A0A060WNH9_ONCMY Loading...

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 A0A060WNH9, 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
1M83.6Confident95.7Very high133 Ų13372.3 Ų72.366%0.65539%0.389SS*.  0128.20174.8175.6-85.800106R59 K66M1-R59 HydrophobicContact CE-CB 4.22Å; M1-R59 HydrophobicContact CE-CG 4.2Å; M1-R59 HydrophobicContact SD-CG 4.22Å; M1-K66 WeakPolarHBondContact CA-O 3.37Å; M1-K66 HydrophobicContact CB-CB 4.04Å; M1-K66 HydrophobicContact CE-CB 4.08Å; M1-K66 HydrophobicContact CE-CD 4.27Å; M1-K66 HydrophobicContact CE-CG 4.48Å; M1-K66 HydrophobicContact CG-CB 4.17Å
2V93.6Very high95.8Very high82 Ų8268.8 Ų68.850%0.49737%0.368SS..EExtended strand (participates in β ladder)trans-101.3129.9-173.2-1750000109.4L4 K66 I67 S68V2-L4 HydrophobicContact CG1-CD2 3.62Å; V2-L4 HydrophobicContact CG1-CG 4.07Å; V2-K66 PolarHBondContact N-O 3.16Å; V2-I67 CarbonylContact O-C 3.58Å; V2-S68 PolarHBondContact O-N 2.86Å; V2-S68 PolarHBondContact O-OG 2.73Å
3L95.9Very high96Very high119 Ų11963.5 Ų63.562%0.62334%0.34SS*.EExtended strand (participates in β ladder)trans-87.8121.6170.8-178.165.2000108.5S68 V70L3-S68 WeakPolarHBondContact CA-O 3.27Å; L3-V70 HydrophobicContact CD1-CG2 4.07Å
4L97.6Very high96.1Very high43 Ų4361.4 Ų61.423%0.22533%0.331CS..  trans-119.3154.6-176.3-62.2175.8000110.4V2 F9 E12 I67 S68 T69V2-L4 HydrophobicContact CG1-CD2 3.62Å; V2-L4 HydrophobicContact CG1-CG 4.07Å; L4-F9 HydrophobicContact CB-CB 4.26Å; L4-E12 HydrophobicContact CD1-CB 4.11Å; L4-E12 HydrophobicContact CD1-CG 3.9Å; L4-I67 HydrophobicContact CD1-CB 4.09Å; L4-I67 HydrophobicContact CD1-CG2 3.99Å; L4-S68 PolarHBondContact N-O 2.94Å; L4-T69 WeakPolarHBondContact O-CB 3.44Å; L4-T69 PolarHBondContact O-OG1 3.38Å
5E97.1Very high96.2Very high157 Ų15766.9 Ų66.973%0.73435%0.345SS*.  trans-62.5158164.2-65.5-176.9172.800111.2D7 S8 F9E5-D7 PolarHBondContact O-N 2.59Å; E5-S8 PolarHBondContact O-N 3.37Å; E5-F9 WeakPolarHBondContact O-CB 3.37Å; E5-F9 PolarHBondContact O-N 3.4Å
6N96.8Very high96.2Very high21 Ų2162.9 Ų62.911%0.11233%0.325CS..Hα-helixtrans-58.7-46.6-172.2-70.2172.7000112.9F9 L10 T69 V70 F79N6-F9 PolarHBondContact O-N 3.48Å; N6-L10 WeakPolarHBondContact O-CG 3.49Å; N6-L10 PolarHBondContact O-N 2.96Å; N6-L10 VanDerWaalsContact O-N 3.15Å; N6-T69 PolarHBondContact ND2-OG1 3.33Å; N6-V70 PolarHBondContact ND2-O 3.48Å; N6-F79 HydrophobicContact CB-CD2 3.87Å; N6-F79 HydrophobicContact CB-CE2 4.22Å
7D96.5Very high96.3Very high91 Ų9160.8 Ų60.849%0.48731%0.312SS..Hα-helixtrans-68.3-42.4-178.5-68.2-17.9000110.8E5 F9 L10 T11 K78E5-D7 PolarHBondContact O-N 2.59Å; D7-F9 VanDerWaalsContact C-N 3.33Å; D7-F9 PolarHBondContact O-N 3.39Å; D7-L10 PolarHBondContact O-N 2.72Å; D7-T11 PolarHBondContact O-N 2.94Å; D7-T11 VanDerWaalsContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 2.71Å; D7-K78 IonicContact OD1-NZ 3.15Å; D7-K78 IonicContact OD2-NZ 2.74Å; D7-K78 PolarHBondContact OD2-NZ 3.26Å; D7-K78 VanDerWaalsContact OD2-NZ 3.16Å
8S97.6Very high96.3Very high56 Ų5664.1 Ų64.139%0.39233%0.326SS..Hα-helixtrans-62.2-38.1174.3-710000112.9E5 T11 E12E5-S8 PolarHBondContact O-N 3.37Å; S8-T11 PolarHBondContact O-N 3.03Å; S8-E12 WeakPolarHBondContact O-CB 3.33Å; S8-E12 WeakPolarHBondContact O-CG 3.43Å; S8-E12 PolarHBondContact O-N 2.7Å
9F98.2Very high96.3Very high0 Ų067.2 Ų67.20%034%0.337CS..Hα-helixtrans-62.6-42.3176174.9-90.9000111.8L4 E5 N6 D7 E12 L13 L58 A60 I67 T69 F79L4-F9 HydrophobicContact CB-CB 4.26Å; E5-F9 WeakPolarHBondContact O-CB 3.37Å; E5-F9 PolarHBondContact O-N 3.4Å; N6-F9 PolarHBondContact O-N 3.48Å; D7-F9 VanDerWaalsContact C-N 3.33Å; D7-F9 PolarHBondContact O-N 3.39Å; F9-E12 PolarHBondContact O-N 3.32Å; F9-L13 HydrophobicContact CE1-CD2 4.06Å; F9-L13 VanDerWaalsContact O-CB 3.24Å; F9-L13 WeakPolarHBondContact O-CB 3.28Å; F9-L13 PolarHBondContact O-N 3.39Å; F9-L58 HydrophobicContact CE1-CB 4.43Å; F9-L58 HydrophobicContact CE1-CD2 4.46Å; F9-L58 HydrophobicContact CZ-CB 4.06Å; F9-A60 HydrophobicContact CE2-CB 4.34Å; F9-A60 HydrophobicContact CZ-CB 4.17Å; F9-I67 HydrophobicContact CD2-CB 4.37Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.06Å; F9-I67 HydrophobicContact CE2-CB 4.47Å; F9-I67 HydrophobicContact CE2-CD1 3.93Å; F9-I67 HydrophobicContact CE2-CG1 3.81Å; F9-T69 HydrophobicContact CB-CG2 3.85Å; F9-T69 HydrophobicContact CD1-CG2 3.59Å; F9-T69 HydrophobicContact CD2-CG2 3.73Å; F9-T69 HydrophobicContact CE1-CG2 4.04Å; F9-T69 HydrophobicContact CE2-CG2 4.15Å; F9-T69 HydrophobicContact CG-CG2 3.43Å; F9-T69 VanDerWaalsContact CG-CG2 3.43Å; F9-T69 HydrophobicContact CZ-CG2 4.3Å; F9-F79 HydrophobicContact CD1-CE2 4.2Å; F9-F79 HydrophobicContact CD1-CZ 4.04Å; F9-F79 HydrophobicContact CE1-CZ 4.16Å
10L98Very high96.3Very high17 Ų1764.9 Ų64.99%0.08933%0.327CS..Hα-helixtrans-63.9-43.2177.9-66.9171000111.3N6 D7 E12 L13 T14 F79 A82 Y83 L86N6-L10 WeakPolarHBondContact O-CG 3.49Å; N6-L10 PolarHBondContact O-N 2.96Å; N6-L10 VanDerWaalsContact O-N 3.15Å; D7-L10 PolarHBondContact O-N 2.72Å; L10-E12 PolarHBondContact O-N 3Å; L10-L13 PolarHBondContact O-N 3.16Å; L10-T14 PolarHBondContact O-N 3.29Å; L10-T14 PolarHBondContact O-OG1 3.49Å; L10-F79 HydrophobicContact CD1-CD2 4.26Å; L10-F79 HydrophobicContact CD1-CE2 4.24Å; L10-F79 HydrophobicContact CD2-CE2 3.88Å; L10-F79 HydrophobicContact CD2-CZ 4.09Å; L10-F79 HydrophobicContact CG-CD2 4.46Å; L10-F79 HydrophobicContact CG-CE2 3.94Å; L10-A82 HydrophobicContact CD1-CB 3.62Å; L10-Y83 HydrophobicContact CD2-CD2 4.06Å; L10-L86 HydrophobicContact CB-CD1 4.19Å; L10-L86 HydrophobicContact CD2-CD1 4.04Å; L10-L86 WeakPolarHBondContact O-CD1 3.46Å
11T97.9Very high96.2Very high76 Ų7668.3 Ų68.347%0.46634%0.336SS..Hα-helixtrans-60.7-46175.1-55.30000112.2D7 S8 L13 T14 R15D7-T11 PolarHBondContact O-N 2.94Å; D7-T11 VanDerWaalsContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 2.71Å; S8-T11 PolarHBondContact O-N 3.03Å; T11-L13 VanDerWaalsContact C-N 3.33Å; T11-L13 PolarHBondContact O-N 3.35Å; T11-T14 PolarHBondContact O-N 3.06Å; T11-R15 PolarHBondContact O-N 3.44Å; T11-R15 VanDerWaalsContact O-N 3.14Å
