A0A061IJZ9_CRIGR Loading...

Beta-defensin 14

AlphaFold DB , UniProt , Accession A0A061IJZ9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100769521, Length 68 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
1M58.2Low75.2Confident192 Ų192138.5 Ų138.595%0.94665%0.653SS**  0-36.60-60-46.4-168.600115Y5M1-Y5 WeakPolarHBondContact O-CD2 3.46Å; M1-Y5 WeakPolarHBondContact O-CE2 3.45Å
2R65.6Low75.1Confident221 Ų221134.2 Ų134.283%0.83464%0.636SS**Hα-helixtrans-71.9-31.3-178-77.2-176.8167.2175.2-3.6115.9H4 Y5 L6R2-H4 PolarHBondContact O-N 3.34Å; R2-Y5 PolarHBondContact O-N 3.2Å; R2-L6 PolarHBondContact O-N 3.3Å
3L75.9Confident75Confident134 Ų134135 Ų13570%0.70265%0.645SS**Hα-helixtrans-65.3-35.6-175.7-154.183000113.2Y5 L6 L7L3-Y5 VanDerWaalsContact C-N 3.32Å; L3-Y5 PolarHBondContact O-N 3.32Å; L3-L6 PolarHBondContact O-N 2.84Å; L3-L7 PolarHBondContact O-N 2.9Å
4H76.3Confident74.5Confident139 Ų139137.5 Ų137.564%0.64465%0.652SS**Hα-helixtrans-65.5-35.8179.2-62.292.1000111.9R2 L7 F8R2-H4 PolarHBondContact O-N 3.34Å; H4-L7 PolarHBondContact O-N 3.32Å; H4-F8 VanDerWaalsContact O-CB 3.29Å; H4-F8 WeakPolarHBondContact O-CB 3.43Å; H4-F8 PolarHBondContact O-N 2.92Å
5Y76.4Confident73.9Confident179 Ų179136.9 Ų136.970%0.70265%0.654SS**Hα-helixtrans-67-37.8175.4-66.6-77.9000112.2M1 R2 L3 F8 A9M1-Y5 WeakPolarHBondContact O-CD2 3.46Å; M1-Y5 WeakPolarHBondContact O-CE2 3.45Å; R2-Y5 PolarHBondContact O-N 3.2Å; L3-Y5 VanDerWaalsContact C-N 3.32Å; L3-Y5 PolarHBondContact O-N 3.32Å; Y5-F8 PolarHBondContact O-N 2.71Å; Y5-A9 VanDerWaalsContact O-CB 3.31Å; Y5-A9 WeakPolarHBondContact O-CB 3.05Å; Y5-A9 PolarHBondContact O-N 3.32Å
6L79.1Confident73.3Confident120 Ų120133.5 Ų133.563%0.62864%0.644SS**Hα-helixtrans-66-45.1175.3-75.3166.8000111.3R2 L3 F8 A9 F10R2-L6 PolarHBondContact O-N 3.3Å; L3-L6 PolarHBondContact O-N 2.84Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.1Å; L6-A9 PolarHBondContact O-N 3.43Å; L6-F10 WeakPolarHBondContact O-CB 3.27Å; L6-F10 PolarHBondContact O-N 3.15Å
7L81.4Confident72.5Confident120 Ų120132.2 Ų132.263%0.62865%0.648SS**Hα-helixtrans-60.7-44.5177-157.896000110.9L3 H4 F10 L11L3-L7 PolarHBondContact O-N 2.9Å; H4-L7 PolarHBondContact O-N 3.32Å; L7-F10 PolarHBondContact O-N 3.14Å; L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 2.03Å
8F78.1Confident71.8Confident141 Ų141128.3 Ų128.362%0.61864%0.641SS**Hα-helixtrans-66.5-40.6179.6-151.5-96.5000112H4 Y5 L6 F10 L11 I12H4-F8 VanDerWaalsContact O-CB 3.29Å; H4-F8 WeakPolarHBondContact O-CB 3.43Å; H4-F8 PolarHBondContact O-N 2.92Å; Y5-F8 PolarHBondContact O-N 2.71Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.1Å; F8-F10 VanDerWaalsContact C-N 3.35Å; F8-F10 PolarHBondContact O-N 3.39Å; F8-L11 PolarHBondContact O-N 2.88Å; F8-I12 HydrophobicContact CD1-CD1 3.57Å; F8-I12 HydrophobicContact CD1-CG1 4.2Å; F8-I12 HydrophobicContact CE1-CD1 3.74Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 VanDerWaalsContact O-CG1 3.29Å; F8-I12 WeakPolarHBondContact O-CG1 3.05Å; F8-I12 PolarHBondContact O-N 2.03Å
9A80.3Confident70.9Confident48 Ų48128.1 Ų128.140%0.39765%0.65SS.*Hα-helixtrans-62.3-41.5174.300000112Y5 L6 L11 I12 L13Y5-A9 VanDerWaalsContact O-CB 3.31Å; Y5-A9 WeakPolarHBondContact O-CB 3.05Å; Y5-A9 PolarHBondContact O-N 3.32Å; L6-A9 PolarHBondContact O-N 3.43Å; A9-L11 VanDerWaalsContact C-N 3.33Å; A9-I12 PolarHBondContact O-N 2.83Å; A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 2.81Å
