A0A5K4F530_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A5K4F530, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 71 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
1M29.2Very low35.4Very low231 Ų231137.9 Ų137.9100%1.13874%0.738SS**  0124.40-69171.5-161.300107.2
2T37.4Very low35.6Very low132 Ų132134.8 Ų134.881%0.8173%0.728SS**  trans-90.2106.9-179.3-39.30000107.4L4T2-L4 PolarHBondContact O-N 3.19Å
3E30.4Very low35.3Very low172 Ų172129.2 Ų129.280%0.80472%0.72SS**  trans-63.1103.4177.5-65.8-85.4112.400108.6I5E3-I5 PolarHBondContact O-N 3.06Å
4L29.8Very low35.2Very low126 Ų126127 Ų12766%0.6671%0.706SS**  trans-82.5102.6179.9-143.7106.2000107.4T2 L6 L17T2-L4 PolarHBondContact O-N 3.19Å; L4-L6 PolarHBondContact O-N 3.21Å; L4-L6 VanDerWaalsContact O-N 3.15Å; L4-L17 HydrophobicContact CD2-CD2 4.27Å
5I38.2Very low35.3Very low143 Ų143129.9 Ų129.973%0.73371%0.709SS**  trans-79.4104.5177.9-59.3172.8000108.4E3 A7E3-I5 PolarHBondContact O-N 3.06Å; I5-A7 PolarHBondContact O-N 3.49Å; I5-A7 VanDerWaalsContact O-N 3.12Å
6L31Very low35.6Very low120 Ų120126.9 Ų126.963%0.62869%0.691SS**  trans-76.686.9172.1-159.1102.3000108.6L4 I8L4-L6 PolarHBondContact O-N 3.21Å; L4-L6 VanDerWaalsContact O-N 3.15Å; L6-I8 HydrophobicContact CD2-CD1 3.85Å; L6-I8 HydrophobicContact CD2-CG1 3.82Å; L6-I8 HydrophobicContact CG-CG1 4.45Å; L6-I8 PolarHBondContact O-N 3.06Å
7A40.8Very low35.5Very low79 Ų79127.3 Ų127.365%0.65369%0.692SS**  trans-85101.6172.700000109.1I5 D9I5-A7 PolarHBondContact O-N 3.49Å; I5-A7 VanDerWaalsContact O-N 3.12Å; A7-D9 PolarHBondContact O-N 3.34Å
8I34.8Very low35.7Very low121 Ų121125.7 Ų125.762%0.62168%0.68SS**  trans-81.7106.9172.3-58.3173.6000107.5L6 Q10L6-I8 HydrophobicContact CD2-CD1 3.85Å; L6-I8 HydrophobicContact CD2-CG1 3.82Å; L6-I8 HydrophobicContact CG-CG1 4.45Å; L6-I8 PolarHBondContact O-N 3.06Å; I8-Q10 HydrophobicContact CG2-CG 3.98Å; I8-Q10 PolarHBondContact O-N 3.09Å
9D38.3Very low36.1Very low78 Ų78128.3 Ų128.342%0.41768%0.684SS.*  trans-84103.6160.8-170.7-66.5000107.7A7 T11 V12 G13A7-D9 PolarHBondContact O-N 3.34Å; D9-T11 PolarHBondContact O-N 3.3Å; D9-T11 WeakPolarHBondContact OD1-CA 3.46Å; D9-T11 VanDerWaalsContact OD1-CB 3.31Å; D9-T11 WeakPolarHBondContact OD1-CB 3.21Å; D9-T11 PolarHBondContact OD1-N 3.31Å; D9-T11 PolarHBondContact OD1-OG1 2.81Å; D9-V12 PolarHBondContact OD1-N 2.85Å; D9-G13 PolarHBondContact O-N 3.46Å
10Q38.8Very low36.5Very low187 Ų187128.1 Ų128.187%0.87469%0.69SS**THydrogen-bonded Turntrans-65.7-13-179.4-70.6-170.74.400113.1I8I8-Q10 HydrophobicContact CG2-CG 3.98Å; I8-Q10 PolarHBondContact O-N 3.09Å
11T40.7Very low36.9Very low128 Ų128126 Ų12679%0.78568%0.682SS**THydrogen-bonded Turntrans-89.1-28.4-177.216.20000113.5D9D9-T11 PolarHBondContact O-N 3.3Å; D9-T11 WeakPolarHBondContact OD1-CA 3.46Å; D9-T11 VanDerWaalsContact OD1-CB 3.31Å; D9-T11 WeakPolarHBondContact OD1-CB 3.21Å; D9-T11 PolarHBondContact OD1-N 3.31Å; D9-T11 PolarHBondContact OD1-OG1 2.81Å
12V37.4Very low37.6Very low101 Ų101126.2 Ų126.261%0.61267%0.67SS**THydrogen-bonded Turntrans-123.4-0-174.6-154.60000113.8D9 L14D9-V12 PolarHBondContact OD1-N 2.85Å; V12-L14 PolarHBondContact O-N 3.4Å
