A0A3B3VED6_9TELE 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 A0A3B3VED6, Species 9TELE (Poecilia latipinna, sailfin molly), 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
1M82.8Confident95.6Very high133 Ų13371.3 Ų71.366%0.65538%0.384SS*.  0128.10174.3175.7-86.600105.9R59 K66M1-R59 HydrophobicContact CE-CB 4.24Å; M1-R59 HydrophobicContact CE-CG 4.25Å; M1-R59 HydrophobicContact SD-CG 4.39Å; M1-K66 WeakPolarHBondContact CA-O 3.37Å; M1-K66 HydrophobicContact CB-CB 4.09Å; M1-K66 HydrophobicContact CE-CB 4.13Å; M1-K66 HydrophobicContact CE-CD 4.32Å; M1-K66 HydrophobicContact CG-CB 4.22Å
2V93.7Very high95.7Very high83 Ų8367.8 Ų67.850%0.50336%0.363SS..EExtended strand (participates in β ladder)trans-101.9128.3-173.4-174.10000109.2L4 K66 I67 S68V2-L4 HydrophobicContact CG1-CD2 3.6Å; V2-L4 HydrophobicContact CG1-CG 4.04Å; V2-K66 PolarHBondContact N-O 2.58Å; V2-I67 CarbonylContact O-C 3.5Å; V2-S68 PolarHBondContact O-N 2.95Å; V2-S68 PolarHBondContact O-OG 2.73Å
3L95.9Very high95.9Very high116 Ų11662.5 Ų62.561%0.60734%0.335SS*.EExtended strand (participates in β ladder)trans-87.1121.4170.8-177.665.2000108.3S68 V70L3-S68 WeakPolarHBondContact CA-O 3.48Å; L3-V70 HydrophobicContact CD1-CG2 4.04Å
4L97.5Very high96Very high42 Ų4260.6 Ų60.622%0.2233%0.327CS..  trans-119.3155.1-175.9-62.7175.6000110.5V2 F9 E12 I67 S68 T69V2-L4 HydrophobicContact CG1-CD2 3.6Å; V2-L4 HydrophobicContact CG1-CG 4.04Å; L4-F9 HydrophobicContact CB-CB 4.25Å; L4-E12 HydrophobicContact CD1-CB 4.12Å; L4-E12 HydrophobicContact CD1-CG 3.91Å; L4-I67 HydrophobicContact CD1-CB 4.1Å; L4-I67 HydrophobicContact CD1-CG2 3.98Å; L4-S68 PolarHBondContact N-O 3.46Å; L4-T69 WeakPolarHBondContact O-CB 3.28Å; L4-T69 PolarHBondContact O-OG1 3.17Å
5E97Very high96Very high153 Ų15366 Ų6672%0.71534%0.341SS*.  trans-62.8157164.4-65.9-175.8170.800111.3D7 S8 F9E5-D7 PolarHBondContact O-N 3.39Å; E5-S8 PolarHBondContact O-N 3.27Å; E5-F9 WeakPolarHBondContact O-CB 3.29Å; E5-F9 PolarHBondContact O-N 2.71Å
6N96.8Very high96.1Very high17 Ų1762.1 Ų62.19%0.09132%0.321CS..Hα-helixtrans-56.5-47.3-173.1-78.6-161.1000112.9F9 L10 T69 V70 E75 F79N6-F9 PolarHBondContact O-N 3.48Å; N6-L10 WeakPolarHBondContact O-CG 3.43Å; N6-L10 PolarHBondContact O-N 2.72Å; N6-L10 VanDerWaalsContact O-N 3.17Å; N6-T69 PolarHBondContact ND2-OG1 3.45Å; N6-V70 PolarHBondContact ND2-O 3.47Å; N6-E75 PolarHBondContact OD1-OE2 2.97Å; N6-F79 HydrophobicContact CB-CD2 3.9Å; N6-F79 HydrophobicContact CB-CE2 4.32Å
7D96.4Very high96.1Very high90 Ų9060.2 Ų60.248%0.48131%0.309SS..Hα-helixtrans-69-42.1-178.3-68.6-18.2000111E5 F9 L10 T11 K78E5-D7 PolarHBondContact O-N 3.39Å; D7-F9 VanDerWaalsContact C-N 3.34Å; D7-F9 PolarHBondContact O-N 3.41Å; D7-L10 PolarHBondContact O-N 2.88Å; D7-T11 PolarHBondContact O-N 3Å; D7-T11 VanDerWaalsContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 3.28Å; D7-K78 IonicContact OD1-NZ 3.28Å; D7-K78 PolarHBondContact OD1-NZ 3.49Å; D7-K78 IonicContact OD2-NZ 2.78Å; D7-K78 PolarHBondContact OD2-NZ 3.38Å
8S97.5Very high96.1Very high56 Ų5663.6 Ų63.639%0.39232%0.324SS..Hα-helixtrans-62.5-38.5174.3-70.80000112.7E5 T11 E12E5-S8 PolarHBondContact O-N 3.27Å; S8-T11 PolarHBondContact O-N 3.42Å; S8-E12 WeakPolarHBondContact O-CB 3.49Å; S8-E12 WeakPolarHBondContact O-CG 3.27Å; S8-E12 PolarHBondContact O-N 3.01Å
9F98.2Very high96.1Very high0 Ų066.8 Ų66.80%034%0.335CS..Hα-helixtrans-62.3-42.6176.3174.7-90.6000111.6L4 E5 N6 D7 E12 L13 I58 A60 I67 T69 F79L4-F9 HydrophobicContact CB-CB 4.25Å; E5-F9 WeakPolarHBondContact O-CB 3.29Å; E5-F9 PolarHBondContact O-N 2.71Å; N6-F9 PolarHBondContact O-N 3.48Å; D7-F9 VanDerWaalsContact C-N 3.34Å; D7-F9 PolarHBondContact O-N 3.41Å; F9-E12 PolarHBondContact O-N 3.02Å; F9-L13 HydrophobicContact CE1-CD2 4.03Å; F9-L13 VanDerWaalsContact O-CB 3.25Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 3.16Å; F9-I58 HydrophobicContact CE1-CG2 3.97Å; F9-I58 HydrophobicContact CE2-CG2 4.47Å; F9-I58 HydrophobicContact CZ-CB 4.31Å; F9-I58 HydrophobicContact CZ-CG2 3.6Å; F9-A60 HydrophobicContact CE2-CB 4.33Å; F9-A60 HydrophobicContact CZ-CB 4.13Å; F9-I67 HydrophobicContact CD2-CB 4.35Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.06Å; F9-I67 HydrophobicContact CE2-CB 4.42Å; F9-I67 HydrophobicContact CE2-CD1 3.88Å; F9-I67 HydrophobicContact CE2-CG1 3.77Å; F9-T69 HydrophobicContact CB-CG2 3.86Å; F9-T69 HydrophobicContact CD1-CG2 3.61Å; F9-T69 HydrophobicContact CD2-CG2 3.78Å; F9-T69 HydrophobicContact CE1-CG2 4.09Å; F9-T69 HydrophobicContact CE2-CG2 4.23Å; F9-T69 HydrophobicContact CG-CG2 3.45Å; F9-T69 VanDerWaalsContact CG-CG2 3.45Å; F9-T69 HydrophobicContact CZ-CG2 4.39Å; F9-F79 HydrophobicContact CD1-CE2 4.12Å; F9-F79 HydrophobicContact CD1-CZ 4.01Å; F9-F79 HydrophobicContact CE1-CZ 4.13Å
10L97.9Very high96.1Very high17 Ų1764.6 Ų64.69%0.08933%0.326CS..Hα-helixtrans-64.1-42.7178-67.2170.7000111.4N6 D7 L13 T14 F79 A82 Y83 L86N6-L10 WeakPolarHBondContact O-CG 3.43Å; N6-L10 PolarHBondContact O-N 2.72Å; N6-L10 VanDerWaalsContact O-N 3.17Å; D7-L10 PolarHBondContact O-N 2.88Å; L10-L13 PolarHBondContact O-N 3.31Å; L10-T14 PolarHBondContact O-N 3.31Å; L10-T14 PolarHBondContact O-OG1 3.05Å; L10-F79 HydrophobicContact CD1-CD2 4.31Å; L10-F79 HydrophobicContact CD1-CE2 4.3Å; L10-F79 HydrophobicContact CD2-CE2 3.93Å; L10-F79 HydrophobicContact CD2-CZ 4.06Å; L10-F79 HydrophobicContact CG-CD2 4.49Å; L10-F79 HydrophobicContact CG-CE2 3.99Å; L10-A82 HydrophobicContact CD1-CB 3.61Å; L10-Y83 HydrophobicContact CD2-CD2 4.04Å; L10-L86 HydrophobicContact CB-CD1 4.22Å; L10-L86 HydrophobicContact CD2-CD1 4.06Å; L10-L86 WeakPolarHBondContact O-CD1 3.49Å
11T97.7Very high96Very high77 Ų7768 Ų6847%0.47234%0.335SS..Hα-helixtrans-61-46.1175-55.50000112.2D7 S8 L13 T14 R15D7-T11 PolarHBondContact O-N 3Å; D7-T11 VanDerWaalsContact O-N 3.17Å; D7-T11 PolarHBondContact O-OG1 3.28Å; S8-T11 PolarHBondContact O-N 3.42Å; T11-L13 VanDerWaalsContact C-N 3.32Å; T11-L13 PolarHBondContact O-N 3.48Å; T11-T14 PolarHBondContact O-N 2.99Å; T11-R15 PolarHBondContact O-N 3.25Å; T11-R15 VanDerWaalsContact O-N 3.16Å
