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Signal recognition particle 14 kDa protein

Component of the signal recognition particle (SRP) complex, a ribonucleoprotein complex that mediates the cotranslational targeting of secretory and membrane proteins to the endoplasmic reticulum (ER). SRP9 together with SRP14 and the Alu portion of the SRP RNA, constitutes the elongation arrest domain of SRP. The complex of SRP9 and SRP14 is required for SRP RNA binding.

AlphaFold DB , UniProt , Accession A0A060WF73, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 110 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
1M82.9Confident95.2Very high134 Ų13472.1 Ų72.166%0.6639%0.388SS*.  0127.30174.7175.2-86.900105.8R59 K66M1-R59 HydrophobicContact CE-CB 4.27Å; M1-R59 HydrophobicContact CE-CG 4.22Å; M1-R59 HydrophobicContact SD-CG 4.35Å; M1-K66 WeakPolarHBondContact CA-O 3.26Å; M1-K66 HydrophobicContact CB-CB 4.09Å; M1-K66 HydrophobicContact CE-CB 4.14Å; M1-K66 HydrophobicContact CE-CD 4.3Å; M1-K66 HydrophobicContact CG-CB 4.22Å
2V93.2Very high95.3Very high81 Ų8168.6 Ų68.649%0.49137%0.368SS..EExtended strand (participates in β ladder)trans-102.6128.7-173-174.70000109.3L4 K66 I67 S68V2-L4 HydrophobicContact CG1-CD2 3.61Å; V2-L4 HydrophobicContact CG1-CG 4.06Å; V2-K66 PolarHBondContact N-O 2.99Å; V2-I67 CarbonylContact O-C 3.58Å; V2-S68 PolarHBondContact O-N 3.31Å; V2-S68 PolarHBondContact O-OG 3.45Å
3L95.3Very high95.5Very high119 Ų11963.3 Ų63.362%0.62334%0.339SS*.EExtended strand (participates in β ladder)trans-86.7122.2170.9-177.765.1000108.5S68 V70L3-S68 WeakPolarHBondContact CA-O 3.49Å; L3-V70 HydrophobicContact CD1-CG2 4.07Å
4L97.1Very high95.6Very high41 Ų4161.2 Ų61.222%0.21533%0.33CS..  trans-120.5154.3-176.1-62.4175.9000110.4V2 F9 E12 I67 S68 T69V2-L4 HydrophobicContact CG1-CD2 3.61Å; V2-L4 HydrophobicContact CG1-CG 4.06Å; L4-F9 HydrophobicContact CB-CB 4.26Å; L4-E12 HydrophobicContact CD1-CB 4.11Å; L4-E12 HydrophobicContact CD1-CG 3.92Å; L4-I67 HydrophobicContact CD1-CB 4.1Å; L4-I67 HydrophobicContact CD1-CG2 3.99Å; L4-S68 PolarHBondContact N-O 2.74Å; L4-T69 WeakPolarHBondContact O-CB 3.27Å; L4-T69 PolarHBondContact O-OG1 2.59Å
5E96.5Very high95.6Very high154 Ų15466.9 Ų66.972%0.7235%0.345SS*.  trans-62.7158.1164.2-65.8-177.1172.900111.2D7 S8 F9E5-D7 PolarHBondContact O-N 2.97Å; E5-S8 PolarHBondContact O-N 3.38Å; E5-F9 WeakPolarHBondContact O-CB 3.36Å; E5-F9 PolarHBondContact O-N 3.41Å
6N96.2Very high95.7Very high22 Ų2263 Ų6312%0.11833%0.325CS..Hα-helixtrans-58.3-46.7-172.1-70.7175.1000113.2F9 L10 T69 V70 F79N6-F9 PolarHBondContact O-N 2.74Å; N6-L10 WeakPolarHBondContact O-CG 3.5Å; N6-L10 PolarHBondContact O-N 3.48Å; N6-L10 VanDerWaalsContact O-N 3.13Å; N6-T69 PolarHBondContact ND2-OG1 3.48Å; N6-V70 PolarHBondContact ND2-O 3.25Å; N6-F79 HydrophobicContact CB-CD2 3.89Å; N6-F79 HydrophobicContact CB-CE2 4.25Å
7D96Very high95.7Very high91 Ų9160.9 Ų60.949%0.48731%0.313SS..Hα-helixtrans-70-38.4-178-68.2-18.9000111.5E5 L10 T11 K78E5-D7 PolarHBondContact O-N 2.97Å; D7-L10 PolarHBondContact O-N 2.87Å; D7-T11 PolarHBondContact O-N 3.01Å; D7-T11 PolarHBondContact O-OG1 3.31Å; D7-K78 IonicContact OD1-NZ 3.29Å; D7-K78 IonicContact OD2-NZ 2.77Å; D7-K78 PolarHBondContact OD2-NZ 3.37Å
8S97.2Very high95.7Very high56 Ų5664.2 Ų64.239%0.39233%0.327SS..Hα-helixtrans-64.6-39.7173.3-71.30000112.2E5 T11 E12E5-S8 PolarHBondContact O-N 3.38Å; S8-T11 PolarHBondContact O-N 3.47Å; S8-E12 WeakPolarHBondContact O-CB 3.26Å; S8-E12 PolarHBondContact O-N 3.01Å
9F97.9Very high95.7Very high0 Ų067.4 Ų67.40%034%0.338CS..Hα-helixtrans-61.7-43.3176.1175.4-91.2000111.8L4 E5 N6 T11 E12 L13 L58 A60 I67 T69 F79L4-F9 HydrophobicContact CB-CB 4.26Å; E5-F9 WeakPolarHBondContact O-CB 3.36Å; E5-F9 PolarHBondContact O-N 3.41Å; N6-F9 PolarHBondContact O-N 2.74Å; F9-T11 VanDerWaalsContact C-N 3.33Å; F9-T11 PolarHBondContact O-N 3.39Å; F9-E12 PolarHBondContact O-N 3Å; F9-L13 HydrophobicContact CE1-CD2 4.06Å; F9-L13 VanDerWaalsContact O-CB 3.24Å; F9-L13 WeakPolarHBondContact O-CB 3.49Å; F9-L13 PolarHBondContact O-N 3.4Å; F9-L58 HydrophobicContact CE1-CB 4.45Å; F9-L58 HydrophobicContact CE1-CD2 4.47Å; F9-L58 HydrophobicContact CZ-CB 4.08Å; F9-A60 HydrophobicContact CE2-CB 4.32Å; F9-A60 HydrophobicContact CZ-CB 4.15Å; F9-I67 HydrophobicContact CD2-CB 4.36Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.05Å; F9-I67 HydrophobicContact CE2-CB 4.45Å; F9-I67 HydrophobicContact CE2-CD1 3.92Å; F9-I67 HydrophobicContact CE2-CG1 3.8Å; F9-T69 HydrophobicContact CB-CG2 3.86Å; F9-T69 HydrophobicContact CD1-CG2 3.61Å; F9-T69 HydrophobicContact CD2-CG2 3.74Å; F9-T69 HydrophobicContact CE1-CG2 4.04Å; F9-T69 HydrophobicContact CE2-CG2 4.15Å; F9-T69 HydrophobicContact CG-CG2 3.44Å; F9-T69 VanDerWaalsContact CG-CG2 3.44Å; F9-T69 HydrophobicContact CZ-CG2 4.3Å; F9-F79 HydrophobicContact CD1-CE2 4.19Å; F9-F79 HydrophobicContact CD1-CZ 4.04Å; F9-F79 HydrophobicContact CE1-CZ 4.16Å
10L97.6Very high95.7Very high18 Ų1865 Ų659%0.09433%0.328CS..Hα-helixtrans-63.5-40.6178-67.5172.1000111.5N6 D7 L13 T14 F79 A82 Y83 L86N6-L10 WeakPolarHBondContact O-CG 3.5Å; N6-L10 PolarHBondContact O-N 3.48Å; N6-L10 VanDerWaalsContact O-N 3.13Å; D7-L10 PolarHBondContact O-N 2.87Å; L10-L13 PolarHBondContact O-N 3.15Å; L10-T14 PolarHBondContact O-N 2.98Å; L10-T14 PolarHBondContact O-OG1 3.01Å; L10-F79 HydrophobicContact CD1-CD2 4.27Å; L10-F79 HydrophobicContact CD1-CE2 4.26Å; L10-F79 HydrophobicContact CD2-CE2 3.9Å; L10-F79 HydrophobicContact CD2-CZ 4.11Å; L10-F79 HydrophobicContact CG-CD2 4.46Å; L10-F79 HydrophobicContact CG-CE2 3.95Å; L10-A82 HydrophobicContact CD1-CB 3.61Å; L10-Y83 HydrophobicContact CD2-CD2 4.04Å; L10-L86 HydrophobicContact CB-CD1 4.19Å; L10-L86 HydrophobicContact CD2-CD1 4.04Å; L10-L86 VanDerWaalsContact O-CD1 3.29Å; L10-L86 WeakPolarHBondContact O-CD1 3.33Å