12E97.6Very high96.7Very high30 Ų3068.7 Ų68.714%0.1435%0.346CS..Hα-helixtrans-68.5-32.4178.6-75.5-62.9141.300112.7L4 S8 F9 L10 R15 L16 K65 I67L4-E12 HydrophobicContact CD1-CB 4.11Å; L4-E12 HydrophobicContact CD1-CG 3.9Å; S8-E12 WeakPolarHBondContact O-CB 3.33Å; S8-E12 WeakPolarHBondContact O-CG 3.43Å; S8-E12 PolarHBondContact O-N 2.7Å; F9-E12 PolarHBondContact O-N 3.32Å; L10-E12 PolarHBondContact O-N 3Å; E12-R15 WeakPolarHBondContact O-CB 3.2Å; E12-R15 PolarHBondContact O-N 3.25Å; E12-R15 WeakPolarHBondContact OE1-CD 3.5Å; E12-R15 IonicContact OE1-CZ 2.59Å; E12-R15 IonicContact OE1-NE 2.72Å; E12-R15 IonicContact OE1-NH1 3.58Å; E12-R15 PolarHBondContact OE1-NH1 3.49Å; E12-L16 WeakPolarHBondContact O-CG 3.44Å; E12-L16 PolarHBondContact O-N 3.05Å; E12-K65 IonicContact OE2-NZ 2.73Å; E12-K65 PolarHBondContact OE2-NZ 3.2Å; E12-I67 HydrophobicContact CB-CD1 3.7Å; E12-I67 HydrophobicContact CB-CG2 4.35Å
13L97.8Very high96.8Very high0 Ų069.4 Ų69.40%036%0.355CS..Hα-helixtrans-66-42.4173.9-178.260.6000111.6F9 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 3.28Å; F9-L13 PolarHBondContact O-N 3.39Å; L10-L13 PolarHBondContact O-N 3.16Å; T11-L13 VanDerWaalsContact C-N 3.33Å; T11-L13 PolarHBondContact O-N 3.35Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.39Å; L13-L16 WeakPolarHBondContact O-CB 3.44Å; L13-L16 PolarHBondContact O-N 3.14Å; L13-L16 VanDerWaalsContact O-N 3.16Å; L13-F17 HydrophobicContact CD1-CD2 4.14Å; L13-F17 HydrophobicContact CD1-CE2 3.78Å; L13-F17 HydrophobicContact CD2-CE2 4.23Å; L13-F17 HydrophobicContact CG-CD2 4.02Å; L13-F17 HydrophobicContact CG-CE2 3.78Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.43Å; L13-V26 HydrophobicContact CD1-CG1 4.39Å; L13-I28 HydrophobicContact CD1-CD1 3.97Å; L13-I28 HydrophobicContact CD1-CG1 4.37Å; L13-I28 HydrophobicContact CD2-CD1 4.31Å; L13-A60 HydrophobicContact CD1-CB 3.7Å; L13-I67 HydrophobicContact CB-CD1 4.34Å; L13-Y83 HydrophobicContact CD2-CD2 4.1Å; L13-Y83 HydrophobicContact CD2-CE2 3.71Å; L13-L86 HydrophobicContact CB-CD1 4.34Å; L13-L86 HydrophobicContact CD2-CD1 4.23Å; L13-L86 HydrophobicContact CD2-CD2 3.79Å; L13-L86 HydrophobicContact CG-CD1 4.39Å; L13-L86 HydrophobicContact CG-CD2 3.94Å
14T97.8Very high96.8Very high35 Ų3566.3 Ų66.322%0.21535%0.352CS..Hα-helixtrans-57.4-44.3172-71.80000111.4L10 T11 L16 F17 Q18 L86L10-T14 PolarHBondContact O-N 3.29Å; L10-T14 PolarHBondContact O-OG1 3.49Å; T11-T14 PolarHBondContact O-N 3.06Å; T14-L16 VanDerWaalsContact C-N 3.31Å; T14-L16 PolarHBondContact O-N 3.36Å; T14-F17 PolarHBondContact O-N 2.99Å; T14-Q18 HydrophobicContact CG2-CG 4.46Å; T14-Q18 WeakPolarHBondContact O-CG 3.48Å; T14-Q18 PolarHBondContact O-N 3.49Å; T14-L86 WeakPolarHBondContact OG1-CD1 2.96Å
15R96.8Very high96.7Very high144 Ų14468.9 Ų68.954%0.54337%0.373SS..Hα-helixtrans-60.7-39.1175.9-69.9174.9177.2-177.7-5.2112.2T11 E12 L13 Q18 K19T11-R15 PolarHBondContact O-N 3.44Å; T11-R15 VanDerWaalsContact O-N 3.14Å; E12-R15 WeakPolarHBondContact O-CB 3.2Å; E12-R15 PolarHBondContact O-N 3.25Å; E12-R15 WeakPolarHBondContact OE1-CD 3.5Å; E12-R15 IonicContact OE1-CZ 2.59Å; E12-R15 IonicContact OE1-NE 2.72Å; E12-R15 IonicContact OE1-NH1 3.58Å; E12-R15 PolarHBondContact OE1-NH1 3.49Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.39Å; R15-Q18 PolarHBondContact O-N 3Å; R15-K19 VanDerWaalsContact O-CB 3.27Å; R15-K19 WeakPolarHBondContact O-CB 3.32Å; R15-K19 PolarHBondContact O-N 3Å
16L96.9Very high96.7Very high3 Ų363 Ų632%0.01635%0.349CS..Hα-helixtrans-62.7-45.4175.5-74.8172.9000112.2E12 L13 T14 K19 C20 V26 A60 D62 K65 I67E12-L16 WeakPolarHBondContact O-CG 3.44Å; E12-L16 PolarHBondContact O-N 3.05Å; L13-L16 WeakPolarHBondContact O-CB 3.44Å; L13-L16 PolarHBondContact O-N 3.14Å; L13-L16 VanDerWaalsContact O-N 3.16Å; T14-L16 VanDerWaalsContact C-N 3.31Å; T14-L16 PolarHBondContact O-N 3.36Å; L16-K19 PolarHBondContact O-N 2.96Å; L16-C20 PolarHBondContact O-N 2.89Å; L16-C20 PolarHBondContact O-SG 3.02Å; L16-V26 HydrophobicContact CB-CG2 4.42Å; L16-A60 HydrophobicContact CD1-CB 4.13Å; L16-D62 HydrophobicContact CD2-CB 3.95Å; L16-K65 HydrophobicContact CD2-CB 4.25Å; L16-K65 HydrophobicContact CD2-CD 4.45Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.91Å
17F97.4Very high96.8Very high26 Ų2665 Ų6511%0.11437%0.368CS..Hα-helixtrans-62.4-44.2177-82.9-67.1000112.4L13 T14 C20 R21 V26 I28 L86 L87 H90 M91L13-F17 HydrophobicContact CD1-CD2 4.14Å; L13-F17 HydrophobicContact CD1-CE2 3.78Å; L13-F17 HydrophobicContact CD2-CE2 4.23Å; L13-F17 HydrophobicContact CG-CD2 4.02Å; L13-F17 HydrophobicContact CG-CE2 3.78Å; L13-F17 WeakPolarHBondContact O-CD2 3.49Å; L13-F17 PolarHBondContact O-N 3.43Å; T14-F17 PolarHBondContact O-N 2.99Å; F17-C20 PolarHBondContact O-N 3.3Å; F17-R21 PolarHBondContact O-N 2.85Å; F17-V26 HydrophobicContact CD1-CG2 4.27Å; F17-V26 HydrophobicContact CE1-CB 4.32Å; F17-I28 HydrophobicContact CE2-CD1 4.21Å; F17-I28 HydrophobicContact CZ-CD1 3.91Å; F17-L86 HydrophobicContact CD2-CD2 3.79Å; F17-L86 HydrophobicContact CE2-CD2 3.62Å; F17-L87 HydrophobicContact CE2-CD2 4.2Å; F17-L87 HydrophobicContact CZ-CD2 3.99Å; F17-H90 HydrophobicContact CB-CB 3.79Å; F17-H90 HydrophobicContact CD1-CB 3.92Å; F17-H90 HydrophobicContact CD2-CB 3.94Å; F17-H90 HydrophobicContact CE1-CB 4.48Å; F17-H90 HydrophobicContact CE2-CB 4.49Å; F17-H90 HydrophobicContact CG-CB 3.63Å; F17-M91 HydrophobicContact CE1-CG 4.13Å; F17-M91 HydrophobicContact CZ-CG 4.41Å
18Q96.1Very high96.8Very high120 Ų12063.2 Ų63.256%0.56136%0.357SS*.Hα-helixtrans-62.7-43.2177.4-70.9171.2-10.200111.6T14 R15 C20 R21T14-Q18 HydrophobicContact CG2-CG 4.46Å; T14-Q18 WeakPolarHBondContact O-CG 3.48Å; T14-Q18 PolarHBondContact O-N 3.49Å; R15-Q18 PolarHBondContact O-N 3Å; Q18-C20 PolarHBondContact O-N 2.82Å; Q18-R21 VanDerWaalsContact O-CB 3.28Å; Q18-R21 WeakPolarHBondContact O-CB 3.47Å; Q18-R21 PolarHBondContact O-N 2.91Å
