A0A087YIU5_POEFO Loading...

Abraxas 2, BRISC complex subunit

AlphaFold DB , UniProt , Accession A0A087YIU5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 450 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
1M84.6Confident95.3Very high67 Ų6747.6 Ų47.633%0.3327%0.269SS..  0131.90176.9-179.3-89.700107.7Q52 V54 I159M1-Q52 CarbonylContact C-O 3.59Å; M1-Q52 WeakPolarHBondContact CA-O 3.5Å; M1-Q52 HydrophobicContact CE-CB 3.98Å; M1-Q52 HydrophobicContact CE-CG 3.68Å; M1-Q52 HydrophobicContact CG-CB 4.41Å; M1-Q52 VanDerWaalsContact CG-O 3.3Å; M1-Q52 WeakPolarHBondContact CG-O 3.23Å; M1-V54 HydrophobicContact CE-CG2 4.22Å; M1-V54 HydrophobicContact CG-CG2 4.45Å; M1-V54 HydrophobicContact SD-CG2 4.15Å; M1-I159 HydrophobicContact CG-CD1 4.12Å; M1-I159 HydrophobicContact SD-CD1 3.26Å; M1-I159 WeakPolarHBondContact SD-CD1 3.22Å; M1-I159 HydrophobicContact SD-CG1 4.21Å
2A90.9Very high95.4Very high41 Ų4147.1 Ų47.134%0.33927%0.271SS..EExtended strand (participates in β ladder)trans-115.3156.817400000109.7V51 Q52 V53 V54A2-V51 HydrophobicContact CB-CG1 4.5Å; A2-Q52 PolarHBondContact N-O 3.14Å; A2-V53 HydrophobicContact CB-CG2 4.46Å; A2-V53 WeakPolarHBondContact O-CA 3.41Å; A2-V54 PolarHBondContact O-N 3.22Å
3A95.7Very high95.5Very high2 Ų243.5 Ų43.52%0.01725%0.25CC..EExtended strand (participates in β ladder)trans-136.3145.5172.200000110.9V54 L147 I159 I160 L161 T162A3-V54 CarbonylContact C-O 3.58Å; A3-V54 WeakPolarHBondContact CA-O 3.2Å; A3-V54 HydrophobicContact CB-CB 4.15Å; A3-L147 HydrophobicContact CB-CD2 3.29Å; A3-I159 HydrophobicContact CB-CG2 3.91Å; A3-I160 PolarHBondContact N-O 3.09Å; A3-L161 HydrophobicContact CB-CD1 3.95Å; A3-T162 PolarHBondContact O-N 3.46Å
4S96.4Very high95.5Very high20 Ų2042.4 Ų42.414%0.1425%0.245CC..EExtended strand (participates in β ladder)trans-133.3147.9174.558.10000111.7V54 I56 T162S4-V54 PolarHBondContact N-O 3.3Å; S4-I56 PolarHBondContact O-N 3.36Å; S4-T162 VanDerWaalsContact CA-O 3.24Å; S4-T162 WeakPolarHBondContact CA-O 3.46Å
5I97.8Very high95.5Very high1 Ų148.6 Ų48.61%0.00527%0.265CS..EExtended strand (participates in β ladder)trans-137.1132.8171.5-173.5169.8000108.6T9 F10 I56 L161 T162 I163 P164I5-T9 HydrophobicContact CD1-CG2 4.03Å; I5-T9 HydrophobicContact CG1-CG2 4.12Å; I5-F10 HydrophobicContact CD1-CB 4.09Å; I5-F10 HydrophobicContact CD1-CD2 4.44Å; I5-F10 HydrophobicContact CG1-CB 4.29Å; I5-F10 HydrophobicContact CG2-CB 4.17Å; I5-F10 HydrophobicContact CG2-CD2 4.08Å; I5-I56 HydrophobicContact CB-CB 4.08Å; I5-I56 HydrophobicContact CB-CD1 4.29Å; I5-I56 HydrophobicContact CD1-CB 4.36Å; I5-I56 HydrophobicContact CD1-CD1 4.42Å; I5-I56 HydrophobicContact CD1-CG2 3.94Å; I5-I56 HydrophobicContact CG1-CB 4Å; I5-I56 HydrophobicContact CG1-CG2 3.96Å; I5-L161 HydrophobicContact CB-CD1 4.02Å; I5-L161 HydrophobicContact CG2-CD1 3.75Å; I5-L161 HydrophobicContact CG2-CD2 3.77Å; I5-L161 HydrophobicContact CG2-CG 3.76Å; I5-T162 PolarHBondContact N-O 2.99Å; I5-T162 VanDerWaalsContact N-O 3.11Å; I5-I163 HydrophobicContact CG2-CG1 3.95Å; I5-P164 WeakPolarHBondContact O-CD 3.36Å
6S96.6Very high95.4Very high42 Ų4249.4 Ų49.429%0.29427%0.266SS..  trans-62.9145.4176.461.80000111.3Y8 T9 F10S6-Y8 PolarHBondContact O-N 3.37Å; S6-T9 PolarHBondContact O-N 3.07Å; S6-T9 VanDerWaalsContact O-N 3.09Å; S6-T9 WeakPolarHBondContact OG-CB 3.39Å; S6-T9 PolarHBondContact OG-N 2.82Å; S6-T9 PolarHBondContact OG-OG1 3.49Å; S6-F10 PolarHBondContact O-N 3.05Å
7G96.6Very high95.2Very high31 Ų3146.5 Ų46.532%0.3225%0.25SS..Hα-helixtrans-56.4-3618000000113.2S11G7-S11 VanDerWaalsContact O-CB 3.23Å; G7-S11 WeakPolarHBondContact O-CB 2.83Å; G7-S11 PolarHBondContact O-N 3.48Å
8Y96.9Very high95Very high207 Ų20747.4 Ų47.481%0.81227%0.265SS*.Hα-helixtrans-67.3-41.9176.7-54-70000112.7S6 S11 S12S6-Y8 PolarHBondContact O-N 3.37Å; Y8-S11 PolarHBondContact O-N 3.19Å; Y8-S12 VanDerWaalsContact O-CB 3.31Å; Y8-S12 WeakPolarHBondContact O-CB 3.46Å; Y8-S12 PolarHBondContact O-N 3.03Å
9T97.8Very high94.9Very high11 Ų1150.3 Ų50.37%0.06728%0.28CS..Hα-helixtrans-68.4-44.3178.1-56.80000110.8I5 S6 S11 S12 V13 I56 H57I5-T9 HydrophobicContact CD1-CG2 4.03Å; I5-T9 HydrophobicContact CG1-CG2 4.12Å; S6-T9 PolarHBondContact O-N 3.07Å; S6-T9 VanDerWaalsContact O-N 3.09Å; S6-T9 WeakPolarHBondContact OG-CB 3.39Å; S6-T9 PolarHBondContact OG-N 2.82Å; S6-T9 PolarHBondContact OG-OG1 3.49Å; T9-S11 VanDerWaalsContact C-N 3.34Å; T9-S11 PolarHBondContact O-N 3.46Å; T9-S12 WeakPolarHBondContact O-CB 3.46Å; T9-S12 PolarHBondContact O-N 3.28Å; T9-V13 WeakPolarHBondContact O-CG2 3.4Å; T9-V13 PolarHBondContact O-N 3.16Å; T9-I56 HydrophobicContact CG2-CG2 4.4Å; T9-H57 PolarHBondContact OG1-O 2.89Å; T9-H57 VanDerWaalsContact OG1-O 3.06Å
10F97.5Very high94.6Very high29 Ų2948.8 Ų48.813%0.12727%0.273CS..Hα-helixtrans-57.3-48.9174.7-175.9-89.1000111.1I5 S6 S12 V13 C14 F130 Y145 I163I5-F10 HydrophobicContact CD1-CB 4.09Å; I5-F10 HydrophobicContact CD1-CD2 4.44Å; I5-F10 HydrophobicContact CG1-CB 4.29Å; I5-F10 HydrophobicContact CG2-CB 4.17Å; I5-F10 HydrophobicContact CG2-CD2 4.08Å; S6-F10 PolarHBondContact O-N 3.05Å; F10-S12 VanDerWaalsContact C-N 3.33Å; F10-S12 PolarHBondContact O-N 3.42Å; F10-V13 PolarHBondContact O-N 3.43Å; F10-C14 PolarHBondContact O-N 3.34Å; F10-C14 VanDerWaalsContact O-N 3.09Å; F10-C14 PolarHBondContact O-SG 3.35Å; F10-F130 HydrophobicContact CD2-CE1 4.24Å; F10-F130 HydrophobicContact CD2-CZ 4.43Å; F10-F130 AromaticContact CE2-CE1 3.6Å; F10-F130 HydrophobicContact CE2-CE1 3.6Å; F10-F130 HydrophobicContact CE2-CZ 4.17Å; F10-F130 AromaticContact CZ-CE1 3.94Å; F10-F130 HydrophobicContact CZ-CE1 3.94Å; F10-Y145 AromaticContact CE2-CD1 3.8Å; F10-Y145 HydrophobicContact CE2-CD1 3.8Å; F10-Y145 HydrophobicContact CE2-CD2 4.16Å; F10-Y145 AromaticContact CE2-CE1 4Å; F10-Y145 HydrophobicContact CE2-CE1 4Å; F10-Y145 HydrophobicContact CE2-CE2 4.34Å; F10-Y145 AromaticContact CE2-CG 3.88Å; F10-Y145 HydrophobicContact CE2-CG 3.88Å; F10-Y145 AromaticContact CZ-CD1 3.56Å; F10-Y145 HydrophobicContact CZ-CD1 3.56Å; F10-Y145 AromaticContact CZ-CE1 3.7Å; F10-Y145 HydrophobicContact CZ-CE1 3.7Å; F10-Y145 HydrophobicContact CZ-CG 4.12Å; F10-I163 HydrophobicContact CB-CD1 4.44Å; F10-I163 HydrophobicContact CD1-CD1 4.1Å; F10-I163 HydrophobicContact CD2-CD1 3.93Å; F10-I163 HydrophobicContact CE1-CD1 4.34Å; F10-I163 HydrophobicContact CE2-CD1 4.17Å; F10-I163 HydrophobicContact CG-CD1 3.89Å; F10-I163 HydrophobicContact CZ-CD1 4.38Å
11S97.5Very high94.2Very high73 Ų7354.3 Ų54.351%0.5130%0.302SS..Hα-helixtrans-61-40.5176.4-176.30000112.4G7 Y8 T9 V13 C14 Y15G7-S11 VanDerWaalsContact O-CB 3.23Å; G7-S11 WeakPolarHBondContact O-CB 2.83Å; G7-S11 PolarHBondContact O-N 3.48Å; Y8-S11 PolarHBondContact O-N 3.19Å; T9-S11 VanDerWaalsContact C-N 3.34Å; T9-S11 PolarHBondContact O-N 3.46Å; S11-V13 PolarHBondContact O-N 2.86Å; S11-C14 WeakPolarHBondContact O-CB 3.41Å; S11-C14 PolarHBondContact O-N 2.9Å; S11-C14 VanDerWaalsContact O-N 3.15Å; S11-Y15 WeakPolarHBondContact O-CB 3.29Å; S11-Y15 PolarHBondContact O-N 3.19Å
12S97.1Very high94.5Very high41 Ų4154.1 Ų54.129%0.28731%0.307SS..Hα-helixtrans-62-43177.5-166.30000112.1Y8 T9 F10 C14 Y15 H16 H59Y8-S12 VanDerWaalsContact O-CB 3.31Å; Y8-S12 WeakPolarHBondContact O-CB 3.46Å; Y8-S12 PolarHBondContact O-N 3.03Å; T9-S12 WeakPolarHBondContact O-CB 3.46Å; T9-S12 PolarHBondContact O-N 3.28Å; F10-S12 VanDerWaalsContact C-N 3.33Å; F10-S12 PolarHBondContact O-N 3.42Å; S12-C14 VanDerWaalsContact C-N 3.3Å; S12-C14 PolarHBondContact O-N 2.95Å; S12-Y15 PolarHBondContact O-N 3.35Å; S12-H16 PolarHBondContact O-N 2.92Å; S12-H16 PolarHBondContact O-ND1 2.95Å; S12-H16 PolarHBondContact OG-CE1 3.3Å; S12-H59 PolarHBondContact OG-CE1 2.9Å; S12-H59 VanDerWaalsContact OG-CE1 3.26Å
13V96.3Very high94.6Very high0 Ų054.5 Ų54.50%030%0.304CS..Hα-helixtrans-60.3-43.1173.51760000110.8T9 F10 S11 S17 H59 Y95 F130T9-V13 WeakPolarHBondContact O-CG2 3.4Å; T9-V13 PolarHBondContact O-N 3.16Å; F10-V13 PolarHBondContact O-N 3.43Å; S11-V13 PolarHBondContact O-N 2.86Å; V13-S17 VanDerWaalsContact O-CB 3.28Å; V13-S17 WeakPolarHBondContact O-CB 3.33Å; V13-S17 PolarHBondContact O-N 3.2Å; V13-S17 PolarHBondContact O-OG 3.11Å; V13-H59 HydrophobicContact CG2-CB 3.91Å; V13-H59 VanDerWaalsContact CG2-CD2 3.5Å; V13-H59 WeakPolarHBondContact CG2-CD2 3.44Å; V13-H59 VanDerWaalsContact CG2-CG 3.49Å; V13-Y95 HydrophobicContact CG1-CD2 3.96Å; V13-Y95 HydrophobicContact CG1-CE2 3.81Å; V13-F130 HydrophobicContact CB-CZ 4.36Å; V13-F130 HydrophobicContact CG1-CD2 4.32Å; V13-F130 HydrophobicContact CG1-CE2 3.58Å; V13-F130 HydrophobicContact CG1-CZ 3.7Å
14C95.7Very high94.5Very high28 Ų2855.4 Ų55.419%0.18931%0.308CS..Hα-helixtrans-62.3-44.1177.6-61.10000111.7F10 S11 S12 S17 A18 L143F10-C14 PolarHBondContact O-N 3.34Å; F10-C14 VanDerWaalsContact O-N 3.09Å; F10-C14 PolarHBondContact O-SG 3.35Å; S11-C14 WeakPolarHBondContact O-CB 3.41Å; S11-C14 PolarHBondContact O-N 2.9Å; S11-C14 VanDerWaalsContact O-N 3.15Å; S12-C14 VanDerWaalsContact C-N 3.3Å; S12-C14 PolarHBondContact O-N 2.95Å; C14-S17 PolarHBondContact O-N 3.25Å; C14-A18 VanDerWaalsContact O-CB 3.29Å; C14-A18 WeakPolarHBondContact O-CB 3.47Å; C14-A18 PolarHBondContact O-N 3.11Å; C14-L143 HydrophobicContact CB-CD2 4.17Å; C14-L143 WeakPolarHBondContact SG-CD2 3.11Å
15Y95.7Very high94.5Very high136 Ų13654.6 Ų54.653%0.53330%0.301SS..Hα-helixtrans-61.3-49.5178.5176.8-99.4000111.8S11 S12 S17 A18 N19S11-Y15 WeakPolarHBondContact O-CB 3.29Å; S11-Y15 PolarHBondContact O-N 3.19Å; S12-Y15 PolarHBondContact O-N 3.35Å; Y15-S17 VanDerWaalsContact C-N 3.31Å; Y15-S17 PolarHBondContact O-N 3.48Å; Y15-A18 PolarHBondContact O-N 2.83Å; Y15-N19 VanDerWaalsContact CE1-ND2 3.31Å; Y15-N19 WeakPolarHBondContact CE1-ND2 3.1Å; Y15-N19 WeakPolarHBondContact CE2-ND2 3.48Å; Y15-N19 PolarHBondContact O-N 3.05Å; Y15-N19 VanDerWaalsContact O-N 3.16Å; Y15-N19 PolarHBondContact O-ND2 3.46Å
16H93.4Very high94.4Very high62 Ų6254.6 Ų54.629%0.28730%0.302SS..Hα-helixtrans-61.3-41.4176.6-71.696.7000111.9S12 N19 S20 H59S12-H16 PolarHBondContact O-N 2.92Å; S12-H16 PolarHBondContact O-ND1 2.95Å; S12-H16 PolarHBondContact OG-CE1 3.3Å; H16-N19 PolarHBondContact O-N 3.34Å; H16-S20 PolarHBondContact O-N 2.85Å; H16-H59 AromaticContact CE1-NE2 3.93Å; H16-H59 AromaticContact ND1-CE1 3.8Å; H16-H59 AromaticContact ND1-NE2 3.4Å; H16-H59 PolarHBondContact ND1-NE2 2.9Å