10F79.1Confident70.2Confident138 Ų138123.5 Ų123.561%0.60564%0.635SS**Hα-helixtrans-63.9-41.1176.9-145-90000111.6L6 L7 F8 L13 F14L6-F10 WeakPolarHBondContact O-CB 3.27Å; L6-F10 PolarHBondContact O-N 3.15Å; L7-F10 PolarHBondContact O-N 3.14Å; F8-F10 VanDerWaalsContact C-N 3.35Å; F8-F10 PolarHBondContact O-N 3.39Å; F10-L13 PolarHBondContact O-N 3.41Å; F10-F14 AromaticContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CE2 4.13Å; F10-F14 AromaticContact CE1-CD2 3.64Å; F10-F14 HydrophobicContact CE1-CD2 3.64Å; F10-F14 AromaticContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CE2 3.43Å; F10-F14 VanDerWaalsContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CZ 4.48Å; F10-F14 HydrophobicContact CZ-CD2 4.48Å; F10-F14 AromaticContact CZ-CE2 3.99Å; F10-F14 HydrophobicContact CZ-CE2 3.99Å; F10-F14 PolarHBondContact O-N 3.14Å
11L76.9Confident69.8Low92 Ų92122.6 Ų122.648%0.48263%0.632SS.*Hα-helixtrans-65.9-42.7178.2-145.5150.5000110.7L7 F8 A9 L13 F14 L15L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 2.03Å; F8-L11 PolarHBondContact O-N 2.88Å; A9-L11 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 3.49Å; L11-F14 PolarHBondContact O-N 2.94Å; L11-L15 HydrophobicContact CD2-CB 4.24Å; L11-L15 HydrophobicContact CD2-CD2 3.82Å; L11-L15 HydrophobicContact CD2-CG 4.49Å; L11-L15 WeakPolarHBondContact O-CA 3Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.41Å
12I73.6Confident70.2Confident86 Ų86116 Ų11644%0.44161%0.609SS.*Hα-helixtrans-62.5-43.1173.9-66.4167.8000111.1F8 A9 F14 L15 V16F8-I12 HydrophobicContact CD1-CD1 3.57Å; F8-I12 HydrophobicContact CD1-CG1 4.2Å; F8-I12 HydrophobicContact CE1-CD1 3.74Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 VanDerWaalsContact O-CG1 3.29Å; F8-I12 WeakPolarHBondContact O-CG1 3.05Å; F8-I12 PolarHBondContact O-N 2.03Å; A9-I12 PolarHBondContact O-N 2.83Å; I12-F14 VanDerWaalsContact C-N 3.34Å; I12-F14 PolarHBondContact O-N 2.74Å; I12-L15 PolarHBondContact O-N 2.91Å; I12-V16 HydrophobicContact CG2-CG2 3.76Å; I12-V16 VanDerWaalsContact O-CB 3.25Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 WeakPolarHBondContact O-CG2 2.96Å; I12-V16 PolarHBondContact O-N 2.03Å
13L73.8Confident70.5Confident145 Ų145112.6 Ų112.676%0.75960%0.6SS**Hα-helixtrans-63.9-37.7-179.5-116.7141.4000113.2A9 F10 L11A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 2.81Å; F10-L13 PolarHBondContact O-N 3.41Å; L11-L13 PolarHBondContact O-N 3.49Å
14F67.9Low70.6Confident170 Ų170110.9 Ų110.975%0.74659%0.59SS**Hα-helixtrans-83.7-32.6177.7-98.7-91.1000113.5F10 L11 I12F10-F14 AromaticContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CE2 4.13Å; F10-F14 AromaticContact CE1-CD2 3.64Å; F10-F14 HydrophobicContact CE1-CD2 3.64Å; F10-F14 AromaticContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CE2 3.43Å; F10-F14 VanDerWaalsContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CZ 4.48Å; F10-F14 HydrophobicContact CZ-CD2 4.48Å; F10-F14 AromaticContact CZ-CE2 3.99Å; F10-F14 HydrophobicContact CZ-CE2 3.99Å; F10-F14 PolarHBondContact O-N 3.14Å; L11-F14 PolarHBondContact O-N 2.94Å; I12-F14 VanDerWaalsContact C-N 3.34Å; I12-F14 PolarHBondContact O-N 2.74Å
15L66.5Low70.6Confident129 Ų129110.2 Ų110.268%0.67559%0.587SS**Hα-helixtrans-88.4-22.3-173.8-156.976.1000112.6L11 I12 P17L11-L15 HydrophobicContact CD2-CB 4.24Å; L11-L15 HydrophobicContact CD2-CD2 3.82Å; L11-L15 HydrophobicContact CD2-CG 4.49Å; L11-L15 WeakPolarHBondContact O-CA 3Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.41Å; I12-L15 PolarHBondContact O-N 2.91Å; L15-P17 WeakPolarHBondContact O-CD 3.01Å