19K96.5Very high96.8Very high123 Ų12363.6 Ų63.654%0.53536%0.358SS..Hα-helixtrans-63.9-39.2178.5-176.5-174.3174.6-163.60112.8R15 L16 R21 D62R15-K19 VanDerWaalsContact O-CB 3.27Å; R15-K19 WeakPolarHBondContact O-CB 3.32Å; R15-K19 PolarHBondContact O-N 3Å; L16-K19 PolarHBondContact O-N 2.96Å; K19-R21 VanDerWaalsContact C-N 3.3Å; K19-R21 PolarHBondContact O-N 2.97Å; K19-D62 IonicContact NZ-OD2 2.89Å; K19-D62 PolarHBondContact NZ-OD2 2.71Å
20C96.1Very high96.7Very high21 Ų2169.3 Ų69.314%0.14239%0.388CS..THydrogen-bonded Turntrans-90.813.8-177.8-55.40000113.4L16 F17 Q18 S23 V26 D62L16-C20 PolarHBondContact O-N 2.89Å; L16-C20 PolarHBondContact O-SG 3.02Å; F17-C20 PolarHBondContact O-N 3.3Å; Q18-C20 PolarHBondContact O-N 2.82Å; C20-S23 CarbonylContact C-O 3.58Å; C20-S23 WeakPolarHBondContact CA-O 3.38Å; C20-V26 HydrophobicContact CB-CG2 3.8Å; C20-D62 WeakPolarHBondContact SG-CB 3.46Å
21R95.1Very high96.6Very high137 Ų13775.2 Ų75.252%0.51741%0.412SS..SBendtrans-66.1-40.4-173.2-171.674.8178.792.6-12.3113F17 Q18 K19 D92F17-R21 PolarHBondContact O-N 2.85Å; Q18-R21 VanDerWaalsContact O-CB 3.28Å; Q18-R21 WeakPolarHBondContact O-CB 3.47Å; Q18-R21 PolarHBondContact O-N 2.91Å; K19-R21 VanDerWaalsContact C-N 3.3Å; K19-R21 PolarHBondContact O-N 2.97Å; R21-D92 IonicContact CZ-OD1 3.16Å; R21-D92 IonicContact CZ-OD2 3.85Å; R21-D92 IonicContact NE-OD1 3.1Å; R21-D92 VanDerWaalsContact NH2-CG 3.27Å; R21-D92 IonicContact NH2-OD1 3.52Å; R21-D92 PolarHBondContact NH2-OD1 3.47Å; R21-D92 IonicContact NH2-OD2 3.43Å; R21-D92 PolarHBondContact NH2-OD2 2.84Å
22T94.5Very high96.3Very high141 Ų14178.9 Ų78.987%0.86542%0.422SS*.SBendtrans-90.1-36.7-177.651.70000112.2
23S94.9Very high96Very high98 Ų9879.9 Ų79.969%0.68543%0.425SS*.SBendtrans-155.2146.3179-177.60000110.5C20C20-S23 CarbonylContact C-O 3.58Å; C20-S23 WeakPolarHBondContact CA-O 3.38Å
24G95.4Very high95.5Very high54 Ų5482.1 Ų82.156%0.55744%0.437SS*.  trans111.5-174.3-179.800000113.2
25S95.8Very high94.9Very high96 Ų9681 Ų8167%0.67143%0.433SS*.  trans-145.4140.4179.9-610000109.2D62S25-D62 WeakPolarHBondContact O-CA 3.34Å
26V97.4Very high94.3Very high35 Ų3579.1 Ų79.121%0.21243%0.426CS..  trans-104.1116.5174.6-1780000108L13 L16 F17 C20 I28 S61L13-V26 HydrophobicContact CD1-CG1 4.39Å; L16-V26 HydrophobicContact CB-CG2 4.42Å; F17-V26 HydrophobicContact CD1-CG2 4.27Å; F17-V26 HydrophobicContact CE1-CB 4.32Å; C20-V26 HydrophobicContact CB-CG2 3.8Å; V26-I28 HydrophobicContact CG1-CG1 4.14Å; V26-S61 WeakPolarHBondContact CA-O 3.39Å
27A97.8Very high93.7Very high63 Ų6384.9 Ų84.952%0.52146%0.461SS..EExtended strand (participates in β ladder)trans-95.9124.7174.200000109.6A60 S61A27-A60 CarbonylContact O-C 3.52Å; A27-A60 VanDerWaalsContact O-CA 3.25Å; A27-A60 WeakPolarHBondContact O-CA 3.35Å; A27-S61 PolarHBondContact N-O 2.81Å; A27-S61 PolarHBondContact O-N 2.89Å
28I97.8Very high93Very high52 Ų5291.7 Ų91.727%0.26749%0.49SS..EExtended strand (participates in β ladder)trans-117.1133.4174.7-52.2175.4000108.7L13 F17 V26 R59 A60 L87L13-I28 HydrophobicContact CD1-CD1 3.97Å; L13-I28 HydrophobicContact CD1-CG1 4.37Å; L13-I28 HydrophobicContact CD2-CD1 4.31Å; F17-I28 HydrophobicContact CE2-CD1 4.21Å; F17-I28 HydrophobicContact CZ-CD1 3.91Å; V26-I28 HydrophobicContact CG1-CG1 4.14Å; I28-R59 CarbonylContact C-O 3.53Å; I28-R59 WeakPolarHBondContact CA-O 3.33Å; I28-A60 HydrophobicContact CG1-CB 4.16Å; I28-L87 HydrophobicContact CD1-CD2 4.04Å
29T97.9Very high92.5Very high65 Ų6591.8 Ų91.840%0.39950%0.502SS..EExtended strand (participates in β ladder)trans-128.2142.4176.765.50000110.5L58 R59T29-L58 CarbonylContact O-C 3.53Å; T29-L58 WeakPolarHBondContact O-CA 3.31Å; T29-R59 PolarHBondContact N-O 3.47Å; T29-R59 PolarHBondContact O-N 2.97Å; T29-R59 PolarHBondContact OG1-NE 3.44Å
30L96.4Very high91.8Very high120 Ų12090.4 Ų90.463%0.62850%0.503SS*.EExtended strand (participates in β ladder)trans-124.4129.4176.8174.968000108.4C56 L58L30-C56 HydrophobicContact CD1-CB 3.79Å; L30-L58 HydrophobicContact CD1-CD1 3.34Å; L30-L58 HydrophobicContact CD1-CG 3.63Å
31K94.9Very high91.1Very high140 Ų14092.1 Ų92.161%0.60951%0.514SS*.EExtended strand (participates in β ladder)trans-139.8144.9176.9-165.8177.9176.7177.50110.5Y33 C56 L57K31-Y33 PolarHBondContact O-N 2.82Å; K31-C56 CarbonylContact O-C 3.58Å; K31-C56 WeakPolarHBondContact O-CA 3.38Å; K31-L57 PolarHBondContact N-O 3.26Å; K31-L57 PolarHBondContact O-N 2.93Å
32K92.4Very high90.6Very high154 Ų15495.9 Ų95.967%0.6753%0.528SS*.EExtended strand (participates in β ladder)trans-55.5130.7166.5-172.9178.4-178.9-176.20108.3
33Y91.1Very high89.9Confident50 Ų5099.6 Ų99.620%0.19653%0.532CS..EExtended strand (participates in β ladder)trans-113.5119.9-179.3-175.1-129.3000108.6K31 G35 R36 K55 L57 V70K31-Y33 PolarHBondContact O-N 2.82Å; Y33-G35 VanDerWaalsContact CE1-CA 3.4Å; Y33-G35 VanDerWaalsContact CZ-CA 3.46Å; Y33-R36 PolarHBondContact OH-O 3.33Å; Y33-K55 HydrophobicContact CD1-CB 4.47Å; Y33-K55 PolarHBondContact N-O 2.84Å; Y33-L57 HydrophobicContact CD2-CB 4.29Å; Y33-L57 HydrophobicContact CD2-CD2 4.42Å; Y33-L57 HydrophobicContact CG-CB 4.04Å; Y33-V70 HydrophobicContact CD1-CB 4.37Å; Y33-V70 HydrophobicContact CD1-CG1 3.73Å; Y33-V70 HydrophobicContact CD1-CG2 3.62Å; Y33-V70 HydrophobicContact CE1-CG1 4.19Å; Y33-V70 HydrophobicContact CE1-CG2 3.59Å
34D86.7Confident89Confident48 Ų4898.9 Ų98.926%0.25754%0.54SS..  trans-82.5-5178.352.812000111.9R36 Y49 A52D34-R36 HydrophobicContact CB-CG 4.45Å; D34-R36 WeakPolarHBondContact OD1-CB 3.46Å; D34-R36 WeakPolarHBondContact OD1-CG 3.25Å; D34-R36 PolarHBondContact OD1-N 3.42Å; D34-R36 WeakPolarHBondContact OD2-CD 3.47Å; D34-R36 IonicContact OD2-CZ 2.96Å; D34-R36 IonicContact OD2-NE 3.92Å; D34-R36 PolarHBondContact OD2-NE 3.39Å; D34-R36 VanDerWaalsContact OD2-NE 3.15Å; D34-R36 IonicContact OD2-NH1 3.86Å; D34-R36 PolarHBondContact OD2-NH1 3.3Å; D34-Y49 WeakPolarHBondContact O-CE1 3.37Å; D34-Y49 PolarHBondContact O-OH 2.99Å; D34-A52 PolarHBondContact O-N 3.35Å