17S92.5Very high94.4Very high0 Ų052.6 Ų52.60%029%0.288CS..Hα-helixtrans-68.4-38179.7-58.10000112.7V13 C14 Y15 N19 S20 F97V13-S17 VanDerWaalsContact O-CB 3.28Å; V13-S17 WeakPolarHBondContact O-CB 3.33Å; V13-S17 PolarHBondContact O-N 3.2Å; V13-S17 PolarHBondContact O-OG 3.11Å; C14-S17 PolarHBondContact O-N 3.25Å; Y15-S17 VanDerWaalsContact C-N 3.31Å; Y15-S17 PolarHBondContact O-N 3.48Å; S17-N19 VanDerWaalsContact C-N 3.31Å; S17-N19 PolarHBondContact O-N 2.76Å; S17-S20 WeakPolarHBondContact O-CB 3.24Å; S17-S20 PolarHBondContact O-N 3.18Å; S17-F97 VanDerWaalsContact CB-CG 3.49Å
18A91.9Very high94.5Very high63 Ų6351.1 Ų51.152%0.52127%0.273SS..Hα-helixtrans-64.9-36.7177.100000112C14 Y15 S20 R99C14-A18 VanDerWaalsContact O-CB 3.29Å; C14-A18 WeakPolarHBondContact O-CB 3.47Å; C14-A18 PolarHBondContact O-N 3.11Å; Y15-A18 PolarHBondContact O-N 2.83Å; A18-S20 VanDerWaalsContact C-N 3.28Å; A18-S20 PolarHBondContact O-N 3.29Å; A18-R99 PolarHBondContact O-NH2 3.31Å
19N92.1Very high94.5Very high102 Ų10242 Ų4255%0.54524%0.238SC..Hα-helixtrans-77.5-10.6177-67.8-37.8000113.8Y15 H16 S17Y15-N19 VanDerWaalsContact CE1-ND2 3.31Å; Y15-N19 WeakPolarHBondContact CE1-ND2 3.1Å; Y15-N19 WeakPolarHBondContact CE2-ND2 3.48Å; Y15-N19 PolarHBondContact O-N 3.05Å; Y15-N19 VanDerWaalsContact O-N 3.16Å; Y15-N19 PolarHBondContact O-ND2 3.46Å; H16-N19 PolarHBondContact O-N 3.34Å; S17-N19 VanDerWaalsContact C-N 3.31Å; S17-N19 PolarHBondContact O-N 2.76Å
20S89.2Confident94.4Very high20 Ų2041.7 Ų41.714%0.1424%0.236CC..  trans-79139171.6177.90000110.2H16 S17 A18 S22 R99H16-S20 PolarHBondContact O-N 2.85Å; S17-S20 WeakPolarHBondContact O-CB 3.24Å; S17-S20 PolarHBondContact O-N 3.18Å; A18-S20 VanDerWaalsContact C-N 3.28Å; A18-S20 PolarHBondContact O-N 3.29Å; S20-S22 VanDerWaalsContact C-N 3.31Å; S20-S22 PolarHBondContact OG-N 3.49Å; S20-S22 VanDerWaalsContact OG-N 3.14Å; S20-S22 PolarHBondContact OG-O 3.19Å; S20-R99 PolarHBondContact O-NH1 2.91Å; S20-R99 PolarHBondContact O-NH2 3.21Å
21N86.1Confident94.3Very high164 Ų16444.7 Ų44.788%0.87725%0.254SS*.SBendtrans-85.9-4.8172.1-65.3-23.3000112.8R99N21-R99 VanDerWaalsContact C-NH1 3.31Å
22S89.9Confident94.1Very high63 Ų6344.2 Ų44.244%0.44125%0.248SC..SBendtrans-133.9-178.4-177.962.80000111.7S20S20-S22 VanDerWaalsContact C-N 3.31Å; S20-S22 PolarHBondContact OG-N 3.49Å; S20-S22 VanDerWaalsContact OG-N 3.14Å; S20-S22 PolarHBondContact OG-O 3.19Å
23D92.9Very high93.8Very high50 Ų5047.5 Ų47.527%0.26725%0.254SS..  trans-46.1145.2160.2-81.816.7000110.3L65 R96 F97D23-L65 HydrophobicContact CB-CD1 3.95Å; D23-L65 HydrophobicContact CB-CD2 3.99Å; D23-R96 IonicContact OD2-CZ 3.83Å; D23-R96 IonicContact OD2-NE 3.87Å; D23-R96 PolarHBondContact OD2-NE 2.84Å; D23-R96 IonicContact OD2-NH2 3.67Å; D23-R96 PolarHBondContact OD2-NH2 2.82Å; D23-F97 WeakPolarHBondContact CA-O 3.41Å
24H94.1Very high93.5Very high21 Ų2154.2 Ų54.210%0.09729%0.285CS..EExtended strand (participates in β ladder)trans-132.1147.8-179.7-17859.3000109.7P61 Y95 R96 F97H24-P61 WeakPolarHBondContact NE2-CB 3.4Å; H24-Y95 AromaticContact CD2-CE2 3.76Å; H24-Y95 AromaticContact NE2-CZ 3.91Å; H24-Y95 PolarHBondContact NE2-OH 3.08Å; H24-R96 CarbonylContact O-C 3.58Å; H24-R96 WeakPolarHBondContact O-CA 3.33Å; H24-F97 HydrophobicContact CB-CB 4.21Å; H24-F97 PolarHBondContact N-O 3.11Å; H24-F97 VanDerWaalsContact N-O 3.16Å; H24-F97 PolarHBondContact O-N 2.87Å
25E96Very high93.3Very high2 Ų257.2 Ų57.21%0.00930%0.297CS..EExtended strand (participates in β ladder)trans-145.7157-177.565.8-168.3-177.400110.8C62 L65 F66 F68 Y69 Y95 R96E25-C62 HydrophobicContact CG-CB 4.11Å; E25-C62 VanDerWaalsContact O-CB 3.29Å; E25-C62 WeakPolarHBondContact O-CB 3.43Å; E25-C62 PolarHBondContact O-N 2.85Å; E25-L65 HydrophobicContact CG-CD2 4.14Å; E25-L65 WeakPolarHBondContact OE1-CA 3.21Å; E25-F66 PolarHBondContact OE1-N 2.94Å; E25-F68 HydrophobicContact CG-CE1 4.35Å; E25-Y69 VanDerWaalsContact OE1-CE1 3.22Å; E25-Y69 WeakPolarHBondContact OE1-CE1 3.34Å; E25-Y69 PolarHBondContact OE1-OH 3.32Å; E25-Y69 WeakPolarHBondContact OE2-CE1 3.43Å; E25-Y69 PolarHBondContact OE2-OH 2.82Å; E25-Y95 WeakPolarHBondContact CA-O 3.35Å; E25-R96 HydrophobicContact CB-CG 4.35Å; E25-R96 IonicContact OE2-CZ 3.26Å; E25-R96 IonicContact OE2-NH1 3.58Å; E25-R96 PolarHBondContact OE2-NH1 3.29Å
26G96.5Very high93Very high1 Ų156.6 Ų56.61%0.0130%0.299CS..EExtended strand (participates in β ladder)trans-175.1-178.3179.200000112.9D60 W94 Y95G26-D60 CarbonylContact C-O 3.6Å; G26-D60 WeakPolarHBondContact CA-O 3.22Å; G26-W94 CarbonylContact O-C 3.55Å; G26-W94 WeakPolarHBondContact O-CA 3.24Å; G26-W94 WeakPolarHBondContact O-CB 3.38Å; G26-Y95 VanDerWaalsContact C-CD1 3.49Å; G26-Y95 VanDerWaalsContact C-CE1 3.41Å; G26-Y95 PolarHBondContact N-O 3.02Å; G26-Y95 VanDerWaalsContact N-O 3.12Å; G26-Y95 WeakPolarHBondContact O-CD1 3.46Å; G26-Y95 PolarHBondContact O-N 3.21Å
27F97.5Very high92.6Very high1 Ų156.2 Ų56.20%0.00430%0.301CS..EExtended strand (participates in β ladder)trans-104150.7-178.5-65.6-82.3000111.6H59 D60 F68 L80 I83 L84 V91 W94 L116F27-H59 CarbonylContact O-C 3.54Å; F27-H59 VanDerWaalsContact O-CA 3.23Å; F27-H59 WeakPolarHBondContact O-CA 3.41Å; F27-D60 PolarHBondContact N-O 2.82Å; F27-D60 PolarHBondContact O-N 2.96Å; F27-F68 HydrophobicContact CE2-CD1 4.16Å; F27-F68 HydrophobicContact CE2-CE1 4.26Å; F27-F68 HydrophobicContact CZ-CD1 4.07Å; F27-F68 HydrophobicContact CZ-CD2 4.16Å; F27-F68 HydrophobicContact CZ-CE1 4.05Å; F27-F68 HydrophobicContact CZ-CE2 4.14Å; F27-F68 HydrophobicContact CZ-CG 4.13Å; F27-F68 HydrophobicContact CZ-CZ 4.09Å; F27-L80 HydrophobicContact CE1-CD1 3.85Å; F27-L80 HydrophobicContact CE2-CD1 4.07Å; F27-L80 HydrophobicContact CZ-CD1 3.35Å; F27-I83 HydrophobicContact CD2-CG2 4.43Å; F27-I83 HydrophobicContact CE2-CG2 4.3Å; F27-L84 HydrophobicContact CB-CD2 3.98Å; F27-L84 HydrophobicContact CD1-CD2 4.34Å; F27-L84 HydrophobicContact CD2-CD2 3.71Å; F27-L84 HydrophobicContact CD2-CG 4.42Å; F27-L84 HydrophobicContact CE2-CD2 4.3Å; F27-L84 HydrophobicContact CG-CD2 3.73Å; F27-V91 HydrophobicContact CD1-CG1 4.12Å; F27-W94 HydrophobicContact CD1-CB 4.02Å; F27-W94 HydrophobicContact CE1-CB 4.36Å; F27-L116 HydrophobicContact CE1-CD1 4.19Å; F27-L116 HydrophobicContact CE1-CD2 4.11Å; F27-L116 HydrophobicContact CZ-CD2 4.46Å
28L97.7Very high92.2Very high0 Ų060.4 Ų60.40%033%0.326CS..EExtended strand (participates in β ladder)trans-105.4127.7175.6-59.9173000108.9I56 H59 I92 G93 Y95 V126 L128L28-I56 HydrophobicContact CB-CG2 4.41Å; L28-I56 HydrophobicContact CD1-CD1 4.08Å; L28-I56 HydrophobicContact CD2-CG2 4.19Å; L28-H59 HydrophobicContact CD2-CB 4.31Å; L28-I92 HydrophobicContact CB-CG1 4.46Å; L28-I92 PolarHBondContact O-N 3.47Å; L28-G93 PolarHBondContact N-O 2.73Å; L28-G93 PolarHBondContact O-N 2.77Å; L28-Y95 HydrophobicContact CD2-CD1 3.72Å; L28-Y95 HydrophobicContact CD2-CG 4.36Å; L28-Y95 HydrophobicContact CG-CD1 4.2Å; L28-V126 HydrophobicContact CD1-CG2 4.39Å; L28-L128 HydrophobicContact CD1-CB 3.85Å; L28-L128 HydrophobicContact CD1-CD2 4.39Å
29L97.1Very high91.7Very high15 Ų1560.7 Ų60.78%0.07932%0.324CS..EExtended strand (participates in β ladder)trans-112.3136.4-178-56.5176.9000110.1H57 N58 D60 R87 N90 V91L29-H57 PolarHBondContact O-N 3.31Å; L29-N58 PolarHBondContact N-O 3.05Å; L29-N58 PolarHBondContact O-N 2.63Å; L29-D60 HydrophobicContact CD1-CB 4.46Å; L29-R87 HydrophobicContact CD1-CB 4.4Å; L29-R87 HydrophobicContact CD2-CB 4.45Å; L29-N90 CarbonylContact C-O 3.53Å; L29-N90 VanDerWaalsContact CA-O 3.24Å; L29-N90 WeakPolarHBondContact CA-O 3.49Å; L29-N90 HydrophobicContact CD2-CB 4.44Å; L29-V91 HydrophobicContact CD2-CB 4.4Å; L29-V91 HydrophobicContact CD2-CG2 3.61Å
30G96.3Very high91.2Very high4 Ų462.1 Ų62.14%0.04133%0.331CS..EExtended strand (participates in β ladder)trans167.6-155.8-179.300000111.8E55 N90 I92G30-E55 VanDerWaalsContact CA-O 3.28Å; G30-E55 WeakPolarHBondContact CA-O 3.48Å; G30-N90 PolarHBondContact N-O 3.37Å; G30-I92 VanDerWaalsContact O-CG2 3.27Å; G30-I92 WeakPolarHBondContact O-CG2 3.39Å
31D93.9Very high90.8Very high92 Ų9263.5 Ų63.549%0.49234%0.34SS..EExtended strand (participates in β ladder)trans-131.2153.2-174.5-67.3-56.1000111.4E55 H57D31-E55 PolarHBondContact N-O 3.36Å; D31-E55 PolarHBondContact O-N 3.11Å; D31-H57 IonicContact OD2-CE1 2.59Å; D31-H57 PolarHBondContact OD2-CE1 2.95Å; D31-H57 IonicContact OD2-ND1 3.11Å
32V93.3Very high90.8Very high64 Ų6464.2 Ų64.239%0.38834%0.344SS..EExtended strand (participates in β ladder)trans-118.3115.5173.9-175.10000107.9Q52 V53 V54 I92V32-Q52 HydrophobicContact CG1-CG 3.52Å; V32-V53 WeakPolarHBondContact CA-O 3.48Å; V32-V54 HydrophobicContact CG1-CG2 4.35Å; V32-V54 HydrophobicContact CG2-CG2 4.28Å; V32-I92 HydrophobicContact CG2-CB 4.26Å; V32-I92 HydrophobicContact CG2-CG2 3.8Å
33R92.1Very high90.5Very high109 Ų10964.5 Ų64.541%0.41135%0.35SS..EExtended strand (participates in β ladder)trans-108.4155.3176.365.5171.7174.4-95.73.6111.2E35 Q52 V53 E55R33-E35 IonicContact NE-OE2 3.94Å; R33-Q52 CarbonylContact O-C 3.53Å; R33-Q52 WeakPolarHBondContact O-CA 3.33Å; R33-V53 HydrophobicContact CG-CB 3.85Å; R33-V53 PolarHBondContact N-O 3.05Å; R33-V53 PolarHBondContact O-N 3.24Å; R33-E55 IonicContact CZ-OE2 3.36Å; R33-E55 IonicContact NH1-OE2 2.66Å; R33-E55 PolarHBondContact NH1-OE2 3.45Å; R33-E55 IonicContact NH2-OE2 3.34Å
34Q90.5Very high89.5Confident141 Ų14171 Ų7166%0.65938%0.379SS*.EExtended strand (participates in β ladder)trans-103.7127164.7-72.7-175.2-10.200108
35E90Very high88.6Confident91 Ų9175.6 Ų75.643%0.42540%0.403SS..EExtended strand (participates in β ladder)trans-116.3122.7179.2-170.2169163.400108R33 T37 V51 V53R33-E35 IonicContact NE-OE2 3.94Å; E35-T37 PolarHBondContact O-N 3Å; E35-V51 PolarHBondContact N-O 3.34Å; E35-V51 PolarHBondContact O-N 2.72Å; E35-V53 HydrophobicContact CB-CG2 4.17Å
36E89.2Confident87.9Confident124 Ų12479.7 Ų79.758%0.57943%0.432SS*.EExtended strand (participates in β ladder)trans-82.4113.9174.4-171.3175.7-175.100108.7S48 E49 L50E36-S48 WeakPolarHBondContact OE1-CB 3.37Å; E36-E49 WeakPolarHBondContact CA-O 3.32Å; E36-L50 HydrophobicContact CB-CD2 3.88Å; E36-L50 HydrophobicContact CG-CD2 4.19Å
37T85.6Confident87.2Confident54 Ų5482.3 Ų82.333%0.33145%0.45SS..EExtended strand (participates in β ladder)trans-100.4117.517455.70000108.6E35 E49 V51E35-T37 PolarHBondContact O-N 3Å; T37-E49 PolarHBondContact N-O 2.91Å; T37-E49 PolarHBondContact O-N 3.28Å; T37-E49 PolarHBondContact OG1-O 3.38Å; T37-V51 HydrophobicContact CG2-CG2 3.92Å; T37-V51 WeakPolarHBondContact OG1-CG2 3.3Å