13G32.5Very low38.2Very low61 Ų61128.7 Ų128.763%0.62967%0.665SS**  trans55.722.4173.900000113.8D9D9-G13 PolarHBondContact O-N 3.46Å
14L33.7Very low39.2Very low99 Ų99123.5 Ų123.552%0.51865%0.647SS.*  trans-100.7106.8-172.6-13591.6000109.8V12 L16V12-L14 PolarHBondContact O-N 3.4Å; L14-L16 HydrophobicContact CD2-CD1 4.36Å; L14-L16 HydrophobicContact CD2-CD2 4.37Å; L14-L16 HydrophobicContact CD2-CG 4.15Å; L14-L16 PolarHBondContact O-N 3.12Å
15F36.5Very low40.2Very low171 Ų171125.3 Ų125.375%0.7566%0.656SS**  trans-68.188.9171.2-68.3-95.6000109.9L17F15-L17 VanDerWaalsContact C-N 3.32Å; F15-L17 PolarHBondContact O-N 3.46Å; F15-L17 VanDerWaalsContact O-N 3.08Å
16L39.6Very low40.9Very low81 Ų81129.4 Ų129.442%0.42466%0.663SS.*  trans-85.177.6172.7-79.3163.6000110.6L14 M18L14-L16 HydrophobicContact CD2-CD1 4.36Å; L14-L16 HydrophobicContact CD2-CD2 4.37Å; L14-L16 HydrophobicContact CD2-CG 4.15Å; L14-L16 PolarHBondContact O-N 3.12Å; L16-M18 HydrophobicContact CD2-CG 4.1Å; L16-M18 PolarHBondContact O-N 3.17Å
17L34.4Very low42.3Very low134 Ų134125.6 Ų125.670%0.70265%0.646SS**  trans-6284.4157.5-92.7121.5000108.9L4 F15L4-L17 HydrophobicContact CD2-CD2 4.27Å; F15-L17 VanDerWaalsContact C-N 3.32Å; F15-L17 PolarHBondContact O-N 3.46Å; F15-L17 VanDerWaalsContact O-N 3.08Å
18M40Very low43.3Very low98 Ų98128.6 Ų128.648%0.48366%0.656SS.*  trans-135.5117.8177-71.7-73.7164.400110.3L16L16-M18 HydrophobicContact CD2-CG 4.1Å; L16-M18 PolarHBondContact O-N 3.17Å
19K41.9Very low44.9Very low176 Ų176125.5 Ų125.577%0.76565%0.649SS**  trans-45.6123.6168.3-74179.2173.8176.20108.9T21K19-T21 WeakPolarHBondContact CB-OG1 3.37Å; K19-T21 PolarHBondContact O-N 2.95Å
20P45Very low46.2Very low123 Ų123128.4 Ų128.480%0.79966%0.664SS**SBendtrans-74.672.6173.831.4-33.5000108.7
21T44.4Very low47.6Very low86 Ų86126.9 Ų126.953%0.52866%0.655SS.*SBendtrans-146.5109.6-17650.80000110.3K19 R23K19-T21 WeakPolarHBondContact CB-OG1 3.37Å; K19-T21 PolarHBondContact O-N 2.95Å; T21-R23 VanDerWaalsContact C-N 3.25Å; T21-R23 PolarHBondContact O-N 3.13Å
22R44.5Very low48.6Very low234 Ų234122.4 Ų122.488%0.88363%0.628SS**SBendtrans62.8-21.8165.4-57.2-169.7-177.5-171.11.4120C24 L25R22-C24 VanDerWaalsContact C-N 3.3Å; R22-C24 PolarHBondContact O-N 2.97Å; R22-L25 PolarHBondContact O-N 3.19Å
23R49Very low50Low185 Ų185120.6 Ų120.670%0.69862%0.618SS**G310 helixtrans-66.1-25.4-174.7-76.3-174.5177.9176.1-1.5114.7T21 L25 R26T21-R23 VanDerWaalsContact C-N 3.25Å; T21-R23 PolarHBondContact O-N 3.13Å; R23-L25 VanDerWaalsContact C-N 3.26Å; R23-L25 PolarHBondContact O-N 3.45Å; R23-R26 PolarHBondContact O-N 2.61Å
24C52.4Low51.7Low63 Ų63120.9 Ų120.943%0.42661%0.61SS.*G310 helixtrans-63.4-27.9179.4-81.40000114.4R22 R26 C36R22-C24 VanDerWaalsContact C-N 3.3Å; R22-C24 PolarHBondContact O-N 2.97Å; C24-R26 PolarHBondContact O-N 3.24Å; C24-C36 WeakPolarHBondContact CA-SG 3.29Å; C24-C36 HydrophobicContact CB-CB 3.72Å; C24-C36 WeakPolarHBondContact CB-SG 3.5Å; C24-C36 WeakPolarHBondContact SG-CB 3.44Å; C24-C36 CovalentContact SG-SG 2.04Å; C24-C36 PolarHBondContact SG-SG 2.68Å