35G84.8Confident87.9Confident12 Ų12102.3 Ų102.312%0.12454%0.542CS..  trans84.66.118000000114.8Y33 T37 Y49Y33-G35 VanDerWaalsContact CE1-CA 3.4Å; Y33-G35 VanDerWaalsContact CZ-CA 3.46Å; G35-T37 PolarHBondContact O-N 2.84Å; G35-Y49 WeakPolarHBondContact CA-OH 3.32Å; G35-Y49 PolarHBondContact O-OH 3.41Å
36R84.2Confident86.7Confident104 Ų104102.3 Ų102.339%0.39254%0.539SS..  trans-67.4128.6179.7-67.9177.8-177.4152.3-10.2111.7Y33 D34 Y49Y33-R36 PolarHBondContact OH-O 3.33Å; D34-R36 HydrophobicContact CB-CG 4.45Å; D34-R36 WeakPolarHBondContact OD1-CB 3.46Å; D34-R36 WeakPolarHBondContact OD1-CG 3.25Å; D34-R36 PolarHBondContact OD1-N 3.42Å; D34-R36 WeakPolarHBondContact OD2-CD 3.47Å; D34-R36 IonicContact OD2-CZ 2.96Å; D34-R36 IonicContact OD2-NE 3.92Å; D34-R36 PolarHBondContact OD2-NE 3.39Å; D34-R36 VanDerWaalsContact OD2-NE 3.15Å; D34-R36 IonicContact OD2-NH1 3.86Å; D34-R36 PolarHBondContact OD2-NH1 3.3Å; R36-Y49 HydrophobicContact CB-CE1 4.45Å; R36-Y49 HydrophobicContact CG-CD1 3.53Å; R36-Y49 HydrophobicContact CG-CE1 3.48Å; R36-Y49 VanDerWaalsContact CG-CE1 3.48Å; R36-Y49 HydrophobicContact CG-CG 4.3Å
37T84.3Confident85.3Confident124 Ų124105 Ų10576%0.76156%0.555SS**  trans-104.3-10.2172.657.50000113.1G35G35-T37 PolarHBondContact O-N 2.84Å
38K84Confident83.7Confident168 Ų168109.2 Ų109.273%0.7357%0.569SS**SBendtrans-125.9153.7-179.5-64.9-179-177.6177.70110.5
39P84.8Confident82.2Confident123 Ų123110.2 Ų110.280%0.79957%0.57SS**PPolyproline II helixtrans-56.9155.9173.2-2333.7000112.4
40V81.2Confident80.9Confident94 Ų94115 Ų11557%0.5759%0.588SS**PPolyproline II helixtrans-63.8128173.1-1780000108.8
41P82.6Confident79.6Confident56 Ų56112.5 Ų112.536%0.36458%0.579SS.*PPolyproline II helixtrans-58.4151.5178.4-2231.7000112.3H45P41-H45 HydrophobicContact CB-CB 3.77Å
42R84.5Confident78.4Confident217 Ų217106.9 Ų106.982%0.81956%0.559SS**PPolyproline II helixtrans-64.8153.2170.9-65.3-177.2-171.7168.92.7109.9G44 H45R42-G44 PolarHBondContact O-N 3.17Å; R42-H45 PolarHBondContact O-N 3.41Å
43K79.5Confident77.4Confident219 Ų219105 Ų10595%0.95256%0.556SS**THydrogen-bonded Turntrans-49.1128.7177.1-74.3-174.1176.7-1770110.1
44G75.6Confident77.1Confident82 Ų82107.8 Ų107.885%0.84557%0.574SS**THydrogen-bonded Turntrans102.6-8.6-179.100000115.2R42R42-G44 PolarHBondContact O-N 3.17Å
45H72.9Confident77.4Confident127 Ų127109.6 Ų109.659%0.58858%0.58SS**SBendtrans-100.2140.5172-68.7-70.1000111.9P41 R42 V47P41-H45 HydrophobicContact CB-CB 3.77Å; R42-H45 PolarHBondContact O-N 3.41Å; H45-V47 PolarHBondContact O-N 3.15Å
46P69.8Low77.8Confident95 Ų95110.6 Ų110.662%0.61759%0.585SS**  trans-64.2135179.825.4-32.6000111.3N48P46-N48 PolarHBondContact O-N 3.43Å
47V68.1Low78.4Confident91 Ų91107.2 Ų107.255%0.55257%0.574SS**  trans-84.991.9174.7-176.50000108.1H45 Y49H45-V47 PolarHBondContact O-N 3.15Å; V47-Y49 PolarHBondContact O-N 3.24Å
48N65.1Low79Confident153 Ų153101.6 Ų101.682%0.81854%0.54SS*.  trans-82.541.8178.1-70.4-10.7000112.4P46P46-N48 PolarHBondContact O-N 3.43Å
49Y66.6Low79.7Confident72 Ų7297.7 Ų97.728%0.28252%0.52SS..  trans-141.3113.8-177.2-175.5-98.8000112.1D34 G35 R36 V47 P51 A52D34-Y49 WeakPolarHBondContact O-CE1 3.37Å; D34-Y49 PolarHBondContact O-OH 2.99Å; G35-Y49 WeakPolarHBondContact CA-OH 3.32Å; G35-Y49 PolarHBondContact O-OH 3.41Å; R36-Y49 HydrophobicContact CB-CE1 4.45Å; R36-Y49 HydrophobicContact CG-CD1 3.53Å; R36-Y49 HydrophobicContact CG-CE1 3.48Å; R36-Y49 VanDerWaalsContact CG-CE1 3.48Å; R36-Y49 HydrophobicContact CG-CG 4.3Å; V47-Y49 PolarHBondContact O-N 3.24Å; Y49-P51 WeakPolarHBondContact O-CD 3.24Å; Y49-A52 PolarHBondContact OH-N 3.18Å
50E68.8Low80.3Confident165 Ų16592 Ų9277%0.77148%0.483SS*.  trans-77119.2168.9-74.2-58136.500109.6A52E50-A52 PolarHBondContact O-N 3.36Å; E50-A52 VanDerWaalsContact O-N 3.12Å
51P69Low81.1Confident68 Ų6888.3 Ų88.344%0.44246%0.462SS..  trans-53.6120174.8-23.133.7000110.8Y49 D53Y49-P51 WeakPolarHBondContact O-CD 3.24Å; P51-D53 PolarHBondContact O-N 3.26Å
52A70.2Confident81.7Confident22 Ų2286.9 Ų86.918%0.18245%0.451CS..  trans-66.9109.7171.500000107.9D34 Y49 E50 K55D34-A52 PolarHBondContact O-N 3.35Å; Y49-A52 PolarHBondContact OH-N 3.18Å; E50-A52 PolarHBondContact O-N 3.36Å; E50-A52 VanDerWaalsContact O-N 3.12Å; A52-K55 HydrophobicContact CB-CD 3.97Å
53D72.4Confident82.2Confident114 Ų11479.6 Ų79.661%0.6144%0.443SS*.THydrogen-bonded Turntrans-70141.5176.5-91.6-29000111.1P51P51-D53 PolarHBondContact O-N 3.26Å
54N84.8Confident82.8Confident110 Ų11078 Ų7859%0.58844%0.436SS*.THydrogen-bonded Turntrans65.139.7168.9-51.2-46.3000116.6S73N54-S73 PolarHBondContact O-N 3.08Å
55K92.1Very high83.7Confident85 Ų8578.6 Ų78.637%0.3742%0.416SS..EExtended strand (participates in β ladder)trans-111.4150.9166.3-62.7-178.8-176.4176.90111.8Y33 A52 V70 V71Y33-K55 HydrophobicContact CD1-CB 4.47Å; Y33-K55 PolarHBondContact N-O 2.84Å; A52-K55 HydrophobicContact CB-CD 3.97Å; K55-V70 HydrophobicContact CB-CG1 4.11Å; K55-V70 HydrophobicContact CD-CG1 4.08Å; K55-V70 HydrophobicContact CG-CG1 4.44Å; K55-V71 WeakPolarHBondContact CA-O 3.37Å
56C94.2Very high84.9Confident34 Ų3477.7 Ų77.723%0.2341%0.41CS..EExtended strand (participates in β ladder)trans-128.1146169.665.60000111.3L30 K31 V70 V71L30-C56 HydrophobicContact CD1-CB 3.79Å; K31-C56 CarbonylContact O-C 3.58Å; K31-C56 WeakPolarHBondContact O-CA 3.38Å; C56-V70 CarbonylContact O-C 3.59Å; C56-V70 WeakPolarHBondContact O-CA 3.36Å; C56-V71 PolarHBondContact N-O 3.15Å; C56-V71 PolarHBondContact O-N 3.43Å