11T97.4Very high95.6Very high77 Ų7768.3 Ų68.347%0.47234%0.336SS..Hα-helixtrans-65.2-44.7177.4-61.30000111.7D7 S8 F9 L13 T14 R15D7-T11 PolarHBondContact O-N 3.01Å; D7-T11 PolarHBondContact O-OG1 3.31Å; S8-T11 PolarHBondContact O-N 3.47Å; F9-T11 VanDerWaalsContact C-N 3.33Å; F9-T11 PolarHBondContact O-N 3.39Å; T11-L13 VanDerWaalsContact C-N 3.33Å; T11-L13 PolarHBondContact O-N 3.34Å; T11-T14 WeakPolarHBondContact O-CB 3.43Å; T11-T14 PolarHBondContact O-N 2.71Å; T11-R15 PolarHBondContact O-N 3.27Å; T11-R15 VanDerWaalsContact O-N 3.15Å
12E96.9Very high96.1Very high30 Ų3068 Ų6814%0.1434%0.342CS..Hα-helixtrans-68.2-32.7176.8-75.6-63.2141.300112.6L4 S8 F9 R15 L16 K65 I67L4-E12 HydrophobicContact CD1-CB 4.11Å; L4-E12 HydrophobicContact CD1-CG 3.92Å; S8-E12 WeakPolarHBondContact O-CB 3.26Å; S8-E12 PolarHBondContact O-N 3.01Å; F9-E12 PolarHBondContact O-N 3Å; E12-R15 WeakPolarHBondContact O-CB 3.45Å; E12-R15 PolarHBondContact O-N 3.26Å; E12-R15 WeakPolarHBondContact OE1-CD 3.49Å; E12-R15 IonicContact OE1-CZ 3.49Å; E12-R15 IonicContact OE1-NE 3Å; E12-R15 IonicContact OE1-NH1 2.59Å; E12-R15 PolarHBondContact OE1-NH1 3.4Å; E12-L16 WeakPolarHBondContact O-CG 3.45Å; E12-L16 PolarHBondContact O-N 3.04Å; E12-K65 WeakPolarHBondContact OE2-CE 3.37Å; E12-K65 IonicContact OE2-NZ 2.74Å; E12-K65 PolarHBondContact OE2-NZ 2.92Å; E12-I67 HydrophobicContact CB-CD1 3.75Å; E12-I67 HydrophobicContact CB-CG2 4.35Å
13L97.3Very high96.1Very high0 Ų069.4 Ų69.40%035%0.351CS..Hα-helixtrans-65.3-42.3173.8-178.160.5000111.6F9 L10 T11 R15 L16 F17 V26 I28 A60 I67 Y83 L86F9-L13 HydrophobicContact CE1-CD2 4.06Å; F9-L13 VanDerWaalsContact O-CB 3.24Å; F9-L13 WeakPolarHBondContact O-CB 3.49Å; F9-L13 PolarHBondContact O-N 3.4Å; L10-L13 PolarHBondContact O-N 3.15Å; T11-L13 VanDerWaalsContact C-N 3.33Å; T11-L13 PolarHBondContact O-N 3.34Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 3.35Å; L13-L16 WeakPolarHBondContact O-CB 3.49Å; L13-L16 PolarHBondContact O-N 3.15Å; L13-L16 VanDerWaalsContact O-N 3.15Å; L13-F17 HydrophobicContact CD1-CD2 4.1Å; L13-F17 HydrophobicContact CD1-CE2 3.74Å; L13-F17 HydrophobicContact CD2-CE2 4.2Å; L13-F17 HydrophobicContact CG-CD2 3.99Å; L13-F17 HydrophobicContact CG-CE2 3.75Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.42Å; L13-V26 HydrophobicContact CD1-CG1 4.42Å; L13-I28 HydrophobicContact CD1-CD1 4.02Å; L13-I28 HydrophobicContact CD1-CG1 4.42Å; L13-I28 HydrophobicContact CD2-CD1 4.37Å; L13-A60 HydrophobicContact CD1-CB 3.7Å; L13-I67 HydrophobicContact CB-CD1 4.32Å; L13-Y83 HydrophobicContact CD2-CD2 4.09Å; L13-Y83 HydrophobicContact CD2-CE2 3.72Å; L13-L86 HydrophobicContact CB-CD1 4.33Å; L13-L86 HydrophobicContact CD2-CD1 4.2Å; L13-L86 HydrophobicContact CD2-CD2 3.8Å; L13-L86 HydrophobicContact CG-CD1 4.37Å; L13-L86 HydrophobicContact CG-CD2 3.94Å
14T97.3Very high96.1Very high34 Ų3466.7 Ų66.721%0.20935%0.352CS..Hα-helixtrans-57-44.9172.3-65.70000111.4L10 T11 L16 F17 Q18 L86L10-T14 PolarHBondContact O-N 2.98Å; L10-T14 PolarHBondContact O-OG1 3.01Å; T11-T14 WeakPolarHBondContact O-CB 3.43Å; T11-T14 PolarHBondContact O-N 2.71Å; T14-L16 VanDerWaalsContact C-N 3.32Å; T14-L16 PolarHBondContact O-N 3.36Å; T14-F17 PolarHBondContact O-N 2.99Å; T14-Q18 HydrophobicContact CG2-CG 4.48Å; T14-Q18 WeakPolarHBondContact O-CG 3.33Å; T14-Q18 PolarHBondContact O-N 3.5Å; T14-L86 VanDerWaalsContact OG1-CD1 3.31Å; T14-L86 WeakPolarHBondContact OG1-CD1 3.38Å
15R96.1Very high96Very high147 Ų14769.3 Ų69.356%0.55537%0.374SS*.Hα-helixtrans-60.9-39.1176.1-69.9174.9177.5-176-5.9112.2T11 E12 L13 K19T11-R15 PolarHBondContact O-N 3.27Å; T11-R15 VanDerWaalsContact O-N 3.15Å; E12-R15 WeakPolarHBondContact O-CB 3.45Å; E12-R15 PolarHBondContact O-N 3.26Å; E12-R15 WeakPolarHBondContact OE1-CD 3.49Å; E12-R15 IonicContact OE1-CZ 3.49Å; E12-R15 IonicContact OE1-NE 3Å; E12-R15 IonicContact OE1-NH1 2.59Å; E12-R15 PolarHBondContact OE1-NH1 3.4Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 3.35Å; R15-K19 VanDerWaalsContact O-CB 3.27Å; R15-K19 WeakPolarHBondContact O-CB 3.38Å; R15-K19 PolarHBondContact O-N 2.83Å
16L96.3Very high96Very high4 Ų463.7 Ų63.72%0.02135%0.35CS..Hα-helixtrans-63-45.2175.7-73.8173.6000112E12 L13 T14 K19 C20 V26 A60 D62 K65 I67E12-L16 WeakPolarHBondContact O-CG 3.45Å; E12-L16 PolarHBondContact O-N 3.04Å; L13-L16 WeakPolarHBondContact O-CB 3.49Å; L13-L16 PolarHBondContact O-N 3.15Å; L13-L16 VanDerWaalsContact O-N 3.15Å; T14-L16 VanDerWaalsContact C-N 3.32Å; T14-L16 PolarHBondContact O-N 3.36Å; L16-K19 PolarHBondContact O-N 3.01Å; L16-C20 WeakPolarHBondContact O-CB 3.44Å; L16-C20 PolarHBondContact O-N 3.06Å; L16-C20 PolarHBondContact O-SG 3.21Å; L16-V26 HydrophobicContact CB-CG2 4.46Å; L16-A60 HydrophobicContact CD1-CB 4.16Å; L16-D62 HydrophobicContact CD2-CB 3.95Å; L16-K65 HydrophobicContact CD2-CB 4.27Å; L16-K65 HydrophobicContact CD2-CD 4.43Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.91Å
17F96.7Very high96Very high28 Ų2865.5 Ų65.512%0.12337%0.368CS..Hα-helixtrans-62.7-44.3177.1-83-66.8000112.5L13 T14 C20 R21 V26 I28 L86 L87 H90 M91L13-F17 HydrophobicContact CD1-CD2 4.1Å; L13-F17 HydrophobicContact CD1-CE2 3.74Å; L13-F17 HydrophobicContact CD2-CE2 4.2Å; L13-F17 HydrophobicContact CG-CD2 3.99Å; L13-F17 HydrophobicContact CG-CE2 3.75Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.42Å; T14-F17 PolarHBondContact O-N 2.99Å; F17-C20 PolarHBondContact O-N 3.49Å; F17-R21 PolarHBondContact O-N 3.28Å; F17-V26 HydrophobicContact CD1-CG2 4.27Å; F17-V26 HydrophobicContact CE1-CB 4.33Å; F17-I28 HydrophobicContact CE2-CD1 4.21Å; F17-I28 HydrophobicContact CZ-CD1 3.9Å; F17-L86 HydrophobicContact CD2-CD2 3.77Å; F17-L86 HydrophobicContact CE2-CD2 3.62Å; F17-L87 HydrophobicContact CE2-CD2 4.22Å; F17-L87 HydrophobicContact CZ-CD2 3.99Å; F17-H90 HydrophobicContact CB-CB 3.78Å; F17-H90 HydrophobicContact CD1-CB 3.94Å; F17-H90 HydrophobicContact CD2-CB 3.96Å; F17-H90 HydrophobicContact CG-CB 3.64Å; F17-M91 HydrophobicContact CE1-CG 4.15Å; F17-M91 HydrophobicContact CZ-CG 4.42Å
18Q95.3Very high96.1Very high120 Ų12063.8 Ų63.856%0.56136%0.358SS*.Hα-helixtrans-62.3-44177.3-70.9171.4-8.700111.6T14 C20 R21T14-Q18 HydrophobicContact CG2-CG 4.48Å; T14-Q18 WeakPolarHBondContact O-CG 3.33Å; T14-Q18 PolarHBondContact O-N 3.5Å; Q18-C20 PolarHBondContact O-N 3Å; Q18-R21 WeakPolarHBondContact O-CB 3.47Å; Q18-R21 PolarHBondContact O-N 2.87Å