12E97.4Very high96.6Very high29 Ų2968.4 Ų68.414%0.13635%0.345CS..Hα-helixtrans-68.2-32.5178.5-75.5-63.1142.200112.6L4 S8 F9 R15 L16 K65 I67L4-E12 HydrophobicContact CD1-CB 4.12Å; L4-E12 HydrophobicContact CD1-CG 3.91Å; S8-E12 WeakPolarHBondContact O-CB 3.49Å; S8-E12 WeakPolarHBondContact O-CG 3.27Å; S8-E12 PolarHBondContact O-N 3.01Å; F9-E12 PolarHBondContact O-N 3.02Å; E12-R15 WeakPolarHBondContact O-CB 3.48Å; E12-R15 PolarHBondContact O-N 3.39Å; E12-R15 IonicContact OE1-CZ 3.97Å; E12-R15 IonicContact OE1-NE 2.94Å; E12-R15 IonicContact OE1-NH1 2.71Å; E12-R15 PolarHBondContact OE1-NH1 2.99Å; E12-L16 PolarHBondContact O-N 3.29Å; E12-K65 WeakPolarHBondContact OE2-CE 3.14Å; E12-K65 IonicContact OE2-NZ 2.58Å; E12-K65 PolarHBondContact OE2-NZ 2.81Å; E12-I67 HydrophobicContact CB-CD1 3.71Å; E12-I67 HydrophobicContact CB-CG2 4.34Å
13L97.6Very high96.6Very high0 Ų069.2 Ų69.20%035%0.354CS..Hα-helixtrans-65.7-42.3174-178.260.5000111.6F9 L10 T11 R15 L16 F17 V26 I28 A60 I67 Y83 L86F9-L13 HydrophobicContact CE1-CD2 4.03Å; F9-L13 VanDerWaalsContact O-CB 3.25Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 3.16Å; L10-L13 PolarHBondContact O-N 3.31Å; T11-L13 VanDerWaalsContact C-N 3.32Å; T11-L13 PolarHBondContact O-N 3.48Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 2.84Å; L13-L16 WeakPolarHBondContact O-CB 3.49Å; L13-L16 PolarHBondContact O-N 3.4Å; L13-L16 VanDerWaalsContact O-N 3.16Å; L13-F17 HydrophobicContact CD1-CD2 4.11Å; L13-F17 HydrophobicContact CD1-CE2 3.75Å; L13-F17 HydrophobicContact CD2-CE2 4.2Å; L13-F17 HydrophobicContact CG-CD2 4Å; L13-F17 HydrophobicContact CG-CE2 3.75Å; L13-F17 VanDerWaalsContact O-CD2 3.32Å; L13-F17 WeakPolarHBondContact O-CD2 3.46Å; L13-F17 PolarHBondContact O-N 3.16Å; L13-V26 HydrophobicContact CD1-CG1 4.4Å; L13-I28 HydrophobicContact CD1-CD1 4.01Å; L13-I28 HydrophobicContact CD1-CG1 4.43Å; 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 4.06Å; L13-Y83 HydrophobicContact CD2-CE2 3.68Å; L13-L86 HydrophobicContact CB-CD1 4.35Å; L13-L86 HydrophobicContact CD2-CD1 4.22Å; L13-L86 HydrophobicContact CD2-CD2 3.79Å; L13-L86 HydrophobicContact CG-CD1 4.38Å; L13-L86 HydrophobicContact CG-CD2 3.93Å
14T97.6Very high96.6Very high35 Ų3566.2 Ų66.222%0.21535%0.351CS..Hα-helixtrans-57.3-44.4172-70.50000111.4L10 T11 L16 F17 Q18 L86L10-T14 PolarHBondContact O-N 3.31Å; L10-T14 PolarHBondContact O-OG1 3.05Å; T11-T14 PolarHBondContact O-N 2.99Å; T14-L16 VanDerWaalsContact C-N 3.31Å; T14-L16 PolarHBondContact O-N 3.17Å; T14-F17 PolarHBondContact O-N 3.39Å; T14-Q18 HydrophobicContact CG2-CG 4.46Å; T14-Q18 WeakPolarHBondContact O-CG 3.45Å; T14-Q18 PolarHBondContact O-N 3.35Å; T14-L86 WeakPolarHBondContact OG1-CD1 3.43Å
15R96.5Very high96.5Very high142 Ų14268.8 Ų68.854%0.53637%0.373SS..Hα-helixtrans-60.7-39.1176.1-69.3175.1177.4-177.7-5.4112.1T11 E12 L13 Q18 K19T11-R15 PolarHBondContact O-N 3.25Å; T11-R15 VanDerWaalsContact O-N 3.16Å; E12-R15 WeakPolarHBondContact O-CB 3.48Å; E12-R15 PolarHBondContact O-N 3.39Å; E12-R15 IonicContact OE1-CZ 3.97Å; E12-R15 IonicContact OE1-NE 2.94Å; E12-R15 IonicContact OE1-NH1 2.71Å; E12-R15 PolarHBondContact OE1-NH1 2.99Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 2.84Å; R15-Q18 PolarHBondContact O-N 3.43Å; R15-K19 VanDerWaalsContact O-CB 3.28Å; R15-K19 WeakPolarHBondContact O-CB 3.32Å; R15-K19 PolarHBondContact O-N 3.02Å
16L96.6Very high96.5Very high4 Ų463.1 Ų63.12%0.02135%0.349CS..Hα-helixtrans-63-45.2175.6-74.6173000112.1E12 L13 T14 K19 C20 V26 A60 D62 K65 I67E12-L16 PolarHBondContact O-N 3.29Å; L13-L16 WeakPolarHBondContact O-CB 3.49Å; L13-L16 PolarHBondContact O-N 3.4Å; L13-L16 VanDerWaalsContact O-N 3.16Å; T14-L16 VanDerWaalsContact C-N 3.31Å; T14-L16 PolarHBondContact O-N 3.17Å; L16-K19 PolarHBondContact O-N 3.28Å; L16-C20 PolarHBondContact O-N 3.02Å; L16-C20 PolarHBondContact O-SG 2.97Å; L16-V26 HydrophobicContact CB-CG2 4.41Å; L16-A60 HydrophobicContact CD1-CB 4.15Å; L16-D62 HydrophobicContact CD2-CB 3.93Å; L16-K65 HydrophobicContact CD2-CB 4.28Å; L16-K65 HydrophobicContact CD2-CD 4.47Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.9Å
17F97.1Very high96.5Very high29 Ų2965.3 Ų65.313%0.12737%0.369CS..Hα-helixtrans-62.5-44.1177-82.4-66000112.5L13 T14 C20 R21 V26 I28 L86 L87 H90 I91L13-F17 HydrophobicContact CD1-CD2 4.11Å; L13-F17 HydrophobicContact CD1-CE2 3.75Å; L13-F17 HydrophobicContact CD2-CE2 4.2Å; L13-F17 HydrophobicContact CG-CD2 4Å; L13-F17 HydrophobicContact CG-CE2 3.75Å; L13-F17 VanDerWaalsContact O-CD2 3.32Å; L13-F17 WeakPolarHBondContact O-CD2 3.46Å; L13-F17 PolarHBondContact O-N 3.16Å; T14-F17 PolarHBondContact O-N 3.39Å; F17-C20 PolarHBondContact O-N 2.82Å; F17-R21 PolarHBondContact O-N 2.88Å; F17-V26 HydrophobicContact CD1-CG2 4.28Å; F17-V26 HydrophobicContact CE1-CB 4.32Å; F17-I28 HydrophobicContact CE2-CD1 4.27Å; F17-I28 HydrophobicContact CZ-CD1 3.93Å; F17-L86 HydrophobicContact CD2-CD2 3.75Å; F17-L86 HydrophobicContact CE2-CD2 3.58Å; F17-L87 HydrophobicContact CE2-CD2 4.16Å; F17-L87 HydrophobicContact CZ-CD2 3.96Å; F17-H90 HydrophobicContact CB-CB 3.8Å; F17-H90 HydrophobicContact CD1-CB 3.94Å; F17-H90 HydrophobicContact CD2-CB 3.95Å; F17-H90 HydrophobicContact CE1-CB 4.49Å; F17-H90 HydrophobicContact CE2-CB 4.5Å; F17-H90 HydrophobicContact CG-CB 3.64Å; F17-I91 HydrophobicContact CE1-CG1 4.13Å; F17-I91 HydrophobicContact CZ-CG1 4.36Å
18Q95.9Very high96.6Very high121 Ų12163.5 Ų63.557%0.56536%0.359SS*.Hα-helixtrans-62.6-43.4177.3-71.1171.4-10.700111.6T14 R15 C20 R21T14-Q18 HydrophobicContact CG2-CG 4.46Å; T14-Q18 WeakPolarHBondContact O-CG 3.45Å; T14-Q18 PolarHBondContact O-N 3.35Å; R15-Q18 PolarHBondContact O-N 3.43Å; Q18-C20 PolarHBondContact O-N 2.91Å; Q18-R21 VanDerWaalsContact O-CB 3.29Å; Q18-R21 WeakPolarHBondContact O-CB 3.34Å; Q18-R21 PolarHBondContact O-N 2.93Å