25L50.2Low53.4Low164 Ų164118.1 Ų118.186%0.85960%0.597SS**G310 helixtrans-72.6-12.3179.2-75.3163.9000113.8R22 R23R22-L25 PolarHBondContact O-N 3.19Å; R23-L25 VanDerWaalsContact C-N 3.26Å; R23-L25 PolarHBondContact O-N 3.45Å
26R52.7Low54.8Low228 Ų228110.5 Ų110.586%0.8657%0.565SS**G310 helixtrans-111.614.2-175.5-74-171.5169.3-175.1-3.5113.8R23 C24R23-R26 PolarHBondContact O-N 2.61Å; C24-R26 PolarHBondContact O-N 3.24Å
27C60.2Low56.2Low41 Ų41111.8 Ų111.828%0.27757%0.572SS.*  trans-85.4120.9-177.1-84.30000112.2C32C27-C32 HydrophobicContact CB-CB 3.44Å; C27-C32 VanDerWaalsContact CB-CB 3.44Å; C27-C32 WeakPolarHBondContact CB-SG 3.33Å; C27-C32 WeakPolarHBondContact SG-CB 3.47Å; C27-C32 CovalentContact SG-SG 2.01Å; C27-C32 PolarHBondContact SG-SG 2.61Å
28T61.2Low58.1Low142 Ų142109.6 Ų109.687%0.87156%0.563SS**  trans-100.4-18.1176.651.50000113.3
29A68.6Low59.2Low56 Ų56109.1 Ų109.146%0.46356%0.559SS.*SBendtrans-88.6134.2178.600000111.2F31 C32 V33A29-F31 PolarHBondContact O-N 2.83Å; A29-F31 VanDerWaalsContact O-N 3.15Å; A29-C32 PolarHBondContact O-N 3.35Å; A29-V33 PolarHBondContact O-N 2.79Å
30D66Low60.5Low138 Ų138105.8 Ų105.874%0.73855%0.549SS*.Hα-helixtrans-52.5-38.5-178.1-65.8-40.1000113.1C32 V33 S34D30-C32 VanDerWaalsContact C-N 3.33Å; D30-C32 PolarHBondContact O-N 3.19Å; D30-V33 PolarHBondContact O-N 2.75Å; D30-S34 PolarHBondContact O-N 3Å; D30-S34 PolarHBondContact O-OG 2.89Å
31F68.6Low61.8Low156 Ų156102.8 Ų102.868%0.68453%0.534SS*.Hα-helixtrans-60.7-42.1176.7179.5-102.4000112A29 S34 V35A29-F31 PolarHBondContact O-N 2.83Å; A29-F31 VanDerWaalsContact O-N 3.15Å; F31-S34 PolarHBondContact O-N 3.15Å; F31-V35 HydrophobicContact CD1-CG2 4.43Å; F31-V35 HydrophobicContact CE1-CG2 3.97Å; F31-V35 HydrophobicContact CE2-CG2 4.2Å; F31-V35 HydrophobicContact CZ-CG2 3.85Å; F31-V35 WeakPolarHBondContact O-CG2 2.95Å; F31-V35 PolarHBondContact O-N 3.36Å; F31-V35 VanDerWaalsContact O-N 3.09Å
32C61.4Low63.1Low34 Ų34103.5 Ų103.523%0.2353%0.534CS..Hα-helixtrans-70.3-38.6179.9-177.40000111.9C27 A29 D30 S34 V35 C36C27-C32 HydrophobicContact CB-CB 3.44Å; C27-C32 VanDerWaalsContact CB-CB 3.44Å; C27-C32 WeakPolarHBondContact CB-SG 3.33Å; C27-C32 WeakPolarHBondContact SG-CB 3.47Å; C27-C32 CovalentContact SG-SG 2.01Å; C27-C32 PolarHBondContact SG-SG 2.61Å; A29-C32 PolarHBondContact O-N 3.35Å; D30-C32 VanDerWaalsContact C-N 3.33Å; D30-C32 PolarHBondContact O-N 3.19Å; C32-S34 VanDerWaalsContact C-N 3.29Å; C32-S34 PolarHBondContact O-N 2.74Å; C32-V35 PolarHBondContact O-N 3.32Å; C32-C36 WeakPolarHBondContact O-CB 2.96Å; C32-C36 PolarHBondContact O-N 2.74Å; C32-C36 PolarHBondContact O-SG 2.87Å
33V66.6Low64.2Low63 Ų6397 Ų9738%0.38252%0.516SS..Hα-helixtrans-59.2-45.3175.3178.10000110.1A29 D30 C36 L37A29-V33 PolarHBondContact O-N 2.79Å; D30-V33 PolarHBondContact O-N 2.75Å; V33-C36 WeakPolarHBondContact O-CB 3.35Å; V33-C36 PolarHBondContact O-N 3Å; V33-C36 VanDerWaalsContact O-N 3.17Å; V33-L37 HydrophobicContact CG1-CD1 4.13Å; V33-L37 HydrophobicContact CG1-CG 4.38Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 2.97Å