38V84.9Confident86.6Confident87 Ų8786.1 Ų86.153%0.52748%0.477SS..EExtended strand (participates in β ladder)trans-95.3114.3174.6-177.20000108.2I40 S47V38-I40 HydrophobicContact CG1-CG1 4.28Å; V38-S47 WeakPolarHBondContact CA-O 3.45Å
39S81Confident86.2Confident69 Ų6992.2 Ų92.248%0.48351%0.506SS..EExtended strand (participates in β ladder)trans-93.9120.7170.8-169.70000108.6S46 S47S39-S46 WeakPolarHBondContact O-CA 3.1Å; S39-S47 PolarHBondContact N-O 3.1Å; S39-S47 PolarHBondContact O-N 3.48Å
40I81.1Confident85.7Confident133 Ų13397.2 Ų97.268%0.68253%0.532SS*.EExtended strand (participates in β ladder)trans-99.3114.7173.5-57.7175.2000106.6V38V38-I40 HydrophobicContact CG1-CG1 4.28Å
41S81.5Confident85.4Confident49 Ų4998.5 Ų98.534%0.34354%0.539SS..  trans-85.2155.8172.366.90000111A43 Q44 I45S41-A43 PolarHBondContact O-N 3.19Å; S41-Q44 PolarHBondContact O-N 3.44Å; S41-Q44 VanDerWaalsContact O-N 3.07Å; S41-I45 PolarHBondContact N-O 3.49Å; S41-I45 PolarHBondContact OG-N 2.95Å; S41-I45 PolarHBondContact OG-O 3.24Å
42D85.5Confident85.2Confident178 Ų17895.9 Ų95.995%0.95252%0.523SS*.THydrogen-bonded Turntrans-60.1-16.3176.4-65.3-27.2000113Q44D42-Q44 VanDerWaalsContact C-N 3.26Å; D42-Q44 PolarHBondContact O-N 2.81Å
43A83.4Confident85.2Confident70 Ų7093.4 Ų93.458%0.57951%0.509SS*.THydrogen-bonded Turntrans-82.610.5176.100000114.3S41 I45S41-A43 PolarHBondContact O-N 3.19Å; A43-I45 HydrophobicContact CB-CD1 4.24Å; A43-I45 HydrophobicContact CB-CG1 4.32Å; A43-I45 PolarHBondContact O-N 3.48Å; A43-I45 VanDerWaalsContact O-N 3.09Å
44Q72.2Confident85.3Confident187 Ų18788.3 Ų88.387%0.87449%0.49SS*.SBendtrans59.415.8-174.1-61.1174.9-33.600114.2S41 D42S41-Q44 PolarHBondContact O-N 3.44Å; S41-Q44 VanDerWaalsContact O-N 3.07Å; D42-Q44 VanDerWaalsContact C-N 3.26Å; D42-Q44 PolarHBondContact O-N 2.81Å
45I75.6Confident85.6Confident116 Ų11684.7 Ų84.760%0.59547%0.473SS*.  trans-89.2119170.8-58.3169.7000107.2S41 A43S41-I45 PolarHBondContact N-O 3.49Å; S41-I45 PolarHBondContact OG-N 2.95Å; S41-I45 PolarHBondContact OG-O 3.24Å; A43-I45 HydrophobicContact CB-CD1 4.24Å; A43-I45 HydrophobicContact CB-CG1 4.32Å; A43-I45 PolarHBondContact O-N 3.48Å; A43-I45 VanDerWaalsContact O-N 3.09Å
46S80.7Confident85.9Confident88 Ų8880.5 Ų80.562%0.61545%0.453SS*.EExtended strand (participates in β ladder)trans-94.9125171.159.90000110.1S39S39-S46 WeakPolarHBondContact O-CA 3.1Å
47S83.2Confident86.3Confident57 Ų5778.8 Ų78.840%0.39945%0.445SS..EExtended strand (participates in β ladder)trans-109.2131166.858.20000110V38 S39V38-S47 WeakPolarHBondContact CA-O 3.45Å; S39-S47 PolarHBondContact N-O 3.1Å; S39-S47 PolarHBondContact O-N 3.48Å
48S84.8Confident86.8Confident81 Ų8180.1 Ų80.157%0.56645%0.45SS*.EExtended strand (participates in β ladder)trans-101.2121.2172.657.90000109.2E36E36-S48 WeakPolarHBondContact OE1-CB 3.37Å
49E87.8Confident87.3Confident128 Ų12876.4 Ų76.460%0.59843%0.427SS*.EExtended strand (participates in β ladder)trans-114.6134172.1-69.6-170172.100110.4E36 T37 V51E36-E49 WeakPolarHBondContact CA-O 3.32Å; T37-E49 PolarHBondContact N-O 2.91Å; T37-E49 PolarHBondContact O-N 3.28Å; T37-E49 PolarHBondContact OG1-O 3.38Å; E49-V51 PolarHBondContact O-N 2.83Å
50L88.1Confident88Confident119 Ų11974.1 Ų74.162%0.62341%0.409SS*.EExtended strand (participates in β ladder)trans-89105.9171.7-70.5171.1000109.5E36E36-L50 HydrophobicContact CB-CD2 3.88Å; E36-L50 HydrophobicContact CG-CD2 4.19Å
51V88.8Confident88.6Confident32 Ų3270 Ų7019%0.19439%0.391CS..EExtended strand (participates in β ladder)trans-93.1115.3176.9-175.30000109.4A2 E35 T37 E49 V53A2-V51 HydrophobicContact CB-CG1 4.5Å; E35-V51 PolarHBondContact N-O 3.34Å; E35-V51 PolarHBondContact O-N 2.72Å; T37-V51 HydrophobicContact CG2-CG2 3.92Å; T37-V51 WeakPolarHBondContact OG1-CG2 3.3Å; E49-V51 PolarHBondContact O-N 2.83Å; V51-V53 HydrophobicContact CG1-CG2 4.15Å; V51-V53 PolarHBondContact O-N 2.95Å
52Q90.1Very high89.1Confident36 Ų3668 Ų6817%0.16838%0.377CS..EExtended strand (participates in β ladder)trans-72.4123.7167.7-165.1174.2900109.3M1 A2 V32 R33 D124M1-Q52 CarbonylContact C-O 3.59Å; M1-Q52 WeakPolarHBondContact CA-O 3.5Å; M1-Q52 HydrophobicContact CE-CB 3.98Å; M1-Q52 HydrophobicContact CE-CG 3.68Å; M1-Q52 HydrophobicContact CG-CB 4.41Å; M1-Q52 VanDerWaalsContact CG-O 3.3Å; M1-Q52 WeakPolarHBondContact CG-O 3.23Å; A2-Q52 PolarHBondContact N-O 3.14Å; V32-Q52 HydrophobicContact CG1-CG 3.52Å; R33-Q52 CarbonylContact O-C 3.53Å; R33-Q52 WeakPolarHBondContact O-CA 3.33Å; Q52-D124 PolarHBondContact NE2-OD2 3.18Å; Q52-D124 PolarHBondContact OE1-OD2 3.36Å
53V92.8Very high89.1Confident13 Ų1364.4 Ų64.48%0.07937%0.372CS..EExtended strand (participates in β ladder)trans-115.8120.8179.9-174.60000109A2 V32 R33 E35 V51A2-V53 HydrophobicContact CB-CG2 4.46Å; A2-V53 WeakPolarHBondContact O-CA 3.41Å; V32-V53 WeakPolarHBondContact CA-O 3.48Å; R33-V53 HydrophobicContact CG-CB 3.85Å; R33-V53 PolarHBondContact N-O 3.05Å; R33-V53 PolarHBondContact O-N 3.24Å; E35-V53 HydrophobicContact CB-CG2 4.17Å; V51-V53 HydrophobicContact CG1-CG2 4.15Å; V51-V53 PolarHBondContact O-N 2.95Å
54V94.8Very high89.2Confident2 Ų267 Ų671%0.01237%0.372CS..EExtended strand (participates in β ladder)trans-97.3113.9177.4-179.50000108.6M1 A2 A3 S4 V32 I92 V126M1-V54 HydrophobicContact CE-CG2 4.22Å; M1-V54 HydrophobicContact CG-CG2 4.45Å; M1-V54 HydrophobicContact SD-CG2 4.15Å; A2-V54 PolarHBondContact O-N 3.22Å; A3-V54 CarbonylContact C-O 3.58Å; A3-V54 WeakPolarHBondContact CA-O 3.2Å; A3-V54 HydrophobicContact CB-CB 4.15Å; S4-V54 PolarHBondContact N-O 3.3Å; V32-V54 HydrophobicContact CG1-CG2 4.35Å; V32-V54 HydrophobicContact CG2-CG2 4.28Å; V54-I92 HydrophobicContact CG1-CD1 3.77Å; V54-V126 HydrophobicContact CG1-CG1 4.44Å; V54-V126 HydrophobicContact CG1-CG2 4.3Å; V54-V126 HydrophobicContact CG2-CG1 4.33Å
55E96.3Very high90.1Very high65 Ų6560.1 Ų60.130%0.30434%0.341SS..EExtended strand (participates in β ladder)trans-108.7115.1179.4-169.3170.1-17100110.6G30 D31 R33 H57 I92G30-E55 VanDerWaalsContact CA-O 3.28Å; G30-E55 WeakPolarHBondContact CA-O 3.48Å; D31-E55 PolarHBondContact N-O 3.36Å; D31-E55 PolarHBondContact O-N 3.11Å; R33-E55 IonicContact CZ-OE2 3.36Å; R33-E55 IonicContact NH1-OE2 2.66Å; R33-E55 PolarHBondContact NH1-OE2 3.45Å; R33-E55 IonicContact NH2-OE2 3.34Å; E55-H57 WeakPolarHBondContact CG-NE2 3.46Å; E55-H57 IonicContact OE1-NE2 3.05Å; E55-H57 IonicContact OE2-NE2 3.96Å; E55-I92 WeakPolarHBondContact O-CD1 3.33Å
56I97.8Very high90.9Very high2 Ų257.6 Ų57.61%0.0133%0.326CS..EExtended strand (participates in β ladder)trans-90.4112.2179.9-58.2165.6000108.9S4 I5 T9 L28 I92 L161S4-I56 PolarHBondContact O-N 3.36Å; I5-I56 HydrophobicContact CB-CB 4.08Å; I5-I56 HydrophobicContact CB-CD1 4.29Å; I5-I56 HydrophobicContact CD1-CB 4.36Å; I5-I56 HydrophobicContact CD1-CD1 4.42Å; I5-I56 HydrophobicContact CD1-CG2 3.94Å; I5-I56 HydrophobicContact CG1-CB 4Å; I5-I56 HydrophobicContact CG1-CG2 3.96Å; T9-I56 HydrophobicContact CG2-CG2 4.4Å; L28-I56 HydrophobicContact CB-CG2 4.41Å; L28-I56 HydrophobicContact CD1-CD1 4.08Å; L28-I56 HydrophobicContact CD2-CG2 4.19Å; I56-I92 HydrophobicContact CB-CD1 4.46Å; I56-I92 HydrophobicContact CG1-CD1 3.85Å; I56-L161 HydrophobicContact CD1-CD1 4.27Å
57H96.1Very high91.4Very high88 Ų8854 Ų5441%0.40730%0.301SS..EExtended strand (participates in β ladder)trans-90.9-39.3-178.7-64.2163.9000112.9T9 L29 D31 E55T9-H57 PolarHBondContact OG1-O 2.89Å; T9-H57 VanDerWaalsContact OG1-O 3.06Å; L29-H57 PolarHBondContact O-N 3.31Å; D31-H57 IonicContact OD2-CE1 2.59Å; D31-H57 PolarHBondContact OD2-CE1 2.95Å; D31-H57 IonicContact OD2-ND1 3.11Å; E55-H57 WeakPolarHBondContact CG-NE2 3.46Å; E55-H57 IonicContact OE1-NE2 3.05Å; E55-H57 IonicContact OE2-NE2 3.96Å
58N96.3Very high92Very high82 Ų8251.4 Ų51.444%0.43928%0.282SS..EExtended strand (participates in β ladder)trans-155.1175.8-177.7-157.2-2.4000111.4L29L29-N58 PolarHBondContact N-O 3.05Å; L29-N58 PolarHBondContact O-N 2.63Å
59H96.4Very high92.5Very high9 Ų947.8 Ų47.84%0.04226%0.256CS..EExtended strand (participates in β ladder)trans-133.4157.2174.575.7-56.8000111S12 V13 H16 F27 L28 Y95S12-H59 PolarHBondContact OG-CE1 2.9Å; S12-H59 VanDerWaalsContact OG-CE1 3.26Å; V13-H59 HydrophobicContact CG2-CB 3.91Å; V13-H59 VanDerWaalsContact CG2-CD2 3.5Å; V13-H59 WeakPolarHBondContact CG2-CD2 3.44Å; V13-H59 VanDerWaalsContact CG2-CG 3.49Å; H16-H59 AromaticContact CE1-NE2 3.93Å; H16-H59 AromaticContact ND1-CE1 3.8Å; H16-H59 AromaticContact ND1-NE2 3.4Å; H16-H59 PolarHBondContact ND1-NE2 2.9Å; F27-H59 CarbonylContact O-C 3.54Å; F27-H59 VanDerWaalsContact O-CA 3.23Å; F27-H59 WeakPolarHBondContact O-CA 3.41Å; L28-H59 HydrophobicContact CD2-CB 4.31Å; H59-Y95 HydrophobicContact CB-CE1 4.01Å; H59-Y95 AromaticContact CD2-CE1 3.91Å; H59-Y95 AromaticContact CD2-CZ 3.91Å; H59-Y95 PolarHBondContact CD2-OH 3.38Å
60D94.6Very high92.8Very high21 Ų2145 Ų4511%0.11225%0.246CC..EExtended strand (participates in β ladder)trans-125.6101.9176.4-158.540.3000109.1G26 F27 L29 R87G26-D60 CarbonylContact C-O 3.6Å; G26-D60 WeakPolarHBondContact CA-O 3.22Å; F27-D60 PolarHBondContact N-O 2.82Å; F27-D60 PolarHBondContact O-N 2.96Å; L29-D60 HydrophobicContact CD1-CB 4.46Å; D60-R87 IonicContact OD1-CZ 2.72Å; D60-R87 VanDerWaalsContact OD1-CZ 3.31Å; D60-R87 IonicContact OD1-NH1 3.1Å; D60-R87 PolarHBondContact OD1-NH1 3.45Å; D60-R87 IonicContact OD1-NH2 3.63Å; D60-R87 PolarHBondContact OD1-NH2 2.94Å; D60-R87 IonicContact OD2-CZ 3.36Å; D60-R87 IonicContact OD2-NH1 3.51Å; D60-R87 IonicContact OD2-NH2 3.19Å; D60-R87 PolarHBondContact OD2-NH2 3.34Å
61P94.1Very high92.9Very high47 Ų4747.5 Ų47.531%0.30525%0.252SS..EExtended strand (participates in β ladder)trans-71.5136-177.127.1-32.6000111.4H24 Y95H24-P61 WeakPolarHBondContact NE2-CB 3.4Å; P61-Y95 WeakPolarHBondContact CA-OH 3.46Å
62C92.4Very high93.1Very high8 Ų850 Ų505%0.05428%0.275CS..  trans-78.5142.2171.7-67.70000110.6E25 H64 S67E25-C62 HydrophobicContact CG-CB 4.11Å; E25-C62 VanDerWaalsContact O-CB 3.29Å; E25-C62 WeakPolarHBondContact O-CB 3.43Å; E25-C62 PolarHBondContact O-N 2.85Å; C62-H64 VanDerWaalsContact C-N 3.33Å; C62-H64 PolarHBondContact O-N 3.47Å; C62-S67 WeakPolarHBondContact CB-OG 3.38Å
63A84.5Confident93.1Very high101 Ų10148.3 Ų48.384%0.83527%0.268SS*.SBendtrans-67-31.5-176.600000113.6