57L95.6Very high86.3Confident32 Ų3273.3 Ų73.317%0.16838%0.381CS..EExtended strand (participates in β ladder)trans-105.3120.5176.8175.868.2000108.3K31 Y33 R59 V70K31-L57 PolarHBondContact N-O 3.26Å; K31-L57 PolarHBondContact O-N 2.93Å; Y33-L57 HydrophobicContact CD2-CB 4.29Å; Y33-L57 HydrophobicContact CD2-CD2 4.42Å; Y33-L57 HydrophobicContact CG-CB 4.04Å; L57-R59 HydrophobicContact CD1-CG 4.45Å; L57-R59 HydrophobicContact CD2-CG 4.29Å; L57-R59 HydrophobicContact CG-CG 4.05Å; L57-V70 HydrophobicContact CD1-CG2 3.83Å
58L97.5Very high87.7Confident7 Ų769.4 Ų69.44%0.03736%0.358CS..EExtended strand (participates in β ladder)trans-99.9138.9169.5-76.582.4000109.4F9 T29 L30 S68 T69 V71 F79 Y83F9-L58 HydrophobicContact CE1-CB 4.43Å; F9-L58 HydrophobicContact CE1-CD2 4.46Å; F9-L58 HydrophobicContact CZ-CB 4.06Å; T29-L58 CarbonylContact O-C 3.53Å; T29-L58 WeakPolarHBondContact O-CA 3.31Å; L30-L58 HydrophobicContact CD1-CD1 3.34Å; L30-L58 HydrophobicContact CD1-CG 3.63Å; L58-S68 CarbonylContact O-C 3.59Å; L58-S68 WeakPolarHBondContact O-CA 3.09Å; L58-S68 WeakPolarHBondContact O-CB 3.37Å; L58-T69 HydrophobicContact CB-CG2 4.14Å; L58-T69 PolarHBondContact N-O 3.39Å; 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 4.39Å; L58-F79 HydrophobicContact CD2-CE1 3.66Å; L58-F79 HydrophobicContact CD2-CZ 3.9Å; L58-Y83 HydrophobicContact CD2-CE2 4.3Å
59R98.1Very high89.2Confident86 Ų8662.1 Ų62.133%0.32532%0.319SS..EExtended strand (participates in β ladder)trans-134.2136.7175-56.9176.3-78.5177-2.5109.4M1 I28 T29 L57 I67M1-R59 HydrophobicContact CE-CB 4.22Å; M1-R59 HydrophobicContact CE-CG 4.2Å; M1-R59 HydrophobicContact SD-CG 4.22Å; I28-R59 CarbonylContact C-O 3.53Å; I28-R59 WeakPolarHBondContact CA-O 3.33Å; T29-R59 PolarHBondContact N-O 3.47Å; T29-R59 PolarHBondContact O-N 2.97Å; T29-R59 PolarHBondContact OG1-NE 3.44Å; L57-R59 HydrophobicContact CD1-CG 4.45Å; L57-R59 HydrophobicContact CD2-CG 4.29Å; L57-R59 HydrophobicContact CG-CG 4.05Å; R59-I67 WeakPolarHBondContact CA-O 3.42Å
60A98.1Very high90.6Very high2 Ų260.4 Ų60.42%0.01732%0.316CS..EExtended strand (participates in β ladder)trans-130145175.600000111.3F9 L13 L16 A27 I28 I67F9-A60 HydrophobicContact CE2-CB 4.34Å; F9-A60 HydrophobicContact CZ-CB 4.17Å; L13-A60 HydrophobicContact CD1-CB 3.7Å; L16-A60 HydrophobicContact CD1-CB 4.13Å; A27-A60 CarbonylContact O-C 3.52Å; A27-A60 VanDerWaalsContact O-CA 3.25Å; A27-A60 WeakPolarHBondContact O-CA 3.35Å; I28-A60 HydrophobicContact CG1-CB 4.16Å; A60-I67 HydrophobicContact CB-CD1 4.25Å; A60-I67 HydrophobicContact CB-CG1 3.9Å; A60-I67 PolarHBondContact N-O 2.97Å; A60-I67 PolarHBondContact O-N 3.37Å
61S97.6Very high91.9Very high17 Ų1752.6 Ų52.612%0.11928%0.28CS..EExtended strand (participates in β ladder)trans-154.6146178.3-170.60000113.2V26 A27 G63 K65 K66V26-S61 WeakPolarHBondContact CA-O 3.39Å; A27-S61 PolarHBondContact N-O 2.81Å; A27-S61 PolarHBondContact O-N 2.89Å; S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact OG-N 2.91Å; S61-K65 WeakPolarHBondContact CA-O 3.32Å; S61-K65 WeakPolarHBondContact CB-O 3.35Å; S61-K65 PolarHBondContact OG-O 3.43Å; S61-K66 VanDerWaalsContact OG-CG 3.31Å; S61-K66 WeakPolarHBondContact OG-CG 3.33Å
62D95.7Very high93.1Very high27 Ų2750.5 Ų50.514%0.14427%0.267CS..SBendtrans-94.116.6166.666.2-7.4000112.6L16 K19 C20 S25 K64 K65L16-D62 HydrophobicContact CD2-CB 3.95Å; K19-D62 IonicContact NZ-OD2 2.89Å; K19-D62 PolarHBondContact NZ-OD2 2.71Å; C20-D62 WeakPolarHBondContact SG-CB 3.46Å; S25-D62 WeakPolarHBondContact O-CA 3.34Å; D62-K64 PolarHBondContact O-N 2.89Å; D62-K64 WeakPolarHBondContact OD1-CA 3.16Å; D62-K64 PolarHBondContact OD1-N 2.93Å; D62-K65 PolarHBondContact N-O 3.46Å; D62-K65 PolarHBondContact OD1-N 2.97Å
63G94.2Very high94.1Very high63 Ų6353 Ų5365%0.64928%0.283SS*.SBendtrans86.2-23.9-171.200000114S61S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact OG-N 2.91Å
64K92.4Very high95Very high185 Ų18556.9 Ų56.980%0.80429%0.294SS*.SBendtrans-107.4-64.9179.6-61.6179.5-178.2179.90111D62D62-K64 PolarHBondContact O-N 2.89Å; D62-K64 WeakPolarHBondContact OD1-CA 3.16Å; D62-K64 PolarHBondContact OD1-N 2.93Å
65K95.3Very high95.3Very high96 Ų9656.3 Ų56.342%0.41729%0.288SS..  trans-81.3137176.7-168.5175.1-172.3178.70109.5E12 L16 S61 D62E12-K65 IonicContact OE2-NZ 2.73Å; E12-K65 PolarHBondContact OE2-NZ 3.2Å; L16-K65 HydrophobicContact CD2-CB 4.25Å; L16-K65 HydrophobicContact CD2-CD 4.45Å; S61-K65 WeakPolarHBondContact CA-O 3.32Å; S61-K65 WeakPolarHBondContact CB-O 3.35Å; S61-K65 PolarHBondContact OG-O 3.43Å; D62-K65 PolarHBondContact N-O 3.46Å; D62-K65 PolarHBondContact OD1-N 2.97Å
66K97.8Very high95.4Very high108 Ų10855.1 Ų55.147%0.4729%0.288SS..EExtended strand (participates in β ladder)trans-130114.8-179.1-68.5177.3-176.8179.30110.1M1 V2 S61M1-K66 WeakPolarHBondContact CA-O 3.37Å; M1-K66 HydrophobicContact CB-CB 4.04Å; M1-K66 HydrophobicContact CE-CB 4.08Å; M1-K66 HydrophobicContact CE-CD 4.27Å; M1-K66 HydrophobicContact CE-CG 4.48Å; M1-K66 HydrophobicContact CG-CB 4.17Å; V2-K66 PolarHBondContact N-O 3.16Å; S61-K66 VanDerWaalsContact OG-CG 3.31Å; S61-K66 WeakPolarHBondContact OG-CG 3.33Å
67I98.2Very high95.5Very high3 Ų359 Ų592%0.01531%0.305CS..EExtended strand (participates in β ladder)trans-115153.6176.162174000110.2V2 L4 F9 E12 L13 L16 R59 A60V2-I67 CarbonylContact O-C 3.58Å; L4-I67 HydrophobicContact CD1-CB 4.09Å; L4-I67 HydrophobicContact CD1-CG2 3.99Å; F9-I67 HydrophobicContact CD2-CB 4.37Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.06Å; F9-I67 HydrophobicContact CE2-CB 4.47Å; F9-I67 HydrophobicContact CE2-CD1 3.93Å; F9-I67 HydrophobicContact CE2-CG1 3.81Å; E12-I67 HydrophobicContact CB-CD1 3.7Å; E12-I67 HydrophobicContact CB-CG2 4.35Å; L13-I67 HydrophobicContact CB-CD1 4.34Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.91Å; R59-I67 WeakPolarHBondContact CA-O 3.42Å; A60-I67 HydrophobicContact CB-CD1 4.25Å; A60-I67 HydrophobicContact CB-CG1 3.9Å; A60-I67 PolarHBondContact N-O 2.97Å; A60-I67 PolarHBondContact O-N 3.37Å