19K95.5Very high96.1Very high124 Ų12464.1 Ų64.154%0.53936%0.357SS..Hα-helixtrans-63.5-39.1178.4-176.5-174.3174.5-163.10112.7R15 L16 R21 D62R15-K19 VanDerWaalsContact O-CB 3.27Å; R15-K19 WeakPolarHBondContact O-CB 3.38Å; R15-K19 PolarHBondContact O-N 2.83Å; L16-K19 PolarHBondContact O-N 3.01Å; K19-R21 VanDerWaalsContact C-N 3.31Å; K19-R21 PolarHBondContact O-N 2.82Å; K19-D62 IonicContact NZ-OD2 3.06Å; K19-D62 PolarHBondContact NZ-OD2 3.39Å
20C95.3Very high96Very high20 Ų2069.8 Ų69.814%0.13539%0.387CS..THydrogen-bonded Turntrans-91.715.6-177.4-54.90000113.5L16 F17 Q18 T23 V26 D62L16-C20 WeakPolarHBondContact O-CB 3.44Å; L16-C20 PolarHBondContact O-N 3.06Å; L16-C20 PolarHBondContact O-SG 3.21Å; F17-C20 PolarHBondContact O-N 3.49Å; Q18-C20 PolarHBondContact O-N 3Å; C20-T23 CarbonylContact C-O 3.46Å; C20-T23 VanDerWaalsContact CA-O 3.26Å; C20-T23 WeakPolarHBondContact CA-O 3.48Å; C20-V26 HydrophobicContact CB-CG2 3.78Å; C20-D62 WeakPolarHBondContact SG-CB 3.31Å
21R94.3Very high95.9Very high135 Ų13575.6 Ų75.651%0.50941%0.412SS..SBendtrans-70-35.2-172-172.362.5177.582.8-6.6113.7F17 Q18 K19 D92F17-R21 PolarHBondContact O-N 3.28Å; Q18-R21 WeakPolarHBondContact O-CB 3.47Å; Q18-R21 PolarHBondContact O-N 2.87Å; K19-R21 VanDerWaalsContact C-N 3.31Å; K19-R21 PolarHBondContact O-N 2.82Å; R21-D92 IonicContact CZ-OD1 3.21Å; R21-D92 IonicContact NE-OD1 3.27Å; R21-D92 PolarHBondContact NE-OD1 2.5Å; R21-D92 IonicContact NH2-OD1 3.61Å; R21-D92 PolarHBondContact NH2-OD1 2.87Å; R21-D92 IonicContact NH2-OD2 2.74Å; R21-D92 PolarHBondContact NH2-OD2 2.9Å
22T92.8Very high95.6Very high127 Ų12779.5 Ų79.578%0.77942%0.422SS*.SBendtrans-94.3-39.8-180530000112
23T94Very high95.3Very high111 Ų11180.5 Ų80.568%0.68143%0.425SS*.SBendtrans-145.3148-177.4610000110.4C20C20-T23 CarbonylContact C-O 3.46Å; C20-T23 VanDerWaalsContact CA-O 3.26Å; C20-T23 WeakPolarHBondContact CA-O 3.48Å
24G94.4Very high94.7Very high62 Ų6282.8 Ų82.864%0.63944%0.437SS*.  trans101.7-171.7177.900000113.6
25S94.8Very high94Very high96 Ų9681.8 Ų81.867%0.67143%0.434SS*.  trans-147.6141.6-178.1-60.40000109.4D62S25-D62 WeakPolarHBondContact O-CA 3.46Å
26V96.8Very high93.4Very high36 Ų3679.2 Ų79.222%0.21842%0.424CS..  trans-104.6117.8174.7-177.70000108.3L13 L16 F17 C20 I28 S61L13-V26 HydrophobicContact CD1-CG1 4.42Å; L16-V26 HydrophobicContact CB-CG2 4.46Å; F17-V26 HydrophobicContact CD1-CG2 4.27Å; F17-V26 HydrophobicContact CE1-CB 4.33Å; C20-V26 HydrophobicContact CB-CG2 3.78Å; V26-I28 HydrophobicContact CG1-CG1 4.13Å; V26-S61 WeakPolarHBondContact CA-O 3.35Å
27A97.2Very high92.8Very high60 Ų6085 Ų8550%0.49646%0.46SS..EExtended strand (participates in β ladder)trans-97.1124.6174.200000109.6A60 S61A27-A60 CarbonylContact O-C 3.51Å; A27-A60 VanDerWaalsContact O-CA 3.26Å; A27-A60 WeakPolarHBondContact O-CA 3.38Å; A27-S61 PolarHBondContact N-O 3.38Å; A27-S61 PolarHBondContact O-N 3.45Å
28I97.3Very high92.1Very high54 Ų5491.6 Ų91.628%0.27749%0.488SS..EExtended strand (participates in β ladder)trans-116.9133.5175-52.3175.6000108.7L13 F17 V26 R59 A60 L87L13-I28 HydrophobicContact CD1-CD1 4.02Å; L13-I28 HydrophobicContact CD1-CG1 4.42Å; L13-I28 HydrophobicContact CD2-CD1 4.37Å; F17-I28 HydrophobicContact CE2-CD1 4.21Å; F17-I28 HydrophobicContact CZ-CD1 3.9Å; V26-I28 HydrophobicContact CG1-CG1 4.13Å; I28-R59 CarbonylContact C-O 3.53Å; I28-R59 VanDerWaalsContact CA-O 3.31Å; I28-R59 WeakPolarHBondContact CA-O 3.35Å; I28-A60 HydrophobicContact CG1-CB 4.17Å; I28-L87 HydrophobicContact CD1-CD2 4.07Å
29T97.5Very high91.5Very high63 Ų6391.7 Ų91.739%0.38750%0.499SS..EExtended strand (participates in β ladder)trans-128.5142.2176.966.80000110.4L58 R59T29-L58 CarbonylContact O-C 3.52Å; T29-L58 WeakPolarHBondContact O-CA 3.16Å; T29-R59 PolarHBondContact N-O 3.24Å; T29-R59 PolarHBondContact O-N 3.07Å; T29-R59 PolarHBondContact OG1-NE 2.97Å
30L95.9Very high90.8Very high120 Ų12089.8 Ų89.863%0.62850%0.498SS*.EExtended strand (participates in β ladder)trans-123.9129.5176.2175.668.4000108.2C56 L58L30-C56 HydrophobicContact CD1-CB 3.81Å; L30-L58 HydrophobicContact CD1-CD1 3.34Å; L30-L58 HydrophobicContact CD1-CD2 4.48Å; L30-L58 HydrophobicContact CD1-CG 3.61Å
31K94.4Very high90.1Very high140 Ų14091.7 Ų91.761%0.60951%0.51SS*.EExtended strand (participates in β ladder)trans-139.5145.5176.7-164.6179.2177.9179.50110.3Y33 C56 L57K31-Y33 PolarHBondContact O-N 2.95Å; K31-C56 CarbonylContact O-C 3.58Å; K31-C56 WeakPolarHBondContact O-CA 3.37Å; K31-L57 PolarHBondContact N-O 2.98Å; K31-L57 PolarHBondContact O-N 2.85Å
32K91.7Very high89.6Confident158 Ų15895.8 Ų95.869%0.68753%0.525SS*.EExtended strand (participates in β ladder)trans-55.9131166.3-173.2177.7-178.4-176.50108.5
33Y90.2Very high88.8Confident51 Ų51100.2 Ų100.220%0.253%0.534CS..EExtended strand (participates in β ladder)trans-112.1119.9179.1-173.2-131.9000108.6K31 G35 R36 K55 L57 V70K31-Y33 PolarHBondContact O-N 2.95Å; Y33-G35 VanDerWaalsContact C-N 3.26Å; Y33-G35 VanDerWaalsContact CE1-CA 3.44Å; Y33-G35 VanDerWaalsContact CZ-CA 3.45Å; Y33-R36 WeakPolarHBondContact CE2-O 3.5Å; Y33-R36 PolarHBondContact OH-O 3.34Å; Y33-K55 HydrophobicContact CD1-CB 4.42Å; Y33-K55 PolarHBondContact N-O 2.93Å; Y33-L57 HydrophobicContact CD2-CB 4.38Å; Y33-L57 HydrophobicContact CG-CB 4.11Å; Y33-V70 HydrophobicContact CD1-CB 4.38Å; Y33-V70 HydrophobicContact CD1-CG1 3.73Å; Y33-V70 HydrophobicContact CD1-CG2 3.64Å; Y33-V70 HydrophobicContact CE1-CG1 4.23Å; Y33-V70 HydrophobicContact CE1-CG2 3.65Å
34D85.4Confident87.8Confident49 Ų4998.9 Ų98.926%0.26254%0.542SS..  trans-79.9-12177.750.112.6000111.9R36 Y49 A52D34-R36 HydrophobicContact CB-CG 4.43Å; D34-R36 WeakPolarHBondContact OD1-CB 3.26Å; D34-R36 WeakPolarHBondContact OD1-CG 3.33Å; D34-R36 PolarHBondContact OD1-N 2.72Å; D34-R36 VanDerWaalsContact OD1-N 3.15Å; D34-R36 WeakPolarHBondContact OD2-CD 3.38Å; D34-R36 IonicContact OD2-CZ 3.59Å; D34-R36 VanDerWaalsContact OD2-CZ 3.27Å; D34-R36 IonicContact OD2-NE 3.53Å; D34-R36 PolarHBondContact OD2-NE 2.84Å; D34-R36 IonicContact OD2-NH1 3.85Å; D34-R36 PolarHBondContact OD2-NH1 3.32Å; D34-Y49 VanDerWaalsContact C-OH 3.31Å; D34-Y49 HydrophobicContact CB-CE1 4.42Å; D34-Y49 WeakPolarHBondContact O-CE1 3.24Å; D34-Y49 PolarHBondContact O-OH 3.43Å; D34-A52 PolarHBondContact O-N 3.41Å