34S68.1Low65Low67 Ų6790.4 Ų90.447%0.46950%0.501SS..Hα-helixtrans-59.8-49.3178.7-58.10000112.2D30 F31 C32 C36 L37 V38D30-S34 PolarHBondContact O-N 3Å; D30-S34 PolarHBondContact O-OG 2.89Å; F31-S34 PolarHBondContact O-N 3.15Å; C32-S34 VanDerWaalsContact C-N 3.29Å; C32-S34 PolarHBondContact O-N 2.74Å; S34-C36 VanDerWaalsContact C-N 3.27Å; S34-C36 PolarHBondContact O-N 3.45Å; S34-L37 PolarHBondContact O-N 3.46Å; S34-V38 WeakPolarHBondContact O-CG2 3.48Å; S34-V38 PolarHBondContact O-N 3.12Å
35V69.5Low65.5Low40 Ų4094.8 Ų94.824%0.24251%0.513CS..Hα-helixtrans-61.7-36.7176.5174.60000111.4F31 C32 K39F31-V35 HydrophobicContact CD1-CG2 4.43Å; F31-V35 HydrophobicContact CE1-CG2 3.97Å; F31-V35 HydrophobicContact CE2-CG2 4.2Å; F31-V35 HydrophobicContact CZ-CG2 3.85Å; F31-V35 WeakPolarHBondContact O-CG2 2.95Å; F31-V35 PolarHBondContact O-N 3.36Å; F31-V35 VanDerWaalsContact O-N 3.09Å; C32-V35 PolarHBondContact O-N 3.32Å; V35-K39 WeakPolarHBondContact O-CG 3.12Å; V35-K39 PolarHBondContact O-N 2.72Å
36C65.9Low66.1Low12 Ų1290 Ų908%0.08149%0.491CS..Hα-helixtrans-69.1-40177.2-76.50000113.1C24 C32 V33 S34 K39 L40C24-C36 WeakPolarHBondContact CA-SG 3.29Å; C24-C36 HydrophobicContact CB-CB 3.72Å; C24-C36 WeakPolarHBondContact CB-SG 3.5Å; C24-C36 WeakPolarHBondContact SG-CB 3.44Å; C24-C36 CovalentContact SG-SG 2.04Å; C24-C36 PolarHBondContact SG-SG 2.68Å; C32-C36 WeakPolarHBondContact O-CB 2.96Å; C32-C36 PolarHBondContact O-N 2.74Å; C32-C36 PolarHBondContact O-SG 2.87Å; V33-C36 WeakPolarHBondContact O-CB 3.35Å; V33-C36 PolarHBondContact O-N 3Å; V33-C36 VanDerWaalsContact O-N 3.17Å; S34-C36 VanDerWaalsContact C-N 3.27Å; S34-C36 PolarHBondContact O-N 3.45Å; C36-K39 PolarHBondContact O-N 3.31Å; C36-L40 PolarHBondContact O-N 3.35Å
37L68.9Low66.4Low108 Ų10884 Ų8457%0.56548%0.475SS*.Hα-helixtrans-64.3-42.7175-72.4174.9000111.4V33 S34 K39 L40 A41V33-L37 HydrophobicContact CG1-CD1 4.13Å; V33-L37 HydrophobicContact CG1-CG 4.38Å; V33-L37 WeakPolarHBondContact O-CG 3.39Å; V33-L37 PolarHBondContact O-N 2.97Å; S34-L37 PolarHBondContact O-N 3.46Å; L37-K39 VanDerWaalsContact C-N 3.32Å; L37-K39 PolarHBondContact O-N 2.82Å; L37-L40 PolarHBondContact O-N 2.83Å; L37-A41 VanDerWaalsContact O-CB 3.32Å; L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 3.35Å
38V74.3Confident66.2Low87 Ų8789.1 Ų89.153%0.52750%0.497SS..Hα-helixtrans-60.7-42.7175.1174.30000110.7S34 A41 I42S34-V38 WeakPolarHBondContact O-CG2 3.48Å; S34-V38 PolarHBondContact O-N 3.12Å; V38-A41 PolarHBondContact O-N 2.79Å; V38-I42 HydrophobicContact CG1-CD1 3.73Å; V38-I42 HydrophobicContact CG1-CG1 4.39Å; V38-I42 VanDerWaalsContact O-CG1 3.26Å; V38-I42 WeakPolarHBondContact O-CG1 3.24Å; V38-I42 PolarHBondContact O-N 3.41Å
39K64.1Low65.8Low88 Ų8886.2 Ų86.238%0.38348%0.482SS..Hα-helixtrans-63.4-44.5175.5-76.2-177.3-180-171.60112.9V35 C36 L37 A41 I42 L43V35-K39 WeakPolarHBondContact O-CG 3.12Å; V35-K39 PolarHBondContact O-N 2.72Å; C36-K39 PolarHBondContact O-N 3.31Å; L37-K39 VanDerWaalsContact C-N 3.32Å; L37-K39 PolarHBondContact O-N 2.82Å; K39-A41 VanDerWaalsContact C-N 3.32Å; K39-I42 PolarHBondContact O-N 3.48Å; K39-L43 WeakPolarHBondContact O-CB 3.4Å; K39-L43 PolarHBondContact O-N 3.45Å