19K96.3Very high96.6Very high125 Ų12563.8 Ų63.854%0.54336%0.358SS..Hα-helixtrans-63.8-39.7178.6-176.7-174.2175-164.10112.8R15 L16 R21 D62R15-K19 VanDerWaalsContact O-CB 3.28Å; R15-K19 WeakPolarHBondContact O-CB 3.32Å; R15-K19 PolarHBondContact O-N 3.02Å; L16-K19 PolarHBondContact O-N 3.28Å; K19-R21 VanDerWaalsContact C-N 3.29Å; K19-R21 PolarHBondContact O-N 2.96Å; K19-D62 IonicContact NZ-OD2 2.73Å; K19-D62 PolarHBondContact NZ-OD2 2.94Å
20C95.8Very high96.5Very high22 Ų2269.7 Ų69.715%0.14939%0.389CS..THydrogen-bonded Turntrans-90.914.7-177.3-550000113.3L16 F17 Q18 S23 V26 D62L16-C20 PolarHBondContact O-N 3.02Å; L16-C20 PolarHBondContact O-SG 2.97Å; F17-C20 PolarHBondContact O-N 2.82Å; Q18-C20 PolarHBondContact O-N 2.91Å; C20-S23 CarbonylContact C-O 3.59Å; C20-S23 WeakPolarHBondContact CA-O 3.39Å; C20-V26 HydrophobicContact CB-CG2 3.79Å; C20-D62 WeakPolarHBondContact SG-CB 3.09Å
21R94.9Very high96.3Very high136 Ų13675.6 Ų75.651%0.51341%0.414SS..SBendtrans-67.9-39.4-172.9-172.967.9177.796.8-13.1113.3F17 Q18 K19 D92F17-R21 PolarHBondContact O-N 2.88Å; Q18-R21 VanDerWaalsContact O-CB 3.29Å; Q18-R21 WeakPolarHBondContact O-CB 3.34Å; Q18-R21 PolarHBondContact O-N 2.93Å; K19-R21 VanDerWaalsContact C-N 3.29Å; K19-R21 PolarHBondContact O-N 2.96Å; R21-D92 IonicContact CZ-OD1 3.01Å; R21-D92 IonicContact CZ-OD2 3.57Å; R21-D92 IonicContact NE-OD1 3.27Å; R21-D92 VanDerWaalsContact NH2-CG 3.3Å; R21-D92 IonicContact NH2-OD1 3.36Å; R21-D92 PolarHBondContact NH2-OD1 2.98Å; R21-D92 IonicContact NH2-OD2 3.85Å; R21-D92 PolarHBondContact NH2-OD2 2.85Å
22T93.9Very high96.1Very high143 Ų14379.2 Ų79.288%0.87742%0.423SS*.SBendtrans-90.7-37.1-178.2520000112.2
23S94.5Very high95.8Very high99 Ų9980.2 Ų80.269%0.69243%0.426SS*.SBendtrans-154.8146179.4-178.40000110.4C20C20-S23 CarbonylContact C-O 3.59Å; C20-S23 WeakPolarHBondContact CA-O 3.39Å
24G95.1Very high95.3Very high53 Ų5382.4 Ų82.455%0.54644%0.438SS..  trans110.9-174.9-179.400000113.1
25S95.5Very high94.7Very high96 Ų9681.4 Ų81.467%0.67144%0.435SS*.  trans-145.7140.6-179.9-61.30000109.2D62S25-D62 WeakPolarHBondContact O-CA 3.5Å
26V97.2Very high94.2Very high35 Ų3578.9 Ų78.921%0.21243%0.425CS..  trans-104.5116.4174.8-177.90000108L13 L16 F17 C20 I28 S61L13-V26 HydrophobicContact CD1-CG1 4.4Å; L16-V26 HydrophobicContact CB-CG2 4.41Å; F17-V26 HydrophobicContact CD1-CG2 4.28Å; F17-V26 HydrophobicContact CE1-CB 4.32Å; C20-V26 HydrophobicContact CB-CG2 3.79Å; V26-I28 HydrophobicContact CG1-CG1 4.14Å; V26-S61 WeakPolarHBondContact CA-O 3.34Å
27A97.5Very high93.6Very high62 Ų6284.5 Ų84.551%0.51246%0.46SS..EExtended strand (participates in β ladder)trans-95.6125174.300000109.7A60 S61A27-A60 CarbonylContact O-C 3.51Å; A27-A60 VanDerWaalsContact O-CA 3.27Å; A27-A60 WeakPolarHBondContact O-CA 3.29Å; A27-S61 PolarHBondContact N-O 3.33Å; A27-S61 PolarHBondContact O-N 3.27Å
28I97.6Very high93Very high53 Ų5391 Ų9127%0.27249%0.488SS..EExtended strand (participates in β ladder)trans-117134.1175-51.9175.5000108.9L13 F17 V26 I58 R59 A60 Y83 L87L13-I28 HydrophobicContact CD1-CD1 4.01Å; L13-I28 HydrophobicContact CD1-CG1 4.43Å; L13-I28 HydrophobicContact CD2-CD1 4.37Å; F17-I28 HydrophobicContact CE2-CD1 4.27Å; F17-I28 HydrophobicContact CZ-CD1 3.93Å; V26-I28 HydrophobicContact CG1-CG1 4.14Å; I28-I58 HydrophobicContact CG2-CG2 4.08Å; I28-R59 CarbonylContact C-O 3.59Å; I28-R59 VanDerWaalsContact CA-O 3.29Å; I28-R59 WeakPolarHBondContact CA-O 3.16Å; I28-A60 HydrophobicContact CG1-CB 4.14Å; I28-Y83 WeakPolarHBondContact CG2-OH 3.39Å; I28-L87 HydrophobicContact CD1-CD2 4.02Å
29T97.7Very high92.4Very high61 Ų6190.9 Ų90.937%0.37450%0.498SS..EExtended strand (participates in β ladder)trans-127.8142.6176.365.50000110.5I58 R59T29-I58 CarbonylContact O-C 3.58Å; T29-I58 WeakPolarHBondContact O-CA 3.47Å; T29-R59 PolarHBondContact N-O 3.47Å; T29-R59 PolarHBondContact O-N 3.36Å; T29-R59 PolarHBondContact OG1-NE 3.1Å; T29-R59 VanDerWaalsContact OG1-NE 3.15Å
30L96.3Very high91.7Very high124 Ų12489 Ų8965%0.64950%0.497SS*.EExtended strand (participates in β ladder)trans-124129.5175.9173.470.3000108.1C56 L57 I58L30-C56 HydrophobicContact CD1-CB 3.78Å; L30-L57 WeakPolarHBondContact CA-O 3.5Å; L30-I58 HydrophobicContact CD1-CD1 4.15Å; L30-I58 HydrophobicContact CD1-CG1 3.52Å
31K94.8Very high91.1Very high142 Ų14290.7 Ų90.762%0.61751%0.507SS*.EExtended strand (participates in β ladder)trans-140.4144.6177.6-166.2178.5175.4177.60110.5Y33 C56 L57K31-Y33 PolarHBondContact O-N 3.38Å; K31-C56 CarbonylContact O-C 3.53Å; K31-C56 WeakPolarHBondContact O-CA 3.38Å; K31-L57 PolarHBondContact N-O 3.35Å; K31-L57 PolarHBondContact O-N 2.82Å
32K92.4Very high90.6Very high152 Ų15292.8 Ų92.866%0.66152%0.52SS*.EExtended strand (participates in β ladder)trans-55.7132.3166.6-173.7179.7180-174.20108.5
33Y91.4Very high89.8Confident51 Ų5196.5 Ų96.520%0.252%0.524CS..EExtended strand (participates in β ladder)trans-117.5123.8-179.6-174.7-125.3000109K31 G35 R36 K55 L57 V70K31-Y33 PolarHBondContact O-N 3.38Å; Y33-G35 VanDerWaalsContact C-N 3.33Å; Y33-G35 VanDerWaalsContact CE1-CA 3.44Å; Y33-R36 PolarHBondContact OH-O 3.27Å; Y33-K55 HydrophobicContact CD1-CB 4.41Å; Y33-K55 PolarHBondContact N-O 3.29Å; Y33-L57 HydrophobicContact CD2-CB 4.3Å; Y33-L57 HydrophobicContact CD2-CD2 4.43Å; Y33-L57 HydrophobicContact CG-CB 4.06Å; Y33-V70 HydrophobicContact CD1-CB 4.43Å; Y33-V70 HydrophobicContact CD1-CG1 3.77Å; Y33-V70 HydrophobicContact CD1-CG2 3.69Å; Y33-V70 HydrophobicContact CE1-CG1 4.24Å; Y33-V70 HydrophobicContact CE1-CG2 3.68Å
34D87.3Confident88.8Confident46 Ų4695.7 Ų95.725%0.24653%0.531CS..  trans-87.9-3.7-179.652.28.9000112.2R36 F49 A52D34-R36 HydrophobicContact CB-CG 4.47Å; D34-R36 WeakPolarHBondContact OD1-CB 3.27Å; D34-R36 WeakPolarHBondContact OD1-CG 3.5Å; D34-R36 PolarHBondContact OD1-N 2.83Å; D34-R36 WeakPolarHBondContact OD2-CD 3.25Å; D34-R36 IonicContact OD2-CZ 3.46Å; D34-R36 VanDerWaalsContact OD2-CZ 3.27Å; D34-R36 IonicContact OD2-NE 3.77Å; D34-R36 PolarHBondContact OD2-NE 3.17Å; D34-R36 IonicContact OD2-NH1 2.96Å; D34-R36 PolarHBondContact OD2-NH1 3.43Å; D34-F49 WeakPolarHBondContact O-CE1 3.41Å; D34-F49 WeakPolarHBondContact O-CZ 3.31Å; D34-A52 PolarHBondContact O-N 3.37Å