64H87.1Confident93.2Very high125 Ų12554.4 Ų54.458%0.57929%0.293SS*.SBendtrans-155.4160.9177.455.8-77.1000110C62 S67C62-H64 VanDerWaalsContact C-N 3.33Å; C62-H64 PolarHBondContact O-N 3.47Å; H64-S67 VanDerWaalsContact O-CB 3.27Å; H64-S67 WeakPolarHBondContact O-CB 3.26Å; H64-S67 PolarHBondContact O-OG 3.45Å; H64-S67 VanDerWaalsContact O-OG 3.07Å
65L90.1Very high93.3Very high43 Ų4354.8 Ų54.823%0.22530%0.296CS..THydrogen-bonded Turntrans-61.3149.7171.3-63.6173.2000110.6D23 E25 S67D23-L65 HydrophobicContact CB-CD1 3.95Å; D23-L65 HydrophobicContact CB-CD2 3.99Å; E25-L65 HydrophobicContact CG-CD2 4.14Å; E25-L65 WeakPolarHBondContact OE1-CA 3.21Å; L65-S67 PolarHBondContact O-N 3.08Å
66F92.1Very high93.2Very high63 Ų6353.6 Ų53.628%0.27630%0.295SS..THydrogen-bonded Turntrans64.922.7-179.5-51.3-89.3000113.4E25 Y69 F71E25-F66 PolarHBondContact OE1-N 2.94Å; F66-Y69 CarbonylContact C-O 3.56Å; F66-Y69 WeakPolarHBondContact CA-O 3.48Å; F66-Y69 HydrophobicContact CB-CE2 4.4Å; F66-Y69 WeakPolarHBondContact CB-O 3.38Å; F66-Y69 AromaticContact CD1-CD2 3.75Å; F66-Y69 HydrophobicContact CD1-CD2 3.75Å; F66-Y69 AromaticContact CD1-CE2 3.24Å; F66-Y69 HydrophobicContact CD1-CE2 3.24Å; F66-Y69 HydrophobicContact CE1-CD2 4.34Å; F66-Y69 AromaticContact CE1-CE2 3.62Å; F66-Y69 HydrophobicContact CE1-CE2 3.62Å; F66-Y69 AromaticContact CG-CE2 3.94Å; F66-Y69 HydrophobicContact CG-CE2 3.94Å; F66-Y69 VanDerWaalsContact O-O 3.13Å; F66-F71 HydrophobicContact CD1-CD1 4.36Å; F66-F71 HydrophobicContact CE1-CD1 4.05Å; F66-F71 HydrophobicContact CE1-CE1 4.5Å; F66-F71 HydrophobicContact CZ-CD1 4.31Å; F66-F71 HydrophobicContact CZ-CE1 4.47Å
67S92.7Very high93Very high13 Ų1357.7 Ų57.79%0.09131%0.314CS..SBendtrans-68.7-37178.649.20000112.4C62 H64 L65 N79C62-S67 WeakPolarHBondContact CB-OG 3.38Å; H64-S67 VanDerWaalsContact O-CB 3.27Å; H64-S67 WeakPolarHBondContact O-CB 3.26Å; H64-S67 PolarHBondContact O-OG 3.45Å; H64-S67 VanDerWaalsContact O-OG 3.07Å; L65-S67 PolarHBondContact O-N 3.08Å; S67-N79 WeakPolarHBondContact O-CB 3.24Å; S67-N79 PolarHBondContact O-ND2 2.98Å
68F94.7Very high92.9Very high1 Ų160.8 Ų60.80%0.00433%0.329CS..SBendtrans-115.74.4-178.564.8-86.3000114.2E25 F27 V75 S76 I83 W94 I112 L116E25-F68 HydrophobicContact CG-CE1 4.35Å; F27-F68 HydrophobicContact CE2-CD1 4.16Å; F27-F68 HydrophobicContact CE2-CE1 4.26Å; F27-F68 HydrophobicContact CZ-CD1 4.07Å; F27-F68 HydrophobicContact CZ-CD2 4.16Å; F27-F68 HydrophobicContact CZ-CE1 4.05Å; F27-F68 HydrophobicContact CZ-CE2 4.14Å; F27-F68 HydrophobicContact CZ-CG 4.13Å; F27-F68 HydrophobicContact CZ-CZ 4.09Å; F68-V75 HydrophobicContact CD2-CG1 4.21Å; F68-V75 WeakPolarHBondContact O-CA 3.34Å; F68-S76 PolarHBondContact O-N 3.09Å; F68-I83 HydrophobicContact CB-CD1 3.95Å; F68-W94 HydrophobicContact CZ-CE3 4.37Å; F68-W94 HydrophobicContact CZ-CZ3 4.44Å; F68-I112 HydrophobicContact CE2-CG2 3.81Å; F68-I112 HydrophobicContact CZ-CG2 4.32Å; F68-L116 HydrophobicContact CD2-CD2 4.26Å; F68-L116 HydrophobicContact CE2-CD1 4.04Å; F68-L116 HydrophobicContact CE2-CD2 4.08Å; F68-L116 HydrophobicContact CE2-CG 4.39Å
69Y95.1Very high92.7Very high5 Ų560.1 Ų60.12%0.0233%0.325CS..BIsolated β-bridgetrans-149153179.563.6-92.1000112E25 F66 K74 R96 I112E25-Y69 VanDerWaalsContact OE1-CE1 3.22Å; E25-Y69 WeakPolarHBondContact OE1-CE1 3.34Å; E25-Y69 PolarHBondContact OE1-OH 3.32Å; E25-Y69 WeakPolarHBondContact OE2-CE1 3.43Å; E25-Y69 PolarHBondContact OE2-OH 2.82Å; F66-Y69 CarbonylContact C-O 3.56Å; F66-Y69 WeakPolarHBondContact CA-O 3.48Å; F66-Y69 HydrophobicContact CB-CE2 4.4Å; F66-Y69 WeakPolarHBondContact CB-O 3.38Å; F66-Y69 AromaticContact CD1-CD2 3.75Å; F66-Y69 HydrophobicContact CD1-CD2 3.75Å; F66-Y69 AromaticContact CD1-CE2 3.24Å; F66-Y69 HydrophobicContact CD1-CE2 3.24Å; F66-Y69 HydrophobicContact CE1-CD2 4.34Å; F66-Y69 AromaticContact CE1-CE2 3.62Å; F66-Y69 HydrophobicContact CE1-CE2 3.62Å; F66-Y69 AromaticContact CG-CE2 3.94Å; F66-Y69 HydrophobicContact CG-CE2 3.94Å; F66-Y69 VanDerWaalsContact O-O 3.13Å; Y69-K74 CarbonylContact C-O 3.59Å; Y69-K74 WeakPolarHBondContact CA-O 3.49Å; Y69-K74 WeakPolarHBondContact CB-O 3.48Å; Y69-R96 PolarHBondContact OH-NH1 2.87Å; Y69-I112 HydrophobicContact CD1-CD1 3.76Å; Y69-I112 HydrophobicContact CD2-CD1 3.7Å; Y69-I112 HydrophobicContact CD2-CG1 4.5Å; Y69-I112 HydrophobicContact CE1-CD1 3.75Å; Y69-I112 HydrophobicContact CE2-CD1 3.73Å; Y69-I112 HydrophobicContact CG-CD1 3.73Å; Y69-I112 HydrophobicContact CG-CG1 4.32Å
70D93.8Very high92.5Very high71 Ų7159.7 Ų59.738%0.3832%0.323SS..  trans-86.7-180-178.372.511.1000113.9A72 G73 K74D70-A72 PolarHBondContact O-N 2.69Å; D70-A72 WeakPolarHBondContact OD1-CA 3.5Å; D70-A72 WeakPolarHBondContact OD1-CB 3.44Å; D70-A72 PolarHBondContact OD1-N 2.93Å; D70-G73 PolarHBondContact O-N 2.83Å; D70-G73 PolarHBondContact OD1-N 3Å; D70-K74 PolarHBondContact N-O 2.7Å; D70-K74 WeakPolarHBondContact OD1-CB 3.36Å; D70-K74 PolarHBondContact OD1-N 3.05Å; D70-K74 WeakPolarHBondContact OD2-CB 3.22Å
71F91.9Very high92.4Very high171 Ų17161.6 Ų61.675%0.7533%0.333SS*.THydrogen-bonded Turntrans-63-26.1178.5-66.5-75.6000113.9F66 R108F66-F71 HydrophobicContact CD1-CD1 4.36Å; F66-F71 HydrophobicContact CE1-CD1 4.05Å; F66-F71 HydrophobicContact CE1-CE1 4.5Å; F66-F71 HydrophobicContact CZ-CD1 4.31Å; F66-F71 HydrophobicContact CZ-CE1 4.47Å; F71-R108 PolarHBondContact O-NH2 3.11Å
72A91.5Very high92.3Very high83 Ų8363.2 Ų63.269%0.68635%0.346SS*.THydrogen-bonded Turntrans-79.1-7.4174.200000112.5D70D70-A72 PolarHBondContact O-N 2.69Å; D70-A72 WeakPolarHBondContact OD1-CA 3.5Å; D70-A72 WeakPolarHBondContact OD1-CB 3.44Å; D70-A72 PolarHBondContact OD1-N 2.93Å
73G90.7Very high92.3Very high2 Ų264.7 Ų64.72%0.02135%0.353CS..  trans81.417.2-177.400000113.5D70 Q115D70-G73 PolarHBondContact O-N 2.83Å; D70-G73 PolarHBondContact OD1-N 3Å; G73-Q115 PolarHBondContact O-NE2 3.28Å
74K95.4Very high92.7Very high140 Ų14059.9 Ų59.961%0.60931%0.313SS*.  trans-80.3125.4173.9-171.8-178.2178.7-176.70109.7Y69 D70Y69-K74 CarbonylContact C-O 3.59Å; Y69-K74 WeakPolarHBondContact CA-O 3.49Å; Y69-K74 WeakPolarHBondContact CB-O 3.48Å; D70-K74 PolarHBondContact N-O 2.7Å; D70-K74 WeakPolarHBondContact OD1-CB 3.36Å; D70-K74 PolarHBondContact OD1-N 3.05Å; D70-K74 WeakPolarHBondContact OD2-CB 3.22Å
75V96.1Very high92.9Very high11 Ų1161 Ų617%0.06732%0.316CS..BIsolated β-bridgetrans-78.8131.6-179.6178.30000110.1F68 L80 I112 Q115 L116 L119F68-V75 HydrophobicContact CD2-CG1 4.21Å; F68-V75 WeakPolarHBondContact O-CA 3.34Å; V75-L80 HydrophobicContact CG1-CD2 4.4Å; V75-I112 HydrophobicContact CG2-CG2 4.24Å; V75-Q115 HydrophobicContact CB-CB 4.2Å; V75-Q115 HydrophobicContact CG2-CB 3.73Å; V75-L116 HydrophobicContact CG1-CD2 4.12Å; V75-L119 HydrophobicContact CB-CD1 3.78Å; V75-L119 HydrophobicContact CG1-CD1 3.51Å
76S94.6Very high92.9Very high40 Ų4066.4 Ų66.428%0.2835%0.345SS..  trans-93.1116173.7175.70000110F68 E78 N79 L80F68-S76 PolarHBondContact O-N 3.09Å; S76-E78 VanDerWaalsContact C-N 3.31Å; S76-E78 PolarHBondContact O-N 2.84Å; S76-N79 PolarHBondContact O-N 3.16Å; S76-L80 WeakPolarHBondContact O-CB 3.28Å; S76-L80 PolarHBondContact O-N 3.44Å
77E93.2Very high92.9Very high88 Ų8868.1 Ų68.141%0.41135%0.35SS..Hα-helixtrans-65.7-34.1178.8-179.6164.6-158.300112.5L80 N81 R88E77-L80 PolarHBondContact O-N 3.4Å; E77-N81 WeakPolarHBondContact O-CB 3.27Å; E77-N81 VanDerWaalsContact O-CG 3.25Å; E77-N81 PolarHBondContact O-N 2.98Å; E77-N81 PolarHBondContact O-ND2 3.11Å; E77-R88 IonicContact OE1-CZ 3.6Å; E77-R88 IonicContact OE1-NH1 3Å; E77-R88 PolarHBondContact OE1-NH1 3.23Å; E77-R88 VanDerWaalsContact OE1-NH1 3.11Å; E77-R88 IonicContact OE1-NH2 3.58Å; E77-R88 PolarHBondContact OE1-NH2 3.41Å
78E93.6Very high92.8Very high153 Ų15370.5 Ų70.572%0.71536%0.357SS*.Hα-helixtrans-61.8-49.4176.8-175.9-180179.300111.3S76 L80 N81 S82S76-E78 VanDerWaalsContact C-N 3.31Å; S76-E78 PolarHBondContact O-N 2.84Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 2.96Å; E78-N81 PolarHBondContact O-N 3.27Å; E78-S82 PolarHBondContact O-N 3.07Å
79N92.2Very high92.6Very high68 Ų6879.7 Ų79.736%0.36440%0.397SS..Hα-helixtrans-65.1-40.8178.3-67.35.2000111S67 S76 N81 S82 I83S67-N79 WeakPolarHBondContact O-CB 3.24Å; S67-N79 PolarHBondContact O-ND2 2.98Å; S76-N79 PolarHBondContact O-N 3.16Å; N79-N81 VanDerWaalsContact C-N 3.32Å; N79-N81 PolarHBondContact O-N 3.38Å; N79-S82 PolarHBondContact O-N 2.88Å; N79-I83 WeakPolarHBondContact O-CD1 3.35Å; N79-I83 VanDerWaalsContact O-CG1 3.28Å; N79-I83 WeakPolarHBondContact O-CG1 3.46Å; N79-I83 PolarHBondContact O-N 3.1Å
80L92.6Very high92.6Very high0 Ų083.4 Ų83.40%042%0.417CS..Hα-helixtrans-58.9-44.5176.6-174.164000111.3F27 V75 S76 E77 E78 I83 L84 L116 L119 L120F27-L80 HydrophobicContact CE1-CD1 3.85Å; F27-L80 HydrophobicContact CE2-CD1 4.07Å; F27-L80 HydrophobicContact CZ-CD1 3.35Å; V75-L80 HydrophobicContact CG1-CD2 4.4Å; S76-L80 WeakPolarHBondContact O-CB 3.28Å; S76-L80 PolarHBondContact O-N 3.44Å; E77-L80 PolarHBondContact O-N 3.4Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 2.96Å; L80-I83 PolarHBondContact O-N 2.96Å; L80-L84 HydrophobicContact CD1-CD1 3.62Å; L80-L84 HydrophobicContact CD1-CG 4.25Å; L80-L84 HydrophobicContact CG-CD1 3.91Å; L80-L84 WeakPolarHBondContact O-CB 3.36Å; L80-L84 WeakPolarHBondContact O-CG 3.05Å; L80-L84 PolarHBondContact O-N 3.46Å; L80-L116 HydrophobicContact CD1-CD2 4.07Å; L80-L116 HydrophobicContact CD2-CD2 4.08Å; L80-L119 HydrophobicContact CD2-CB 4.44Å; L80-L120 HydrophobicContact CD2-CD2 3.85Å; L80-L120 HydrophobicContact CD2-CG 4.3Å; L80-L120 HydrophobicContact CG-CD2 4.4Å
81N92.1Very high92.7Very high61 Ų6180.1 Ų80.133%0.32640%0.4SS..Hα-helixtrans-66.2-38.5175.5-74.1-30.2000112.5E77 E78 N79 I83 K85 R88E77-N81 WeakPolarHBondContact O-CB 3.27Å; E77-N81 VanDerWaalsContact O-CG 3.25Å; E77-N81 PolarHBondContact O-N 2.98Å; E77-N81 PolarHBondContact O-ND2 3.11Å; E78-N81 PolarHBondContact O-N 3.27Å; N79-N81 VanDerWaalsContact C-N 3.32Å; N79-N81 PolarHBondContact O-N 3.38Å; N81-I83 VanDerWaalsContact C-N 3.29Å; N81-I83 PolarHBondContact O-N 2.88Å; N81-K85 WeakPolarHBondContact O-CA 3.33Å; N81-K85 PolarHBondContact O-N 3.48Å; N81-R88 PolarHBondContact OD1-NH1 3.14Å
82S93Very high92.9Very high81 Ų8172.5 Ų72.557%0.56637%0.366SS*.Hα-helixtrans-64.3-33.9176.7-177.10000112.8E78 N79 K85E78-S82 PolarHBondContact O-N 3.07Å; N79-S82 PolarHBondContact O-N 2.88Å; S82-K85 WeakPolarHBondContact O-CE 3.4Å; S82-K85 WeakPolarHBondContact O-CG 3.37Å