40L69.3Low64.8Low107 Ų10789.7 Ų89.756%0.5649%0.493SS*.Hα-helixtrans-63.8-39.3176-79171.3000111.4C36 L37 L43 A44C36-L40 PolarHBondContact O-N 3.35Å; L37-L40 PolarHBondContact O-N 2.83Å; L40-L43 PolarHBondContact O-N 2.86Å; L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 2.74Å
41A71.7Confident63.7Low60 Ų6087.7 Ų87.750%0.49649%0.486SS..Hα-helixtrans-66.7-43.5177.400000112L37 V38 K39 A44 K45L37-A41 VanDerWaalsContact O-CB 3.32Å; L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 3.35Å; V38-A41 PolarHBondContact O-N 2.79Å; K39-A41 VanDerWaalsContact C-N 3.32Å; A41-A44 PolarHBondContact O-N 2.91Å; A41-K45 WeakPolarHBondContact O-CB 3.11Å; A41-K45 PolarHBondContact O-N 3.43Å
42I71.6Confident62.5Low101 Ų10187.3 Ų87.352%0.51848%0.484SS..Hα-helixtrans-64.8-44.1175.3-66.8166.6000110.2V38 K39 K45 T46V38-I42 HydrophobicContact CG1-CD1 3.73Å; V38-I42 HydrophobicContact CG1-CG1 4.39Å; V38-I42 VanDerWaalsContact O-CG1 3.26Å; V38-I42 WeakPolarHBondContact O-CG1 3.24Å; V38-I42 PolarHBondContact O-N 3.41Å; K39-I42 PolarHBondContact O-N 3.48Å; I42-K45 PolarHBondContact O-N 3.26Å; I42-T46 WeakPolarHBondContact O-CB 3.34Å; I42-T46 PolarHBondContact O-N 3.19Å; I42-T46 PolarHBondContact O-OG1 3.29Å
43L67.9Low61.6Low98 Ų9890.5 Ų90.551%0.51350%0.504SS..Hα-helixtrans-63.7-45.2177.8-175.366.3000111.2K39 L40 T46 L47K39-L43 WeakPolarHBondContact O-CB 3.4Å; K39-L43 PolarHBondContact O-N 3.45Å; L40-L43 PolarHBondContact O-N 2.86Å; L43-T46 PolarHBondContact O-N 2.88Å; L43-L47 HydrophobicContact CD1-CD1 4.34Å; L43-L47 HydrophobicContact CG-CD1 3.92Å; L43-L47 WeakPolarHBondContact O-CB 3.17Å; L43-L47 PolarHBondContact O-N 3.46Å
44A66.6Low60.4Low45 Ų4595.3 Ų95.337%0.37252%0.522SS..Hα-helixtrans-62.8-42.8175.900000111.1L40 A41 T46 L47 M48L40-A44 WeakPolarHBondContact O-CB 3.33Å; L40-A44 PolarHBondContact O-N 2.74Å; A41-A44 PolarHBondContact O-N 2.91Å; A44-T46 VanDerWaalsContact C-N 3.34Å; A44-T46 PolarHBondContact O-N 2.8Å; A44-L47 PolarHBondContact O-N 2.77Å; A44-M48 VanDerWaalsContact O-CB 3.26Å; A44-M48 WeakPolarHBondContact O-CB 3.26Å; A44-M48 WeakPolarHBondContact O-CG 3.26Å; A44-M48 PolarHBondContact O-N 3.48Å
45K63.1Low59Low155 Ų155102.2 Ų102.267%0.67454%0.538SS*.Hα-helixtrans-65.7-37.6176.6-168.4174.6-175-179.40112.1A41 I42 M48 S49A41-K45 WeakPolarHBondContact O-CB 3.11Å; A41-K45 PolarHBondContact O-N 3.43Å; I42-K45 PolarHBondContact O-N 3.26Å; K45-M48 PolarHBondContact O-N 3.05Å; K45-S49 VanDerWaalsContact O-CB 3.24Å; K45-S49 WeakPolarHBondContact O-CB 3.33Å; K45-S49 PolarHBondContact O-N 2.56Å; K45-S49 PolarHBondContact O-OG 2.95Å
