact CE1-CG 4.11Å; F46-L51 HydrophobicContact CZ-CD1 4.44Å; L51-C53 WeakPolarHBondContact CD2-SG 3.34Å; L51-L66 PolarHBondContact N-O 2.77Å; L51-L66 PolarHBondContact O-N 2.91Å; L51-S71 WeakPolarHBondContact CD1-O 3.41Å; L51-C73 HydrophobicContact CD2-CB 4.48Å; L51-C73 WeakPolarHBondContact CD2-SG 2.92Å
52I56.5Low52Low46 Ų4682.9 Ų82.924%0.23644%0.438CS..EExtended strand (participates in β ladder)trans-98.7113.6-179.6-55.7-179.3000108.5V44 R45 V63V44-I52 PolarHBondContact N-O 2.91Å; R45-I52 HydrophobicContact CB-CB 4.34Å; R45-I52 HydrophobicContact CB-CD1 4.21Å; R45-I52 PolarHBondContact N-O 3.08Å; R45-I52 PolarHBondContact O-N 3.46Å; I52-V63 HydrophobicContact CG2-CG1 3.75Å
53C54.3Low51.9Low0 Ų080.2 Ų80.20%043%0.431CS..EExtended strand (participates in β ladder)trans-102134.8177.1-59.20000110M41 Q42 L51 V63 Q64 L66 C73M41-C53 HydrophobicContact CB-CB 4.19Å; M41-C53 HydrophobicContact SD-CB 3.67Å; Q42-C53 WeakPolarHBondContact O-CA 2.9Å; L51-C53 WeakPolarHBondContact CD2-SG 3.34Å; C53-V63 WeakPolarHBondContact O-CA 3.2Å; C53-Q64 PolarHBondContact N-O 2.96Å; C53-Q64 PolarHBondContact O-N 3.34Å; C53-L66 HydrophobicContact CB-CD1 4.44Å; C53-C73 WeakPolarHBondContact CA-SG 2.83Å; C53-C73 HydrophobicContact CB-CB 3.7Å; C53-C73 WeakPolarHBondContact CB-SG 3.24Å; C53-C73 WeakPolarHBondContact SG-CA 2.98Å; C53-C73 WeakPolarHBondContact SG-CB 3.06Å; C53-C73 CovalentContact SG-SG 2.02Å; C53-C73 PolarHBondContact SG-SG 2.84Å
54I54.7Low51.8Low45 Ų4582.2 Ų82.223%0.23144%0.437CS..EExtended strand (participates in β ladder)trans-114.5128.3168.9-57-169.9000108.4M41 Q42 V44 V63M41-I54 WeakPolarHBondContact CA-O 2.94Å; Q42-I54 PolarHBondContact N-O 3.06Å; Q42-I54 PolarHBondContact O-N 2.02Å; V44-I54 HydrophobicContact CB-CD1 3.85Å; V44-I54 HydrophobicContact CB-CG1 3.85Å; V44-I54 HydrophobicContact CG1-CD1 3.83Å; V44-I54 HydrophobicContact CG1-CG1 4.4Å; V44-I54 HydrophobicContact CG2-CB 3.57Å; V44-I54 HydrophobicContact CG2-CD1 3.56Å; V44-I54 HydrophobicContact CG2-CG1 3.37Å; I54-V63 HydrophobicContact CD1-CG2 4.37Å; I54-V63 HydrophobicContact CG1-CG2 4.22Å
55C54.6Low51.3Low0 Ų082.5 Ų82.50%044%0.439CS..EExtended strand (participates in β ladder)trans-90.6110.6166.4175.80000108.8M41 T57 D61 Q62 C76M41-C55 HydrophobicContact CG-CB 4.01Å; C55-T57 PolarHBondContact O-N 3.48Å; C55-T57 WeakPolarHBondContact SG-CG2 3.39Å; C55-D61 WeakPolarHBondContact O-CA 3.25Å; C55-Q62 HydrophobicContact CB-CB 3.93Å; C55-Q62 PolarHBondContact N-O 3.16Å; C55-Q62 PolarHBondContact O-N 2.92Å; C55-C76 HydrophobicContact CB-CB 3.38Å; C55-C76 WeakPolarHBondContact CB-SG 3.4Å; C55-C76 WeakPolarHBondContact SG-CB 3.45Å; C55-C76 CovalentContact SG-SG 1.98Å; C55-C76 PolarHBondContact SG-SG 2.65Å
56N50.8Low51.2Low128 Ų12874.3 Ų74.368%0.68441%0.409SS*.EExtended strand (participates in β ladder)trans-91.888.8171.9-162.7-6.7000108.1