35G85.1Confident87.5Confident14 Ų1499.6 Ų99.614%0.14454%0.535CS..  trans88.21.9-178.600000114.4Y33 T37 F49Y33-G35 VanDerWaalsContact C-N 3.33Å; Y33-G35 VanDerWaalsContact CE1-CA 3.44Å; G35-T37 PolarHBondContact O-N 3.37Å; G35-F49 WeakPolarHBondContact O-CE2 3.34Å; G35-F49 WeakPolarHBondContact O-CZ 3.35Å
36R84.6Confident86.1Confident89 Ų89100.4 Ų100.434%0.33654%0.538SS..  trans-67.5126.3-176.6-70.5-179.6178.7149.9-14.9111.7Y33 D34 E47 F49Y33-R36 PolarHBondContact OH-O 3.27Å; D34-R36 HydrophobicContact CB-CG 4.47Å; D34-R36 WeakPolarHBondContact OD1-CB 3.27Å; D34-R36 WeakPolarHBondContact OD1-CG 3.5Å; D34-R36 PolarHBondContact OD1-N 2.83Å; D34-R36 WeakPolarHBondContact OD2-CD 3.25Å; D34-R36 IonicContact OD2-CZ 3.46Å; D34-R36 VanDerWaalsContact OD2-CZ 3.27Å; D34-R36 IonicContact OD2-NE 3.77Å; D34-R36 PolarHBondContact OD2-NE 3.17Å; D34-R36 IonicContact OD2-NH1 2.96Å; D34-R36 PolarHBondContact OD2-NH1 3.43Å; R36-E47 IonicContact NH2-OE1 3.91Å; R36-F49 HydrophobicContact CB-CE1 4.29Å; R36-F49 HydrophobicContact CG-CD1 3.42Å; R36-F49 VanDerWaalsContact CG-CD1 3.42Å; R36-F49 HydrophobicContact CG-CE1 3.29Å; R36-F49 HydrophobicContact CG-CG 4.14Å; R36-F49 HydrophobicContact CG-CZ 3.97Å
37T84.6Confident84.6Confident121 Ų121105.2 Ų105.274%0.74256%0.558SS**  trans-103.8-10.717357.60000113G35G35-T37 PolarHBondContact O-N 3.37Å
38K84.4Confident83.1Confident166 Ų166108 Ų10872%0.72257%0.573SS**SBendtrans-126.6153.9-179.7-64.4-178.6-177177.40110.4
39P84.6Confident81.6Confident119 Ų119108.5 Ų108.577%0.77357%0.574SS**PPolyproline II helixtrans-58.3154.6173-21.933.2000112.3
40V81.5Confident80.3Confident86 Ų86113.6 Ų113.652%0.52159%0.593SS.*PPolyproline II helixtrans-65.1128.5172.8-178.40000108.9
41P82.3Confident79Confident57 Ų57110.9 Ų110.937%0.3758%0.583SS.*PPolyproline II helixtrans-59.1153.7178.1-2131.1000112.5H45P41-H45 HydrophobicContact CB-CB 3.83Å
42K83.7Confident77.9Confident180 Ų180105.5 Ų105.578%0.78357%0.565SS**PPolyproline II helixtrans-65.9150170.2-66.5-178.6-179.5177.40109.8G44 H45K42-G44 PolarHBondContact O-N 2.95Å; K42-H45 PolarHBondContact O-N 3.42Å
43K77.7Confident76.9Confident221 Ų221103.9 Ų103.996%0.96156%0.564SS**THydrogen-bonded Turntrans-47.1125.8175.7-86.7-174173.9-177.10110.3
44G73.1Confident76.5Confident81 Ų81106.3 Ų106.384%0.83558%0.58SS**THydrogen-bonded Turntrans109.9-8.9-18000000115.1K42K42-G44 PolarHBondContact O-N 2.95Å
45H68.9Low76.8Confident135 Ų135108 Ų10863%0.62559%0.585SS**SBendtrans-102141.4169.4-69.5-71.4000111.1P41 K42 E47P41-H45 HydrophobicContact CB-CB 3.83Å; K42-H45 PolarHBondContact O-N 3.42Å; H45-E47 PolarHBondContact O-N 2.94Å
46P65.6Low77.2Confident114 Ų114109 Ų10974%0.7459%0.59SS**  trans-61.9132.1179.223.5-31.5000110.9S48P46-S48 PolarHBondContact O-N 3.38Å
47E66.5Low77.7Confident135 Ų135106.2 Ų106.263%0.63158%0.581SS**  trans-68.6109.7169.7-79.1-165.6117.800108.5R36 H45 F49R36-E47 IonicContact NH2-OE1 3.91Å; H45-E47 PolarHBondContact O-N 2.94Å; E47-F49 VanDerWaalsContact C-N 3.28Å; E47-F49 PolarHBondContact O-N 3.4Å
48S64.4Low78.3Confident120 Ų120100.9 Ų100.984%0.83955%0.548SS*.  trans-89.812-178.876.50000113.2P46P46-S48 PolarHBondContact O-N 3.38Å
49F66.9Low79Confident65 Ų6597.2 Ų97.229%0.28553%0.53SS..  trans-130.1111.7-165.9-177.2-97.4000112D34 G35 R36 E47 P51D34-F49 WeakPolarHBondContact O-CE1 3.41Å; D34-F49 WeakPolarHBondContact O-CZ 3.31Å; G35-F49 WeakPolarHBondContact O-CE2 3.34Å; G35-F49 WeakPolarHBondContact O-CZ 3.35Å; R36-F49 HydrophobicContact CB-CE1 4.29Å; R36-F49 HydrophobicContact CG-CD1 3.42Å; R36-F49 VanDerWaalsContact CG-CD1 3.42Å; R36-F49 HydrophobicContact CG-CE1 3.29Å; R36-F49 HydrophobicContact CG-CG 4.14Å; R36-F49 HydrophobicContact CG-CZ 3.97Å; E47-F49 VanDerWaalsContact C-N 3.28Å; E47-F49 PolarHBondContact O-N 3.4Å; F49-P51 WeakPolarHBondContact O-CD 3.37Å
50E69.9Low79.6Confident167 Ų16791.6 Ų91.678%0.7849%0.494SS*.  trans-75.7119.7167.8-71-59.3133.900109.7A52E50-A52 PolarHBondContact O-N 3.19Å; E50-A52 VanDerWaalsContact O-N 3.15Å
51P70.3Confident80.4Confident68 Ų6888.6 Ų88.644%0.44248%0.476SS..  trans-56.4120.2176.3-22.533.2000111.1F49 D53F49-P51 WeakPolarHBondContact O-CD 3.37Å; P51-D53 PolarHBondContact O-N 3.42Å
52A70.2Confident81Confident28 Ų2887.1 Ų87.123%0.23147%0.465CS..  trans-67.8110170.400000108.2D34 E50 K55D34-A52 PolarHBondContact O-N 3.37Å; E50-A52 PolarHBondContact O-N 3.19Å; E50-A52 VanDerWaalsContact O-N 3.15Å; A52-K55 HydrophobicContact CB-CD 4.19Å
53D71.4Confident81.5Confident118 Ų11881.3 Ų81.363%0.63146%0.457SS*.THydrogen-bonded Turntrans-68.8138.4179.8-92.8-30.8000111.7P51P51-D53 PolarHBondContact O-N 3.42Å
54N84.3Confident82.2Confident103 Ų10379.7 Ų79.755%0.55145%0.45SS*.THydrogen-bonded Turntrans66.641.8167.6-51-48.8000117T73N54-T73 HydrophobicContact CB-CG2 3.49Å; N54-T73 VanDerWaalsContact CB-CG2 3.49Å; N54-T73 WeakPolarHBondContact O-CG2 3.35Å
55K92.3Very high83.2Confident81 Ų8180.3 Ų80.335%0.35243%0.429SS..EExtended strand (participates in β ladder)trans-106.7153.8165.1-61.8-179.4-176.5177.70111.6Y33 A52 V70 V71Y33-K55 HydrophobicContact CD1-CB 4.41Å; Y33-K55 PolarHBondContact N-O 3.29Å; A52-K55 HydrophobicContact CB-CD 4.19Å; K55-V70 HydrophobicContact CB-CG1 4.04Å; K55-V70 HydrophobicContact CD-CG1 4.01Å; K55-V70 HydrophobicContact CG-CG1 4.42Å; K55-V71 WeakPolarHBondContact CA-O 3.37Å
56C94.1Very high84.6Confident34 Ų3478.9 Ų78.923%0.2342%0.422CS..EExtended strand (participates in β ladder)trans-126.3142.4169.467.10000111.4L30 K31 V70 V71L30-C56 HydrophobicContact CD1-CB 3.78Å; K31-C56 CarbonylContact O-C 3.53Å; K31-C56 WeakPolarHBondContact O-CA 3.38Å; C56-V70 CarbonylContact O-C 3.59Å; C56-V70 WeakPolarHBondContact O-CA 3.45Å; C56-V71 PolarHBondContact N-O 2.81Å; C56-V71 PolarHBondContact O-N 3.31Å