83I92.3Very high93.1Very high39 Ų3968.5 Ų68.520%0.233%0.334CS..Hα-helixtrans-78.6-54.3179.6-66.5163000110.1F27 F68 N79 L80 N81F27-I83 HydrophobicContact CD2-CG2 4.43Å; F27-I83 HydrophobicContact CE2-CG2 4.3Å; F68-I83 HydrophobicContact CB-CD1 3.95Å; N79-I83 WeakPolarHBondContact O-CD1 3.35Å; N79-I83 VanDerWaalsContact O-CG1 3.28Å; N79-I83 WeakPolarHBondContact O-CG1 3.46Å; N79-I83 PolarHBondContact O-N 3.1Å; L80-I83 PolarHBondContact O-N 2.96Å; N81-I83 VanDerWaalsContact C-N 3.29Å; N81-I83 PolarHBondContact O-N 2.88Å
84L91.3Very high93.4Very high0 Ų068.5 Ų68.50%033%0.333CS..Hα-helixtrans-76.4-31.9-172.6-66.8175.4000113.2F27 L80 D86 R87 R88 V91 L120F27-L84 HydrophobicContact CB-CD2 3.98Å; F27-L84 HydrophobicContact CD1-CD2 4.34Å; F27-L84 HydrophobicContact CD2-CD2 3.71Å; F27-L84 HydrophobicContact CD2-CG 4.42Å; F27-L84 HydrophobicContact CE2-CD2 4.3Å; F27-L84 HydrophobicContact CG-CD2 3.73Å; L80-L84 HydrophobicContact CD1-CD1 3.62Å; L80-L84 HydrophobicContact CD1-CG 4.25Å; L80-L84 HydrophobicContact CG-CD1 3.91Å; L80-L84 WeakPolarHBondContact O-CB 3.36Å; L80-L84 WeakPolarHBondContact O-CG 3.05Å; L80-L84 PolarHBondContact O-N 3.46Å; L84-D86 PolarHBondContact O-N 3.38Å; L84-R87 WeakPolarHBondContact O-CB 3.19Å; L84-R87 PolarHBondContact O-N 3.38Å; L84-R88 HydrophobicContact CB-CB 4.18Å; L84-R88 HydrophobicContact CD1-CB 4.44Å; L84-R88 HydrophobicContact CD1-CG 4.33Å; L84-V91 HydrophobicContact CD1-CG2 3.89Å; L84-V91 HydrophobicContact CD2-CG2 3.69Å; L84-V91 HydrophobicContact CG-CG2 4.38Å; L84-L120 HydrophobicContact CD1-CD2 3.81Å
85K91.9Very high93.5Very high148 Ų14861.8 Ų61.864%0.64330%0.304SS*.G310 helixtrans48-129.8-177.1-54.5179.6-177.5176.50110.5N81 S82 R87 R88N81-K85 WeakPolarHBondContact O-CA 3.33Å; N81-K85 PolarHBondContact O-N 3.48Å; S82-K85 WeakPolarHBondContact O-CE 3.4Å; S82-K85 WeakPolarHBondContact O-CG 3.37Å; K85-R87 PolarHBondContact O-N 2.82Å; K85-R88 PolarHBondContact O-N 3.02Å
86D90.9Very high93.6Very high157 Ų15762 Ų6284%0.8430%0.303SS*.G310 helixtrans-68.5-15-178.8-54.6-40.3000113.8L84 R88L84-D86 PolarHBondContact O-N 3.38Å; D86-R88 VanDerWaalsContact C-N 3.3Å; D86-R88 PolarHBondContact O-N 2.92Å
87R90.8Very high93.7Very high98 Ų9860.4 Ų60.437%0.3729%0.291SS..G310 helixtrans-83.1-3.1-176.2-59175.7-73.51724113.4L29 D60 L84 K85 K89 N90L29-R87 HydrophobicContact CD1-CB 4.4Å; L29-R87 HydrophobicContact CD2-CB 4.45Å; D60-R87 IonicContact OD1-CZ 2.72Å; D60-R87 VanDerWaalsContact OD1-CZ 3.31Å; D60-R87 IonicContact OD1-NH1 3.1Å; D60-R87 PolarHBondContact OD1-NH1 3.45Å; D60-R87 IonicContact OD1-NH2 3.63Å; D60-R87 PolarHBondContact OD1-NH2 2.94Å; D60-R87 IonicContact OD2-CZ 3.36Å; D60-R87 IonicContact OD2-NH1 3.51Å; D60-R87 IonicContact OD2-NH2 3.19Å; D60-R87 PolarHBondContact OD2-NH2 3.34Å; L84-R87 WeakPolarHBondContact O-CB 3.19Å; L84-R87 PolarHBondContact O-N 3.38Å; K85-R87 PolarHBondContact O-N 2.82Å; R87-K89 PolarHBondContact O-N 3.2Å; R87-K89 VanDerWaalsContact O-N 3.09Å; R87-N90 PolarHBondContact O-N 3.47Å
88R91Very high93.8Very high64 Ų6457.5 Ų57.524%0.24228%0.276CS..G310 helixtrans-51.9-34.5-179.5-176.4175.5177174-1.5113E77 N81 L84 K85 D86 N90 V91 L119 L120E77-R88 IonicContact OE1-CZ 3.6Å; E77-R88 IonicContact OE1-NH1 3Å; E77-R88 PolarHBondContact OE1-NH1 3.23Å; E77-R88 VanDerWaalsContact OE1-NH1 3.11Å; E77-R88 IonicContact OE1-NH2 3.58Å; E77-R88 PolarHBondContact OE1-NH2 3.41Å; N81-R88 PolarHBondContact OD1-NH1 3.14Å; L84-R88 HydrophobicContact CB-CB 4.18Å; L84-R88 HydrophobicContact CD1-CB 4.44Å; L84-R88 HydrophobicContact CD1-CG 4.33Å; K85-R88 PolarHBondContact O-N 3.02Å; D86-R88 VanDerWaalsContact C-N 3.3Å; D86-R88 PolarHBondContact O-N 2.92Å; R88-N90 VanDerWaalsContact C-N 3.28Å; R88-N90 PolarHBondContact O-N 3.05Å; R88-V91 PolarHBondContact O-N 3.27Å; R88-L119 PolarHBondContact NH2-O 3.23Å; R88-L120 HydrophobicContact CG-CD2 3.9Å
89K90.9Very high93.7Very high193 Ų19354 Ų5484%0.83926%0.257SS*.G310 helixtrans-68.6-25-179.2-63.9-178.4-178.9177.80113.8R87R87-K89 PolarHBondContact O-N 3.2Å; R87-K89 VanDerWaalsContact O-N 3.09Å
90N94.2Very high93.6Very high83 Ų8356 Ų5644%0.44427%0.267SS..G310 helixtrans-97.34.5-174.8-56.6-1.3000111.3L29 G30 R87 R88 I92L29-N90 CarbonylContact C-O 3.53Å; L29-N90 VanDerWaalsContact CA-O 3.24Å; L29-N90 WeakPolarHBondContact CA-O 3.49Å; L29-N90 HydrophobicContact CD2-CB 4.44Å; G30-N90 PolarHBondContact N-O 3.37Å; R87-N90 PolarHBondContact O-N 3.47Å; R88-N90 VanDerWaalsContact C-N 3.28Å; R88-N90 PolarHBondContact O-N 3.05Å; N90-I92 PolarHBondContact O-N 3.22Å
91V96.3Very high93.6Very high3 Ų358.3 Ų58.32%0.01828%0.282CS..EExtended strand (participates in β ladder)trans-76.4117.2-180-179.60000109.1F27 L29 L84 R88 G93 L120 L125F27-V91 HydrophobicContact CD1-CG1 4.12Å; L29-V91 HydrophobicContact CD2-CB 4.4Å; L29-V91 HydrophobicContact CD2-CG2 3.61Å; L84-V91 HydrophobicContact CD1-CG2 3.89Å; L84-V91 HydrophobicContact CD2-CG2 3.69Å; L84-V91 HydrophobicContact CG-CG2 4.38Å; R88-V91 PolarHBondContact O-N 3.27Å; V91-G93 WeakPolarHBondContact CG1-O 3.1Å; V91-L120 HydrophobicContact CB-CD1 4.46Å; V91-L120 HydrophobicContact CG1-CD1 3.79Å; V91-L125 HydrophobicContact CG1-CD1 4.36Å
92I96Very high93.7Very high10 Ų1062.4 Ų62.45%0.05130%0.299CS..EExtended strand (participates in β ladder)trans-111.1-12.6178.555.2166.9000112L28 G30 V32 V54 E55 I56 N90 V126L28-I92 HydrophobicContact CB-CG1 4.46Å; L28-I92 PolarHBondContact O-N 3.47Å; G30-I92 VanDerWaalsContact O-CG2 3.27Å; G30-I92 WeakPolarHBondContact O-CG2 3.39Å; V32-I92 HydrophobicContact CG2-CB 4.26Å; V32-I92 HydrophobicContact CG2-CG2 3.8Å; V54-I92 HydrophobicContact CG1-CD1 3.77Å; E55-I92 WeakPolarHBondContact O-CD1 3.33Å; I56-I92 HydrophobicContact CB-CD1 4.46Å; I56-I92 HydrophobicContact CG1-CD1 3.85Å; N90-I92 PolarHBondContact O-N 3.22Å; I92-V126 PolarHBondContact O-N 3.17Å; I92-V126 VanDerWaalsContact O-N 3.08Å
93G96.4Very high93.7Very high0 Ų059.7 Ų59.70%028%0.277CS..EExtended strand (participates in β ladder)trans-171.4-173.7-179.300000113.6L28 V91 V126L28-G93 PolarHBondContact N-O 2.73Å; L28-G93 PolarHBondContact O-N 2.77Å; V91-G93 WeakPolarHBondContact CG1-O 3.1Å; G93-V126 CarbonylContact C-O 3.56Å; G93-V126 WeakPolarHBondContact CA-O 3.42Å
94W97.6Very high93.8Very high1 Ų163 Ų630%0.00429%0.292CS..EExtended strand (participates in β ladder)trans-143.7161.6171.672.2-60.1000109.7G26 F27 F68 E109 I112 H113 L116 V126 F127 L128G26-W94 CarbonylContact O-C 3.55Å; G26-W94 WeakPolarHBondContact O-CA 3.24Å; G26-W94 WeakPolarHBondContact O-CB 3.38Å; F27-W94 HydrophobicContact CD1-CB 4.02Å; F27-W94 HydrophobicContact CE1-CB 4.36Å; F68-W94 HydrophobicContact CZ-CE3 4.37Å; F68-W94 HydrophobicContact CZ-CZ3 4.44Å; W94-E109 HydrophobicContact CH2-CB 4.15Å; W94-E109 HydrophobicContact CH2-CG 3.87Å; W94-E109 HydrophobicContact CZ2-CB 4.21Å; W94-E109 HydrophobicContact CZ2-CG 4.36Å; W94-I112 HydrophobicContact CH2-CB 4.13Å; W94-I112 HydrophobicContact CH2-CG2 3.8Å; W94-I112 HydrophobicContact CZ2-CB 4.33Å; W94-I112 HydrophobicContact CZ2-CG2 4.02Å; W94-I112 HydrophobicContact CZ3-CG2 4.2Å; W94-H113 AromaticContact CD1-ND1 3.83Å; W94-H113 HydrophobicContact CZ2-CB 4.19Å; W94-H113 AromaticContact NE1-CG 3.94Å; W94-H113 AromaticContact NE1-ND1 3.21Å; W94-H113 PolarHBondContact NE1-ND1 3.48Å; W94-L116 HydrophobicContact CB-CD1 4.47Å; W94-L116 HydrophobicContact CD2-CD1 3.94Å; W94-L116 HydrophobicContact CE3-CD1 4.48Å; W94-L116 HydrophobicContact CG-CD1 3.93Å; W94-V126 PolarHBondContact N-O 2.9Å; W94-F127 AromaticContact CD1-CD2 3.78Å; W94-F127 AromaticContact CD2-CD2 3.65Å; W94-F127 HydrophobicContact CD2-CD2 3.65Å; W94-F127 AromaticContact CD2-CE2 3.91Å; W94-F127 HydrophobicContact CD2-CE2 3.91Å; W94-F127 AromaticContact CE2-CD2 3.25Å; W94-F127 AromaticContact CE2-CE2 3.66Å; W94-F127 HydrophobicContact CE3-CD2 4.29Å; W94-F127 HydrophobicContact CE3-CE2 4.07Å; W94-F127 HydrophobicContact CG-CD2 4Å; W94-F127 HydrophobicContact CH2-CD2 4.28Å; W94-F127 AromaticContact CH2-CE2 3.85Å; W94-F127 HydrophobicContact CH2-CE2 3.85Å; W94-F127 AromaticContact CZ2-CD2 3.61Å; W94-F127 HydrophobicContact CZ2-CD2 3.61Å; W94-F127 AromaticContact CZ2-CE2 3.63Å; W94-F127 HydrophobicContact CZ2-CE2 3.63Å; W94-F127 HydrophobicContact CZ2-CG 4.34Å; W94-F127 HydrophobicContact CZ2-CZ 4.4Å; W94-F127 HydrophobicContact CZ3-CE2 4.05Å; W94-F127 AromaticContact NE1-CD2 3.28Å; W94-F127 VanDerWaalsContact NE1-CD2 3.28Å; W94-F127 AromaticContact NE1-CG 3.81Å; W94-F127 CarbonylContact O-C 3.53Å; W94-F127 WeakPolarHBondContact O-CA 3.37Å; W94-L128 PolarHBondContact O-N 3.13Å
95Y97.6Very high93.9Very high0 Ų063.3 Ų63.30%029%0.293CS..EExtended strand (participates in β ladder)trans-132154.1-179.374.3-89.2000111.7V13 H24 E25 G26 L28 H59 P61 L128 F130V13-Y95 HydrophobicContact CG1-CD2 3.96Å; V13-Y95 HydrophobicContact CG1-CE2 3.81Å; H24-Y95 AromaticContact CD2-CE2 3.76Å; H24-Y95 AromaticContact NE2-CZ 3.91Å; H24-Y95 PolarHBondContact NE2-OH 3.08Å; E25-Y95 WeakPolarHBondContact CA-O 3.35Å; G26-Y95 VanDerWaalsContact C-CD1 3.49Å; G26-Y95 VanDerWaalsContact C-CE1 3.41Å; G26-Y95 PolarHBondContact N-O 3.02Å; G26-Y95 VanDerWaalsContact N-O 3.12Å; G26-Y95 WeakPolarHBondContact O-CD1 3.46Å; G26-Y95 PolarHBondContact O-N 3.21Å; L28-Y95 HydrophobicContact CD2-CD1 3.72Å; L28-Y95 HydrophobicContact CD2-CG 4.36Å; L28-Y95 HydrophobicContact CG-CD1 4.2Å; H59-Y95 HydrophobicContact CB-CE1 4.01Å; H59-Y95 AromaticContact CD2-CE1 3.91Å; H59-Y95 AromaticContact CD2-CZ 3.91Å; H59-Y95 PolarHBondContact CD2-OH 3.38Å; P61-Y95 WeakPolarHBondContact CA-OH 3.46Å; Y95-L128 CarbonylContact C-O 3.57Å; Y95-L128 WeakPolarHBondContact CA-O 3.44Å; Y95-L128 VanDerWaalsContact CB-O 3.29Å; Y95-L128 WeakPolarHBondContact CB-O 3.37Å; Y95-F130 HydrophobicContact CD2-CD2 4.44Å; Y95-F130 HydrophobicContact CD2-CE2 4.3Å
96R97.3Very high94Very high16 Ų1658.1 Ų58.16%0.0628%0.276CS..EExtended strand (participates in β ladder)trans-135.2138.1168.7-162-170.7-176.188.23.7110D23 H24 E25 Y69 E109 F127 L128 F130D23-R96 IonicContact OD2-CZ 3.83Å; D23-R96 IonicContact OD2-NE 3.87Å; D23-R96 PolarHBondContact OD2-NE 2.84Å; D23-R96 IonicContact OD2-NH2 3.67Å; D23-R96 PolarHBondContact OD2-NH2 2.82Å; H24-R96 CarbonylContact O-C 3.58Å; H24-R96 WeakPolarHBondContact O-CA 3.33Å; E25-R96 HydrophobicContact CB-CG 4.35Å; E25-R96 IonicContact OE2-CZ 3.26Å; E25-R96 IonicContact OE2-NH1 3.58Å; E25-R96 PolarHBondContact OE2-NH1 3.29Å; Y69-R96 PolarHBondContact OH-NH1 2.87Å; R96-E109 WeakPolarHBondContact CD-OE1 3.44Å; R96-E109 IonicContact NE-OE1 3.95Å; R96-F127 HydrophobicContact CB-CE2 3.85Å; R96-F127 HydrophobicContact CB-CZ 3.83Å; R96-L128 PolarHBondContact N-O 2.88Å; R96-F130 PolarHBondContact O-N 2.87Å