35G83.4Confident86.5Confident13 Ų13102.6 Ų102.613%0.13454%0.542CS..  trans89.96.7-177.900000114Y33 T37 Y49Y33-G35 VanDerWaalsContact C-N 3.26Å; Y33-G35 VanDerWaalsContact CE1-CA 3.44Å; Y33-G35 VanDerWaalsContact CZ-CA 3.45Å; G35-T37 PolarHBondContact O-N 3.13Å; G35-Y49 WeakPolarHBondContact CA-OH 3.29Å; G35-Y49 PolarHBondContact N-OH 3.46Å; G35-Y49 PolarHBondContact O-OH 2.82Å
36R82.5Confident85Confident93 Ų93103.3 Ų103.335%0.35155%0.545SS..  trans-65.2133.6178.4-68.1178.8178.9148.9-14.9111Y33 D34 E47 Y49Y33-R36 WeakPolarHBondContact CE2-O 3.5Å; Y33-R36 PolarHBondContact OH-O 3.34Å; D34-R36 HydrophobicContact CB-CG 4.43Å; D34-R36 WeakPolarHBondContact OD1-CB 3.26Å; D34-R36 WeakPolarHBondContact OD1-CG 3.33Å; D34-R36 PolarHBondContact OD1-N 2.72Å; D34-R36 VanDerWaalsContact OD1-N 3.15Å; D34-R36 WeakPolarHBondContact OD2-CD 3.38Å; D34-R36 IonicContact OD2-CZ 3.59Å; D34-R36 VanDerWaalsContact OD2-CZ 3.27Å; D34-R36 IonicContact OD2-NE 3.53Å; D34-R36 PolarHBondContact OD2-NE 2.84Å; D34-R36 IonicContact OD2-NH1 3.85Å; D34-R36 PolarHBondContact OD2-NH1 3.32Å; R36-E47 IonicContact NH2-OE1 3.99Å; R36-Y49 HydrophobicContact CG-CD1 3.55Å; R36-Y49 HydrophobicContact CG-CD2 4.41Å; R36-Y49 HydrophobicContact CG-CE1 3.55Å; R36-Y49 HydrophobicContact CG-CE2 4.45Å; R36-Y49 HydrophobicContact CG-CG 4.03Å
37T83Confident83.5Confident125 Ų125107.8 Ų107.877%0.76756%0.563SS**  trans-112-11.8173.157.50000112.6G35G35-T37 PolarHBondContact O-N 3.13Å
38K82.8Confident81.8Confident167 Ų167110.7 Ų110.773%0.72658%0.58SS**SBendtrans-123.9154.4178.9-64.6-178.6-176.9177.30110.3
39P83.3Confident80.2Confident122 Ų122111.3 Ų111.379%0.79258%0.58SS**PPolyproline II helixtrans-57.8154.4173.2-21.532.8000112
40V79.9Confident78.7Confident84 Ų84116.2 Ų116.251%0.50960%0.598SS.*PPolyproline II helixtrans-62.6128.9172.2-1790000108.6
41P80.9Confident77.3Confident59 Ų59114.4 Ų114.438%0.38359%0.593SS.*PPolyproline II helixtrans-57.4152.6178.2-22.231.9000112.3H45P41-H45 HydrophobicContact CB-CB 3.79Å
42R82.6Confident75.9Confident221 Ų221109 Ų10983%0.83458%0.575SS**PPolyproline II helixtrans-65.2150.6170.2-64.5-177.4-169.2167.33.4109.5G44 H45R42-G44 PolarHBondContact O-N 3.39Å; R42-H45 PolarHBondContact O-N 3.48Å
43K77.2Confident74.9Confident221 Ų221107.6 Ų107.696%0.96158%0.575SS**THydrogen-bonded Turntrans-47.6127176.7-79.4-173.4175.3-176.50110.3
44G71.8Confident74.6Confident83 Ų83109.8 Ų109.886%0.85659%0.59SS**THydrogen-bonded Turntrans108.1-9179.900000115.2R42R42-G44 PolarHBondContact O-N 3.39Å
45H67.4Low74.9Confident139 Ų139111.4 Ų111.464%0.64460%0.595SS**SBendtrans-100141169.4-73.6-73.2000111.3P41 R42 E47P41-H45 HydrophobicContact CB-CB 3.79Å; R42-H45 PolarHBondContact O-N 3.48Å; H45-E47 PolarHBondContact O-N 3.18Å
46P64.4Low75.3Confident112 Ų112112.4 Ų112.473%0.72760%0.6SS**  trans-61.6131.9179.123.2-31000111S48P46-S48 PolarHBondContact O-N 3.39Å
47E65.1Low75.9Confident129 Ų129109.5 Ų109.560%0.60359%0.591SS**  trans-69.7107.6169.3-75.7-154.3136.600108.4R36 H45 Y49R36-E47 IonicContact NH2-OE1 3.99Å; H45-E47 PolarHBondContact O-N 3.18Å; E47-Y49 PolarHBondContact O-N 3.2Å
48S61.8Low76.6Confident122 Ų122103.9 Ų103.985%0.85356%0.556SS**  trans-87.51417983.90000113P46P46-S48 PolarHBondContact O-N 3.39Å
49Y62.3Low77.3Confident67 Ų67100 Ų10026%0.26354%0.537SS..  trans-118.2105.8-164.2-170.9-98.4000112D34 G35 R36 E47 P51 A52D34-Y49 VanDerWaalsContact C-OH 3.31Å; D34-Y49 HydrophobicContact CB-CE1 4.42Å; D34-Y49 WeakPolarHBondContact O-CE1 3.24Å; D34-Y49 PolarHBondContact O-OH 3.43Å; G35-Y49 WeakPolarHBondContact CA-OH 3.29Å; G35-Y49 PolarHBondContact N-OH 3.46Å; G35-Y49 PolarHBondContact O-OH 2.82Å; R36-Y49 HydrophobicContact CG-CD1 3.55Å; R36-Y49 HydrophobicContact CG-CD2 4.41Å; R36-Y49 HydrophobicContact CG-CE1 3.55Å; R36-Y49 HydrophobicContact CG-CE2 4.45Å; R36-Y49 HydrophobicContact CG-CG 4.03Å; E47-Y49 PolarHBondContact O-N 3.2Å; Y49-P51 WeakPolarHBondContact O-CD 3.42Å; Y49-A52 PolarHBondContact OH-N 3.34Å
50E66.4Low78Confident166 Ų16694.3 Ų94.378%0.77650%0.5SS*.  trans-72.2120.1166.1-73.3-59.9136.300109.5A52E50-A52 PolarHBondContact O-N 3.15Å; E50-A52 VanDerWaalsContact O-N 3.1Å
51P66.1Low78.8Confident81 Ų8191.4 Ų91.453%0.52648%0.483SS..  trans-55.1117.8175.3-22.733.3000110.8Y49 D53Y49-P51 WeakPolarHBondContact O-CD 3.42Å; P51-D53 PolarHBondContact O-N 3Å; P51-D53 VanDerWaalsContact O-N 3.1Å
52A66.1Low79.5Confident26 Ų2689.9 Ų89.922%0.21547%0.472CS..  trans-67.4114.5172.300000108D34 Y49 E50 N54 K55D34-A52 PolarHBondContact O-N 3.41Å; Y49-A52 PolarHBondContact OH-N 3.34Å; E50-A52 PolarHBondContact O-N 3.15Å; E50-A52 VanDerWaalsContact O-N 3.1Å; A52-N54 PolarHBondContact O-N 3.21Å; A52-K55 HydrophobicContact CB-CD 4.26Å
53D70.4Confident80Confident129 Ų12982.2 Ų82.269%0.6946%0.461SS*.THydrogen-bonded Turntrans-63.9127.6-174-92.3-28.5000112.2P51P51-D53 PolarHBondContact O-N 3Å; P51-D53 VanDerWaalsContact O-N 3.1Å
54N83.1Confident80.6Confident98 Ų9880.7 Ų80.752%0.52446%0.455SS..THydrogen-bonded Turntrans59.248.1163-56.6-47.4000117A52 T73A52-N54 PolarHBondContact O-N 3.21Å; N54-T73 HydrophobicContact CB-CG2 3.61Å; N54-T73 WeakPolarHBondContact O-CG2 3.31Å
55K91.6Very high81.7Confident82 Ų8281.1 Ų81.136%0.35743%0.433SS..EExtended strand (participates in β ladder)trans-100.3155.3166.8-60.8-179.7-175.2176.60111.9Y33 A52 V70 V71Y33-K55 HydrophobicContact CD1-CB 4.42Å; Y33-K55 PolarHBondContact N-O 2.93Å; A52-K55 HydrophobicContact CB-CD 4.26Å; K55-V70 HydrophobicContact CB-CG1 4.02Å; K55-V70 HydrophobicContact CD-CG1 3.99Å; K55-V70 HydrophobicContact CG-CG1 4.42Å; K55-V71 WeakPolarHBondContact CA-O 3.47Å