46T61.8Low57.4Low65 Ų65105.9 Ų105.940%0.39956%0.562SS.*Hα-helixtrans-68.1-49.2175.5-53.30000109.8I42 L43 A44 M48 S49 D50I42-T46 WeakPolarHBondContact O-CB 3.34Å; I42-T46 PolarHBondContact O-N 3.19Å; I42-T46 PolarHBondContact O-OG1 3.29Å; L43-T46 PolarHBondContact O-N 2.88Å; A44-T46 VanDerWaalsContact C-N 3.34Å; A44-T46 PolarHBondContact O-N 2.8Å; T46-M48 VanDerWaalsContact C-N 3.3Å; T46-M48 PolarHBondContact O-N 3.08Å; T46-S49 CarbonylContact O-C 3.55Å; T46-S49 PolarHBondContact O-N 2.94Å; T46-D50 WeakPolarHBondContact CG2-OD2 3.31Å; T46-D50 WeakPolarHBondContact O-CB 3.21Å; T46-D50 PolarHBondContact O-N 2.91Å
47L59Low56.1Low102 Ų102111.6 Ų111.653%0.53459%0.591SS.*Hα-helixtrans-56.5-40.9172.1-85.7155000112.1L43 A44 S49 V51L43-L47 HydrophobicContact CD1-CD1 4.34Å; L43-L47 HydrophobicContact CG-CD1 3.92Å; L43-L47 WeakPolarHBondContact O-CB 3.17Å; L43-L47 PolarHBondContact O-N 3.46Å; A44-L47 PolarHBondContact O-N 2.77Å; L47-S49 VanDerWaalsContact C-N 3.31Å; L47-V51 WeakPolarHBondContact O-CA 3.38Å; L47-V51 WeakPolarHBondContact O-CB 3.37Å; L47-V51 WeakPolarHBondContact O-CG2 3.38Å; L47-V51 PolarHBondContact O-N 3.32Å
48M56.2Low54.6Low148 Ų148113.1 Ų113.173%0.72960%0.595SS**Hα-helixtrans-76-17.3177.1-70.5179.481.700113.2A44 K45 T46 V51A44-M48 VanDerWaalsContact O-CB 3.26Å; A44-M48 WeakPolarHBondContact O-CB 3.26Å; A44-M48 WeakPolarHBondContact O-CG 3.26Å; A44-M48 PolarHBondContact O-N 3.48Å; K45-M48 PolarHBondContact O-N 3.05Å; T46-M48 VanDerWaalsContact C-N 3.3Å; T46-M48 PolarHBondContact O-N 3.08Å; M48-V51 CarbonylContact O-C 3.35Å
49S53.1Low53.2Low81 Ų81114.3 Ų114.357%0.56660%0.597SS**Hα-helixtrans-93.9-31.3175.7-57.20000112.1K45 T46 L47 K52K45-S49 VanDerWaalsContact O-CB 3.24Å; K45-S49 WeakPolarHBondContact O-CB 3.33Å; K45-S49 PolarHBondContact O-N 2.56Å; K45-S49 PolarHBondContact O-OG 2.95Å; T46-S49 CarbonylContact O-C 3.55Å; T46-S49 PolarHBondContact O-N 2.94Å; L47-S49 VanDerWaalsContact C-N 3.31Å; S49-K52 PolarHBondContact O-N 3.07Å
50D48.1Very low52.2Low129 Ų129118 Ų11869%0.6962%0.616SS**Hα-helixtrans-80.5-30.9170.6-87.3-56.3000112T46 K52T46-D50 WeakPolarHBondContact CG2-OD2 3.31Å; T46-D50 WeakPolarHBondContact O-CB 3.21Å; T46-D50 PolarHBondContact O-N 2.91Å; D50-K52 PolarHBondContact O-N 3.43Å
51V42.9Very low51.3Low96 Ų96114.7 Ų114.758%0.58260%0.602SS**SBendtrans-73.858.7145.1-170.50000107L47 M48 P53L47-V51 WeakPolarHBondContact O-CA 3.38Å; L47-V51 WeakPolarHBondContact O-CB 3.37Å; L47-V51 WeakPolarHBondContact O-CG2 3.38Å; L47-V51 PolarHBondContact O-N 3.32Å; M48-V51 CarbonylContact O-C 3.35Å; V51-P53 WeakPolarHBondContact O-CD 3.21Å; V51-P53 VanDerWaalsContact O-N 3.08Å
52K43.2Very low50.3Low148 Ų148115.4 Ų115.464%0.64360%0.6SS**  trans-36.7124133.2-145.1177.5-168.21740103S49 D50 Q54S49-K52 PolarHBondContact O-N 3.07Å; D50-K52 PolarHBondContact O-N 3.43Å; K52-Q54 PolarHBondContact O-N 2.89Å
53P41Very low49.4Very low100 Ų100116.4 Ų116.465%0.64960%0.601SS**  trans-51.798.3147.223.3-28.2000102.2V51 R55V51-P53 WeakPolarHBondContact O-CD 3.21Å; V51-P53 VanDerWaalsContact O-N 3.08Å; P53-R55 PolarHBondContact O-N 3.33Å
54Q41.8Very low48.9Very low164 Ų164118.9 Ų118.977%0.76661%0.608SS**  trans-45.3109152.1-93-170.92300100K52 P56K52-Q54 PolarHBondContact O-N 2.89Å; Q54-P56 VanDerWaalsContact O-N 3.1Å