16V64.3Low70.7Confident82 Ų82105.7 Ų105.750%0.49757%0.569SS.*SBendtrans-79.2107.6172.8178.60000108.2I12 A18I12-V16 HydrophobicContact CG2-CG2 3.76Å; I12-V16 VanDerWaalsContact O-CB 3.25Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 WeakPolarHBondContact O-CG2 2.96Å; I12-V16 PolarHBondContact O-N 2.03Å; V16-A18 PolarHBondContact O-N 2.89Å
17P58.8Low70.9Confident111 Ų111103.4 Ų103.472%0.72156%0.56SS**  trans-63113.9175.526.2-31.6000107.5L15 P19L15-P17 WeakPolarHBondContact O-CD 3.01Å; P17-P19 WeakPolarHBondContact O-CD 3.3Å
18A60.9Low71.1Confident62 Ų62102.5 Ų102.551%0.51256%0.555SS.*  trans-47.2108.2179.400000109.8V16 G20V16-A18 PolarHBondContact O-N 2.89Å; A18-G20 PolarHBondContact O-N 2.94Å
19P54.5Low71.5Confident125 Ų12598.9 Ų98.981%0.81254%0.54SS*.THydrogen-bonded Turntrans-72.80.1-168.926-31000113P17P17-P19 WeakPolarHBondContact O-CD 3.3Å
20G56.8Low71.8Confident35 Ų35101.2 Ų101.236%0.36154%0.541SS..THydrogen-bonded Turntrans-88-18.9-173.500000116.2A18 A22 F23 I24A18-G20 PolarHBondContact O-N 2.94Å; G20-A22 VanDerWaalsContact C-N 3.34Å; G20-A22 PolarHBondContact O-N 3.36Å; G20-F23 PolarHBondContact O-N 3.14Å; G20-I24 PolarHBondContact O-N 3.45Å
21N61.1Low72.3Confident105 Ų10599.7 Ų99.756%0.56154%0.539SS*.Hα-helixtrans-69-33.1-166.6-65.4-4.7000113F23 I24 Q25N21-F23 VanDerWaalsContact C-N 3.29Å; N21-F23 PolarHBondContact O-N 3.05Å; N21-I24 PolarHBondContact O-N 3.45Å; N21-Q25 WeakPolarHBondContact O-CG 3.36Å; N21-Q25 PolarHBondContact O-N 3.18Å; N21-Q25 VanDerWaalsContact O-N 3.09Å
22A66.3Low72.8Confident55 Ų55100.6 Ų100.646%0.45554%0.539SS..Hα-helixtrans-67.2-29.8-179.800000112.8G20 R26G20-A22 VanDerWaalsContact C-N 3.34Å; G20-A22 PolarHBondContact O-N 3.36Å; A22-R26 VanDerWaalsContact O-CD 3.3Å; A22-R26 WeakPolarHBondContact O-CD 3.48Å; A22-R26 WeakPolarHBondContact O-CG 3.16Å; A22-R26 PolarHBondContact O-N 3.31Å
23F72.2Confident73.6Confident149 Ų14996.7 Ų96.765%0.65452%0.52SS*.Hα-helixtrans-77.2-41.1179.7-167-96.1000111.7G20 N21 R26 T27G20-F23 PolarHBondContact O-N 3.14Å; N21-F23 VanDerWaalsContact C-N 3.29Å; N21-F23 PolarHBondContact O-N 3.05Å; F23-R26 PolarHBondContact O-N 3.05Å; F23-T27 PolarHBondContact O-N 2.97Å; F23-T27 PolarHBondContact O-OG1 2.92Å
24I78.4Confident74.3Confident97 Ų9798.2 Ų98.250%0.49752%0.515SS..Hα-helixtrans-62.7-48.7177.6-62.2167.4000109.7G20 N21 R26 T27 I28G20-I24 PolarHBondContact O-N 3.45Å; N21-I24 PolarHBondContact O-N 3.45Å; I24-R26 PolarHBondContact O-N 2.89Å; I24-T27 PolarHBondContact O-N 3.42Å; I24-T27 VanDerWaalsContact O-N 3.14Å; I24-I28 HydrophobicContact CG2-CD1 3.73Å; I24-I28 HydrophobicContact CG2-CG1 4.39Å; I24-I28 WeakPolarHBondContact O-CG1 3.43Å; I24-I28 PolarHBondContact O-N 2.81Å
25Q76.9Confident75.4Confident125 Ų12596.5 Ų96.558%0.58451%0.513SS*.Hα-helixtrans-62.1-40.3179.5-72.6-143.1-29.800113.4N21 T27 I28 Q29N21-Q25 WeakPolarHBondContact O-CG 3.36Å; N21-Q25 PolarHBondContact O-N 3.18Å; N21-Q25 VanDerWaalsContact O-N 3.09Å; Q25-T27 VanDerWaalsContact C-N 3.31Å; Q25-T27 PolarHBondContact O-N 3.4Å; Q25-I28 PolarHBondContact O-N 2.92Å; Q25-Q29 WeakPolarHBondContact O-CB 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.44Å; Q25-Q29 PolarHBondContact O-N 3.42Å