56C93.3Very high83.2Confident35 Ų3579.4 Ų79.424%0.23642%0.424CS..EExtended strand (participates in β ladder)trans-126144.3168.866.90000111.6L30 K31 V70 V71L30-C56 HydrophobicContact CD1-CB 3.81Å; K31-C56 CarbonylContact O-C 3.58Å; K31-C56 WeakPolarHBondContact O-CA 3.37Å; C56-V70 CarbonylContact O-C 3.58Å; C56-V70 WeakPolarHBondContact O-CA 3.42Å; C56-V71 PolarHBondContact N-O 3.37Å; C56-V71 PolarHBondContact O-N 3.4Å
57L95.1Very high84.8Confident31 Ų3174.2 Ų74.216%0.16239%0.39CS..EExtended strand (participates in β ladder)trans-104.2120.6176.4177.670.4000108.4K31 Y33 R59 V70K31-L57 PolarHBondContact N-O 2.98Å; K31-L57 PolarHBondContact O-N 2.85Å; Y33-L57 HydrophobicContact CD2-CB 4.38Å; Y33-L57 HydrophobicContact CG-CB 4.11Å; L57-R59 HydrophobicContact CD2-CG 4.26Å; L57-R59 HydrophobicContact CG-CG 4.07Å; L57-V70 HydrophobicContact CD1-CG2 3.77Å
58L97.2Very high86.3Confident7 Ų768.5 Ų68.54%0.03736%0.364CS..EExtended strand (participates in β ladder)trans-100.8139.1169.8-76.382.8000109.5F9 T29 L30 S68 T69 V71 F79 Y83F9-L58 HydrophobicContact CE1-CB 4.45Å; F9-L58 HydrophobicContact CE1-CD2 4.47Å; F9-L58 HydrophobicContact CZ-CB 4.08Å; T29-L58 CarbonylContact O-C 3.52Å; T29-L58 WeakPolarHBondContact O-CA 3.16Å; L30-L58 HydrophobicContact CD1-CD1 3.34Å; L30-L58 HydrophobicContact CD1-CD2 4.48Å; L30-L58 HydrophobicContact CD1-CG 3.61Å; L58-S68 CarbonylContact O-C 3.59Å; L58-S68 WeakPolarHBondContact O-CA 3.37Å; L58-S68 WeakPolarHBondContact O-CB 3.47Å; L58-T69 HydrophobicContact CB-CG2 4.11Å; L58-T69 PolarHBondContact N-O 3.46Å; L58-T69 PolarHBondContact O-N 2.82Å; L58-V71 HydrophobicContact CD1-CB 4.48Å; L58-V71 HydrophobicContact CD1-CG2 3.85Å; L58-F79 HydrophobicContact CD1-CE1 4.4Å; L58-F79 HydrophobicContact CD2-CE1 3.65Å; L58-F79 HydrophobicContact CD2-CZ 3.88Å; L58-Y83 HydrophobicContact CD2-CE2 4.36Å
59R97.6Very high88Confident87 Ų8762.7 Ų62.733%0.32832%0.324SS..EExtended strand (participates in β ladder)trans-134.3136.1175.1-55.6177.2-79.1-179.6-3109.5M1 I28 T29 L57 I67M1-R59 HydrophobicContact CE-CB 4.27Å; M1-R59 HydrophobicContact CE-CG 4.22Å; M1-R59 HydrophobicContact SD-CG 4.35Å; I28-R59 CarbonylContact C-O 3.53Å; I28-R59 VanDerWaalsContact CA-O 3.31Å; I28-R59 WeakPolarHBondContact CA-O 3.35Å; T29-R59 PolarHBondContact N-O 3.24Å; T29-R59 PolarHBondContact O-N 3.07Å; T29-R59 PolarHBondContact OG1-NE 2.97Å; L57-R59 HydrophobicContact CD2-CG 4.26Å; L57-R59 HydrophobicContact CG-CG 4.07Å; R59-I67 WeakPolarHBondContact CA-O 3.44Å
60A97.8Very high89.6Confident2 Ų261.2 Ų61.22%0.01732%0.322CS..EExtended strand (participates in β ladder)trans-129.1145.2175.200000111.1F9 L13 L16 A27 I28 I67F9-A60 HydrophobicContact CE2-CB 4.32Å; F9-A60 HydrophobicContact CZ-CB 4.15Å; L13-A60 HydrophobicContact CD1-CB 3.7Å; L16-A60 HydrophobicContact CD1-CB 4.16Å; A27-A60 CarbonylContact O-C 3.51Å; A27-A60 VanDerWaalsContact O-CA 3.26Å; A27-A60 WeakPolarHBondContact O-CA 3.38Å; I28-A60 HydrophobicContact CG1-CB 4.17Å; A60-I67 HydrophobicContact CB-CD1 4.21Å; A60-I67 HydrophobicContact CB-CG1 3.87Å; A60-I67 PolarHBondContact N-O 3.4Å; A60-I67 PolarHBondContact O-N 3.23Å
61S96.9Very high90.9Very high22 Ų2253.5 Ų53.515%0.15429%0.286CS..EExtended strand (participates in β ladder)trans-154.4138.5-176175.20000112.4V26 A27 G63 K65V26-S61 WeakPolarHBondContact CA-O 3.35Å; A27-S61 PolarHBondContact N-O 3.38Å; A27-S61 PolarHBondContact O-N 3.45Å; S61-G63 VanDerWaalsContact C-N 3.31Å; S61-G63 PolarHBondContact OG-N 2.81Å; S61-K65 VanDerWaalsContact CA-O 3.26Å; S61-K65 WeakPolarHBondContact CA-O 3.09Å
62D94.7Very high92.2Very high27 Ų2750.9 Ų50.914%0.14427%0.269CS..SBendtrans-91.98.616767.8-4.6000112.8L16 K19 C20 S25 K64 K65L16-D62 HydrophobicContact CD2-CB 3.95Å; K19-D62 IonicContact NZ-OD2 3.06Å; K19-D62 PolarHBondContact NZ-OD2 3.39Å; C20-D62 WeakPolarHBondContact SG-CB 3.31Å; S25-D62 WeakPolarHBondContact O-CA 3.46Å; D62-K64 VanDerWaalsContact C-N 3.33Å; D62-K64 WeakPolarHBondContact OD1-CA 3.35Å; D62-K64 PolarHBondContact OD1-N 2.88Å; D62-K65 PolarHBondContact N-O 2.88Å; D62-K65 PolarHBondContact OD1-N 2.92Å
63G92.9Very high93.4Very high60 Ų6053.8 Ų53.862%0.61929%0.285SS*.SBendtrans95.1-25.8-173.400000113.1S61S61-G63 VanDerWaalsContact C-N 3.31Å; S61-G63 PolarHBondContact OG-N 2.81Å
64K91.5Very high94.4Very high189 Ų18956.9 Ų56.982%0.82229%0.292SS*.SBendtrans-105.9-61.8178.9-60.3179.2-177.91800110.8D62D62-K64 VanDerWaalsContact C-N 3.33Å; D62-K64 WeakPolarHBondContact OD1-CA 3.35Å; D62-K64 PolarHBondContact OD1-N 2.88Å
65K94.6Very high94.8Very high92 Ų9256.9 Ų56.940%0.429%0.289SS..  trans-87.5131.7178.7-170.1176.1-171.9178.70109.8E12 L16 S61 D62E12-K65 WeakPolarHBondContact OE2-CE 3.37Å; E12-K65 IonicContact OE2-NZ 2.74Å; E12-K65 PolarHBondContact OE2-NZ 2.92Å; L16-K65 HydrophobicContact CD2-CB 4.27Å; L16-K65 HydrophobicContact CD2-CD 4.43Å; S61-K65 VanDerWaalsContact CA-O 3.26Å; S61-K65 WeakPolarHBondContact CA-O 3.09Å; D62-K65 PolarHBondContact N-O 2.88Å; D62-K65 PolarHBondContact OD1-N 2.92Å
66K97.4Very high94.9Very high104 Ų10456 Ų5645%0.45229%0.29SS..EExtended strand (participates in β ladder)trans-124.5116.8-179.3-63.8179-178.1176.60110.5M1 V2M1-K66 WeakPolarHBondContact CA-O 3.26Å; M1-K66 HydrophobicContact CB-CB 4.09Å; M1-K66 HydrophobicContact CE-CB 4.14Å; M1-K66 HydrophobicContact CE-CD 4.3Å; M1-K66 HydrophobicContact CG-CB 4.22Å; V2-K66 PolarHBondContact N-O 2.99Å
67I97.9Very high95Very high3 Ų359.8 Ų59.82%0.01531%0.307CS..EExtended strand (participates in β ladder)trans-115153.4175.861.9174000110.4V2 L4 F9 E12 L13 L16 R59 A60V2-I67 CarbonylContact O-C 3.58Å; L4-I67 HydrophobicContact CD1-CB 4.1Å; L4-I67 HydrophobicContact CD1-CG2 3.99Å; F9-I67 HydrophobicContact CD2-CB 4.36Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.05Å; F9-I67 HydrophobicContact CE2-CB 4.45Å; F9-I67 HydrophobicContact CE2-CD1 3.92Å; F9-I67 HydrophobicContact CE2-CG1 3.8Å; E12-I67 HydrophobicContact CB-CD1 3.75Å; E12-I67 HydrophobicContact CB-CG2 4.35Å; L13-I67 HydrophobicContact CB-CD1 4.32Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.91Å; R59-I67 WeakPolarHBondContact CA-O 3.44Å; A60-I67 HydrophobicContact CB-CD1 4.21Å; A60-I67 HydrophobicContact CB-CG1 3.87Å; A60-I67 PolarHBondContact N-O 3.4Å; A60-I67 PolarHBondContact O-N 3.23Å