68S97.9Very high95.5Very high8 Ų863.6 Ų63.66%0.05632%0.324CS..EExtended strand (participates in β ladder)trans-149.4152.8180580000111.2V2 L3 L4 L58V2-S68 PolarHBondContact O-N 2.86Å; V2-S68 PolarHBondContact O-OG 2.73Å; L3-S68 WeakPolarHBondContact CA-O 3.27Å; L4-S68 PolarHBondContact N-O 2.94Å; L58-S68 CarbonylContact O-C 3.59Å; L58-S68 WeakPolarHBondContact O-CA 3.09Å; L58-S68 WeakPolarHBondContact O-CB 3.37Å
69T97.7Very high95.4Very high1 Ų164 Ų641%0.00633%0.325CS..EExtended strand (participates in β ladder)trans-146.5150.6173.1-163.50000110.1L4 N6 F9 L58 V71 F79L4-T69 WeakPolarHBondContact O-CB 3.44Å; L4-T69 PolarHBondContact O-OG1 3.38Å; N6-T69 PolarHBondContact ND2-OG1 3.33Å; F9-T69 HydrophobicContact CB-CG2 3.85Å; F9-T69 HydrophobicContact CD1-CG2 3.59Å; F9-T69 HydrophobicContact CD2-CG2 3.73Å; F9-T69 HydrophobicContact CE1-CG2 4.04Å; F9-T69 HydrophobicContact CE2-CG2 4.15Å; F9-T69 HydrophobicContact CG-CG2 3.43Å; F9-T69 VanDerWaalsContact CG-CG2 3.43Å; F9-T69 HydrophobicContact CZ-CG2 4.3Å; L58-T69 HydrophobicContact CB-CG2 4.14Å; L58-T69 PolarHBondContact N-O 3.39Å; L58-T69 PolarHBondContact O-N 2.82Å; T69-V71 HydrophobicContact CG2-CG2 4.22Å; T69-F79 HydrophobicContact CG2-CE2 4.27Å; T69-F79 HydrophobicContact CG2-CZ 4.23Å
70V95.9Very high95.4Very high35 Ų3565.7 Ų65.721%0.21234%0.337CS..EExtended strand (participates in β ladder)trans-104.3128.5173.4175.10000107.6L3 N6 Y33 K55 C56 L57L3-V70 HydrophobicContact CD1-CG2 4.07Å; N6-V70 PolarHBondContact ND2-O 3.48Å; Y33-V70 HydrophobicContact CD1-CB 4.37Å; Y33-V70 HydrophobicContact CD1-CG1 3.73Å; Y33-V70 HydrophobicContact CD1-CG2 3.62Å; Y33-V70 HydrophobicContact CE1-CG1 4.19Å; Y33-V70 HydrophobicContact CE1-CG2 3.59Å; K55-V70 HydrophobicContact CB-CG1 4.11Å; K55-V70 HydrophobicContact CD-CG1 4.08Å; K55-V70 HydrophobicContact CG-CG1 4.44Å; C56-V70 CarbonylContact O-C 3.59Å; C56-V70 WeakPolarHBondContact O-CA 3.36Å; L57-V70 HydrophobicContact CD1-CG2 3.83Å
71V95.6Very high95.3Very high2 Ų271.2 Ų71.21%0.01236%0.363CS..EExtended strand (participates in β ladder)trans-109.8126.2177.1-178.30000108.1K55 C56 L58 T69 V76 F79K55-V71 WeakPolarHBondContact CA-O 3.37Å; C56-V71 PolarHBondContact N-O 3.15Å; C56-V71 PolarHBondContact O-N 3.43Å; L58-V71 HydrophobicContact CD1-CB 4.48Å; L58-V71 HydrophobicContact CD1-CG2 3.85Å; T69-V71 HydrophobicContact CG2-CG2 4.22Å; V71-V76 HydrophobicContact CG1-CB 4.32Å; V71-V76 HydrophobicContact CG1-CG2 4.39Å; V71-F79 HydrophobicContact CG1-CB 4.17Å; V71-F79 HydrophobicContact CG1-CD1 4.3Å; V71-F79 HydrophobicContact CG1-CG 4.24Å; V71-F79 HydrophobicContact CG2-CD1 3.8Å; V71-F79 HydrophobicContact CG2-CD2 4.08Å; V71-F79 HydrophobicContact CG2-CE1 3.87Å; V71-F79 HydrophobicContact CG2-CE2 4.13Å; V71-F79 HydrophobicContact CG2-CG 3.9Å; V71-F79 HydrophobicContact CG2-CZ 4.02Å
72S93.8Very high95.3Very high24 Ų2472.4 Ų72.417%0.16838%0.375CS..EExtended strand (participates in β ladder)trans-90.2162.1175.573.90000110.9K74 E75 V76S72-K74 PolarHBondContact O-N 3.38Å; S72-K74 PolarHBondContact OG-N 3.42Å; S72-E75 PolarHBondContact O-N 3.02Å; S72-E75 PolarHBondContact OG-OE2 3.19Å; S72-V76 PolarHBondContact O-N 3.5Å
73S90.9Very high95.4Very high75 Ų7573.4 Ų73.452%0.52438%0.377SS..THydrogen-bonded Turntrans-57.8-28173550000113.5N54 V76N54-S73 PolarHBondContact O-N 3.08Å; S73-V76 WeakPolarHBondContact O-CG1 3.4Å
74K91.7Very high95.6Very high195 Ų19572.1 Ų72.185%0.84836%0.357SS*.THydrogen-bonded Turntrans-69.8-35.3-179-63.1-176.7179-177.60112.6S72S72-K74 PolarHBondContact O-N 3.38Å; S72-K74 PolarHBondContact OG-N 3.42Å
75E91.9Very high95.8Very high98 Ų9867.9 Ų67.946%0.45834%0.344SS..THydrogen-bonded Turntrans-103.8-3.5-172.5-65.5149.3157.800112.6S72 I77 K78 F79S72-E75 PolarHBondContact O-N 3.02Å; S72-E75 PolarHBondContact OG-OE2 3.19Å; E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.15Å; E75-K78 PolarHBondContact O-N 2.84Å; E75-F79 WeakPolarHBondContact O-CB 3.49Å; E75-F79 PolarHBondContact O-N 3.43Å
76V93.8Very high95.9Very high60 Ų6064 Ų6436%0.36433%0.327SS..Hα-helixtrans-58.5-38.6-171.975.20000113V71 S72 S73 F79 Q80V71-V76 HydrophobicContact CG1-CB 4.32Å; V71-V76 HydrophobicContact CG1-CG2 4.39Å; S72-V76 PolarHBondContact O-N 3.5Å; S73-V76 WeakPolarHBondContact O-CG1 3.4Å; V76-F79 PolarHBondContact O-N 2.86Å; V76-Q80 WeakPolarHBondContact O-CB 3.14Å; V76-Q80 PolarHBondContact O-N 3.23Å
77I95.3Very high95.9Very high116 Ų11660.3 Ų60.360%0.59531%0.313SS*.Hα-helixtrans-67.1-48.8-177.5-61.2174000110.2E75 Q80 M81E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.15Å; I77-Q80 PolarHBondContact O-N 2.94Å; I77-M81 HydrophobicContact CG2-CE 4.32Å; I77-M81 WeakPolarHBondContact O-CG 3.13Å; I77-M81 PolarHBondContact O-N 3.22Å
78K95.5Very high95.8Very high128 Ų12868.8 Ų68.856%0.55734%0.344SS*.Hα-helixtrans-60.6-48.6176.7-175-169.2176.1-156.70110.2D7 E75 Q80 M81 A82D7-K78 IonicContact OD1-NZ 3.15Å; D7-K78 IonicContact OD2-NZ 2.74Å; D7-K78 PolarHBondContact OD2-NZ 3.26Å; D7-K78 VanDerWaalsContact OD2-NZ 3.16Å; E75-K78 PolarHBondContact O-N 2.84Å; K78-Q80 PolarHBondContact O-N 3.28Å; K78-M81 PolarHBondContact O-N 3Å; K78-A82 PolarHBondContact O-N 2.81Å