26R77.3Confident76.4Confident84 Ų8496.8 Ų96.832%0.31751%0.505SS..Hα-helixtrans-61.5-41.8174.9-74.7170.2-173.7-176.97111.6A22 F23 I24 K30A22-R26 VanDerWaalsContact O-CD 3.3Å; A22-R26 WeakPolarHBondContact O-CD 3.48Å; A22-R26 WeakPolarHBondContact O-CG 3.16Å; A22-R26 PolarHBondContact O-N 3.31Å; F23-R26 PolarHBondContact O-N 3.05Å; I24-R26 PolarHBondContact O-N 2.89Å; R26-K30 VanDerWaalsContact O-CB 3.22Å; R26-K30 WeakPolarHBondContact O-CB 3.47Å; R26-K30 PolarHBondContact O-N 3.38Å
27T83.7Confident77.5Confident73 Ų7395.6 Ų95.645%0.44851%0.509SS..Hα-helixtrans-65.8-45.5179.8-56.40000110.9F23 I24 Q25 K30 L31F23-T27 PolarHBondContact O-N 2.97Å; F23-T27 PolarHBondContact O-OG1 2.92Å; I24-T27 PolarHBondContact O-N 3.42Å; I24-T27 VanDerWaalsContact O-N 3.14Å; Q25-T27 VanDerWaalsContact C-N 3.31Å; Q25-T27 PolarHBondContact O-N 3.4Å; T27-K30 PolarHBondContact O-N 2.79Å; T27-L31 WeakPolarHBondContact O-CB 3.03Å; T27-L31 PolarHBondContact O-N 2.76Å
28I86.8Confident79Confident101 Ų10190.9 Ų90.952%0.51848%0.481SS..Hα-helixtrans-61-51.2177.3-66.1169.9000110.9I24 Q25 K30 L31 F32I24-I28 HydrophobicContact CG2-CD1 3.73Å; I24-I28 HydrophobicContact CG2-CG1 4.39Å; I24-I28 WeakPolarHBondContact O-CG1 3.43Å; I24-I28 PolarHBondContact O-N 2.81Å; Q25-I28 PolarHBondContact O-N 2.92Å; I28-K30 VanDerWaalsContact C-N 3.28Å; I28-K30 PolarHBondContact O-N 3.47Å; I28-L31 PolarHBondContact O-N 2.95Å; I28-F32 WeakPolarHBondContact O-CB 3.22Å; I28-F32 PolarHBondContact O-N 3.24Å
29Q85.3Confident80.2Confident64 Ų6493.9 Ų93.930%0.29948%0.479SS..Hα-helixtrans-59.1-40.3179.8-73.7179-4.700112.1Q25 F32 C33 C55 S56Q25-Q29 WeakPolarHBondContact O-CB 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.44Å; Q25-Q29 PolarHBondContact O-N 3.42Å; Q29-F32 PolarHBondContact O-N 3.23Å; Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 3.09Å; Q29-C55 PolarHBondContact OE1-O 3.32Å; Q29-S56 VanDerWaalsContact OE1-CA 3.32Å
30K86.4Confident81.9Confident98 Ų9890.2 Ų90.243%0.42646%0.456SS..Hα-helixtrans-67.7-39.9178.4-158.5178.2-169.1-172.80111.9R26 T27 I28 R34R26-K30 VanDerWaalsContact O-CB 3.22Å; R26-K30 WeakPolarHBondContact O-CB 3.47Å; R26-K30 PolarHBondContact O-N 3.38Å; T27-K30 PolarHBondContact O-N 2.79Å; I28-K30 VanDerWaalsContact C-N 3.28Å; I28-K30 PolarHBondContact O-N 3.47Å; K30-R34 PolarHBondContact O-N 3.45Å; K30-R34 VanDerWaalsContact O-N 3.14Å
31L89Confident83.4Confident106 Ų10689.1 Ų89.156%0.55544%0.443SS*.Hα-helixtrans-65.2-44.8175.5-162.777.4000110.7T27 I28 C33 R34 L35T27-L31 WeakPolarHBondContact O-CB 3.03Å; T27-L31 PolarHBondContact O-N 2.76Å; I28-L31 PolarHBondContact O-N 2.95Å; L31-C33 VanDerWaalsContact C-N 3.34Å; L31-C33 PolarHBondContact O-N 3.42Å; L31-R34 PolarHBondContact O-N 3.3Å; L31-R34 VanDerWaalsContact O-N 3.15Å; L31-L35 HydrophobicContact CG-CD1 4.44Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.37Å
32F89.1Confident84.5Confident111 Ų11189.4 Ų89.449%0.48744%0.444SS..Hα-helixtrans-62.9-39.9178.8-144.7-104.6000112.4I28 Q29 L35 R36I28-F32 WeakPolarHBondContact O-CB 3.22Å; I28-F32 PolarHBondContact O-N 3.24Å; Q29-F32 PolarHBondContact O-N 3.23Å; F32-L35 PolarHBondContact O-N 3.16Å; F32-R36 VanDerWaalsContact CE1-CZ 3.49Å; F32-R36 PolarHBondContact O-N 3.3Å; F32-R36 VanDerWaalsContact O-N 3.14Å