97F96.5Very high94.1Very high5 Ų558.2 Ų58.22%0.02227%0.269CS..EExtended strand (participates in β ladder)trans-108.2130.1172.2179.5-86.1000110.2S17 D23 H24 R99 F130 F132 L143S17-F97 VanDerWaalsContact CB-CG 3.49Å; D23-F97 WeakPolarHBondContact CA-O 3.41Å; H24-F97 HydrophobicContact CB-CB 4.21Å; H24-F97 PolarHBondContact N-O 3.11Å; H24-F97 VanDerWaalsContact N-O 3.16Å; H24-F97 PolarHBondContact O-N 2.87Å; F97-R99 HydrophobicContact CE1-CG 3.65Å; F97-R99 HydrophobicContact CZ-CG 4.3Å; F97-F130 HydrophobicContact CB-CB 4.25Å; F97-F130 HydrophobicContact CD2-CB 3.54Å; F97-F130 HydrophobicContact CD2-CG 4.27Å; F97-F130 HydrophobicContact CE2-CB 4.34Å; F97-F130 HydrophobicContact CG-CB 4.26Å; F97-F132 HydrophobicContact CE1-CB 4.42Å; F97-F132 HydrophobicContact CE2-CB 4.03Å; F97-F132 HydrophobicContact CZ-CB 3.55Å; F97-F132 HydrophobicContact CZ-CG 4.33Å; F97-L143 HydrophobicContact CD2-CD1 4.35Å; F97-L143 HydrophobicContact CE2-CD1 3.69Å
98R95.4Very high94.2Very high27 Ų2758 Ų5810%0.10227%0.268CS..EExtended strand (participates in β ladder)trans-127.1162.1176.3-63-179.5177.1165.4-2.4110.7T101 Q104 S106 E109 L129 F130 S131 F132R98-T101 HydrophobicContact CB-CG2 4.01Å; R98-T101 WeakPolarHBondContact CB-OG1 3.28Å; R98-T101 WeakPolarHBondContact CD-OG1 3.49Å; R98-Q104 PolarHBondContact NH1-O 3.39Å; R98-Q104 VanDerWaalsContact NH1-O 3.17Å; R98-S106 PolarHBondContact NH2-OG 3.45Å; R98-E109 IonicContact CZ-OE1 3.86Å; R98-E109 IonicContact CZ-OE2 2.61Å; R98-E109 IonicContact NE-OE1 3.04Å; R98-E109 PolarHBondContact NE-OE1 3.2Å; R98-E109 IonicContact NH1-OE1 2.69Å; R98-E109 IonicContact NH1-OE2 2.66Å; R98-E109 IonicContact NH2-OE1 2.87Å; R98-E109 PolarHBondContact NH2-OE1 2.96Å; R98-E109 IonicContact NH2-OE2 3.15Å; R98-E109 PolarHBondContact NH2-OE2 2.98Å; R98-L129 HydrophobicContact CG-CD1 4.34Å; R98-F130 PolarHBondContact N-O 3.46Å; R98-S131 WeakPolarHBondContact O-CA 3.35Å; R98-F132 PolarHBondContact O-N 3.34Å
99R92.3Very high94.4Very high79 Ų7955 Ų5530%0.29826%0.257SS..EExtended strand (participates in β ladder)trans-119130.8177.3-66.8-176.6158.4126.5-1.8111.1A18 S20 N21 F97 T101 F132A18-R99 PolarHBondContact O-NH2 3.31Å; S20-R99 PolarHBondContact O-NH1 2.91Å; S20-R99 PolarHBondContact O-NH2 3.21Å; N21-R99 VanDerWaalsContact C-NH1 3.31Å; F97-R99 HydrophobicContact CE1-CG 3.65Å; F97-R99 HydrophobicContact CZ-CG 4.3Å; R99-T101 VanDerWaalsContact C-N 3.3Å; R99-T101 WeakPolarHBondContact O-CG2 3.35Å; R99-T101 PolarHBondContact O-N 3.17Å; R99-F132 HydrophobicContact CG-CB 4.44Å
100N89.9Confident94.5Very high110 Ų11049 Ų4959%0.58823%0.232SC*.SBendtrans55.243.5176.3-55.3-58.4000112.7F132N100-F132 PolarHBondContact N-O 3.36Å; N100-F132 PolarHBondContact OD1-O 3.38Å
101T92.9Very high94.5Very high50 Ų5047.5 Ų47.531%0.30722%0.223SC..  trans-123.7164.4179.770.30000112.4R98 R99 S131R98-T101 HydrophobicContact CB-CG2 4.01Å; R98-T101 WeakPolarHBondContact CB-OG1 3.28Å; R98-T101 WeakPolarHBondContact CD-OG1 3.49Å; R99-T101 VanDerWaalsContact C-N 3.3Å; R99-T101 WeakPolarHBondContact O-CG2 3.35Å; R99-T101 PolarHBondContact O-N 3.17Å; T101-S131 PolarHBondContact N-OG 2.91Å; T101-S131 PolarHBondContact O-OG 3.17Å; T101-S131 PolarHBondContact OG1-OG 3.42Å
102Q92.8Very high94.4Very high147 Ų14747.3 Ų47.369%0.68722%0.223SC*.  trans-71.6151.3176.3-61.6177.28.400111.8Q104Q102-Q104 PolarHBondContact O-N 3.46Å
103Q93.9Very high94.4Very high23 Ų2347.1 Ų47.111%0.10722%0.221CC..SBendtrans-77.460.9174-69.8-65.7-9.800112.5E144 V146 R158Q103-E144 HydrophobicContact CG-CB 4.22Å; Q103-E144 VanDerWaalsContact CG-OE2 3.29Å; Q103-E144 WeakPolarHBondContact CG-OE2 3.49Å; Q103-E144 PolarHBondContact NE2-O 3.48Å; Q103-V146 HydrophobicContact CB-CG2 4Å; Q103-V146 HydrophobicContact CG-CG2 4.16Å; Q103-R158 PolarHBondContact O-NH2 2.94Å; Q103-R158 VanDerWaalsContact O-NH2 3.08Å
104Q93.4Very high94.2Very high110 Ų11053.8 Ų53.851%0.51425%0.25SS..SBendtrans-139.3139.8179-170.9178.99.400111.2R98 Q102 S106R98-Q104 PolarHBondContact NH1-O 3.39Å; R98-Q104 VanDerWaalsContact NH1-O 3.17Å; Q102-Q104 PolarHBondContact O-N 3.46Å; Q104-S106 PolarHBondContact O-N 3.18Å
105M93.6Very high94.1Very high5 Ų555.7 Ų55.73%0.02526%0.259CS..  trans-62.7126.2171.9-66-17170.300111.2E109 Q110 H113 F127 F148 P150M105-E109 VanDerWaalsContact CA-OE2 3.24Å; M105-E109 WeakPolarHBondContact CA-OE2 3.43Å; M105-E109 HydrophobicContact CE-CB 4.04Å; M105-Q110 HydrophobicContact CB-CG 4.02Å; M105-Q110 HydrophobicContact CE-CG 4.25Å; M105-Q110 PolarHBondContact O-NE2 3.41Å; M105-H113 HydrophobicContact CE-CB 4.25Å; M105-F127 HydrophobicContact CE-CB 4.36Å; M105-F127 HydrophobicContact CE-CD1 3.53Å; M105-F127 HydrophobicContact CE-CE1 4.07Å; M105-F127 HydrophobicContact CE-CG 4.05Å; M105-F127 HydrophobicContact CG-CD1 3.68Å; M105-F127 HydrophobicContact CG-CE1 3.79Å; M105-F127 HydrophobicContact SD-CD1 3.77Å; M105-F127 HydrophobicContact SD-CE1 4.43Å; M105-F148 HydrophobicContact CG-CD1 4.39Å; M105-F148 HydrophobicContact CG-CD2 3.92Å; M105-F148 HydrophobicContact CG-CE2 4.16Å; M105-F148 HydrophobicContact CG-CG 4.03Å; M105-F148 HydrophobicContact CG-CZ 4.48Å; M105-F148 HydrophobicContact SD-CB 3.97Å; M105-F148 HydrophobicContact SD-CD1 4.5Å; M105-F148 HydrophobicContact SD-CD2 4.43Å; M105-F148 HydrophobicContact SD-CG 4.06Å; M105-P150 HydrophobicContact CE-CG 3.92Å; M105-P150 HydrophobicContact SD-CG 3.55Å; M105-P150 VanDerWaalsContact SD-CG 3.55Å
106S94.1Very high94Very high40 Ų4055.7 Ų55.728%0.2826%0.259SS..  trans-73164.5172.971.60000111.5R98 Q104 R108 E109 Q110R98-S106 PolarHBondContact NH2-OG 3.45Å; Q104-S106 PolarHBondContact O-N 3.18Å; S106-R108 VanDerWaalsContact C-N 3.27Å; S106-R108 PolarHBondContact O-N 3.49Å; S106-E109 PolarHBondContact N-OE2 2.89Å; S106-E109 PolarHBondContact O-N 3.43Å; S106-E109 PolarHBondContact OG-N 3.34Å; S106-E109 PolarHBondContact OG-OE2 3.29Å; S106-Q110 WeakPolarHBondContact O-CG 3.48Å; S106-Q110 PolarHBondContact O-N 3.27Å
107F92.8Very high93.8Very high158 Ų15856.4 Ų56.469%0.69327%0.265SS*.Hα-helixtrans-54-43.9174.8179.2-110.3000112.7Q110 I111F107-Q110 PolarHBondContact O-N 3.34Å; F107-I111 HydrophobicContact CD1-CD1 3.82Å; F107-I111 HydrophobicContact CD2-CD1 4.37Å; F107-I111 HydrophobicContact CE1-CD1 3.3Å; F107-I111 HydrophobicContact CE2-CD1 3.92Å; F107-I111 HydrophobicContact CG-CD1 4.34Å; F107-I111 HydrophobicContact CZ-CD1 3.37Å; F107-I111 HydrophobicContact CZ-CG1 4.43Å; F107-I111 WeakPolarHBondContact O-CG1 3.35Å; F107-I111 PolarHBondContact O-N 2.92Å; F107-I111 VanDerWaalsContact O-N 3.15Å
108R94.1Very high93.6Very high94 Ų9463.7 Ų63.736%0.35530%0.3SS..Hα-helixtrans-64.7-42.9178.8-178.3178.5-73148.3-3.7111.6F71 S106 Q110 I111 I112F71-R108 PolarHBondContact O-NH2 3.11Å; S106-R108 VanDerWaalsContact C-N 3.27Å; S106-R108 PolarHBondContact O-N 3.49Å; R108-Q110 VanDerWaalsContact C-N 3.31Å; R108-Q110 PolarHBondContact O-N 3.4Å; R108-I111 PolarHBondContact O-N 3.44Å; R108-I112 HydrophobicContact CG-CD1 3.62Å; R108-I112 HydrophobicContact CG-CG1 4.22Å; R108-I112 WeakPolarHBondContact O-CG1 3.17Å; R108-I112 PolarHBondContact O-N 3.32Å
109E95.1Very high93.5Very high1 Ų164.9 Ų64.91%0.00531%0.307CS..Hα-helixtrans-62.4-39.5177.6-73.7168.5167.400112.3W94 R96 R98 M105 S106 I111 I112 H113 F127W94-E109 HydrophobicContact CH2-CB 4.15Å; W94-E109 HydrophobicContact CH2-CG 3.87Å; W94-E109 HydrophobicContact CZ2-CB 4.21Å; W94-E109 HydrophobicContact CZ2-CG 4.36Å; R96-E109 WeakPolarHBondContact CD-OE1 3.44Å; R96-E109 IonicContact NE-OE1 3.95Å; R98-E109 IonicContact CZ-OE1 3.86Å; R98-E109 IonicContact CZ-OE2 2.61Å; R98-E109 IonicContact NE-OE1 3.04Å; R98-E109 PolarHBondContact NE-OE1 3.2Å; R98-E109 IonicContact NH1-OE1 2.69Å; R98-E109 IonicContact NH1-OE2 2.66Å; R98-E109 IonicContact NH2-OE1 2.87Å; R98-E109 PolarHBondContact NH2-OE1 2.96Å; R98-E109 IonicContact NH2-OE2 3.15Å; R98-E109 PolarHBondContact NH2-OE2 2.98Å; M105-E109 VanDerWaalsContact CA-OE2 3.24Å; M105-E109 WeakPolarHBondContact CA-OE2 3.43Å; M105-E109 HydrophobicContact CE-CB 4.04Å; S106-E109 PolarHBondContact N-OE2 2.89Å; S106-E109 PolarHBondContact O-N 3.43Å; S106-E109 PolarHBondContact OG-N 3.34Å; S106-E109 PolarHBondContact OG-OE2 3.29Å; E109-I111 VanDerWaalsContact C-N 3.32Å; E109-I111 PolarHBondContact O-N 2.87Å; E109-I112 PolarHBondContact O-N 2.98Å; E109-H113 WeakPolarHBondContact O-CB 3.43Å; E109-H113 PolarHBondContact O-N 3.11Å; E109-F127 HydrophobicContact CB-CE1 4.45Å; E109-F127 HydrophobicContact CB-CZ 4.39Å; E109-F127 HydrophobicContact CG-CE1 4.38Å; E109-F127 HydrophobicContact CG-CZ 3.93Å; E109-F127 VanDerWaalsContact OE1-CZ 3.32Å; E109-F127 WeakPolarHBondContact OE1-CZ 3.4Å
110Q92.9Very high93.5Very high66 Ų6662 Ų6231%0.30830%0.298SS..Hα-helixtrans-63.4-39.9176.7-66.7173.636.900111.6M105 S106 F107 R108 K114M105-Q110 HydrophobicContact CB-CG 4.02Å; M105-Q110 HydrophobicContact CE-CG 4.25Å; M105-Q110 PolarHBondContact O-NE2 3.41Å; S106-Q110 WeakPolarHBondContact O-CG 3.48Å; S106-Q110 PolarHBondContact O-N 3.27Å; F107-Q110 PolarHBondContact O-N 3.34Å; R108-Q110 VanDerWaalsContact C-N 3.31Å; R108-Q110 PolarHBondContact O-N 3.4Å; Q110-K114 WeakPolarHBondContact O-CG 3.4Å; Q110-K114 PolarHBondContact O-N 2.84Å
111I93.6Very high93.5Very high52 Ų5259.6 Ų59.627%0.26730%0.299SS..Hα-helixtrans-67.5-47.2176.8-73.1171.4000111.4F107 R108 E109 K114 Q115F107-I111 HydrophobicContact CD1-CD1 3.82Å; F107-I111 HydrophobicContact CD2-CD1 4.37Å; F107-I111 HydrophobicContact CE1-CD1 3.3Å; F107-I111 HydrophobicContact CE2-CD1 3.92Å; F107-I111 HydrophobicContact CG-CD1 4.34Å; F107-I111 HydrophobicContact CZ-CD1 3.37Å; F107-I111 HydrophobicContact CZ-CG1 4.43Å; F107-I111 WeakPolarHBondContact O-CG1 3.35Å; F107-I111 PolarHBondContact O-N 2.92Å; F107-I111 VanDerWaalsContact O-N 3.15Å; R108-I111 PolarHBondContact O-N 3.44Å; E109-I111 VanDerWaalsContact C-N 3.32Å; E109-I111 PolarHBondContact O-N 2.87Å; I111-K114 PolarHBondContact O-N 2.85Å; I111-Q115 PolarHBondContact O-N 3.01Å; I111-Q115 PolarHBondContact O-NE2 2.83Å