57L95.6Very high86.1Confident31 Ų3173.6 Ų73.616%0.16239%0.387CS..EExtended strand (participates in β ladder)trans-102.3123.6175.6176.568.2000108.4L30 K31 Y33 R59 V70L30-L57 WeakPolarHBondContact CA-O 3.5Å; K31-L57 PolarHBondContact N-O 3.35Å; K31-L57 PolarHBondContact O-N 2.82Å; Y33-L57 HydrophobicContact CD2-CB 4.3Å; Y33-L57 HydrophobicContact CD2-CD2 4.43Å; Y33-L57 HydrophobicContact CG-CB 4.06Å; L57-R59 HydrophobicContact CD1-CG 4.45Å; L57-R59 HydrophobicContact CD2-CG 4.26Å; L57-R59 HydrophobicContact CG-CG 4.01Å; L57-V70 HydrophobicContact CD1-CG2 3.83Å
58I97.6Very high87.6Confident9 Ų967.5 Ų67.55%0.04636%0.359CS..EExtended strand (participates in β ladder)trans-108.1134.2174.3-56.7174.9000108F9 I28 T29 L30 S68 T69 V71 F79F9-I58 HydrophobicContact CE1-CG2 3.97Å; F9-I58 HydrophobicContact CE2-CG2 4.47Å; F9-I58 HydrophobicContact CZ-CB 4.31Å; F9-I58 HydrophobicContact CZ-CG2 3.6Å; I28-I58 HydrophobicContact CG2-CG2 4.08Å; T29-I58 CarbonylContact O-C 3.58Å; T29-I58 WeakPolarHBondContact O-CA 3.47Å; L30-I58 HydrophobicContact CD1-CD1 4.15Å; L30-I58 HydrophobicContact CD1-CG1 3.52Å; I58-S68 CarbonylContact O-C 3.57Å; I58-S68 WeakPolarHBondContact O-CA 3.35Å; I58-S68 WeakPolarHBondContact O-CB 3.37Å; I58-T69 HydrophobicContact CB-CG2 4.21Å; I58-T69 PolarHBondContact N-O 2.89Å; I58-T69 PolarHBondContact O-N 3.01Å; I58-V71 HydrophobicContact CD1-CG2 3.87Å; I58-F79 HydrophobicContact CD1-CD1 4.23Å; I58-F79 HydrophobicContact CD1-CE1 3.3Å; I58-F79 HydrophobicContact CD1-CZ 3.65Å
59R98Very high89.2Confident89 Ų8961.9 Ų61.934%0.33632%0.32SS..EExtended strand (participates in β ladder)trans-131.5137177.8-51.7176.6-72.1-175.9-2.3109.7M1 I28 T29 L57 I67M1-R59 HydrophobicContact CE-CB 4.24Å; M1-R59 HydrophobicContact CE-CG 4.25Å; M1-R59 HydrophobicContact SD-CG 4.39Å; I28-R59 CarbonylContact C-O 3.59Å; I28-R59 VanDerWaalsContact CA-O 3.29Å; I28-R59 WeakPolarHBondContact CA-O 3.16Å; T29-R59 PolarHBondContact N-O 3.47Å; T29-R59 PolarHBondContact O-N 3.36Å; T29-R59 PolarHBondContact OG1-NE 3.1Å; T29-R59 VanDerWaalsContact OG1-NE 3.15Å; L57-R59 HydrophobicContact CD1-CG 4.45Å; L57-R59 HydrophobicContact CD2-CG 4.26Å; L57-R59 HydrophobicContact CG-CG 4.01Å; R59-I67 WeakPolarHBondContact CA-O 3.48Å
60A98.1Very high90.6Very high2 Ų260.2 Ų60.22%0.01732%0.315CS..EExtended strand (participates in β ladder)trans-129.5145.1175.400000111.3F9 L13 L16 A27 I28 I67F9-A60 HydrophobicContact CE2-CB 4.33Å; F9-A60 HydrophobicContact CZ-CB 4.13Å; L13-A60 HydrophobicContact CD1-CB 3.7Å; L16-A60 HydrophobicContact CD1-CB 4.15Å; A27-A60 CarbonylContact O-C 3.51Å; A27-A60 VanDerWaalsContact O-CA 3.27Å; A27-A60 WeakPolarHBondContact O-CA 3.29Å; I28-A60 HydrophobicContact CG1-CB 4.14Å; A60-I67 HydrophobicContact CB-CD1 4.25Å; A60-I67 HydrophobicContact CB-CG1 3.9Å; A60-I67 PolarHBondContact N-O 2.71Å; A60-I67 PolarHBondContact O-N 2.87Å
61S97.4Very high91.8Very high22 Ų2252.4 Ų52.415%0.15428%0.279CS..EExtended strand (participates in β ladder)trans-154.5138.6-176.6174.30000112.5V26 A27 G63 K65V26-S61 WeakPolarHBondContact CA-O 3.34Å; A27-S61 PolarHBondContact N-O 3.33Å; A27-S61 PolarHBondContact O-N 3.27Å; S61-G63 VanDerWaalsContact C-N 3.31Å; S61-G63 PolarHBondContact OG-N 2.97Å; S61-K65 VanDerWaalsContact CA-O 3.27Å; S61-K65 WeakPolarHBondContact CA-O 3.37Å
62D95.4Very high92.9Very high26 Ų2650.3 Ų50.314%0.13927%0.265CS..SBendtrans-91.78.716767.8-6.1000112.9L16 K19 C20 S25 K64 K65L16-D62 HydrophobicContact CD2-CB 3.93Å; K19-D62 IonicContact NZ-OD2 2.73Å; K19-D62 PolarHBondContact NZ-OD2 2.94Å; C20-D62 WeakPolarHBondContact SG-CB 3.09Å; S25-D62 WeakPolarHBondContact O-CA 3.5Å; D62-K64 VanDerWaalsContact C-N 3.32Å; D62-K64 WeakPolarHBondContact OD1-CA 3.38Å; D62-K64 PolarHBondContact OD1-N 3.41Å; D62-K65 PolarHBondContact N-O 2.9Å; D62-K65 PolarHBondContact OD1-N 2.99Å
63G93.8Very high94Very high59 Ų5953.1 Ų53.161%0.60828%0.28SS*.SBendtrans94.7-23.8-173.400000113.1S61S61-G63 VanDerWaalsContact C-N 3.31Å; S61-G63 PolarHBondContact OG-N 2.97Å
64K92Very high94.9Very high186 Ų18656.9 Ų56.981%0.80929%0.291SS*.SBendtrans-107.5-63.2178.7-62.2177.4-178.4179.70110.6D62D62-K64 VanDerWaalsContact C-N 3.32Å; D62-K64 WeakPolarHBondContact OD1-CA 3.38Å; D62-K64 PolarHBondContact OD1-N 3.41Å
65K95.1Very high95.3Very high94 Ų9455.6 Ų55.641%0.40928%0.281SS..  trans-86.6130.3179-170.6176.1-172.1178.30109.8E12 L16 S61 D62E12-K65 WeakPolarHBondContact OE2-CE 3.14Å; E12-K65 IonicContact OE2-NZ 2.58Å; E12-K65 PolarHBondContact OE2-NZ 2.81Å; L16-K65 HydrophobicContact CD2-CB 4.28Å; L16-K65 HydrophobicContact CD2-CD 4.47Å; S61-K65 VanDerWaalsContact CA-O 3.27Å; S61-K65 WeakPolarHBondContact CA-O 3.37Å; D62-K65 PolarHBondContact N-O 2.9Å; D62-K65 PolarHBondContact OD1-N 2.99Å
66K97.7Very high95.4Very high106 Ų10654.6 Ų54.646%0.46128%0.282SS..EExtended strand (participates in β ladder)trans-122.7116.4-179.6-62.2-179.3-177.3177.10110.6M1 V2M1-K66 WeakPolarHBondContact CA-O 3.37Å; M1-K66 HydrophobicContact CB-CB 4.09Å; M1-K66 HydrophobicContact CE-CB 4.13Å; M1-K66 HydrophobicContact CE-CD 4.32Å; M1-K66 HydrophobicContact CG-CB 4.22Å; V2-K66 PolarHBondContact N-O 2.58Å
67I98.2Very high95.5Very high3 Ų358.7 Ų58.72%0.01530%0.3CS..EExtended strand (participates in β ladder)trans-115153.3175.661.6173.5000110.4V2 L4 F9 E12 L13 L16 R59 A60V2-I67 CarbonylContact O-C 3.5Å; L4-I67 HydrophobicContact CD1-CB 4.1Å; L4-I67 HydrophobicContact CD1-CG2 3.98Å; F9-I67 HydrophobicContact CD2-CB 4.35Å; F9-I67 HydrophobicContact CD2-CD1 3.94Å; F9-I67 HydrophobicContact CD2-CG1 4.06Å; F9-I67 HydrophobicContact CE2-CB 4.42Å; F9-I67 HydrophobicContact CE2-CD1 3.88Å; F9-I67 HydrophobicContact CE2-CG1 3.77Å; E12-I67 HydrophobicContact CB-CD1 3.71Å; E12-I67 HydrophobicContact CB-CG2 4.34Å; L13-I67 HydrophobicContact CB-CD1 4.32Å; L16-I67 HydrophobicContact CD1-CD1 3.67Å; L16-I67 HydrophobicContact CD1-CG1 3.9Å; R59-I67 WeakPolarHBondContact CA-O 3.48Å; A60-I67 HydrophobicContact CB-CD1 4.25Å; A60-I67 HydrophobicContact CB-CG1 3.9Å; A60-I67 PolarHBondContact N-O 2.71Å; A60-I67 PolarHBondContact O-N 2.87Å