33C90.1Very high85.2Confident4 Ų495.1 Ų95.13%0.02746%0.459CS..Hα-helixtrans-62-43173.5-173.70000111.7Q29 L31 R36 G38 C62Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 3.09Å; L31-C33 VanDerWaalsContact C-N 3.34Å; L31-C33 PolarHBondContact O-N 3.42Å; C33-R36 PolarHBondContact O-N 2.97Å; C33-G38 WeakPolarHBondContact O-CA 3.35Å; C33-G38 PolarHBondContact O-N 3.12Å; C33-C62 VanDerWaalsContact CA-SG 3.52Å; C33-C62 HydrophobicContact CB-CB 3.9Å; C33-C62 WeakPolarHBondContact CB-SG 3.29Å; C33-C62 VanDerWaalsContact SG-CA 3.6Å; C33-C62 WeakPolarHBondContact SG-CB 3.33Å; C33-C62 CovalentContact SG-SG 2.03Å; C33-C62 PolarHBondContact SG-SG 3.16Å
34R88.3Confident85.8Confident177 Ų17792 Ų9267%0.66846%0.456SS*.Hα-helixtrans-64.5-43.4175.8-78.5-155.6-119.4-173.51.2112.8K30 L31 R36 G37K30-R34 PolarHBondContact O-N 3.45Å; K30-R34 VanDerWaalsContact O-N 3.14Å; L31-R34 PolarHBondContact O-N 3.3Å; L31-R34 VanDerWaalsContact O-N 3.15Å; R34-R36 PolarHBondContact O-N 2.99Å; R34-G37 WeakPolarHBondContact O-CA 3.3Å; R34-G37 PolarHBondContact O-N 2.98Å
35L90.6Very high86.2Confident133 Ų13388.6 Ų88.670%0.69644%0.441SS*.Hα-helixtrans-61.2-33.2178.6-73.9170.5000112.3L31 F32 G37L31-L35 HydrophobicContact CG-CD1 4.44Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.37Å; F32-L35 PolarHBondContact O-N 3.16Å; L35-G37 PolarHBondContact O-N 3.48Å
36R87.4Confident86.8Confident135 Ų13586.8 Ų86.851%0.50943%0.434SS..THydrogen-bonded Turntrans-77.53.1173.5-71179.1173-169.5-6.2113.9F32 C33 R34 G38F32-R36 VanDerWaalsContact CE1-CZ 3.49Å; F32-R36 PolarHBondContact O-N 3.3Å; F32-R36 VanDerWaalsContact O-N 3.14Å; C33-R36 PolarHBondContact O-N 2.97Å; R34-R36 PolarHBondContact O-N 2.99Å; R36-G38 VanDerWaalsContact C-N 3.29Å
37G87.6Confident87.2Confident57 Ų5787.8 Ų87.859%0.58846%0.46SS*.THydrogen-bonded Turntrans71.923.2-176.600000113.5R34 L35R34-G37 WeakPolarHBondContact O-CA 3.3Å; R34-G37 PolarHBondContact O-N 2.98Å; L35-G37 PolarHBondContact O-N 3.48Å
38G89.6Confident87.3Confident12 Ų1294.4 Ų94.412%0.12448%0.477CS..  trans-98163178.200000113.3C33 R36 C63C33-G38 WeakPolarHBondContact O-CA 3.35Å; C33-G38 PolarHBondContact O-N 3.12Å; R36-G38 VanDerWaalsContact C-N 3.29Å; G38-C63 CarbonylContact C-O 3.45Å; G38-C63 WeakPolarHBondContact CA-O 3.15Å
39R87.9Confident87.4Confident125 Ų12590.5 Ų90.547%0.47246%0.457SS..EExtended strand (participates in β ladder)trans-115143.3172.759.1-172.7-100.1-1596.9110.5E49 C63R39-E49 VanDerWaalsContact CD-OE1 3.27Å; R39-E49 WeakPolarHBondContact CD-OE1 3.1Å; R39-E49 IonicContact CZ-OE1 3.46Å; R39-E49 IonicContact CZ-OE2 3.71Å; R39-E49 IonicContact NE-OE1 3.64Å; R39-E49 IonicContact NE-OE2 3.61Å; R39-E49 IonicContact NH1-OE1 2.71Å; R39-E49 PolarHBondContact NH1-OE1 3.37Å; R39-E49 IonicContact NH1-OE2 3.64Å; R39-C63 HydrophobicContact CG-CB 4.18Å; R39-C63 PolarHBondContact N-O 3.46Å; R39-C63 PolarHBondContact O-N 2.92Å
40C88.6Confident87.7Confident48 Ų4891.1 Ų91.132%0.32446%0.46SS..EExtended strand (participates in β ladder)trans-83.9120.8174.7-60.50000110.4C55 K61C40-C55 VanDerWaalsContact CA-SG 3.55Å; C40-C55 HydrophobicContact CB-CB 3.68Å; C40-C55 WeakPolarHBondContact CB-SG 3.47Å; C40-C55 WeakPolarHBondContact SG-CB 3.13Å; C40-C55 CovalentContact SG-SG 2.03Å; C40-C55 PolarHBondContact SG-SG 3.43Å; C40-K61 CarbonylContact C-O 3.56Å; C40-K61 VanDerWaalsContact CA-O 3.31Å; C40-K61 WeakPolarHBondContact CA-O 3.27Å