68S97.6Very high95Very high8 Ų864.3 Ų64.36%0.05633%0.325CS..EExtended strand (participates in β ladder)trans-149152.6179.856.80000111.2V2 L3 L4 L58V2-S68 PolarHBondContact O-N 3.31Å; V2-S68 PolarHBondContact O-OG 3.45Å; L3-S68 WeakPolarHBondContact CA-O 3.49Å; L4-S68 PolarHBondContact N-O 2.74Å; L58-S68 CarbonylContact O-C 3.59Å; L58-S68 WeakPolarHBondContact O-CA 3.37Å; L58-S68 WeakPolarHBondContact O-CB 3.47Å
69T97.3Very high95Very high1 Ų164.7 Ų64.71%0.00633%0.327CS..EExtended strand (participates in β ladder)trans-146.3151.3173.1-163.50000110L4 N6 F9 L58 V71 F79L4-T69 WeakPolarHBondContact O-CB 3.27Å; L4-T69 PolarHBondContact O-OG1 2.59Å; N6-T69 PolarHBondContact ND2-OG1 3.48Å; F9-T69 HydrophobicContact CB-CG2 3.86Å; F9-T69 HydrophobicContact CD1-CG2 3.61Å; F9-T69 HydrophobicContact CD2-CG2 3.74Å; F9-T69 HydrophobicContact CE1-CG2 4.04Å; F9-T69 HydrophobicContact CE2-CG2 4.15Å; F9-T69 HydrophobicContact CG-CG2 3.44Å; F9-T69 VanDerWaalsContact CG-CG2 3.44Å; F9-T69 HydrophobicContact CZ-CG2 4.3Å; L58-T69 HydrophobicContact CB-CG2 4.11Å; L58-T69 PolarHBondContact N-O 3.46Å; L58-T69 PolarHBondContact O-N 2.82Å; T69-V71 HydrophobicContact CG2-CG2 4.23Å; T69-F79 HydrophobicContact CG2-CE2 4.26Å; T69-F79 HydrophobicContact CG2-CZ 4.22Å
70V95.4Very high94.9Very high36 Ų3666.4 Ų66.422%0.21834%0.338CS..EExtended strand (participates in β ladder)trans-105.3129.3173.6175.20000107.7L3 N6 Y33 K55 C56 L57L3-V70 HydrophobicContact CD1-CG2 4.07Å; N6-V70 PolarHBondContact ND2-O 3.25Å; Y33-V70 HydrophobicContact CD1-CB 4.38Å; Y33-V70 HydrophobicContact CD1-CG1 3.73Å; Y33-V70 HydrophobicContact CD1-CG2 3.64Å; Y33-V70 HydrophobicContact CE1-CG1 4.23Å; Y33-V70 HydrophobicContact CE1-CG2 3.65Å; K55-V70 HydrophobicContact CB-CG1 4.02Å; K55-V70 HydrophobicContact CD-CG1 3.99Å; K55-V70 HydrophobicContact CG-CG1 4.42Å; C56-V70 CarbonylContact O-C 3.58Å; C56-V70 WeakPolarHBondContact O-CA 3.42Å; L57-V70 HydrophobicContact CD1-CG2 3.77Å
71V94.9Very high94.8Very high3 Ų371.7 Ų71.72%0.01836%0.364CS..EExtended strand (participates in β ladder)trans-111.4127.3177.8-1780000108.4K55 C56 L58 T69 V76 F79K55-V71 WeakPolarHBondContact CA-O 3.47Å; C56-V71 PolarHBondContact N-O 3.37Å; C56-V71 PolarHBondContact O-N 3.4Å; L58-V71 HydrophobicContact CD1-CB 4.48Å; L58-V71 HydrophobicContact CD1-CG2 3.85Å; T69-V71 HydrophobicContact CG2-CG2 4.23Å; V71-V76 HydrophobicContact CG1-CB 4.32Å; V71-V76 HydrophobicContact CG1-CG2 4.4Å; V71-F79 HydrophobicContact CG1-CB 4.19Å; V71-F79 HydrophobicContact CG1-CD1 4.31Å; V71-F79 HydrophobicContact CG1-CG 4.25Å; V71-F79 HydrophobicContact CG2-CD1 3.83Å; V71-F79 HydrophobicContact CG2-CD2 4.1Å; V71-F79 HydrophobicContact CG2-CE1 3.9Å; V71-F79 HydrophobicContact CG2-CE2 4.15Å; V71-F79 HydrophobicContact CG2-CG 3.92Å; V71-F79 HydrophobicContact CG2-CZ 4.05Å
72S93.2Very high94.8Very high26 Ų2672.6 Ų72.618%0.18237%0.373CS..  trans-91.6164.4176.4730000111K74 E75 V76S72-K74 PolarHBondContact O-N 3.12Å; S72-K74 PolarHBondContact OG-N 3.5Å; S72-E75 PolarHBondContact O-N 2.85Å; S72-E75 PolarHBondContact OG-OE2 2.82Å; S72-V76 PolarHBondContact O-N 2.94Å
73T91.2Very high95Very high88 Ų8873.6 Ų73.654%0.5438%0.375SS..THydrogen-bonded Turntrans-59.1-29.517349.40000113.2N54 V76N54-T73 HydrophobicContact CB-CG2 3.61Å; N54-T73 WeakPolarHBondContact O-CG2 3.31Å; T73-V76 WeakPolarHBondContact O-CG1 3.37Å
74K91.6Very high95.2Very high193 Ų19372.2 Ų72.284%0.83936%0.356SS*.THydrogen-bonded Turntrans-68.7-35.4-178.1-63.7-177.3178.6-178.40112.5S72S72-K74 PolarHBondContact O-N 3.12Å; S72-K74 PolarHBondContact OG-N 3.5Å
75E91.4Very high95.5Very high98 Ų9867.9 Ų67.946%0.45834%0.342SS..THydrogen-bonded Turntrans-104.1-4.1-172.1-64.9151.1156.500112.6S72 I77 K78 F79S72-E75 PolarHBondContact O-N 2.85Å; S72-E75 PolarHBondContact OG-OE2 2.82Å; E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.02Å; E75-K78 PolarHBondContact O-N 3.42Å; E75-F79 WeakPolarHBondContact O-CB 3.37Å; E75-F79 PolarHBondContact O-N 3.15Å
76V93.4Very high95.6Very high63 Ų6364.2 Ų64.238%0.38233%0.327SS..Hα-helixtrans-58.6-38.7-17275.40000113V71 S72 T73 F79 Q80V71-V76 HydrophobicContact CG1-CB 4.32Å; V71-V76 HydrophobicContact CG1-CG2 4.4Å; S72-V76 PolarHBondContact O-N 2.94Å; T73-V76 WeakPolarHBondContact O-CG1 3.37Å; V76-F79 PolarHBondContact O-N 2.82Å; V76-Q80 WeakPolarHBondContact O-CB 3.15Å; V76-Q80 PolarHBondContact O-N 3.33Å
77I95.1Very high95.6Very high116 Ų11660.8 Ų60.860%0.59531%0.313SS*.Hα-helixtrans-67.1-48.6-177.5-61.8173.4000110.2E75 Q80 M81E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.02Å; I77-Q80 PolarHBondContact O-N 2.82Å; I77-M81 HydrophobicContact CG2-CE 4.27Å; I77-M81 PolarHBondContact O-N 2.85Å
78K95.3Very high95.4Very high126 Ų12669.4 Ų69.455%0.54835%0.345SS..Hα-helixtrans-61.5-48176.8-175.3-171175.1-157.90110.3D7 E75 Q80 M81 A82D7-K78 IonicContact OD1-NZ 3.29Å; D7-K78 IonicContact OD2-NZ 2.77Å; D7-K78 PolarHBondContact OD2-NZ 3.37Å; E75-K78 PolarHBondContact O-N 3.42Å; K78-Q80 PolarHBondContact O-N 3.42Å; K78-M81 PolarHBondContact O-N 3.46Å; K78-A82 PolarHBondContact O-N 2.84Å