68S97.9Very high95.5Very high7 Ų763.1 Ų63.15%0.04932%0.318CS..EExtended strand (participates in β ladder)trans-149.2152.9179.355.90000111.3V2 L3 L4 I58V2-S68 PolarHBondContact O-N 2.95Å; V2-S68 PolarHBondContact O-OG 2.73Å; L3-S68 WeakPolarHBondContact CA-O 3.48Å; L4-S68 PolarHBondContact N-O 3.46Å; I58-S68 CarbonylContact O-C 3.57Å; I58-S68 WeakPolarHBondContact O-CA 3.35Å; I58-S68 WeakPolarHBondContact O-CB 3.37Å
69T97.7Very high95.4Very high1 Ų163.3 Ų63.31%0.00632%0.319CS..EExtended strand (participates in β ladder)trans-145.3151.8172.4-162.50000110.1L4 N6 F9 I58 V71 F79L4-T69 WeakPolarHBondContact O-CB 3.28Å; L4-T69 PolarHBondContact O-OG1 3.17Å; N6-T69 PolarHBondContact ND2-OG1 3.45Å; F9-T69 HydrophobicContact CB-CG2 3.86Å; F9-T69 HydrophobicContact CD1-CG2 3.61Å; F9-T69 HydrophobicContact CD2-CG2 3.78Å; F9-T69 HydrophobicContact CE1-CG2 4.09Å; F9-T69 HydrophobicContact CE2-CG2 4.23Å; F9-T69 HydrophobicContact CG-CG2 3.45Å; F9-T69 VanDerWaalsContact CG-CG2 3.45Å; F9-T69 HydrophobicContact CZ-CG2 4.39Å; I58-T69 HydrophobicContact CB-CG2 4.21Å; I58-T69 PolarHBondContact N-O 2.89Å; I58-T69 PolarHBondContact O-N 3.01Å; T69-V71 HydrophobicContact CG2-CG2 4.21Å; T69-F79 HydrophobicContact CG2-CE2 4.12Å; T69-F79 HydrophobicContact CG2-CZ 4.21Å
70V95.9Very high95.4Very high31 Ų3165 Ų6519%0.18833%0.33CS..EExtended strand (participates in β ladder)trans-105.4128.8173.6175.30000107.4L3 N6 Y33 K55 C56 L57L3-V70 HydrophobicContact CD1-CG2 4.04Å; N6-V70 PolarHBondContact ND2-O 3.47Å; Y33-V70 HydrophobicContact CD1-CB 4.43Å; Y33-V70 HydrophobicContact CD1-CG1 3.77Å; Y33-V70 HydrophobicContact CD1-CG2 3.69Å; Y33-V70 HydrophobicContact CE1-CG1 4.24Å; Y33-V70 HydrophobicContact CE1-CG2 3.68Å; K55-V70 HydrophobicContact CB-CG1 4.04Å; K55-V70 HydrophobicContact CD-CG1 4.01Å; K55-V70 HydrophobicContact CG-CG1 4.42Å; C56-V70 CarbonylContact O-C 3.59Å; C56-V70 WeakPolarHBondContact O-CA 3.45Å; L57-V70 HydrophobicContact CD1-CG2 3.83Å
71V95.6Very high95.3Very high3 Ų370.3 Ų70.32%0.01836%0.356CS..EExtended strand (participates in β ladder)trans-110.9125.4176.9-175.10000108K55 C56 I58 T69 V76 F79K55-V71 WeakPolarHBondContact CA-O 3.37Å; C56-V71 PolarHBondContact N-O 2.81Å; C56-V71 PolarHBondContact O-N 3.31Å; I58-V71 HydrophobicContact CD1-CG2 3.87Å; T69-V71 HydrophobicContact CG2-CG2 4.21Å; V71-V76 HydrophobicContact CG1-CB 4.27Å; V71-V76 HydrophobicContact CG1-CG2 4.41Å; V71-F79 HydrophobicContact CG1-CB 4.12Å; V71-F79 HydrophobicContact CG1-CD1 4.42Å; V71-F79 HydrophobicContact CG1-CG 4.23Å; V71-F79 HydrophobicContact CG2-CD1 3.91Å; V71-F79 HydrophobicContact CG2-CD2 4.03Å; V71-F79 HydrophobicContact CG2-CE1 4.02Å; V71-F79 HydrophobicContact CG2-CE2 4.12Å; V71-F79 HydrophobicContact CG2-CG 3.92Å; V71-F79 HydrophobicContact CG2-CZ 4.12Å
72S93.8Very high95.3Very high23 Ų2371.2 Ų71.216%0.16137%0.365CS..EExtended strand (participates in β ladder)trans-94.6167.1173.570.50000111.7K74 E75 V76S72-K74 PolarHBondContact O-N 3.4Å; S72-E75 WeakPolarHBondContact CB-OE1 3.5Å; S72-E75 PolarHBondContact N-OE1 3.43Å; S72-E75 PolarHBondContact O-N 3.38Å; S72-E75 WeakPolarHBondContact OG-CG 3.37Å; S72-E75 PolarHBondContact OG-OE1 3.04Å; S72-V76 PolarHBondContact O-N 3.4Å
73T91.8Very high95.4Very high88 Ų8872.4 Ų72.454%0.5437%0.368SS..THydrogen-bonded Turntrans-57-29.5176.848.80000113.8N54 E75 V76N54-T73 HydrophobicContact CB-CG2 3.49Å; N54-T73 VanDerWaalsContact CB-CG2 3.49Å; N54-T73 WeakPolarHBondContact O-CG2 3.35Å; T73-E75 VanDerWaalsContact C-N 3.32Å; T73-E75 PolarHBondContact O-N 3.14Å; T73-V76 WeakPolarHBondContact O-CG1 3.11Å
74K91.9Very high95.6Very high196 Ų19671.2 Ų71.285%0.85235%0.351SS*.THydrogen-bonded Turntrans-68.9-31.4-176.8-63.5-176.1179.3-177.50113.1S72S72-K74 PolarHBondContact O-N 3.4Å
75E92.1Very high95.9Very high76 Ų7667.1 Ų67.136%0.35534%0.337SS..THydrogen-bonded Turntrans-112.3-4.5-169.325.2179-175.500111.7N6 S72 T73 I77 K78 F79N6-E75 PolarHBondContact OD1-OE2 2.97Å; S72-E75 WeakPolarHBondContact CB-OE1 3.5Å; S72-E75 PolarHBondContact N-OE1 3.43Å; S72-E75 PolarHBondContact O-N 3.38Å; S72-E75 WeakPolarHBondContact OG-CG 3.37Å; S72-E75 PolarHBondContact OG-OE1 3.04Å; T73-E75 VanDerWaalsContact C-N 3.32Å; T73-E75 PolarHBondContact O-N 3.14Å; E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.21Å; E75-K78 PolarHBondContact O-N 2.84Å; E75-F79 WeakPolarHBondContact O-CB 3.12Å; E75-F79 PolarHBondContact O-N 2.96Å
76V93.9Very high96Very high61 Ų6163.4 Ų63.437%0.3732%0.322SS..Hα-helixtrans-57.6-39.1-17674.90000113.1V71 S72 T73 F79 Q80V71-V76 HydrophobicContact CG1-CB 4.27Å; V71-V76 HydrophobicContact CG1-CG2 4.41Å; S72-V76 PolarHBondContact O-N 3.4Å; T73-V76 WeakPolarHBondContact O-CG1 3.11Å; V76-F79 PolarHBondContact O-N 2.96Å; V76-Q80 WeakPolarHBondContact O-CB 3.13Å; V76-Q80 PolarHBondContact O-N 2.86Å
77I95.6Very high95.9Very high119 Ų11960.2 Ų60.261%0.6131%0.31SS*.Hα-helixtrans-67.7-48.3-177.4-61.1174.4000110.2E75 Q80 M81E75-I77 VanDerWaalsContact C-N 3.3Å; E75-I77 PolarHBondContact O-N 3.21Å; I77-Q80 PolarHBondContact O-N 3.14Å; I77-M81 HydrophobicContact CG2-CE 4.23Å; I77-M81 WeakPolarHBondContact O-CG 3.46Å; I77-M81 PolarHBondContact O-N 2.89Å
78K95.6Very high95.8Very high125 Ų12568.8 Ų68.854%0.54334%0.342SS..Hα-helixtrans-60.8-48.9176.5-176.4-170.9171.9-157.90110.2D7 E75 Q80 M81 A82D7-K78 IonicContact OD1-NZ 3.28Å; D7-K78 PolarHBondContact OD1-NZ 3.49Å; D7-K78 IonicContact OD2-NZ 2.78Å; D7-K78 PolarHBondContact OD2-NZ 3.38Å; E75-K78 PolarHBondContact O-N 2.84Å; K78-Q80 PolarHBondContact O-N 3.38Å; K78-M81 PolarHBondContact O-N 3.16Å; K78-A82 PolarHBondContact O-N 3.15Å