55R40.1Very low48.4Very low213 Ų213122.8 Ų122.880%0.80462%0.618SS**  trans-34.9128.9179.9-63.5178.5-168.7161.70.8104.5P53 L57P53-R55 PolarHBondContact O-N 3.33Å; R55-L57 PolarHBondContact O-N 3.05Å
56P35.1Very low48.1Very low117 Ų117119.4 Ų119.476%0.7661%0.607SS**  trans-41119.417018.5-30.8000104.7Q54 H58Q54-P56 VanDerWaalsContact O-N 3.1Å; P56-H58 PolarHBondContact O-N 2.83Å
57L39.2Very low47.5Very low131 Ų131120.8 Ų120.869%0.68661%0.611SS**  trans-41.8137.9-177.3-98.794.6000105R55 I59R55-L57 PolarHBondContact O-N 3.05Å; L57-I59 HydrophobicContact CB-CD1 4.3Å; L57-I59 HydrophobicContact CB-CG1 3.98Å; L57-I59 WeakPolarHBondContact O-CG1 3.04Å; L57-I59 PolarHBondContact O-N 3.34Å
58H36.4Very low47.5Very low140 Ų140121.7 Ų121.765%0.64862%0.617SS**SBendtrans-6442.9-178.1-158.3-138.1000111.2P56 H60 S61 T62P56-H58 PolarHBondContact O-N 2.83Å; H58-H60 PolarHBondContact O-N 2.86Å; H58-S61 WeakPolarHBondContact CE1-CB 3.32Å; H58-S61 PolarHBondContact CE1-OG 2.93Å; H58-S61 VanDerWaalsContact CG-CB 3.5Å; H58-S61 WeakPolarHBondContact ND1-CB 3.14Å; H58-S61 PolarHBondContact ND1-OG 3.31Å; H58-S61 WeakPolarHBondContact NE2-CB 3.35Å; H58-S61 PolarHBondContact O-N 2.04Å; H58-T62 PolarHBondContact O-N 3.43Å; H58-T62 VanDerWaalsContact O-N 3.12Å; H58-T62 PolarHBondContact O-OG1 2.87Å
59I45.1Very low47.6Very low112 Ų112122 Ų12257%0.57462%0.62SS**Hα-helixtrans-52.1-35.7169.9-61.2167.1000108.2L57 S61 T62 F63L57-I59 HydrophobicContact CB-CD1 4.3Å; L57-I59 HydrophobicContact CB-CG1 3.98Å; L57-I59 WeakPolarHBondContact O-CG1 3.04Å; L57-I59 PolarHBondContact O-N 3.34Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 3.17Å; I59-T62 PolarHBondContact O-N 3.41Å; I59-F63 VanDerWaalsContact O-CB 3.29Å; I59-F63 WeakPolarHBondContact O-CB 2.95Å; I59-F63 PolarHBondContact O-N 2.93Å
60H43.5Very low48.1Very low165 Ų165124.4 Ų124.476%0.76463%0.626SS**Hα-helixtrans-65.7-31.1177.1-141.2146.4000113.2H58 K64H58-H60 PolarHBondContact O-N 2.86Å; H60-K64 WeakPolarHBondContact O-CB 3.48Å; H60-K64 PolarHBondContact O-N 3.28Å; H60-K64 VanDerWaalsContact O-N 3.13Å
61S50.3Low48.2Very low39 Ų39129.6 Ų129.627%0.27364%0.642SS.*Hα-helixtrans-80.9-38.9175.6-173.50000112.2H58 I59 F63 K64 E65H58-S61 WeakPolarHBondContact CE1-CB 3.32Å; H58-S61 PolarHBondContact CE1-OG 2.93Å; H58-S61 VanDerWaalsContact CG-CB 3.5Å; H58-S61 WeakPolarHBondContact ND1-CB 3.14Å; H58-S61 PolarHBondContact ND1-OG 3.31Å; H58-S61 WeakPolarHBondContact NE2-CB 3.35Å; H58-S61 PolarHBondContact O-N 2.04Å; I59-S61 VanDerWaalsContact C-N 3.3Å; I59-S61 PolarHBondContact O-N 3.17Å; S61-F63 VanDerWaalsContact C-N 3.29Å; S61-F63 PolarHBondContact O-N 3.39Å; S61-K64 CarbonylContact O-C 3.6Å; S61-K64 PolarHBondContact O-N 3.09Å; S61-E65 WeakPolarHBondContact O-CB 3.34Å; S61-E65 PolarHBondContact O-N 3.4Å
62T51.1Low48.5Very low74 Ų74131.3 Ų131.345%0.45465%0.645SS.*Hα-helixtrans-65.5-37.5175.3-37.90000110.5H58 I59 K64 E65 I66H58-T62 PolarHBondContact O-N 3.43Å; H58-T62 VanDerWaalsContact O-N 3.12Å; H58-T62 PolarHBondContact O-OG1 2.87Å; I59-T62 PolarHBondContact O-N 3.41Å; T62-K64 VanDerWaalsContact C-N 3.32Å; T62-K64 PolarHBondContact O-N 3.03Å; T62-E65 PolarHBondContact O-N 2.01Å; T62-I66 HydrophobicContact CG2-CD1 4.11Å; T62-I66 WeakPolarHBondContact O-CB 3.39Å; T62-I66 WeakPolarHBondContact O-CG1 3.4Å; T62-I66 PolarHBondContact O-N 3.27Å