79F96.8Very high95.8Very high15 Ų1571.4 Ų71.47%0.06637%0.367CS..Hα-helixtrans-61.8-44.8-179-173.7-95000111.9N6 F9 L10 L58 T69 V71 E75 V76 M81 A82 Y83N6-F79 HydrophobicContact CB-CD2 3.87Å; N6-F79 HydrophobicContact CB-CE2 4.22Å; F9-F79 HydrophobicContact CD1-CE2 4.2Å; F9-F79 HydrophobicContact CD1-CZ 4.04Å; F9-F79 HydrophobicContact CE1-CZ 4.16Å; L10-F79 HydrophobicContact CD1-CD2 4.26Å; L10-F79 HydrophobicContact CD1-CE2 4.24Å; L10-F79 HydrophobicContact CD2-CE2 3.88Å; L10-F79 HydrophobicContact CD2-CZ 4.09Å; L10-F79 HydrophobicContact CG-CD2 4.46Å; L10-F79 HydrophobicContact CG-CE2 3.94Å; L58-F79 HydrophobicContact CD1-CE1 4.39Å; L58-F79 HydrophobicContact CD2-CE1 3.66Å; L58-F79 HydrophobicContact CD2-CZ 3.9Å; T69-F79 HydrophobicContact CG2-CE2 4.27Å; T69-F79 HydrophobicContact CG2-CZ 4.23Å; V71-F79 HydrophobicContact CG1-CB 4.17Å; V71-F79 HydrophobicContact CG1-CD1 4.3Å; V71-F79 HydrophobicContact CG1-CG 4.24Å; V71-F79 HydrophobicContact CG2-CD1 3.8Å; V71-F79 HydrophobicContact CG2-CD2 4.08Å; V71-F79 HydrophobicContact CG2-CE1 3.87Å; V71-F79 HydrophobicContact CG2-CE2 4.13Å; V71-F79 HydrophobicContact CG2-CG 3.9Å; V71-F79 HydrophobicContact CG2-CZ 4.02Å; E75-F79 WeakPolarHBondContact O-CB 3.49Å; E75-F79 PolarHBondContact O-N 3.43Å; V76-F79 PolarHBondContact O-N 2.86Å; F79-M81 PolarHBondContact O-N 2.8Å; F79-A82 PolarHBondContact O-N 3.43Å; F79-Y83 HydrophobicContact CE1-CD1 4.48Å; F79-Y83 HydrophobicContact CE1-CD2 4.25Å; F79-Y83 AromaticContact CE1-CG 3.97Å; F79-Y83 HydrophobicContact CE1-CG 3.97Å; F79-Y83 HydrophobicContact CZ-CD2 4.32Å; F79-Y83 HydrophobicContact CZ-CG 4.45Å; F79-Y83 WeakPolarHBondContact O-CB 3.11Å; F79-Y83 PolarHBondContact O-N 3.45Å
80Q96.4Very high95.7Very high122 Ų12273.8 Ų73.857%0.5738%0.378SS*.Hα-helixtrans-60-45.1-179.1-179-165.1-20.400111.9V76 I77 K78 S84V76-Q80 WeakPolarHBondContact O-CB 3.14Å; V76-Q80 PolarHBondContact O-N 3.23Å; I77-Q80 PolarHBondContact O-N 2.94Å; K78-Q80 PolarHBondContact O-N 3.28Å; Q80-S84 WeakPolarHBondContact O-CB 3.07Å; Q80-S84 PolarHBondContact O-N 3.49Å
81M97.1Very high95.6Very high117 Ų11776.8 Ų76.858%0.57639%0.391SS*.Hα-helixtrans-60.8-49.5179.8-70.3-171.9-67.300111.2I77 K78 F79 N85I77-M81 HydrophobicContact CG2-CE 4.32Å; I77-M81 WeakPolarHBondContact O-CG 3.13Å; I77-M81 PolarHBondContact O-N 3.22Å; K78-M81 PolarHBondContact O-N 3Å; F79-M81 PolarHBondContact O-N 2.8Å; M81-N85 VanDerWaalsContact O-CG 3.3Å; M81-N85 PolarHBondContact O-N 3.48Å; M81-N85 VanDerWaalsContact O-N 3.15Å; M81-N85 PolarHBondContact O-ND2 3.45Å
82A97.6Very high95.6Very high43 Ų4381 Ų8136%0.35541%0.413SS..Hα-helixtrans-66.1-44.5179.700000112L10 K78 F79 N85 L86L10-A82 HydrophobicContact CD1-CB 3.62Å; K78-A82 PolarHBondContact O-N 2.81Å; F79-A82 PolarHBondContact O-N 3.43Å; A82-N85 PolarHBondContact O-N 3.48Å; A82-L86 WeakPolarHBondContact O-CB 3.4Å; A82-L86 PolarHBondContact O-N 2.85Å
83Y97.9Very high95.5Very high48 Ų4882.9 Ų82.919%0.18844%0.436CS..Hα-helixtrans-62.9-43.1178.5-179-113.1000112.4L10 L13 L58 F79 L86 L87L10-Y83 HydrophobicContact CD2-CD2 4.06Å; L13-Y83 HydrophobicContact CD2-CD2 4.1Å; L13-Y83 HydrophobicContact CD2-CE2 3.71Å; L58-Y83 HydrophobicContact CD2-CE2 4.3Å; F79-Y83 HydrophobicContact CE1-CD1 4.48Å; F79-Y83 HydrophobicContact CE1-CD2 4.25Å; F79-Y83 AromaticContact CE1-CG 3.97Å; F79-Y83 HydrophobicContact CE1-CG 3.97Å; F79-Y83 HydrophobicContact CZ-CD2 4.32Å; F79-Y83 HydrophobicContact CZ-CG 4.45Å; F79-Y83 WeakPolarHBondContact O-CB 3.11Å; F79-Y83 PolarHBondContact O-N 3.45Å; Y83-L86 PolarHBondContact O-N 2.97Å; Y83-L87 HydrophobicContact CD1-CD1 4.05Å; Y83-L87 HydrophobicContact CD1-CG 4.48Å; 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 4.12Å; Y83-L87 HydrophobicContact CE2-CD1 4.27Å; Y83-L87 HydrophobicContact CE2-CD2 4.19Å; Y83-L87 HydrophobicContact CE2-CG 4.1Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 WeakPolarHBondContact O-CG 3.43Å; Y83-L87 PolarHBondContact O-N 3.24Å
84S97.8Very high95.5Very high35 Ų3586 Ų8625%0.24545%0.446CS..Hα-helixtrans-62.5-43.9177.2-176.90000112Q80 L87 R88Q80-S84 WeakPolarHBondContact O-CB 3.07Å; Q80-S84 PolarHBondContact O-N 3.49Å; S84-L87 PolarHBondContact O-N 3.04Å; S84-R88 WeakPolarHBondContact O-CG 3.34Å; S84-R88 PolarHBondContact O-N 3.19Å; S84-R88 PolarHBondContact OG-NH2 2.51Å
85N97.5Very high95.6Very high96 Ų9686.5 Ų86.551%0.51345%0.449SS..Hα-helixtrans-64.8-43177.1-71.2-13.9000111.6M81 A82 L87 R88 A89M81-N85 VanDerWaalsContact O-CG 3.3Å; M81-N85 PolarHBondContact O-N 3.48Å; M81-N85 VanDerWaalsContact O-N 3.15Å; M81-N85 PolarHBondContact O-ND2 3.45Å; A82-N85 PolarHBondContact O-N 3.48Å; N85-L87 PolarHBondContact O-N 2.89Å; N85-R88 PolarHBondContact O-N 3.41Å; N85-A89 WeakPolarHBondContact O-CB 3.35Å; N85-A89 PolarHBondContact O-N 2.85Å
86L97.8Very high95.5Very high15 Ų1591 Ų918%0.07947%0.467CS..Hα-helixtrans-58-49.5175.2-175162.5000111.2L10 L13 T14 F17 A82 Y83 R88 A89 H90L10-L86 HydrophobicContact CB-CD1 4.19Å; L10-L86 HydrophobicContact CD2-CD1 4.04Å; L10-L86 WeakPolarHBondContact O-CD1 3.46Å; L13-L86 HydrophobicContact CB-CD1 4.34Å; L13-L86 HydrophobicContact CD2-CD1 4.23Å; L13-L86 HydrophobicContact CD2-CD2 3.79Å; L13-L86 HydrophobicContact CG-CD1 4.39Å; L13-L86 HydrophobicContact CG-CD2 3.94Å; T14-L86 WeakPolarHBondContact OG1-CD1 2.96Å; F17-L86 HydrophobicContact CD2-CD2 3.79Å; F17-L86 HydrophobicContact CE2-CD2 3.62Å; A82-L86 WeakPolarHBondContact O-CB 3.4Å; A82-L86 PolarHBondContact O-N 2.85Å; Y83-L86 PolarHBondContact O-N 2.97Å; L86-R88 PolarHBondContact O-N 2.89Å; L86-A89 PolarHBondContact O-N 2.9Å; L86-H90 PolarHBondContact O-CD2 2.82Å; L86-H90 VanDerWaalsContact O-CD2 3.26Å; L86-H90 PolarHBondContact O-N 3.31Å; L86-H90 VanDerWaalsContact O-N 3.08Å
87L97.4Very high95.1Very high31 Ų3197.8 Ų97.816%0.16249%0.491CS..Hα-helixtrans-59.1-46.7179-79.4-169.9000112.2F17 I28 Y83 S84 N85 A89 H90 M91F17-L87 HydrophobicContact CE2-CD2 4.2Å; F17-L87 HydrophobicContact CZ-CD2 3.99Å; I28-L87 HydrophobicContact CD1-CD2 4.04Å; Y83-L87 HydrophobicContact CD1-CD1 4.05Å; Y83-L87 HydrophobicContact CD1-CG 4.48Å; 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 4.12Å; Y83-L87 HydrophobicContact CE2-CD1 4.27Å; Y83-L87 HydrophobicContact CE2-CD2 4.19Å; Y83-L87 HydrophobicContact CE2-CG 4.1Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 WeakPolarHBondContact O-CG 3.43Å; Y83-L87 PolarHBondContact O-N 3.24Å; S84-L87 PolarHBondContact O-N 3.04Å; N85-L87 PolarHBondContact O-N 2.89Å; L87-A89 VanDerWaalsContact C-N 3.32Å; L87-A89 PolarHBondContact O-N 2.74Å; L87-H90 PolarHBondContact O-N 3.15Å; L87-M91 HydrophobicContact CB-CE 3.66Å; L87-M91 HydrophobicContact CD1-CE 4.2Å; L87-M91 HydrophobicContact CD2-CE 3.84Å; L87-M91 HydrophobicContact CD2-SD 4.38Å; L87-M91 HydrophobicContact CG-CE 4.1Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 PolarHBondContact O-N 2.98Å