79F96.8Very high95.8Very high13 Ų1371.4 Ų71.46%0.05736%0.364CS..Hα-helixtrans-61.2-45.3-179.4-173.5-89.6000111.7N6 F9 L10 I58 T69 V71 E75 V76 M81 A82 Y83N6-F79 HydrophobicContact CB-CD2 3.9Å; N6-F79 HydrophobicContact CB-CE2 4.32Å; F9-F79 HydrophobicContact CD1-CE2 4.12Å; F9-F79 HydrophobicContact CD1-CZ 4.01Å; F9-F79 HydrophobicContact CE1-CZ 4.13Å; L10-F79 HydrophobicContact CD1-CD2 4.31Å; L10-F79 HydrophobicContact CD1-CE2 4.3Å; L10-F79 HydrophobicContact CD2-CE2 3.93Å; L10-F79 HydrophobicContact CD2-CZ 4.06Å; L10-F79 HydrophobicContact CG-CD2 4.49Å; L10-F79 HydrophobicContact CG-CE2 3.99Å; I58-F79 HydrophobicContact CD1-CD1 4.23Å; I58-F79 HydrophobicContact CD1-CE1 3.3Å; I58-F79 HydrophobicContact CD1-CZ 3.65Å; T69-F79 HydrophobicContact CG2-CE2 4.12Å; T69-F79 HydrophobicContact CG2-CZ 4.21Å; V71-F79 HydrophobicContact CG1-CB 4.12Å; V71-F79 HydrophobicContact CG1-CD1 4.42Å; V71-F79 HydrophobicContact CG1-CG 4.23Å; V71-F79 HydrophobicContact CG2-CD1 3.91Å; V71-F79 HydrophobicContact CG2-CD2 4.03Å; V71-F79 HydrophobicContact CG2-CE1 4.02Å; V71-F79 HydrophobicContact CG2-CE2 4.12Å; V71-F79 HydrophobicContact CG2-CG 3.92Å; V71-F79 HydrophobicContact CG2-CZ 4.12Å; E75-F79 WeakPolarHBondContact O-CB 3.12Å; E75-F79 PolarHBondContact O-N 2.96Å; V76-F79 PolarHBondContact O-N 2.96Å; F79-M81 PolarHBondContact O-N 2.86Å; F79-A82 PolarHBondContact O-N 3.45Å; F79-Y83 HydrophobicContact CE1-CD1 4.37Å; F79-Y83 HydrophobicContact CE1-CD2 4.11Å; F79-Y83 AromaticContact CE1-CG 3.84Å; F79-Y83 HydrophobicContact CE1-CG 3.84Å; F79-Y83 HydrophobicContact CZ-CD2 4.23Å; F79-Y83 HydrophobicContact CZ-CG 4.39Å; F79-Y83 WeakPolarHBondContact O-CB 3.36Å; F79-Y83 PolarHBondContact O-N 2.91Å
80Q96.4Very high95.7Very high123 Ų12373.8 Ų73.858%0.57538%0.375SS*.Hα-helixtrans-59.4-45.9-179-180-164.6-23.800111.9V76 I77 K78 S84V76-Q80 WeakPolarHBondContact O-CB 3.13Å; V76-Q80 PolarHBondContact O-N 2.86Å; I77-Q80 PolarHBondContact O-N 3.14Å; K78-Q80 PolarHBondContact O-N 3.38Å; Q80-S84 WeakPolarHBondContact O-CB 3.42Å; Q80-S84 PolarHBondContact O-N 3.28Å
81M97Very high95.6Very high114 Ų11476.4 Ų76.456%0.56239%0.387SS*.Hα-helixtrans-61.3-49.4-180-70.5-172.4-6800111.2I77 K78 F79 N85I77-M81 HydrophobicContact CG2-CE 4.23Å; I77-M81 WeakPolarHBondContact O-CG 3.46Å; I77-M81 PolarHBondContact O-N 2.89Å; K78-M81 PolarHBondContact O-N 3.16Å; F79-M81 PolarHBondContact O-N 2.86Å; M81-N85 VanDerWaalsContact O-CG 3.28Å; M81-N85 PolarHBondContact O-N 2.68Å; M81-N85 VanDerWaalsContact O-N 3.14Å; M81-N85 PolarHBondContact O-ND2 3.33Å
82A97.5Very high95.6Very high42 Ų4280.7 Ų80.735%0.34741%0.41SS..Hα-helixtrans-65.7-44.3179.600000112.1L10 K78 F79 N85 L86L10-A82 HydrophobicContact CD1-CB 3.61Å; K78-A82 PolarHBondContact O-N 3.15Å; F79-A82 PolarHBondContact O-N 3.45Å; A82-N85 PolarHBondContact O-N 3.49Å; A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.44Å
83Y97.8Very high95.4Very high50 Ų5082.5 Ų82.520%0.19643%0.433CS..Hα-helixtrans-63.3-43.3178.4-178.1-112.8000112.4L10 L13 I28 F79 L86 L87L10-Y83 HydrophobicContact CD2-CD2 4.04Å; L13-Y83 HydrophobicContact CD2-CD2 4.06Å; L13-Y83 HydrophobicContact CD2-CE2 3.68Å; I28-Y83 WeakPolarHBondContact CG2-OH 3.39Å; F79-Y83 HydrophobicContact CE1-CD1 4.37Å; F79-Y83 HydrophobicContact CE1-CD2 4.11Å; F79-Y83 AromaticContact CE1-CG 3.84Å; F79-Y83 HydrophobicContact CE1-CG 3.84Å; F79-Y83 HydrophobicContact CZ-CD2 4.23Å; F79-Y83 HydrophobicContact CZ-CG 4.39Å; F79-Y83 WeakPolarHBondContact O-CB 3.36Å; F79-Y83 PolarHBondContact O-N 2.91Å; Y83-L86 PolarHBondContact O-N 2.97Å; Y83-L87 HydrophobicContact CD1-CD1 4.05Å; Y83-L87 HydrophobicContact CE1-CD1 3.47Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.47Å; Y83-L87 HydrophobicContact CE1-CG 4.17Å; Y83-L87 HydrophobicContact CE2-CD1 4.31Å; Y83-L87 HydrophobicContact CE2-CD2 4.15Å; Y83-L87 HydrophobicContact CE2-CG 4.17Å; Y83-L87 WeakPolarHBondContact O-CG 3.44Å; Y83-L87 PolarHBondContact O-N 2.9Å
84S97.6Very high95.5Very high34 Ų3484.5 Ų84.524%0.23844%0.439CS..Hα-helixtrans-61.9-44.7176.9-177.20000112Q80 L87 R88Q80-S84 WeakPolarHBondContact O-CB 3.42Å; Q80-S84 PolarHBondContact O-N 3.28Å; S84-L87 PolarHBondContact O-N 3.27Å; S84-R88 WeakPolarHBondContact O-CG 3.03Å; S84-R88 PolarHBondContact O-N 3.23Å; S84-R88 PolarHBondContact OG-NH1 3.46Å
85N97.3Very high95.5Very high100 Ų10085.1 Ų85.154%0.53544%0.442SS..Hα-helixtrans-63.9-42.3177-70.7-14.1000111.5M81 A82 R88 A89M81-N85 VanDerWaalsContact O-CG 3.28Å; M81-N85 PolarHBondContact O-N 2.68Å; M81-N85 VanDerWaalsContact O-N 3.14Å; M81-N85 PolarHBondContact O-ND2 3.33Å; A82-N85 PolarHBondContact O-N 3.49Å; N85-R88 PolarHBondContact O-N 3.24Å; N85-A89 WeakPolarHBondContact O-CB 3.34Å; N85-A89 PolarHBondContact O-N 2.81Å
86L97.6Very high95.4Very high16 Ų1690.7 Ų90.78%0.08447%0.465CS..Hα-helixtrans-59.2-49.4175.9-174162.3000111.5L10 L13 T14 F17 A82 Y83 R88 A89 H90L10-L86 HydrophobicContact CB-CD1 4.22Å; L10-L86 HydrophobicContact CD2-CD1 4.06Å; L10-L86 WeakPolarHBondContact O-CD1 3.49Å; L13-L86 HydrophobicContact CB-CD1 4.35Å; L13-L86 HydrophobicContact CD2-CD1 4.22Å; L13-L86 HydrophobicContact CD2-CD2 3.79Å; L13-L86 HydrophobicContact CG-CD1 4.38Å; L13-L86 HydrophobicContact CG-CD2 3.93Å; T14-L86 WeakPolarHBondContact OG1-CD1 3.43Å; F17-L86 HydrophobicContact CD2-CD2 3.75Å; F17-L86 HydrophobicContact CE2-CD2 3.58Å; A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.44Å; Y83-L86 PolarHBondContact O-N 2.97Å; L86-R88 PolarHBondContact O-N 2.9Å; L86-A89 PolarHBondContact O-N 3.05Å; L86-H90 PolarHBondContact O-CD2 3.35Å; L86-H90 VanDerWaalsContact O-CD2 3.28Å; L86-H90 PolarHBondContact O-N 2.87Å; L86-H90 VanDerWaalsContact O-N 3.1Å
87L96.9Very high95Very high40 Ų4097.5 Ų97.521%0.20949%0.49CS..Hα-helixtrans-61-45.2179.3-70.2-177.6000111.9F17 I28 Y83 S84 A89 H90 I91F17-L87 HydrophobicContact CE2-CD2 4.16Å; F17-L87 HydrophobicContact CZ-CD2 3.96Å; I28-L87 HydrophobicContact CD1-CD2 4.02Å; Y83-L87 HydrophobicContact CD1-CD1 4.05Å; Y83-L87 HydrophobicContact CE1-CD1 3.47Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.47Å; Y83-L87 HydrophobicContact CE1-CG 4.17Å; Y83-L87 HydrophobicContact CE2-CD1 4.31Å; Y83-L87 HydrophobicContact CE2-CD2 4.15Å; Y83-L87 HydrophobicContact CE2-CG 4.17Å; Y83-L87 WeakPolarHBondContact O-CG 3.44Å; Y83-L87 PolarHBondContact O-N 2.9Å; S84-L87 PolarHBondContact O-N 3.27Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 3.06Å; L87-H90 PolarHBondContact O-N 3.2Å; L87-I91 HydrophobicContact CB-CD1 4.28Å; L87-I91 HydrophobicContact CD2-CD1 4.02Å; L87-I91 WeakPolarHBondContact O-CB 3.09Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.44Å; L87-I91 PolarHBondContact O-N 2.88Å