112I95.3Very high93.4Very high0 Ų058.8 Ų58.80%029%0.294CS..Hα-helixtrans-63.5-45.8179.6-70.1171.2000109.9F68 Y69 V75 W94 R108 E109 K114 Q115 L116F68-I112 HydrophobicContact CE2-CG2 3.81Å; F68-I112 HydrophobicContact CZ-CG2 4.32Å; Y69-I112 HydrophobicContact CD1-CD1 3.76Å; Y69-I112 HydrophobicContact CD2-CD1 3.7Å; Y69-I112 HydrophobicContact CD2-CG1 4.5Å; Y69-I112 HydrophobicContact CE1-CD1 3.75Å; Y69-I112 HydrophobicContact CE2-CD1 3.73Å; Y69-I112 HydrophobicContact CG-CD1 3.73Å; Y69-I112 HydrophobicContact CG-CG1 4.32Å; V75-I112 HydrophobicContact CG2-CG2 4.24Å; W94-I112 HydrophobicContact CH2-CB 4.13Å; W94-I112 HydrophobicContact CH2-CG2 3.8Å; W94-I112 HydrophobicContact CZ2-CB 4.33Å; W94-I112 HydrophobicContact CZ2-CG2 4.02Å; W94-I112 HydrophobicContact CZ3-CG2 4.2Å; R108-I112 HydrophobicContact CG-CD1 3.62Å; R108-I112 HydrophobicContact CG-CG1 4.22Å; R108-I112 WeakPolarHBondContact O-CG1 3.17Å; R108-I112 PolarHBondContact O-N 3.32Å; E109-I112 PolarHBondContact O-N 2.98Å; I112-K114 VanDerWaalsContact C-N 3.34Å; I112-K114 PolarHBondContact O-N 3.38Å; I112-Q115 PolarHBondContact O-N 2.89Å; I112-Q115 VanDerWaalsContact O-N 3.14Å; I112-L116 HydrophobicContact CG2-CD1 3.69Å; I112-L116 HydrophobicContact CG2-CG 4Å; I112-L116 WeakPolarHBondContact O-CB 3.33Å; I112-L116 WeakPolarHBondContact O-CG 3.34Å; I112-L116 PolarHBondContact O-N 3.44Å
113H95.1Very high93.1Very high6 Ų655.9 Ų55.93%0.02829%0.287CS..Hα-helixtrans-59.2-43.6-179.3-177.874.4000112.4W94 M105 E109 Q115 L116 T117 L125 P150W94-H113 AromaticContact CD1-ND1 3.83Å; W94-H113 HydrophobicContact CZ2-CB 4.19Å; W94-H113 AromaticContact NE1-CG 3.94Å; W94-H113 AromaticContact NE1-ND1 3.21Å; W94-H113 PolarHBondContact NE1-ND1 3.48Å; M105-H113 HydrophobicContact CE-CB 4.25Å; E109-H113 WeakPolarHBondContact O-CB 3.43Å; E109-H113 PolarHBondContact O-N 3.11Å; H113-Q115 VanDerWaalsContact C-N 3.35Å; H113-Q115 PolarHBondContact O-N 3.06Å; H113-L116 PolarHBondContact O-N 2.9Å; H113-T117 WeakPolarHBondContact O-CB 3.42Å; H113-T117 PolarHBondContact O-N 2.83Å; H113-T117 PolarHBondContact O-OG1 2.91Å; H113-L125 PolarHBondContact CE1-O 3.07Å; H113-P150 VanDerWaalsContact CD2-CG 3.49Å; H113-P150 WeakPolarHBondContact CD2-CG 3.46Å; H113-P150 WeakPolarHBondContact NE2-CD 3.32Å; H113-P150 WeakPolarHBondContact NE2-CG 3.46Å
114K92.9Very high92.8Very high139 Ų13956.9 Ų56.960%0.60429%0.294SS*.Hα-helixtrans-60.7-43.3175.4-75.2176.7-179.7-178.90112.2Q110 I111 I112 Q118Q110-K114 WeakPolarHBondContact O-CG 3.4Å; Q110-K114 PolarHBondContact O-N 2.84Å; I111-K114 PolarHBondContact O-N 2.85Å; I112-K114 VanDerWaalsContact C-N 3.34Å; I112-K114 PolarHBondContact O-N 3.38Å; K114-Q118 WeakPolarHBondContact O-CG 3.36Å; K114-Q118 PolarHBondContact O-N 2.81Å
115Q95Very high92.8Very high42 Ų4251.8 Ų51.820%0.19627%0.27CS..Hα-helixtrans-67.7-43.2177.4-74.8173.67600112.1G73 V75 I111 I112 H113 T117 Q118 L119G73-Q115 PolarHBondContact O-NE2 3.28Å; V75-Q115 HydrophobicContact CB-CB 4.2Å; V75-Q115 HydrophobicContact CG2-CB 3.73Å; I111-Q115 PolarHBondContact O-N 3.01Å; I111-Q115 PolarHBondContact O-NE2 2.83Å; I112-Q115 PolarHBondContact O-N 2.89Å; I112-Q115 VanDerWaalsContact O-N 3.14Å; H113-Q115 VanDerWaalsContact C-N 3.35Å; H113-Q115 PolarHBondContact O-N 3.06Å; Q115-T117 VanDerWaalsContact C-N 3.34Å; Q115-T117 PolarHBondContact O-N 2.78Å; Q115-Q118 PolarHBondContact O-N 3.48Å; Q115-L119 WeakPolarHBondContact O-CB 3.41Å; Q115-L119 WeakPolarHBondContact O-CG 3.5Å; Q115-L119 PolarHBondContact O-N 3.2Å
116L95.2Very high92.9Very high0 Ų051.5 Ų51.50%027%0.269CS..Hα-helixtrans-61.1-42.2176.9-74.1176.7000111.8F27 F68 V75 L80 W94 I112 H113 Q118 L119 L120 L125F27-L116 HydrophobicContact CE1-CD1 4.19Å; F27-L116 HydrophobicContact CE1-CD2 4.11Å; F27-L116 HydrophobicContact CZ-CD2 4.46Å; F68-L116 HydrophobicContact CD2-CD2 4.26Å; F68-L116 HydrophobicContact CE2-CD1 4.04Å; F68-L116 HydrophobicContact CE2-CD2 4.08Å; F68-L116 HydrophobicContact CE2-CG 4.39Å; V75-L116 HydrophobicContact CG1-CD2 4.12Å; L80-L116 HydrophobicContact CD1-CD2 4.07Å; L80-L116 HydrophobicContact CD2-CD2 4.08Å; W94-L116 HydrophobicContact CB-CD1 4.47Å; W94-L116 HydrophobicContact CD2-CD1 3.94Å; W94-L116 HydrophobicContact CE3-CD1 4.48Å; W94-L116 HydrophobicContact CG-CD1 3.93Å; I112-L116 HydrophobicContact CG2-CD1 3.69Å; I112-L116 HydrophobicContact CG2-CG 4Å; I112-L116 WeakPolarHBondContact O-CB 3.33Å; I112-L116 WeakPolarHBondContact O-CG 3.34Å; I112-L116 PolarHBondContact O-N 3.44Å; H113-L116 PolarHBondContact O-N 2.9Å; L116-Q118 VanDerWaalsContact C-N 3.28Å; L116-Q118 PolarHBondContact O-N 2.98Å; L116-L119 PolarHBondContact O-N 3.46Å; L116-L120 HydrophobicContact CB-CD1 4.32Å; L116-L120 HydrophobicContact CD2-CD1 4.35Å; L116-L120 WeakPolarHBondContact O-CB 3.32Å; L116-L120 WeakPolarHBondContact O-CG 3.24Å; L116-L120 PolarHBondContact O-N 3.15Å; L116-L125 HydrophobicContact CB-CD2 3.73Å
117T93.3Very high93.1Very high30 Ų3049.6 Ų49.618%0.18426%0.255CS..Hα-helixtrans-56.5-43.8176-56.80000111.1H113 Q115 G121 V122H113-T117 WeakPolarHBondContact O-CB 3.42Å; H113-T117 PolarHBondContact O-N 2.83Å; H113-T117 PolarHBondContact O-OG1 2.91Å; Q115-T117 VanDerWaalsContact C-N 3.34Å; Q115-T117 PolarHBondContact O-N 2.78Å; T117-G121 PolarHBondContact O-N 3.36Å; T117-V122 VanDerWaalsContact CG2-O 3.22Å; T117-V122 WeakPolarHBondContact CG2-O 3.32Å; T117-V122 PolarHBondContact O-N 3.33Å
118Q92.3Very high93.3Very high159 Ų15942.1 Ų42.174%0.74322%0.222SC*.Hα-helixtrans-71.6-46.4179-69.5175.1-7.100112.5K114 Q115 L116 G121K114-Q118 WeakPolarHBondContact O-CG 3.36Å; K114-Q118 PolarHBondContact O-N 2.81Å; Q115-Q118 PolarHBondContact O-N 3.48Å; L116-Q118 VanDerWaalsContact C-N 3.28Å; L116-Q118 PolarHBondContact O-N 2.98Å; Q118-G121 PolarHBondContact O-N 3.09Å
119L93.3Very high93.5Very high51 Ų5137.6 Ų37.627%0.26721%0.205SC..Hα-helixtrans-71.6-41.9-176.2-70.5171.7000112.3V75 L80 R88 Q115 L116 G121V75-L119 HydrophobicContact CB-CD1 3.78Å; V75-L119 HydrophobicContact CG1-CD1 3.51Å; L80-L119 HydrophobicContact CD2-CB 4.44Å; R88-L119 PolarHBondContact NH2-O 3.23Å; Q115-L119 WeakPolarHBondContact O-CB 3.41Å; Q115-L119 WeakPolarHBondContact O-CG 3.5Å; Q115-L119 PolarHBondContact O-N 3.2Å; L116-L119 PolarHBondContact O-N 3.46Å; L119-G121 VanDerWaalsContact C-N 3.26Å; L119-G121 PolarHBondContact O-N 3.06Å
120L92.1Very high93.6Very high20 Ų2037.6 Ų37.611%0.10521%0.205CC..Hα-helixtrans-77-16.7178.7-63.8172.6000112.2L80 L84 R88 V91 L116 V122 L125L80-L120 HydrophobicContact CD2-CD2 3.85Å; L80-L120 HydrophobicContact CD2-CG 4.3Å; L80-L120 HydrophobicContact CG-CD2 4.4Å; L84-L120 HydrophobicContact CD1-CD2 3.81Å; R88-L120 HydrophobicContact CG-CD2 3.9Å; V91-L120 HydrophobicContact CB-CD1 4.46Å; V91-L120 HydrophobicContact CG1-CD1 3.79Å; L116-L120 HydrophobicContact CB-CD1 4.32Å; L116-L120 HydrophobicContact CD2-CD1 4.35Å; L116-L120 WeakPolarHBondContact O-CB 3.32Å; L116-L120 WeakPolarHBondContact O-CG 3.24Å; L116-L120 PolarHBondContact O-N 3.15Å; L120-V122 VanDerWaalsContact C-N 3.27Å; L120-V122 HydrophobicContact CB-CG2 4.05Å; L120-V122 PolarHBondContact O-N 3.42Å; L120-L125 HydrophobicContact CD1-CD1 4.29Å
121G90.4Very high93.7Very high58 Ų5834.5 Ų34.560%0.59819%0.191SC*.THydrogen-bonded Turntrans68.726.6-176.900000113T117 Q118 L119 P123T117-G121 PolarHBondContact O-N 3.36Å; Q118-G121 PolarHBondContact O-N 3.09Å; L119-G121 VanDerWaalsContact C-N 3.26Å; L119-G121 PolarHBondContact O-N 3.06Å; G121-P123 WeakPolarHBondContact O-CD 3.38Å
122V90.6Very high93.7Very high33 Ų3334.7 Ų34.720%0.219%0.19CC..  trans-109.698.2-178.4-178.10000108.4T117 L120 D124 L125T117-V122 VanDerWaalsContact CG2-O 3.22Å; T117-V122 WeakPolarHBondContact CG2-O 3.32Å; T117-V122 PolarHBondContact O-N 3.33Å; L120-V122 VanDerWaalsContact C-N 3.27Å; L120-V122 HydrophobicContact CB-CG2 4.05Å; L120-V122 PolarHBondContact O-N 3.42Å; V122-D124 VanDerWaalsContact C-N 3.33Å; V122-D124 PolarHBondContact O-N 3.19Å; V122-L125 HydrophobicContact CB-CD1 4.25Å; V122-L125 HydrophobicContact CG1-CB 4.28Å; V122-L125 HydrophobicContact CG1-CD1 4.14Å; V122-L125 PolarHBondContact O-N 2.9Å
123P85.6Confident93.7Very high86 Ų8637.5 Ų37.556%0.55820%0.204SC*.THydrogen-bonded Turntrans-65.8-31.8-171.5-23.534.9000114.6G121G121-P123 WeakPolarHBondContact O-CD 3.38Å
124D87.9Confident93.6Very high45 Ų4538.8 Ų38.824%0.24121%0.214CC..THydrogen-bonded Turntrans-10740.4-178.4-72.9-40.4000111.8Q52 V122 V126 R149Q52-D124 PolarHBondContact NE2-OD2 3.18Å; Q52-D124 PolarHBondContact OE1-OD2 3.36Å; V122-D124 VanDerWaalsContact C-N 3.33Å; V122-D124 PolarHBondContact O-N 3.19Å; D124-V126 PolarHBondContact O-N 2.97Å; D124-R149 IonicContact OD1-CZ 2.89Å; D124-R149 IonicContact OD1-NE 2.82Å; D124-R149 PolarHBondContact OD1-NE 2.76Å; D124-R149 IonicContact OD1-NH2 3.85Å; D124-R149 PolarHBondContact OD1-NH2 3.41Å; D124-R149 IonicContact OD2-NH2 3.72Å; D124-R149 PolarHBondContact OD2-NH2 2.74Å
125L94Very high93.6Very high2 Ų234.9 Ų34.91%0.0120%0.202CC..  trans-57.2134.1176.5-168.775.3000109.5V91 H113 L116 L120 V122V91-L125 HydrophobicContact CG1-CD1 4.36Å; H113-L125 PolarHBondContact CE1-O 3.07Å; L116-L125 HydrophobicContact CB-CD2 3.73Å; L120-L125 HydrophobicContact CD1-CD1 4.29Å; V122-L125 HydrophobicContact CB-CD1 4.25Å; V122-L125 HydrophobicContact CG1-CB 4.28Å; V122-L125 HydrophobicContact CG1-CD1 4.14Å; V122-L125 PolarHBondContact O-N 2.9Å
126V95.6Very high93.6Very high0 Ų038.5 Ų38.50%024%0.239CC..EExtended strand (participates in β ladder)trans-98.4153.4175.6-59.90000111.7L28 V54 I92 G93 W94 D124 L147 I159L28-V126 HydrophobicContact CD1-CG2 4.39Å; V54-V126 HydrophobicContact CG1-CG1 4.44Å; V54-V126 HydrophobicContact CG1-CG2 4.3Å; V54-V126 HydrophobicContact CG2-CG1 4.33Å; I92-V126 PolarHBondContact O-N 3.17Å; I92-V126 VanDerWaalsContact O-N 3.08Å; G93-V126 CarbonylContact C-O 3.56Å; G93-V126 WeakPolarHBondContact CA-O 3.42Å; W94-V126 PolarHBondContact N-O 2.9Å; D124-V126 PolarHBondContact O-N 2.97Å; V126-L147 HydrophobicContact CB-CD1 3.83Å; V126-L147 HydrophobicContact CB-CG 4.27Å; V126-L147 HydrophobicContact CG2-CD1 3.86Å; V126-I159 HydrophobicContact CG1-CD1 4.46Å