57T51.8Low50.8Low12 Ų1270.8 Ų70.87%0.07440%0.402CS..  trans-98.3155.2167.761.60000109A39 C55 E59 V60 N78A39-T57 HydrophobicContact CB-CG2 3.72Å; C55-T57 PolarHBondContact O-N 3.48Å; C55-T57 WeakPolarHBondContact SG-CG2 3.39Å; T57-E59 PolarHBondContact O-N 3.21Å; T57-V60 PolarHBondContact O-N 1.98Å; T57-V60 PolarHBondContact OG1-N 2.89Å; T57-V60 PolarHBondContact OG1-O 3.34Å; T57-N78 HydrophobicContact CG2-CB 3.65Å
58S51.2Low50.4Low124 Ų12472.4 Ų72.487%0.86741%0.411SS*.SBendtrans-52.6-16.7-175.8-41.50000114.8
59E46.5Very low49.8Very low123 Ų12372.1 Ų72.158%0.57541%0.409SS*.SBendtrans-129.6-24.1-172-71.2172.7170.800114.7T57T57-E59 PolarHBondContact O-N 3.21Å
60V46.2Very low49.6Very low74 Ų7470.1 Ų70.145%0.44840%0.398SS..  trans-145.7120.4-177.4-171.30000112T57 Q62T57-V60 PolarHBondContact O-N 1.98Å; T57-V60 PolarHBondContact OG1-N 2.89Å; T57-V60 PolarHBondContact OG1-O 3.34Å; V60-Q62 HydrophobicContact CG1-CG 3.99Å; V60-Q62 PolarHBondContact O-N 3.32Å; V60-Q62 VanDerWaalsContact O-N 3.16Å
61D45.8Very low49.6Very low113 Ų11371.3 Ų71.360%0.60441%0.412SS*.EExtended strand (participates in β ladder)trans-73.597165.2-73.4-42.6000109.2C55C55-D61 WeakPolarHBondContact O-CA 3.25Å
62Q46.2Very low49.5Very low95 Ų9576.9 Ų76.944%0.44444%0.44SS..EExtended strand (participates in β ladder)trans-87.1117.8171.3-68-173.4-900109.8C55 V60C55-Q62 HydrophobicContact CB-CB 3.93Å; C55-Q62 PolarHBondContact N-O 3.16Å; C55-Q62 PolarHBondContact O-N 2.92Å; V60-Q62 HydrophobicContact CG1-CG 3.99Å; V60-Q62 PolarHBondContact O-N 3.32Å; V60-Q62 VanDerWaalsContact O-N 3.16Å
63V48.2Very low49.1Very low92 Ų9275.4 Ų75.456%0.55843%0.434SS*.EExtended strand (participates in β ladder)trans-97.6115.3172.7-175.10000108.7I52 C53 I54I52-V63 HydrophobicContact CG2-CG1 3.75Å; C53-V63 WeakPolarHBondContact O-CA 3.2Å; I54-V63 HydrophobicContact CD1-CG2 4.37Å; I54-V63 HydrophobicContact CG1-CG2 4.22Å
64Q49.6Very low49.2Very low93 Ų9377.3 Ų77.344%0.43545%0.446SS..EExtended strand (participates in β ladder)trans-111.3131.4173-160.2173.122.700110M41 C53 L66M41-Q64 HydrophobicContact CE-CB 4.44Å; C53-Q64 PolarHBondContact N-O 2.96Å; C53-Q64 PolarHBondContact O-N 3.34Å; Q64-L66 HydrophobicContact CB-CD1 4.12Å; Q64-L66 HydrophobicContact CG-CD1 3.91Å
65T45.2Very low48.9Very low77 Ų7782.4 Ų82.447%0.47247%0.467SS..EExtended strand (participates in β ladder)trans-102.1115.3173.7-56.80000108.4N50N50-T65 HydrophobicContact CB-CG2 3.71Å
66L50Low48.7Very low13 Ų1382.5 Ų82.57%0.06847%0.468CS..EExtended strand (participates in β ladder)trans-99.2128177.5-75.481000109.9L51 C53 Q64 L70 P74L51-L66 PolarHBondContact N-O 2.77Å; L51-L66 PolarHBondContact O-N 2.91Å; C53-L66 HydrophobicContact CB-CD1 4.44Å; Q64-L66 HydrophobicContact CB-CD1 4.12Å; Q64-L66 HydrophobicContact CG-CD1 3.91Å; L66-L70 HydrophobicContact CB-CB 4.13Å; L66-L70 HydrophobicContact CB-CD1 4.36Å; L66-L70 HydrophobicContact CD2-CB 3.77Å; L66-L70 HydrophobicContact CD2-CD1 3.72Å; L66-L70 HydrophobicContact CD2-CG 4.19Å; L66-L70 HydrophobicContact CG-CD1 4.34Å; L66-P74 HydrophobicContact CD2-CG 4.23Å