79F96.4Very high95.4Very high15 Ų1572 Ų727%0.06637%0.367CS..Hα-helixtrans-62-44.6-179.1-173.9-94.6000111.9N6 F9 L10 L58 T69 V71 E75 V76 M81 A82 Y83N6-F79 HydrophobicContact CB-CD2 3.89Å; N6-F79 HydrophobicContact CB-CE2 4.25Å; F9-F79 HydrophobicContact CD1-CE2 4.19Å; F9-F79 HydrophobicContact CD1-CZ 4.04Å; F9-F79 HydrophobicContact CE1-CZ 4.16Å; L10-F79 HydrophobicContact CD1-CD2 4.27Å; L10-F79 HydrophobicContact CD1-CE2 4.26Å; L10-F79 HydrophobicContact CD2-CE2 3.9Å; L10-F79 HydrophobicContact CD2-CZ 4.11Å; L10-F79 HydrophobicContact CG-CD2 4.46Å; L10-F79 HydrophobicContact CG-CE2 3.95Å; L58-F79 HydrophobicContact CD1-CE1 4.4Å; L58-F79 HydrophobicContact CD2-CE1 3.65Å; L58-F79 HydrophobicContact CD2-CZ 3.88Å; T69-F79 HydrophobicContact CG2-CE2 4.26Å; T69-F79 HydrophobicContact CG2-CZ 4.22Å; V71-F79 HydrophobicContact CG1-CB 4.19Å; V71-F79 HydrophobicContact CG1-CD1 4.31Å; V71-F79 HydrophobicContact CG1-CG 4.25Å; V71-F79 HydrophobicContact CG2-CD1 3.83Å; V71-F79 HydrophobicContact CG2-CD2 4.1Å; V71-F79 HydrophobicContact CG2-CE1 3.9Å; V71-F79 HydrophobicContact CG2-CE2 4.15Å; V71-F79 HydrophobicContact CG2-CG 3.92Å; V71-F79 HydrophobicContact CG2-CZ 4.05Å; E75-F79 WeakPolarHBondContact O-CB 3.37Å; E75-F79 PolarHBondContact O-N 3.15Å; V76-F79 PolarHBondContact O-N 2.82Å; F79-M81 PolarHBondContact O-N 3.19Å; F79-A82 PolarHBondContact O-N 3.48Å; F79-Y83 HydrophobicContact CE1-CD2 4.28Å; F79-Y83 HydrophobicContact CE1-CG 4Å; F79-Y83 HydrophobicContact CZ-CD2 4.34Å; F79-Y83 HydrophobicContact CZ-CG 4.47Å; F79-Y83 WeakPolarHBondContact O-CB 3.14Å; F79-Y83 PolarHBondContact O-N 2.98Å
80Q96.1Very high95.3Very high123 Ų12374.4 Ų74.458%0.57538%0.379SS*.Hα-helixtrans-60.2-45.5-179.1-176.4-151.9-22.500111.9V76 I77 K78 Y83 S84V76-Q80 WeakPolarHBondContact O-CB 3.15Å; V76-Q80 PolarHBondContact O-N 3.33Å; I77-Q80 PolarHBondContact O-N 2.82Å; K78-Q80 PolarHBondContact O-N 3.42Å; Q80-Y83 PolarHBondContact O-N 3.28Å; Q80-S84 WeakPolarHBondContact O-CB 3.11Å; Q80-S84 PolarHBondContact O-N 3.24Å
81M96.8Very high95.2Very high112 Ų11277.5 Ų77.555%0.55239%0.392SS*.Hα-helixtrans-61.2-49.2180-70.6-171.9-68.400111.2I77 K78 F79 N85I77-M81 HydrophobicContact CG2-CE 4.27Å; I77-M81 PolarHBondContact O-N 2.85Å; K78-M81 PolarHBondContact O-N 3.46Å; F79-M81 PolarHBondContact O-N 3.19Å; M81-N85 VanDerWaalsContact O-CG 3.3Å; M81-N85 PolarHBondContact O-N 3.25Å; M81-N85 VanDerWaalsContact O-N 3.12Å; M81-N85 PolarHBondContact O-ND2 3.49Å
82A97.1Very high95.2Very high42 Ų4281.9 Ų81.935%0.34742%0.415SS..Hα-helixtrans-65.7-44179.600000112L10 K78 F79 N85 L86L10-A82 HydrophobicContact CD1-CB 3.61Å; K78-A82 PolarHBondContact O-N 2.84Å; F79-A82 PolarHBondContact O-N 3.48Å; A82-N85 PolarHBondContact O-N 2.82Å; A82-L86 WeakPolarHBondContact O-CB 3.12Å; A82-L86 PolarHBondContact O-N 2.88Å
83Y97.6Very high95.1Very high47 Ų4783.6 Ų83.618%0.18444%0.437CS..Hα-helixtrans-63.4-43178.1-178.7-113.3000112.4L10 L13 L58 F79 Q80 L86 L87L10-Y83 HydrophobicContact CD2-CD2 4.04Å; L13-Y83 HydrophobicContact CD2-CD2 4.09Å; L13-Y83 HydrophobicContact CD2-CE2 3.72Å; L58-Y83 HydrophobicContact CD2-CE2 4.36Å; F79-Y83 HydrophobicContact CE1-CD2 4.28Å; F79-Y83 HydrophobicContact CE1-CG 4Å; F79-Y83 HydrophobicContact CZ-CD2 4.34Å; F79-Y83 HydrophobicContact CZ-CG 4.47Å; F79-Y83 WeakPolarHBondContact O-CB 3.14Å; F79-Y83 PolarHBondContact O-N 2.98Å; Q80-Y83 PolarHBondContact O-N 3.28Å; Y83-L86 PolarHBondContact O-N 2.99Å; Y83-L87 HydrophobicContact CD1-CD1 4.04Å; Y83-L87 HydrophobicContact CD1-CG 4.49Å; Y83-L87 HydrophobicContact CD2-CG 4.47Å; Y83-L87 HydrophobicContact CE1-CD1 3.45Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.45Å; Y83-L87 HydrophobicContact CE1-CG 4.13Å; Y83-L87 HydrophobicContact CE2-CD1 4.27Å; Y83-L87 HydrophobicContact CE2-CD2 4.21Å; Y83-L87 HydrophobicContact CE2-CG 4.11Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 WeakPolarHBondContact O-CG 3.45Å; Y83-L87 PolarHBondContact O-N 2.92Å
84S97.5Very high95.1Very high32 Ų3286.1 Ų86.122%0.22445%0.447CS..Hα-helixtrans-62.1-44.2176.8-178.10000111.9Q80 L87 R88Q80-S84 WeakPolarHBondContact O-CB 3.11Å; Q80-S84 PolarHBondContact O-N 3.24Å; S84-L87 PolarHBondContact O-N 3.08Å; S84-R88 WeakPolarHBondContact O-CG 3.38Å; S84-R88 PolarHBondContact O-N 3.29Å
85N97.1Very high95.1Very high98 Ų9886.9 Ų86.952%0.52445%0.45SS..Hα-helixtrans-64.7-43.1177.4-71.5-14.6000111.6M81 A82 R88 A89M81-N85 VanDerWaalsContact O-CG 3.3Å; M81-N85 PolarHBondContact O-N 3.25Å; M81-N85 VanDerWaalsContact O-N 3.12Å; M81-N85 PolarHBondContact O-ND2 3.49Å; A82-N85 PolarHBondContact O-N 2.82Å; N85-R88 PolarHBondContact O-N 3.47Å; N85-A89 WeakPolarHBondContact O-CB 3.35Å; N85-A89 PolarHBondContact O-N 3.15Å
86L97.3Very high95Very high15 Ų1591.4 Ų91.48%0.07947%0.468CS..Hα-helixtrans-58.4-49.7175.4-174.6163000111.2L10 L13 T14 F17 A82 Y83 R88 A89 H90L10-L86 HydrophobicContact CB-CD1 4.19Å; L10-L86 HydrophobicContact CD2-CD1 4.04Å; L10-L86 VanDerWaalsContact O-CD1 3.29Å; L10-L86 WeakPolarHBondContact O-CD1 3.33Å; L13-L86 HydrophobicContact CB-CD1 4.33Å; L13-L86 HydrophobicContact CD2-CD1 4.2Å; L13-L86 HydrophobicContact CD2-CD2 3.8Å; L13-L86 HydrophobicContact CG-CD1 4.37Å; L13-L86 HydrophobicContact CG-CD2 3.94Å; T14-L86 VanDerWaalsContact OG1-CD1 3.31Å; T14-L86 WeakPolarHBondContact OG1-CD1 3.38Å; F17-L86 HydrophobicContact CD2-CD2 3.77Å; F17-L86 HydrophobicContact CE2-CD2 3.62Å; A82-L86 WeakPolarHBondContact O-CB 3.12Å; A82-L86 PolarHBondContact O-N 2.88Å; Y83-L86 PolarHBondContact O-N 2.99Å; L86-R88 PolarHBondContact O-N 2.89Å; L86-A89 PolarHBondContact O-N 3.47Å; L86-H90 PolarHBondContact O-CD2 2.95Å; L86-H90 VanDerWaalsContact O-CD2 3.28Å; L86-H90 PolarHBondContact O-N 3.1Å; L86-H90 VanDerWaalsContact O-N 3.07Å
87L96.8Very high94.6Very high32 Ų3298.1 Ų98.117%0.16849%0.492CS..Hα-helixtrans-58.7-46.7178.8-79.2-171.1000112.2F17 I28 Y83 S84 A89 H90 M91F17-L87 HydrophobicContact CE2-CD2 4.22Å; F17-L87 HydrophobicContact CZ-CD2 3.99Å; I28-L87 HydrophobicContact CD1-CD2 4.07Å; Y83-L87 HydrophobicContact CD1-CD1 4.04Å; Y83-L87 HydrophobicContact CD1-CG 4.49Å; Y83-L87 HydrophobicContact CD2-CG 4.47Å; Y83-L87 HydrophobicContact CE1-CD1 3.45Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.45Å; Y83-L87 HydrophobicContact CE1-CG 4.13Å; Y83-L87 HydrophobicContact CE2-CD1 4.27Å; Y83-L87 HydrophobicContact CE2-CD2 4.21Å; Y83-L87 HydrophobicContact CE2-CG 4.11Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 WeakPolarHBondContact O-CG 3.45Å; Y83-L87 PolarHBondContact O-N 2.92Å; S84-L87 PolarHBondContact O-N 3.08Å; L87-A89 VanDerWaalsContact C-N 3.32Å; L87-A89 PolarHBondContact O-N 2.86Å; L87-H90 PolarHBondContact O-N 2.91Å; L87-M91 HydrophobicContact CB-CE 3.7Å; L87-M91 HydrophobicContact CD1-CE 4.26Å; L87-M91 HydrophobicContact CD2-CE 3.9Å; L87-M91 HydrophobicContact CD2-SD 4.28Å; L87-M91 HydrophobicContact CG-CE 4.16Å; L87-M91 WeakPolarHBondContact O-CB 2.93Å; L87-M91 WeakPolarHBondContact O-CG 3.42Å; L87-M91 PolarHBondContact O-N 2.77Å