88R95.7Very high94.2Very high182 Ų18298.9 Ų98.969%0.68750%0.499SS*.Hα-helixtrans-63-36.6178.2-72.1175.1-174.8149.9-2.5112.5S84 N85 L86S84-R88 WeakPolarHBondContact O-CG 3.03Å; S84-R88 PolarHBondContact O-N 3.23Å; S84-R88 PolarHBondContact OG-NH1 3.46Å; N85-R88 PolarHBondContact O-N 3.24Å; L86-R88 PolarHBondContact O-N 2.9Å
89A96.4Very high93.2Very high63 Ų63102.7 Ų102.752%0.52152%0.515SS..Hα-helixtrans-71.6-33.6-179.900000113N85 L86 L87N85-A89 WeakPolarHBondContact O-CB 3.34Å; N85-A89 PolarHBondContact O-N 2.81Å; L86-A89 PolarHBondContact O-N 3.05Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-A89 PolarHBondContact O-N 3.06Å
90H96.1Very high91.8Very high51 Ų51111.8 Ų111.824%0.23655%0.554CS.*Hα-helixtrans-104-15.4-172.9-69.3-61.4000115.3F17 L86 L87 D92F17-H90 HydrophobicContact CB-CB 3.8Å; F17-H90 HydrophobicContact CD1-CB 3.94Å; F17-H90 HydrophobicContact CD2-CB 3.95Å; F17-H90 HydrophobicContact CE1-CB 4.49Å; F17-H90 HydrophobicContact CE2-CB 4.5Å; F17-H90 HydrophobicContact CG-CB 3.64Å; L86-H90 PolarHBondContact O-CD2 3.35Å; L86-H90 VanDerWaalsContact O-CD2 3.28Å; L86-H90 PolarHBondContact O-N 2.87Å; L86-H90 VanDerWaalsContact O-N 3.1Å; L87-H90 PolarHBondContact O-N 3.2Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 2.83Å
91I94.9Very high90Very high86 Ų86111 Ų11144%0.44156%0.563SS.*  trans-98.157.5173.9-51.3175.1000109F17 L87 L94F17-I91 HydrophobicContact CE1-CG1 4.13Å; F17-I91 HydrophobicContact CZ-CG1 4.36Å; L87-I91 HydrophobicContact CB-CD1 4.28Å; L87-I91 HydrophobicContact CD2-CD1 4.02Å; L87-I91 WeakPolarHBondContact O-CB 3.09Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.44Å; L87-I91 PolarHBondContact O-N 2.88Å; I91-L94 HydrophobicContact CG2-CD1 3.84Å; I91-L94 HydrophobicContact CG2-CG 4.42Å
92D94.2Very high88.4Confident92 Ų92115.3 Ų115.349%0.49258%0.578SS.*  trans-99.5-14.7-174.566.1-30.9000113.4R21 H90 L94R21-D92 IonicContact CZ-OD1 3.01Å; R21-D92 IonicContact CZ-OD2 3.57Å; R21-D92 IonicContact NE-OD1 3.27Å; R21-D92 VanDerWaalsContact NH2-CG 3.3Å; R21-D92 IonicContact NH2-OD1 3.36Å; R21-D92 PolarHBondContact NH2-OD1 2.98Å; R21-D92 IonicContact NH2-OD2 3.85Å; R21-D92 PolarHBondContact NH2-OD2 2.85Å; H90-D92 VanDerWaalsContact C-N 3.3Å; H90-D92 PolarHBondContact O-N 2.83Å; D92-L94 PolarHBondContact O-N 2.82Å
93G91.1Very high86.3Confident62 Ų62118 Ų11864%0.63960%0.595SS**  trans-7913.2-175.800000116.5
94L92.3Very high84.2Confident130 Ų130125 Ų12568%0.68163%0.626SS**SBendtrans-83.3150.7-179.7-69.4165.3000111.5I91 D92 K96I91-L94 HydrophobicContact CG2-CD1 3.84Å; I91-L94 HydrophobicContact CG2-CG 4.42Å; D92-L94 PolarHBondContact O-N 2.82Å; L94-K96 PolarHBondContact O-N 3.18Å
95K93.1Very high82.2Confident209 Ų209132.7 Ų132.791%0.90966%0.655SS**PPolyproline II helixtrans-58.9132.5173.9-69.2-174.2179.2-177.70109.8
96K89.4Confident80.1Confident193 Ų193134.1 Ų134.184%0.83967%0.668SS**PPolyproline II helixtrans-63.7140.2172.2-65.6-177.9-177.9176.50108.6L94 D98L94-K96 PolarHBondContact O-N 3.18Å; K96-D98 PolarHBondContact O-N 3.18Å
97K86.3Confident78Confident203 Ų203143 Ų14388%0.88371%0.706SS**PPolyproline II helixtrans-62.5121.5173.9-170.8175.6-177.2175.90108.3K99K97-K99 PolarHBondContact O-N 3.29Å; K97-K99 VanDerWaalsContact O-N 3.14Å
98D79.4Confident75.9Confident149 Ų149145.7 Ų145.780%0.79773%0.734SS**PPolyproline II helixtrans-57.3121.6173.3-69-47.8000108.7K96 K100K96-D98 PolarHBondContact O-N 3.18Å; D98-K100 VanDerWaalsContact C-N 3.29Å; D98-K100 PolarHBondContact O-N 3.25Å
99K74.4Confident73.7Confident204 Ų204143.6 Ų143.689%0.88774%0.741SS**  trans-65100.1165.7-84.7-178.1177.9174.40105.4K97 S101K97-K99 PolarHBondContact O-N 3.29Å; K97-K99 VanDerWaalsContact O-N 3.14Å; K99-S101 PolarHBondContact O-N 3.18Å
100K67.6Low71.6Confident204 Ų204153.1 Ų153.189%0.88778%0.775SS**  trans-46.6108.4168-151.3177.2-167.6177.20105.8D98 K102D98-K100 VanDerWaalsContact C-N 3.29Å; D98-K100 PolarHBondContact O-N 3.25Å; K100-K102 PolarHBondContact O-N 2.78Å
101S58.6Low70.4Confident107 Ų107158.2 Ų158.275%0.74880%0.802SS**  trans-58.2115-177.149.10000106.1K99 S103K99-S101 PolarHBondContact O-N 3.18Å; S101-S103 VanDerWaalsContact C-N 3.27Å; S101-S103 PolarHBondContact O-N 3.15Å
102K61.5Low69.1Low204 Ų204162 Ų16289%0.88782%0.821SS**  trans-59106.3159.9-93-177175.8175.90103.6K100 K104K100-K102 PolarHBondContact O-N 2.78Å; K102-K104 PolarHBondContact O-N 3.28Å
103S55.3Low67.7Low99 Ų99165.9 Ų165.969%0.69284%0.839SS**  trans-49.7121.9172.159.70000106.6S101 K105S101-S103 VanDerWaalsContact C-N 3.27Å; S101-S103 PolarHBondContact O-N 3.15Å; S103-K105 VanDerWaalsContact C-N 3.28Å; S103-K105 PolarHBondContact O-N 3.23Å
104K53.7Low66.4Low197 Ų197172 Ų17286%0.85785%0.851SS**  trans-58.8102.2165-84.5179.5175.4177.10104.8K102 T106K102-K104 PolarHBondContact O-N 3.28Å; K104-T106 PolarHBondContact O-N 3.06Å
105K54.2Low64.7Low195 Ų195174.6 Ų174.685%0.84886%0.862SS**  trans-61.496.5157.7-81.2-172.7176.7-176.30105.4S103 K107S103-K105 VanDerWaalsContact C-N 3.28Å; S103-K105 PolarHBondContact O-N 3.23Å; K105-K107 PolarHBondContact O-N 3.41Å
106T54.6Low62.8Low131 Ų131172.3 Ų172.380%0.80486%0.859SS**  trans-58106.9159.2390000106.1K104 A108K104-T106 PolarHBondContact O-N 3.06Å; T106-A108 PolarHBondContact O-N 3.47Å
107K52.1Low60.9Low201 Ų201170.9 Ų170.987%0.87486%0.86SS**PPolyproline II helixtrans-61.7119.6163.1-92.2-176171.2-175.50106.3K105K105-K107 PolarHBondContact O-N 3.41Å
108A53.5Low59Low97 Ų97168.4 Ų168.480%0.80286%0.858SS**PPolyproline II helixtrans-66.7127.7164.500000108T106T106-A108 PolarHBondContact O-N 3.47Å
109T48.8Very low57.3Low138 Ų138170 Ų17085%0.84786%0.863SS**PPolyproline II helixtrans-74129.5166-63.70000107.8
110Q53.3Low55.7Low263 Ų263166.9 Ų166.9100%1.22986%0.861SS**  trans-89.40160.6-83.6-173.312.700109

Retrieved 110 of 110 residues in 65 ms (Link to these results)

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