88R95.9Very high94.4Very high180 Ų18099.2 Ų99.268%0.67950%0.5SS*.Hα-helixtrans-63.8-37.5177.9-71.7175.7-172.1147.6-2.8112.6S84 N85 L86S84-R88 WeakPolarHBondContact O-CG 3.34Å; S84-R88 PolarHBondContact O-N 3.19Å; S84-R88 PolarHBondContact OG-NH2 2.51Å; N85-R88 PolarHBondContact O-N 3.41Å; L86-R88 PolarHBondContact O-N 2.89Å
89A96.7Very high93.4Very high64 Ų64102.9 Ų102.953%0.52952%0.516SS..Hα-helixtrans-70.7-32.8-179.200000113N85 L86 L87N85-A89 WeakPolarHBondContact O-CB 3.35Å; N85-A89 PolarHBondContact O-N 2.85Å; L86-A89 PolarHBondContact O-N 2.9Å; L87-A89 VanDerWaalsContact C-N 3.32Å; L87-A89 PolarHBondContact O-N 2.74Å
90H96.4Very high92Very high50 Ų50111.9 Ų111.923%0.23156%0.555CS.*Hα-helixtrans-105.4-14.3-172.7-68.4-60.2000115.4F17 L86 L87 D92F17-H90 HydrophobicContact CB-CB 3.79Å; F17-H90 HydrophobicContact CD1-CB 3.92Å; F17-H90 HydrophobicContact CD2-CB 3.94Å; F17-H90 HydrophobicContact CE1-CB 4.48Å; F17-H90 HydrophobicContact CE2-CB 4.49Å; F17-H90 HydrophobicContact CG-CB 3.63Å; L86-H90 PolarHBondContact O-CD2 2.82Å; L86-H90 VanDerWaalsContact O-CD2 3.26Å; L86-H90 PolarHBondContact O-N 3.31Å; L86-H90 VanDerWaalsContact O-N 3.08Å; L87-H90 PolarHBondContact O-N 3.15Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 3.31Å
91M94.8Very high90.2Very high98 Ų98111.1 Ų111.148%0.48356%0.563SS.*  trans-96.848.6173-63.5-170.9-63.800111.6F17 L87F17-M91 HydrophobicContact CE1-CG 4.13Å; F17-M91 HydrophobicContact CZ-CG 4.41Å; L87-M91 HydrophobicContact CB-CE 3.66Å; L87-M91 HydrophobicContact CD1-CE 4.2Å; L87-M91 HydrophobicContact CD2-CE 3.84Å; L87-M91 HydrophobicContact CD2-SD 4.38Å; L87-M91 HydrophobicContact CG-CE 4.1Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 PolarHBondContact O-N 2.98Å
92D94.2Very high88.5Confident91 Ų91115.3 Ų115.349%0.48758%0.578SS.*  trans-91.1-12.6-174.465.7-29.5000113.9R21 H90 L94R21-D92 IonicContact CZ-OD1 3.16Å; R21-D92 IonicContact CZ-OD2 3.85Å; R21-D92 IonicContact NE-OD1 3.1Å; R21-D92 VanDerWaalsContact NH2-CG 3.27Å; R21-D92 IonicContact NH2-OD1 3.52Å; R21-D92 PolarHBondContact NH2-OD1 3.47Å; R21-D92 IonicContact NH2-OD2 3.43Å; R21-D92 PolarHBondContact NH2-OD2 2.84Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 3.31Å; D92-L94 PolarHBondContact O-N 3.2Å
93G91.2Very high86.5Confident63 Ų63118 Ų11865%0.64959%0.594SS**  trans-78.814-175.300000116.6
94L92.1Very high84.4Confident141 Ų141125.1 Ų125.174%0.73863%0.626SS**SBendtrans-85.2151.8-179.2-71.7156.4000111.4D92 K96D92-L94 PolarHBondContact O-N 3.2Å; L94-K96 PolarHBondContact O-N 3.27Å
95K93.3Very high82.3Confident206 Ų206132.7 Ų132.790%0.89666%0.655SS**PPolyproline II helixtrans-58.6133.6173.6-69-172.7179.5-176.60109.8
96K89.4Confident80.3Confident192 Ų192134.3 Ų134.384%0.83567%0.668SS**PPolyproline II helixtrans-63.3141.1172.2-66-178.1-178.4176.60108.6L94 D98L94-K96 PolarHBondContact O-N 3.27Å; K96-D98 PolarHBondContact O-N 3.2Å
97K85.8Confident78.1Confident202 Ų202143.2 Ų143.288%0.87871%0.706SS**PPolyproline II helixtrans-61.9121.1174-173.6175.2-177.91760108.5K99K97-K99 PolarHBondContact O-N 3.26Å; K97-K99 VanDerWaalsContact O-N 3.15Å
98D79.9Confident76Confident147 Ų147146.4 Ų146.479%0.78674%0.737SS**PPolyproline II helixtrans-57.5121.8172.7-67.9-45.3000108.6K96 K100K96-D98 PolarHBondContact O-N 3.2Å; D98-K100 PolarHBondContact O-N 2.86Å
99K75.1Confident73.7Confident205 Ų205144.4 Ų144.489%0.89175%0.745SS**  trans-65.896.2165.7-84.3-177.7177.9175.20105.6K97 S101K97-K99 PolarHBondContact O-N 3.26Å; K97-K99 VanDerWaalsContact O-N 3.15Å; K99-S101 PolarHBondContact O-N 3.05Å
100K68.2Low71.4Confident203 Ų203153.8 Ų153.888%0.88378%0.778SS**  trans-48.5108.4167.3-153.4175.7-168.5176.60105.5D98 K102D98-K100 PolarHBondContact O-N 2.86Å; K100-K102 PolarHBondContact O-N 3.28Å
101S58Low70.2Confident106 Ų106159 Ų15974%0.74181%0.806SS**  trans-57.5115-178.148.40000105.9K99 S103K99-S101 PolarHBondContact O-N 3.05Å; S101-S103 VanDerWaalsContact C-N 3.26Å; S101-S103 PolarHBondContact O-N 3.17Å
102K61.1Low68.9Low206 Ų206162.2 Ų162.290%0.89682%0.823SS**  trans-58.2106.3159-98.3-178.1174.5176.30103.4K100 K104K100-K102 PolarHBondContact O-N 3.28Å; K102-K104 PolarHBondContact O-N 3.48Å
103S55.5Low67.5Low98 Ų98166.2 Ų166.269%0.68584%0.841SS**  trans-51.4122.5171.866.20000106S101 K105S101-S103 VanDerWaalsContact C-N 3.26Å; S101-S103 PolarHBondContact O-N 3.17Å; S103-K105 VanDerWaalsContact C-N 3.27Å; S103-K105 PolarHBondContact O-N 3.03Å
104K53.6Low66.1Low199 Ų199172.2 Ų172.287%0.86585%0.852SS**  trans-59102.3166-83.7178.9174.6177.30104.5K102 T106K102-K104 PolarHBondContact O-N 3.48Å; K104-T106 PolarHBondContact O-N 3.26Å
105K55.1Low64.5Low193 Ų193174.2 Ų174.284%0.83986%0.86SS**  trans-6098.1157.4-82.7-173176.2-1760105S103 K107S103-K105 VanDerWaalsContact C-N 3.27Å; S103-K105 PolarHBondContact O-N 3.03Å; K105-K107 PolarHBondContact O-N 3.12Å
106T54.2Low62.6Low131 Ų131172.1 Ų172.180%0.80486%0.857SS**  trans-55.8108.8160.337.10000106.1K104 A108K104-T106 PolarHBondContact O-N 3.26Å; T106-A108 PolarHBondContact O-N 3.03Å
107K52.6Low60.6Low201 Ų201170.6 Ų170.687%0.87486%0.859SS**PPolyproline II helixtrans-61.5119.9163.8-88.7-176.2171.7-175.90106.2K105K105-K107 PolarHBondContact O-N 3.12Å
108A52.4Low58.7Low98 Ų98168.2 Ų168.281%0.8186%0.857SS**PPolyproline II helixtrans-68.1126.1163.900000107.7T106T106-A108 PolarHBondContact O-N 3.03Å
109T47.4Very low56.9Low138 Ų138170 Ų17085%0.84786%0.863SS**PPolyproline II helixtrans-73129.4166.3-59.50000107.8
110Q50.2Low55.3Low262 Ų262166.8 Ų166.8100%1.22486%0.861SS**  trans-93.50158.3-80.2-172.314.300108.5

Retrieved 110 of 110 residues in 52.3 ms (Link to these results)

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