67P44.4Very low48.5Very low80 Ų8077.4 Ų77.452%0.51944%0.441SS..PPolyproline II helixtrans-73.3152.816930.4-32.4000110.7L70P67-L70 PolarHBondContact O-N 3.12Å
68P45.1Very low48Very low89 Ų8977.6 Ų77.658%0.57844%0.442SS*.THydrogen-bonded Turntrans-59.1148173.223-33.9000110.9N49N49-P68 WeakPolarHBondContact O-CD 3.49Å
69P47Very low47.6Very low124 Ų12477.1 Ų77.181%0.80543%0.428SS*.THydrogen-bonded Turncis-95.81617.637.4-36.1000115.2S71P69-S71 PolarHBondContact O-N 3.24Å
70L49.9Very low47.3Very low72 Ų7277.5 Ų77.538%0.37742%0.424SS..  trans-67.4101.7179.8-67.4157.7000109.6L66 P67 I72L66-L70 HydrophobicContact CB-CB 4.13Å; L66-L70 HydrophobicContact CB-CD1 4.36Å; L66-L70 HydrophobicContact CD2-CB 3.77Å; L66-L70 HydrophobicContact CD2-CD1 3.72Å; L66-L70 HydrophobicContact CD2-CG 4.19Å; L66-L70 HydrophobicContact CG-CD1 4.34Å; P67-L70 PolarHBondContact O-N 3.12Å; L70-I72 VanDerWaalsContact C-N 3.31Å
71S50.9Low46.8Very low90 Ų9084.2 Ų84.263%0.62944%0.442SS*.  trans-90.15.1178.451.40000113.2L51 P69L51-S71 WeakPolarHBondContact CD1-O 3.41Å; P69-S71 PolarHBondContact O-N 3.24Å
72I50.1Low46.1Very low124 Ų12485.7 Ų85.764%0.63645%0.448SS*.SBendtrans-134.2137.3-172-53.4174.8000108.9L70L70-I72 VanDerWaalsContact C-N 3.31Å
73C49.2Very low45.3Very low15 Ų1589.5 Ų89.510%0.10147%0.466CS..  trans-75126.6168.1-71.50000111M41 V43 L51 C53M41-C73 HydrophobicContact CB-CB 3.78Å; V43-C73 HydrophobicContact CG2-CB 4.37Å; V43-C73 VanDerWaalsContact CG2-SG 3.51Å; L51-C73 HydrophobicContact CD2-CB 4.48Å; L51-C73 WeakPolarHBondContact CD2-SG 2.92Å; C53-C73 WeakPolarHBondContact CA-SG 2.83Å; C53-C73 HydrophobicContact CB-CB 3.7Å; C53-C73 WeakPolarHBondContact CB-SG 3.24Å; C53-C73 WeakPolarHBondContact SG-CA 2.98Å; C53-C73 WeakPolarHBondContact SG-CB 3.06Å; C53-C73 CovalentContact SG-SG 2.02Å; C53-C73 PolarHBondContact SG-SG 2.84Å
74P55.1Low44.7Very low41 Ų4193.4 Ų93.427%0.26650%0.497SS..  trans-68.8175.6172.429.9-33.9000111.3M41 L66M41-P74 WeakPolarHBondContact CB-O 3.25Å; M41-P74 HydrophobicContact CE-CG 4.47Å; M41-P74 WeakPolarHBondContact CG-O 3.42Å; M41-P74 HydrophobicContact SD-CG 4.07Å; L66-P74 HydrophobicContact CD2-CG 4.23Å
75F49.9Very low44.4Very low151 Ų15193.4 Ų93.466%0.66250%0.5SS*.EExtended strand (participates in β ladder)trans-76.7156.4170.9-58.6-90000110.7V38 P40V38-F75 HydrophobicContact CG1-CB 3.84Å; V38-F75 HydrophobicContact CG1-CD1 4.19Å; V38-F75 HydrophobicContact CG1-CG 4.22Å; P40-F75 HydrophobicContact CB-CD1 4.49Å