63F51.7Low48.8Very low123 Ų123130.4 Ų130.454%0.53965%0.645SS.*Hα-helixtrans-64.6-37.4173.3-128.6-89.7000112.2I59 S61 N67I59-F63 VanDerWaalsContact O-CB 3.29Å; I59-F63 WeakPolarHBondContact O-CB 2.95Å; I59-F63 PolarHBondContact O-N 2.93Å; S61-F63 VanDerWaalsContact C-N 3.29Å; S61-F63 PolarHBondContact O-N 3.39Å; F63-N67 WeakPolarHBondContact O-CB 3.01Å; F63-N67 PolarHBondContact O-N 3.23Å
64K57.7Low49.2Very low150 Ų150132.1 Ų132.165%0.65265%0.645SS**Hα-helixtrans-70.7-35.2175.9-162.4175-176.4-178.20112.2H60 S61 T62 N68H60-K64 WeakPolarHBondContact O-CB 3.48Å; H60-K64 PolarHBondContact O-N 3.28Å; H60-K64 VanDerWaalsContact O-N 3.13Å; S61-K64 CarbonylContact O-C 3.6Å; S61-K64 PolarHBondContact O-N 3.09Å; T62-K64 VanDerWaalsContact C-N 3.32Å; T62-K64 PolarHBondContact O-N 3.03Å; K64-N68 WeakPolarHBondContact O-CB 3.08Å; K64-N68 PolarHBondContact O-N 3.34Å
65E56.6Low49.6Very low126 Ų126130.2 Ų130.259%0.58964%0.638SS**Hα-helixtrans-67.8-45.1173.4-114.3170.3159.600111.7S61 T62 N67 N68 L69S61-E65 WeakPolarHBondContact O-CB 3.34Å; S61-E65 PolarHBondContact O-N 3.4Å; T62-E65 PolarHBondContact O-N 2.01Å; E65-N67 PolarHBondContact O-N 3.22Å; E65-N68 PolarHBondContact O-N 2.89Å; E65-L69 PolarHBondContact O-N 3.43Å
66I56.1Low50.2Low85 Ų85125.1 Ų125.144%0.43663%0.628SS.*Hα-helixtrans-62.4-44.5176-67.1165000110.3T62 N68 L69 I70T62-I66 HydrophobicContact CG2-CD1 4.11Å; T62-I66 WeakPolarHBondContact O-CB 3.39Å; T62-I66 WeakPolarHBondContact O-CG1 3.4Å; T62-I66 PolarHBondContact O-N 3.27Å; I66-N68 VanDerWaalsContact C-N 3.28Å; I66-N68 PolarHBondContact O-N 3.28Å; I66-L69 PolarHBondContact O-N 3.31Å; I66-L69 VanDerWaalsContact O-N 3.09Å; I66-I70 HydrophobicContact CG2-CD1 3.72Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.15Å
67N50Low51.2Low93 Ų93125.6 Ų125.650%0.49762%0.619SS.*Hα-helixtrans-67.4-25.3177.6-85.8-11.5000113.8F63 E65F63-N67 WeakPolarHBondContact O-CB 3.01Å; F63-N67 PolarHBondContact O-N 3.23Å; E65-N67 PolarHBondContact O-N 3.22Å
68N58Low52.1Low122 Ų122125.2 Ų125.265%0.65261%0.614SS**Hα-helixtrans-81.5-18.2172.5-100.113.3000113.1K64 E65 I66K64-N68 WeakPolarHBondContact O-CB 3.08Å; K64-N68 PolarHBondContact O-N 3.34Å; E65-N68 PolarHBondContact O-N 2.89Å; I66-N68 VanDerWaalsContact C-N 3.28Å; I66-N68 PolarHBondContact O-N 3.28Å
69L57.7Low53.3Low153 Ų153124.1 Ų124.180%0.80161%0.611SS**Hα-helixtrans-87.2-17.9175.3-128.794.3000113.2E65 I66E65-L69 PolarHBondContact O-N 3.43Å; I66-L69 PolarHBondContact O-N 3.31Å; I66-L69 VanDerWaalsContact O-N 3.09Å
70I64.7Low54Low132 Ų132125.1 Ų125.168%0.67761%0.614SS**  trans-90.3-7.2179.3-63.8168.5000111.9I66I66-I70 HydrophobicContact CG2-CD1 3.72Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.15Å
71K50.7Low55Low239 Ų239121.5 Ų121.5100%1.03960%0.601SS**  trans-900166.6-96.4-172.3174.6-1770110.8

Retrieved 71 of 71 residues in 13.6 ms (Link to these results)