41A88.9Confident87.8Confident12 Ų1291.3 Ų91.310%0.09946%0.462CS..EExtended strand (participates in β ladder)trans-101.4148.9173.100000111.2S44 R60 K61 C63A41-S44 VanDerWaalsContact CB-O 3.26Å; A41-S44 WeakPolarHBondContact CB-O 3.47Å; A41-R60 CarbonylContact O-C 3.5Å; A41-R60 VanDerWaalsContact O-CA 3.29Å; A41-R60 WeakPolarHBondContact O-CA 3.29Å; A41-K61 PolarHBondContact N-O 2.97Å; A41-K61 PolarHBondContact O-N 2.93Å; A41-C63 VanDerWaalsContact CB-SG 3.57Å
42L84.3Confident87.8Confident112 Ų11288.9 Ų88.959%0.58645%0.449SS*.SBendtrans-76.9-40.8-177.4-129.186.6000112.9R60L42-R60 HydrophobicContact CD1-CG 4.49Å
43F81.2Confident87.7Confident175 Ų17584.9 Ų84.977%0.76844%0.439SS*.SBendtrans-119-58.2-174.4-80.9-84.7000112.5
44S85.2Confident87.5Confident82 Ų8290 Ų9057%0.57346%0.463SS*.  trans-145157.3-175.953.90000111.4A41A41-S44 VanDerWaalsContact CB-O 3.26Å; A41-S44 WeakPolarHBondContact CB-O 3.47Å
45C87.1Confident87.4Confident27 Ų2781.9 Ų81.918%0.18243%0.433CS..  trans-77152.7170.5-58.30000110.2E49 C63C45-E49 HydrophobicContact CB-CB 4.27Å; C45-C63 WeakPolarHBondContact CA-SG 2.95Å; C45-C63 HydrophobicContact CB-CB 3.64Å; C45-C63 WeakPolarHBondContact CB-SG 3.46Å; C45-C63 VanDerWaalsContact SG-CA 3.55Å; C45-C63 WeakPolarHBondContact SG-CB 3.41Å; C45-C63 CovalentContact SG-SG 2.03Å; C45-C63 PolarHBondContact SG-SG 3.42Å
46L88.8Confident86.9Confident87 Ų8776 Ų7646%0.45540%0.402SS..  trans-68.5157.1175.2-82.271.3000110.5R48 E49L46-R48 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact O-N 3.1Å; L46-E49 HydrophobicContact CB-CB 4.42Å; L46-E49 HydrophobicContact CB-CG 4.09Å; L46-E49 WeakPolarHBondContact O-CA 3.11Å; L46-E49 WeakPolarHBondContact O-CB 3.25Å; L46-E49 PolarHBondContact O-N 3.46Å; L46-E49 VanDerWaalsContact O-O 3.04Å
47A85.2Confident86.1Confident104 Ų10474.1 Ų74.186%0.8641%0.41SS*.THydrogen-bonded Turntrans-58.4-26.8179.500000114.2E49A47-E49 VanDerWaalsContact C-N 3.3Å
48R86.4Confident85.5Confident212 Ų21281.1 Ų81.180%0.842%0.419SS*.THydrogen-bonded Turntrans-85.1-1.2175.2-64.5-176.1179.1175.50.5113.5L46 K66L46-R48 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact O-N 3.1Å; R48-K66 PolarHBondContact O-N 3.24Å
49E89.3Confident84.9Confident20 Ų2082.3 Ų82.39%0.09343%0.431CS..EExtended strand (participates in β ladder)trans-117148.7-176.9-60.3-176.4164.800110.4R39 C45 L46 A47 C63 R64R39-E49 VanDerWaalsContact CD-OE1 3.27Å; R39-E49 WeakPolarHBondContact CD-OE1 3.1Å; R39-E49 IonicContact CZ-OE1 3.46Å; R39-E49 IonicContact CZ-OE2 3.71Å; R39-E49 IonicContact NE-OE1 3.64Å; R39-E49 IonicContact NE-OE2 3.61Å; R39-E49 IonicContact NH1-OE1 2.71Å; R39-E49 PolarHBondContact NH1-OE1 3.37Å; R39-E49 IonicContact NH1-OE2 3.64Å; C45-E49 HydrophobicContact CB-CB 4.27Å; L46-E49 HydrophobicContact CB-CB 4.42Å; L46-E49 HydrophobicContact CB-CG 4.09Å; L46-E49 WeakPolarHBondContact O-CA 3.11Å; L46-E49 WeakPolarHBondContact O-CB 3.25Å; L46-E49 PolarHBondContact O-N 3.46Å; L46-E49 VanDerWaalsContact O-O 3.04Å; A47-E49 VanDerWaalsContact C-N 3.3Å; E49-C63 HydrophobicContact CB-CB 4.26Å; E49-C63 WeakPolarHBondContact OE2-CB 3.31Å; E49-R64 CarbonylContact C-O 3.4Å; E49-R64 WeakPolarHBondContact CA-O 3.37Å; E49-R64 WeakPolarHBondContact CB-O 3.14Å
50E90.1Very high84.9Confident77 Ų7781.5 Ų81.536%0.3643%0.428SS..EExtended strand (participates in β ladder)trans-101.7144.2173.459.9178.7174.600110.8I52 C63 R64 K66E50-I52 HydrophobicContact CG-CD1 4.26Å; E50-I52 HydrophobicContact CG-CG1 4.01Å; E50-I52 PolarHBondContact O-N 2.98Å; E50-C63 CarbonylContact O-C 3.5Å; E50-C63 VanDerWaalsContact O-CA 3.3Å; E50-C63 WeakPolarHBondContact O-CA 3.29Å; E50-R64 HydrophobicContact CG-CB 4.21Å; E50-R64 PolarHBondContact N-O 3Å; E50-R64 PolarHBondContact O-N 3.44Å; E50-K66 HydrophobicContact CB-CG 4.13Å; E50-K66 HydrophobicContact CG-CG 4.33Å