76C50.2Low44.4Very low3 Ų394.3 Ų94.32%0.0250%0.502CS..EExtended strand (participates in β ladder)trans-112.4151.5168.753.50000110.8A39 M41 C55A39-C76 PolarHBondContact N-O 2.99Å; A39-C76 PolarHBondContact O-N 3.15Å; A39-C76 PolarHBondContact O-SG 3Å; M41-C76 HydrophobicContact CE-CB 3.56Å; M41-C76 HydrophobicContact CG-CB 3.89Å; C55-C76 HydrophobicContact CB-CB 3.38Å; C55-C76 WeakPolarHBondContact CB-SG 3.4Å; C55-C76 WeakPolarHBondContact SG-CB 3.45Å; C55-C76 CovalentContact SG-SG 1.98Å; C55-C76 PolarHBondContact SG-SG 2.65Å
77V45.7Very low44.1Very low20 Ų2098.8 Ų98.812%0.12153%0.526CS..EExtended strand (participates in β ladder)trans-113.3119.3175.61780000108.6F29 Q36 V38 I79F29-V77 HydrophobicContact CD1-CG2 4.34Å; F29-V77 HydrophobicContact CD2-CG2 4.22Å; F29-V77 HydrophobicContact CE1-CB 4.09Å; F29-V77 HydrophobicContact CE1-CG1 4.27Å; F29-V77 HydrophobicContact CE1-CG2 3.63Å; F29-V77 HydrophobicContact CE2-CG2 3.48Å; F29-V77 VanDerWaalsContact CE2-CG2 3.48Å; F29-V77 HydrophobicContact CZ-CB 4.02Å; F29-V77 HydrophobicContact CZ-CG2 3.16Å; Q36-V77 HydrophobicContact CB-CG1 3.93Å; Q36-V77 HydrophobicContact CG-CG1 4.14Å; V38-V77 HydrophobicContact CG2-CG2 4.28Å; V77-I79 HydrophobicContact CG1-CG1 4.32Å; V77-I79 PolarHBondContact O-N 2.77Å
78N42.4Very low44.1Very low17 Ų1799.9 Ų99.99%0.09153%0.526CS..EExtended strand (participates in β ladder)trans-77.9101.6166.5-163.81000107.7T37 T57 R80T37-N78 PolarHBondContact O-N 2.75Å; T37-N78 VanDerWaalsContact O-N 3.12Å; T57-N78 HydrophobicContact CG2-CB 3.65Å; N78-R80 PolarHBondContact O-N 3.39Å; N78-R80 VanDerWaalsContact O-N 3.15Å
79I42.4Very low44Very low113 Ų113100.6 Ų100.658%0.57952%0.523SS*.EExtended strand (participates in β ladder)trans-75.4100162.9-55.2171.1000104V77 R81V77-I79 HydrophobicContact CG1-CG1 4.32Å; V77-I79 PolarHBondContact O-N 2.77Å; I79-R81 PolarHBondContact O-N 2.83Å
80R40Very low43.8Very low132 Ų13299 Ų9950%0.49850%0.504SS..  trans-52.7104157.3-88.8-172.7175.6179.71.7104.9E35 N78 I82E35-R80 WeakPolarHBondContact OE2-CD 3.46Å; E35-R80 IonicContact OE2-CZ 3.96Å; E35-R80 IonicContact OE2-NH1 2.98Å; E35-R80 PolarHBondContact OE2-NH1 2.81Å; N78-R80 PolarHBondContact O-N 3.39Å; N78-R80 VanDerWaalsContact O-N 3.15Å; R80-I82 VanDerWaalsContact C-N 3.29Å; R80-I82 PolarHBondContact O-N 3.49Å
81R35.6Very low43.4Very low214 Ų214100.9 Ų100.981%0.80851%0.513SS*.  trans-60.5107.8171.4-145.9179.7-164.6173.63.7102.2I79 Q83I79-R81 PolarHBondContact O-N 2.83Å; R81-Q83 PolarHBondContact O-N 2.84Å
82I30.4Very low42.8Very low145 Ų145101.8 Ų101.874%0.74450%0.504SS*.  trans-59.786.7168.6-59168000103.9R80 S84R80-I82 VanDerWaalsContact C-N 3.29Å; R80-I82 PolarHBondContact O-N 3.49Å; I82-S84 PolarHBondContact O-N 2.98Å
83Q30.3Very low42.2Very low175 Ų17599.9 Ų99.982%0.81849%0.493SS*.  trans-71.388157.3-77.7-168.6-22.600103.3R81R81-Q83 PolarHBondContact O-N 2.84Å
84S34.8Very low41.5Very low173 Ų173107.6 Ų107.6100%1.2153%0.529SS*.  trans-55.20155.6178.50000110.3I82I82-S84 PolarHBondContact O-N 2.98Å

Retrieved 84 of 84 residues in 104 ms (Link to these results)