88R95.4Very high93.9Very high183 Ų18399.7 Ų99.769%0.69150%0.502SS*.Hα-helixtrans-63.7-37.3177.9-72.9174.7-176.3157.3-1.1112.6S84 N85 L86S84-R88 WeakPolarHBondContact O-CG 3.38Å; S84-R88 PolarHBondContact O-N 3.29Å; N85-R88 PolarHBondContact O-N 3.47Å; L86-R88 PolarHBondContact O-N 2.89Å
89A96.3Very high92.9Very high63 Ų63103.5 Ų103.552%0.52152%0.518SS..Hα-helixtrans-70.5-34.2-179.500000112.9N85 L86 L87N85-A89 WeakPolarHBondContact O-CB 3.35Å; N85-A89 PolarHBondContact O-N 3.15Å; L86-A89 PolarHBondContact O-N 3.47Å; L87-A89 VanDerWaalsContact C-N 3.32Å; L87-A89 PolarHBondContact O-N 2.86Å
90H95.7Very high91.5Very high52 Ų52112.4 Ų112.424%0.24156%0.557CS.*Hα-helixtrans-104.1-14.8-172.2-69.2-60.8000115.6F17 L86 L87 D92F17-H90 HydrophobicContact CB-CB 3.78Å; F17-H90 HydrophobicContact CD1-CB 3.94Å; F17-H90 HydrophobicContact CD2-CB 3.96Å; F17-H90 HydrophobicContact CG-CB 3.64Å; L86-H90 PolarHBondContact O-CD2 2.95Å; L86-H90 VanDerWaalsContact O-CD2 3.28Å; L86-H90 PolarHBondContact O-N 3.1Å; L86-H90 VanDerWaalsContact O-N 3.07Å; L87-H90 PolarHBondContact O-N 2.91Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 3.48Å
91M94.1Very high89.7Confident101 Ų101111.5 Ų111.550%0.49856%0.564SS.*  trans-96.548.5173.8-62-170.8-60.800111.6F17 L87F17-M91 HydrophobicContact CE1-CG 4.15Å; F17-M91 HydrophobicContact CZ-CG 4.42Å; L87-M91 HydrophobicContact CB-CE 3.7Å; L87-M91 HydrophobicContact CD1-CE 4.26Å; L87-M91 HydrophobicContact CD2-CE 3.9Å; L87-M91 HydrophobicContact CD2-SD 4.28Å; L87-M91 HydrophobicContact CG-CE 4.16Å; L87-M91 WeakPolarHBondContact O-CB 2.93Å; L87-M91 WeakPolarHBondContact O-CG 3.42Å; L87-M91 PolarHBondContact O-N 2.77Å
92D93.8Very high88Confident94 Ų94116 Ų11650%0.50358%0.581SS.*  trans-89.4-14.5-17467.3-35.4000114R21 H90 L94R21-D92 IonicContact CZ-OD1 3.21Å; R21-D92 IonicContact NE-OD1 3.27Å; R21-D92 PolarHBondContact NE-OD1 2.5Å; R21-D92 IonicContact NH2-OD1 3.61Å; R21-D92 PolarHBondContact NH2-OD1 2.87Å; R21-D92 IonicContact NH2-OD2 2.74Å; R21-D92 PolarHBondContact NH2-OD2 2.9Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 3.48Å; D92-L94 PolarHBondContact O-N 3.29Å; D92-L94 VanDerWaalsContact O-N 3.15Å
93G90.8Very high86Confident63 Ų63118.7 Ų118.765%0.64960%0.597SS**  trans-7812.9-174.100000116.6
94L91.6Very high84Confident141 Ų141125.9 Ų125.974%0.73863%0.629SS**SBendtrans-84.5151.1-179.2-71.6157.4000111.6D92 K96D92-L94 PolarHBondContact O-N 3.29Å; D92-L94 VanDerWaalsContact O-N 3.15Å; L94-K96 PolarHBondContact O-N 2.99Å
95K92.7Very high81.9Confident208 Ų208133.7 Ų133.790%0.90466%0.659SS**PPolyproline II helixtrans-58.9132.2174.1-69.7-174.4178.8-177.60109.8
96K89Confident79.8Confident194 Ų194135.4 Ų135.484%0.84367%0.673SS**PPolyproline II helixtrans-64.4139.4172.2-66-178-178.6176.50108.5L94 D98L94-K96 PolarHBondContact O-N 2.99Å; K96-D98 PolarHBondContact O-N 3.21Å
97K85.4Confident77.7Confident204 Ų204144.1 Ų144.189%0.88771%0.711SS**PPolyproline II helixtrans-62.5122.5173.4-173.2175-178.1175.90108.3K99K97-K99 PolarHBondContact O-N 3.26Å; K97-K99 VanDerWaalsContact O-N 3.15Å
98D78.9Confident75.6Confident149 Ų149147.2 Ų147.280%0.79774%0.74SS**PPolyproline II helixtrans-57122.2172.7-68.7-45.4000108.6K96 K100K96-D98 PolarHBondContact O-N 3.21Å; D98-K100 VanDerWaalsContact C-N 3.28Å; D98-K100 PolarHBondContact O-N 3.34Å
99K73.9Confident73.3Confident205 Ų205145.1 Ų145.189%0.89175%0.748SS**  trans-64.5100.1165.7-88.5-178.8176.7173.90105.4K97 S101K97-K99 PolarHBondContact O-N 3.26Å; K97-K99 VanDerWaalsContact O-N 3.15Å; K99-S101 PolarHBondContact O-N 3.07Å
100K67.1Low71.2Confident203 Ų203154.5 Ų154.588%0.88378%0.782SS**  trans-48.9107.4166.2-154.4177.1-167.9177.40105.4D98 K102D98-K100 VanDerWaalsContact C-N 3.28Å; D98-K100 PolarHBondContact O-N 3.34Å; K100-K102 PolarHBondContact O-N 3.25Å
101S58.6Low70Confident104 Ų104159.7 Ų159.773%0.72781%0.809SS**  trans-57.4116.9-178.149.30000105.7K99 S103K99-S101 PolarHBondContact O-N 3.07Å; S101-S103 VanDerWaalsContact C-N 3.28Å; S101-S103 PolarHBondContact O-N 3.47Å
102K61.5Low68.7Low206 Ų206162.7 Ų162.790%0.89683%0.825SS**  trans-57.6107.5159.9-95-178.2175175.80103.4K100 K104K100-K102 PolarHBondContact O-N 3.25Å; K102-K104 PolarHBondContact O-N 3.41Å; K102-K104 VanDerWaalsContact O-N 3.08Å
103S55.8Low67.3Low99 Ų99166.6 Ų166.669%0.69284%0.843SS**  trans-49.3124.317359.10000106.6S101 K105S101-S103 VanDerWaalsContact C-N 3.28Å; S101-S103 PolarHBondContact O-N 3.47Å; S103-K105 VanDerWaalsContact C-N 3.29Å; S103-K105 PolarHBondContact O-N 3.24Å
104K54.5Low65.9Low198 Ų198172.6 Ų172.686%0.86185%0.854SS**  trans-57.5103.7165.5-85178.9175176.70104.8K102 T106K102-K104 PolarHBondContact O-N 3.41Å; K102-K104 VanDerWaalsContact O-N 3.08Å; K104-T106 PolarHBondContact O-N 3.24Å
105K53.9Low64.3Low195 Ų195174.6 Ų174.685%0.84886%0.861SS**  trans-59.899.3158.1-83.6-173.7175.1-176.20105S103 K107S103-K105 VanDerWaalsContact C-N 3.29Å; S103-K105 PolarHBondContact O-N 3.24Å; K105-K107 PolarHBondContact O-N 3.18Å
106T53.9Low62.4Low134 Ų134172.4 Ų172.482%0.82286%0.859SS**  trans-56.4109159.4320000105.9K104 A108K104-T106 PolarHBondContact O-N 3.24Å; T106-A108 PolarHBondContact O-N 3.1Å
107K51.7Low60.5Low199 Ų199170.9 Ų170.987%0.86586%0.86SS**PPolyproline II helixtrans-63.2118.1162.9-91.4-176.4171.2-175.80105.8K105 T109K105-K107 PolarHBondContact O-N 3.18Å; K107-T109 PolarHBondContact O-N 3.4Å
108A52.8Low58.6Low96 Ų96168.3 Ų168.379%0.79386%0.858SS**PPolyproline II helixtrans-67.1124.6163.200000107.7T106T106-A108 PolarHBondContact O-N 3.1Å
109T47.3Very low56.9Low140 Ų140169.9 Ų169.986%0.85986%0.863SS**PPolyproline II helixtrans-74127.5165.5-59.90000107.5K107K107-T109 PolarHBondContact O-N 3.4Å
110Q52.1Low55.4Low260 Ų260166.7 Ų166.7100%1.21586%0.86SS**  trans-91.30159.8-81.3-172.314.300108.8

Retrieved 110 of 110 residues in 618.2 ms (Link to these results)