51Q89.8Confident85Confident102 Ų10282.3 Ų82.348%0.47743%0.426SS..EExtended strand (participates in β ladder)trans-81.3116.4172.7-177.8-174.2-32.900109.3K61Q51-K61 HydrophobicContact CG-CD 4.31Å
52I87.6Confident85Confident55 Ų5582 Ų8228%0.28242%0.423SS..EExtended strand (participates in β ladder)trans-100.7-22.6179.7-57.6-162.5000112E50 C62 R64E50-I52 HydrophobicContact CG-CD1 4.26Å; E50-I52 HydrophobicContact CG-CG1 4.01Å; E50-I52 PolarHBondContact O-N 2.98Å; I52-C62 PolarHBondContact N-O 3.32Å; I52-R64 HydrophobicContact CD1-CB 3.25Å; I52-R64 HydrophobicContact CD1-CG 3.9Å; I52-R64 HydrophobicContact CG1-CB 3.9Å
53G86.8Confident85.4Confident26 Ų2676.7 Ų76.727%0.26840%0.395SS..EExtended strand (participates in β ladder)trans175-149.1-178.800000113.3C62G53-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact O-N 2.8Å
54Q86.8Confident85.9Confident113 Ų11372.8 Ų72.853%0.52838%0.376SS..EExtended strand (participates in β ladder)trans-129.8144.3-179-57-178.423.700110.5R60Q54-R60 CarbonylContact C-O 3.47Å; Q54-R60 VanDerWaalsContact CA-O 3.27Å; Q54-R60 WeakPolarHBondContact CA-O 3.48Å
55C85.6Confident86Confident6 Ų673 Ų734%0.04137%0.374CS..EExtended strand (participates in β ladder)trans-100.6-12.3176.7-69.70000113.6Q29 C40 R60Q29-C55 PolarHBondContact OE1-O 3.32Å; C40-C55 VanDerWaalsContact CA-SG 3.55Å; C40-C55 HydrophobicContact CB-CB 3.68Å; C40-C55 WeakPolarHBondContact CB-SG 3.47Å; C40-C55 WeakPolarHBondContact SG-CB 3.13Å; C40-C55 CovalentContact SG-SG 2.03Å; C40-C55 PolarHBondContact SG-SG 3.43Å; C55-R60 HydrophobicContact CB-CB 4.1Å; C55-R60 PolarHBondContact N-O 3.03Å
56S79.9Confident85.8Confident8 Ų877.4 Ų77.46%0.05639%0.39CS..EExtended strand (participates in β ladder)trans-159145.5178.3177.70000109.4Q29 R58 G59Q29-S56 VanDerWaalsContact OE1-CA 3.32Å; S56-R58 PolarHBondContact O-N 3.49Å; S56-R58 VanDerWaalsContact O-N 3.12Å; S56-R58 PolarHBondContact OG-N 2.91Å; S56-G59 PolarHBondContact O-N 3.49Å; S56-G59 VanDerWaalsContact O-N 3.16Å
57S72.3Confident85.2Confident97 Ų9782 Ų8268%0.67841%0.406SS*.THydrogen-bonded Turntrans-58.6-20.3170.657.40000113.6G59S57-G59 PolarHBondContact O-N 3.4Å; S57-G59 VanDerWaalsContact O-N 3.16Å
58R74.3Confident84.1Confident203 Ų20390.2 Ų90.277%0.76642%0.422SS*.THydrogen-bonded Turntrans-80.727.3173.2-71.9-171.8177.2179.3-0.8113.7S56S56-R58 PolarHBondContact O-N 3.49Å; S56-R58 VanDerWaalsContact O-N 3.12Å; S56-R58 PolarHBondContact OG-N 2.91Å
59G77.9Confident84Confident37 Ų3784.1 Ų84.138%0.38140%0.403SS..THydrogen-bonded Turntrans84.58.2170.200000116.7S56 S57 K61S56-G59 PolarHBondContact O-N 3.49Å; S56-G59 VanDerWaalsContact O-N 3.16Å; S57-G59 PolarHBondContact O-N 3.4Å; S57-G59 VanDerWaalsContact O-N 3.16Å; G59-K61 PolarHBondContact O-N 3.31Å
60R87.2Confident83.7Confident109 Ų10987.5 Ų87.541%0.41142%0.419SS..EExtended strand (participates in β ladder)trans-72.2127.9174.4-65.8-172.5173.8170.4-3.2109.6A41 L42 Q54 C55A41-R60 CarbonylContact O-C 3.5Å; A41-R60 VanDerWaalsContact O-CA 3.29Å; A41-R60 WeakPolarHBondContact O-CA 3.29Å; L42-R60 HydrophobicContact CD1-CG 4.49Å; Q54-R60 CarbonylContact C-O 3.47Å; Q54-R60 VanDerWaalsContact CA-O 3.27Å; Q54-R60 WeakPolarHBondContact CA-O 3.48Å; C55-R60 HydrophobicContact CB-CB 4.1Å; C55-R60 PolarHBondContact N-O 3.03Å
61K89.8Confident83.4Confident64 Ų6488.1 Ų88.128%0.27842%0.423SS..EExtended strand (participates in β ladder)trans-95.4147.2-178.7-64.5-172.8167.4-164.30111.4C40 A41 Q51 G59C40-K61 CarbonylContact C-O 3.56Å; C40-K61 VanDerWaalsContact CA-O 3.31Å; C40-K61 WeakPolarHBondContact CA-O 3.27Å; A41-K61 PolarHBondContact N-O 2.97Å; A41-K61 PolarHBondContact O-N 2.93Å; Q51-K61 HydrophobicContact CG-CD 4.31Å; G59-K61 PolarHBondContact O-N 3.31Å
62C90.6Very high83Confident6 Ų687.2 Ų87.24%0.04142%0.42CS..EExtended strand (participates in β ladder)trans-95.4121170.1-178.60000108.8C33 I52 G53C33-C62 VanDerWaalsContact CA-SG 3.52Å; C33-C62 HydrophobicContact CB-CB 3.9Å; C33-C62 WeakPolarHBondContact CB-SG 3.29Å; C33-C62 VanDerWaalsContact SG-CA 3.6Å; C33-C62 WeakPolarHBondContact SG-CB 3.33Å; C33-C62 CovalentContact SG-SG 2.03Å; C33-C62 PolarHBondContact SG-SG 3.16Å; I52-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact O-N 2.8Å
63C91.7Very high82.7Confident0 Ų089.3 Ų89.30%043%0.428CS..EExtended strand (participates in β ladder)trans-118.6136.7-173.8-52.30000109.8G38 R39 A41 C45 E49 E50G38-C63 CarbonylContact C-O 3.45Å; G38-C63 WeakPolarHBondContact CA-O 3.15Å; R39-C63 HydrophobicContact CG-CB 4.18Å; R39-C63 PolarHBondContact N-O 3.46Å; R39-C63 PolarHBondContact O-N 2.92Å; A41-C63 VanDerWaalsContact CB-SG 3.57Å; C45-C63 WeakPolarHBondContact CA-SG 2.95Å; C45-C63 HydrophobicContact CB-CB 3.64Å; C45-C63 WeakPolarHBondContact CB-SG 3.46Å; C45-C63 VanDerWaalsContact SG-CA 3.55Å; C45-C63 WeakPolarHBondContact SG-CB 3.41Å; C45-C63 CovalentContact SG-SG 2.03Å; C45-C63 PolarHBondContact SG-SG 3.42Å; E49-C63 HydrophobicContact CB-CB 4.26Å; E49-C63 WeakPolarHBondContact OE2-CB 3.31Å; E50-C63 CarbonylContact O-C 3.5Å; E50-C63 VanDerWaalsContact O-CA 3.3Å; E50-C63 WeakPolarHBondContact O-CA 3.29Å
64R91Very high82.4Confident94 Ų9493.5 Ų93.536%0.35544%0.439SS..EExtended strand (participates in β ladder)trans-122.9142.9175.3-172.6-170.9-176.6-171.77.3109.6E49 E50 I52 K66E49-R64 CarbonylContact C-O 3.4Å; E49-R64 WeakPolarHBondContact CA-O 3.37Å; E49-R64 WeakPolarHBondContact CB-O 3.14Å; E50-R64 HydrophobicContact CG-CB 4.21Å; E50-R64 PolarHBondContact N-O 3Å; E50-R64 PolarHBondContact O-N 3.44Å; I52-R64 HydrophobicContact CD1-CB 3.25Å; I52-R64 HydrophobicContact CD1-CG 3.9Å; I52-R64 HydrophobicContact CG1-CB 3.9Å; R64-K66 PolarHBondContact O-N 3.44Å
65T88.4Confident82.1Confident87 Ų8792.1 Ų92.153%0.53443%0.432SS..EExtended strand (participates in β ladder)trans-63.7127.1172.8-40.60000109.4K67T65-K67 PolarHBondContact O-N 3.43Å
66K83.1Confident81.8Confident119 Ų11998.7 Ų98.752%0.51746%0.463SS..PPolyproline II helixtrans-61.2128.7173.1-68.7-176.4178.7-1790107.9R48 E50 R64 K68R48-K66 PolarHBondContact O-N 3.24Å; E50-K66 HydrophobicContact CB-CG 4.13Å; E50-K66 HydrophobicContact CG-CG 4.33Å; R64-K66 PolarHBondContact O-N 3.44Å; K66-K68 PolarHBondContact O-N 2.93Å
67K76Confident82Confident183 Ų183106.3 Ų106.380%0.79650%0.496SS*.PPolyproline II helixtrans-65.8126.1167.7-73.5-163.5176.1-170.70107T65T65-K67 PolarHBondContact O-N 3.43Å
68K62Low82.9Confident276 Ų276107.1 Ų107.1100%1.248%0.48SS*.  trans-74.20-179.8-159-176.8-174.4-168.90110K66K66-K68 PolarHBondContact O-N 2.93Å

Retrieved 68 of 68 residues in 54.5 ms (Link to these results)