127F97.2Very high93.7Very high0 Ų044 Ų440%027%0.269CS..EExtended strand (participates in β ladder)trans-125.2114.2176.1175.1-117.5000111.1W94 R96 M105 E109 L129 F148W94-F127 AromaticContact CD1-CD2 3.78Å; W94-F127 AromaticContact CD2-CD2 3.65Å; W94-F127 HydrophobicContact CD2-CD2 3.65Å; W94-F127 AromaticContact CD2-CE2 3.91Å; W94-F127 HydrophobicContact CD2-CE2 3.91Å; W94-F127 AromaticContact CE2-CD2 3.25Å; W94-F127 AromaticContact CE2-CE2 3.66Å; W94-F127 HydrophobicContact CE3-CD2 4.29Å; W94-F127 HydrophobicContact CE3-CE2 4.07Å; W94-F127 HydrophobicContact CG-CD2 4Å; W94-F127 HydrophobicContact CH2-CD2 4.28Å; W94-F127 AromaticContact CH2-CE2 3.85Å; W94-F127 HydrophobicContact CH2-CE2 3.85Å; W94-F127 AromaticContact CZ2-CD2 3.61Å; W94-F127 HydrophobicContact CZ2-CD2 3.61Å; W94-F127 AromaticContact CZ2-CE2 3.63Å; W94-F127 HydrophobicContact CZ2-CE2 3.63Å; W94-F127 HydrophobicContact CZ2-CG 4.34Å; W94-F127 HydrophobicContact CZ2-CZ 4.4Å; W94-F127 HydrophobicContact CZ3-CE2 4.05Å; W94-F127 AromaticContact NE1-CD2 3.28Å; W94-F127 VanDerWaalsContact NE1-CD2 3.28Å; W94-F127 AromaticContact NE1-CG 3.81Å; W94-F127 CarbonylContact O-C 3.53Å; W94-F127 WeakPolarHBondContact O-CA 3.37Å; R96-F127 HydrophobicContact CB-CE2 3.85Å; R96-F127 HydrophobicContact CB-CZ 3.83Å; M105-F127 HydrophobicContact CE-CB 4.36Å; M105-F127 HydrophobicContact CE-CD1 3.53Å; M105-F127 HydrophobicContact CE-CE1 4.07Å; M105-F127 HydrophobicContact CE-CG 4.05Å; M105-F127 HydrophobicContact CG-CD1 3.68Å; M105-F127 HydrophobicContact CG-CE1 3.79Å; M105-F127 HydrophobicContact SD-CD1 3.77Å; M105-F127 HydrophobicContact SD-CE1 4.43Å; E109-F127 HydrophobicContact CB-CE1 4.45Å; E109-F127 HydrophobicContact CB-CZ 4.39Å; E109-F127 HydrophobicContact CG-CE1 4.38Å; E109-F127 HydrophobicContact CG-CZ 3.93Å; E109-F127 VanDerWaalsContact OE1-CZ 3.32Å; E109-F127 WeakPolarHBondContact OE1-CZ 3.4Å; F127-L129 HydrophobicContact CE1-CB 3.86Å; F127-L129 HydrophobicContact CE1-CD1 4.32Å; F127-L129 HydrophobicContact CZ-CB 4.23Å; F127-L129 HydrophobicContact CZ-CD1 4.14Å; F127-F148 HydrophobicContact CB-CB 4.33Å; F127-F148 HydrophobicContact CD1-CB 4.37Å; F127-F148 AromaticContact CD1-CD2 3.94Å; F127-F148 HydrophobicContact CD1-CD2 3.94Å; F127-F148 HydrophobicContact CE1-CD2 4.43Å; F127-F148 PolarHBondContact N-O 3.15Å; F127-F148 PolarHBondContact O-N 2.89Å
128L97.8Very high93.7Very high0 Ų046.1 Ų46.10%028%0.284CS..EExtended strand (participates in β ladder)trans-96.8113.3178.6-177.557.6000110.5L28 W94 Y95 R96 F130 L147 L161L28-L128 HydrophobicContact CD1-CB 3.85Å; L28-L128 HydrophobicContact CD1-CD2 4.39Å; W94-L128 PolarHBondContact O-N 3.13Å; Y95-L128 CarbonylContact C-O 3.57Å; Y95-L128 WeakPolarHBondContact CA-O 3.44Å; Y95-L128 VanDerWaalsContact CB-O 3.29Å; Y95-L128 WeakPolarHBondContact CB-O 3.37Å; R96-L128 PolarHBondContact N-O 2.88Å; L128-F130 HydrophobicContact CB-CE2 4.5Å; L128-F130 HydrophobicContact CD1-CE2 4.45Å; L128-F130 HydrophobicContact CD1-CZ 4.5Å; L128-F130 HydrophobicContact CD2-CE2 3.45Å; L128-F130 VanDerWaalsContact CD2-CE2 3.45Å; L128-F130 HydrophobicContact CD2-CZ 3.48Å; L128-F130 VanDerWaalsContact CD2-CZ 3.48Å; L128-F130 HydrophobicContact CG-CD2 4.14Å; L128-F130 HydrophobicContact CG-CE2 3.48Å; L128-F130 VanDerWaalsContact CG-CE2 3.48Å; L128-F130 HydrophobicContact CG-CZ 3.86Å; L128-L147 HydrophobicContact CB-CD1 3.83Å; L128-L147 HydrophobicContact CD1-CB 4.24Å; L128-L147 HydrophobicContact CD1-CD1 4.17Å; L128-L161 HydrophobicContact CD1-CD2 3.89Å; L128-L161 HydrophobicContact CD2-CD2 4.31Å
129L97.6Very high94Very high0 Ų042.4 Ų42.40%028%0.276CS..EExtended strand (participates in β ladder)trans-99.4129.8176.5-178.562.3000110R98 F127 Y145 V146 F148R98-L129 HydrophobicContact CG-CD1 4.34Å; F127-L129 HydrophobicContact CE1-CB 3.86Å; F127-L129 HydrophobicContact CE1-CD1 4.32Å; F127-L129 HydrophobicContact CZ-CB 4.23Å; F127-L129 HydrophobicContact CZ-CD1 4.14Å; L129-Y145 CarbonylContact O-C 3.52Å; L129-Y145 WeakPolarHBondContact O-CA 3.18Å; L129-V146 PolarHBondContact N-O 3.08Å; L129-V146 PolarHBondContact O-N 2.87Å; L129-F148 HydrophobicContact CB-CD2 4.25Å; L129-F148 HydrophobicContact CB-CE2 3.91Å; L129-F148 HydrophobicContact CD2-CE2 4.03Å
130F97.3Very high94.1Very high1 Ų144 Ų440%0.00429%0.288CS..EExtended strand (participates in β ladder)trans-109.9140.7168.5-63.5-95.5000110.3F10 V13 Y95 R96 F97 R98 L128 L143 E144F10-F130 HydrophobicContact CD2-CE1 4.24Å; F10-F130 HydrophobicContact CD2-CZ 4.43Å; F10-F130 AromaticContact CE2-CE1 3.6Å; F10-F130 HydrophobicContact CE2-CE1 3.6Å; F10-F130 HydrophobicContact CE2-CZ 4.17Å; F10-F130 AromaticContact CZ-CE1 3.94Å; F10-F130 HydrophobicContact CZ-CE1 3.94Å; V13-F130 HydrophobicContact CB-CZ 4.36Å; V13-F130 HydrophobicContact CG1-CD2 4.32Å; V13-F130 HydrophobicContact CG1-CE2 3.58Å; V13-F130 HydrophobicContact CG1-CZ 3.7Å; Y95-F130 HydrophobicContact CD2-CD2 4.44Å; Y95-F130 HydrophobicContact CD2-CE2 4.3Å; R96-F130 PolarHBondContact O-N 2.87Å; F97-F130 HydrophobicContact CB-CB 4.25Å; F97-F130 HydrophobicContact CD2-CB 3.54Å; F97-F130 HydrophobicContact CD2-CG 4.27Å; F97-F130 HydrophobicContact CE2-CB 4.34Å; F97-F130 HydrophobicContact CG-CB 4.26Å; R98-F130 PolarHBondContact N-O 3.46Å; L128-F130 HydrophobicContact CB-CE2 4.5Å; L128-F130 HydrophobicContact CD1-CE2 4.45Å; L128-F130 HydrophobicContact CD1-CZ 4.5Å; L128-F130 HydrophobicContact CD2-CE2 3.45Å; L128-F130 VanDerWaalsContact CD2-CE2 3.45Å; L128-F130 HydrophobicContact CD2-CZ 3.48Å; L128-F130 VanDerWaalsContact CD2-CZ 3.48Å; L128-F130 HydrophobicContact CG-CD2 4.14Å; L128-F130 HydrophobicContact CG-CE2 3.48Å; L128-F130 VanDerWaalsContact CG-CE2 3.48Å; L128-F130 HydrophobicContact CG-CZ 3.86Å; F130-L143 HydrophobicContact CB-CD1 4.27Å; F130-L143 HydrophobicContact CD1-CD1 4.19Å; F130-L143 HydrophobicContact CD1-CD2 4.34Å; F130-L143 HydrophobicContact CD1-CG 4.36Å; F130-E144 CarbonylContact C-O 3.48Å; F130-E144 WeakPolarHBondContact CA-O 3.44Å
131S95.8Very high94.2Very high0 Ų048 Ų480%031%0.306CS..EExtended strand (participates in β ladder)trans-132.3121.6168.8-163.60000110R98 T101 E144R98-S131 WeakPolarHBondContact O-CA 3.35Å; T101-S131 PolarHBondContact N-OG 2.91Å; T101-S131 PolarHBondContact O-OG 3.17Å; T101-S131 PolarHBondContact OG1-OG 3.42Å; S131-E144 PolarHBondContact N-O 2.85Å; S131-E144 PolarHBondContact O-N 2.91Å
132F94.4Very high94.5Very high57 Ų5747.4 Ų47.425%0.2530%0.295CS..EExtended strand (participates in β ladder)trans-95122.9174.1179-95.4000110.3F97 R98 R99 N100 S134 H141 L143F97-F132 HydrophobicContact CE1-CB 4.42Å; F97-F132 HydrophobicContact CE2-CB 4.03Å; F97-F132 HydrophobicContact CZ-CB 3.55Å; F97-F132 HydrophobicContact CZ-CG 4.33Å; R98-F132 PolarHBondContact O-N 3.34Å; R99-F132 HydrophobicContact CG-CB 4.44Å; N100-F132 PolarHBondContact N-O 3.36Å; N100-F132 PolarHBondContact OD1-O 3.38Å; F132-S134 WeakPolarHBondContact CE1-OG 3.44Å; F132-H141 AromaticContact CE1-ND1 3.79Å; F132-H141 HydrophobicContact CE2-CB 3.65Å; F132-H141 HydrophobicContact CZ-CB 3.67Å; F132-H141 AromaticContact CZ-CG 3.55Å; F132-H141 AromaticContact CZ-ND1 3.25Å; F132-H141 WeakPolarHBondContact CZ-ND1 3.47Å; F132-L143 HydrophobicContact CB-CD1 4.28Å
133I93.7Very high94.7Very high58 Ų5848.6 Ų48.630%0.29730%0.3SS..EExtended strand (participates in β ladder)trans-120.2139.9-178.4-54.4171.5000108.3H141 A142I133-H141 WeakPolarHBondContact O-CA 3.28Å; I133-A142 PolarHBondContact N-O 3.23Å; I133-A142 PolarHBondContact O-N 2.89Å
134S93.6Very high95.2Very high34 Ų3448.8 Ų48.824%0.23829%0.293CS..EExtended strand (participates in β ladder)trans-125.3147.9176.6-56.30000110.9F132 H141F132-S134 WeakPolarHBondContact CE1-OG 3.44Å; S134-H141 WeakPolarHBondContact CB-ND1 3.39Å; S134-H141 PolarHBondContact OG-CE1 3.2Å; S134-H141 PolarHBondContact OG-ND1 3.01Å
135T93.9Very high95.7Very high56 Ų5650.8 Ų50.834%0.34430%0.298SS..  trans-66160.1169.654.70000111N137 S138 S139 T140T135-N137 WeakPolarHBondContact CB-OD1 2.95Å; T135-N137 PolarHBondContact O-N 3.05Å; T135-N137 VanDerWaalsContact O-N 3.14Å; T135-N137 PolarHBondContact OG1-OD1 3.17Å; T135-S138 WeakPolarHBondContact O-CA 3.44Å; T135-S138 PolarHBondContact O-N 3.36Å; T135-S139 PolarHBondContact OG1-N 3.41Å; T135-T140 PolarHBondContact N-O 2.89Å; T135-T140 PolarHBondContact OG1-N 2.97Å; T135-T140 PolarHBondContact OG1-O 2.78Å
136A94.6Very high95.8Very high118 Ų11851.8 Ų51.898%0.97531%0.305SS*.THydrogen-bonded Turntrans-56.8-32.4-178.200000113.6
137N95.9Very high95.9Very high117 Ų11751.9 Ų51.963%0.62631%0.305SS*.THydrogen-bonded Turntrans-91.83.2176.467.2-13.3000113.6T135 S139T135-N137 WeakPolarHBondContact CB-OD1 2.95Å; T135-N137 PolarHBondContact O-N 3.05Å; T135-N137 VanDerWaalsContact O-N 3.14Å; T135-N137 PolarHBondContact OG1-OD1 3.17Å; N137-S139 VanDerWaalsContact CG-OG 3.32Å; N137-S139 PolarHBondContact ND2-OG 3.02Å; N137-S139 PolarHBondContact O-N 3.18Å; N137-S139 VanDerWaalsContact O-N 3.07Å; N137-S139 PolarHBondContact OD1-N 3.45Å; N137-S139 PolarHBondContact OD1-OG 2.86Å
138S94.9Very high95.8Very high74 Ų7452.1 Ų52.152%0.51731%0.306SS..SBendtrans53.823.3-177-55.90000115.2T135 H141T135-S138 WeakPolarHBondContact O-CA 3.44Å; T135-S138 PolarHBondContact O-N 3.36Å; S138-H141 PolarHBondContact O-NE2 2.98Å
139S96.9Very high95.5Very high80 Ų8053.9 Ų53.956%0.55931%0.313SS*.SBendtrans-83-17.7176.568.10000113.1T135 N137T135-S139 PolarHBondContact OG1-N 3.41Å; N137-S139 VanDerWaalsContact CG-OG 3.32Å; N137-S139 PolarHBondContact ND2-OG 3.02Å; N137-S139 PolarHBondContact O-N 3.18Å; N137-S139 VanDerWaalsContact O-N 3.07Å; N137-S139 PolarHBondContact OD1-N 3.45Å; N137-S139 PolarHBondContact OD1-OG 2.86Å
140T95.8Very high94.7Very high85 Ų8555.2 Ų55.252%0.52132%0.321SS..  trans-137.3130.6-178.5-53.70000109.1T135T135-T140 PolarHBondContact N-O 2.89Å; T135-T140 PolarHBondContact OG1-N 2.97Å; T135-T140 PolarHBondContact OG1-O 2.78Å
141H95.1Very high93.4Very high104 Ų10458.6 Ų58.648%0.48134%0.339SS..EExtended strand (participates in β ladder)trans-119.6140.1179.1-57.2-71.6000109.4F132 I133 S134 S138F132-H141 AromaticContact CE1-ND1 3.79Å; F132-H141 HydrophobicContact CE2-CB 3.65Å; F132-H141 HydrophobicContact CZ-CB 3.67Å; F132-H141 AromaticContact CZ-CG 3.55Å; F132-H141 AromaticContact CZ-ND1 3.25Å; F132-H141 WeakPolarHBondContact CZ-ND1 3.47Å; I133-H141 WeakPolarHBondContact O-CA 3.28Å; S134-H141 WeakPolarHBondContact CB-ND1 3.39Å; S134-H141 PolarHBondContact OG-CE1 3.2Å; S134-H141 PolarHBondContact OG-ND1 3.01Å; S138-H141 PolarHBondContact O-NE2 2.98Å
142A95.5Very high91.8Very high45 Ų4569.6 Ų69.637%0.37238%0.381SS..EExtended strand (participates in β ladder)trans-122.7126.6173.900000108.7I133I133-A142 PolarHBondContact N-O 3.23Å; I133-A142 PolarHBondContact O-N 2.89Å
143L96.1Very high90.1Very high58 Ų5870 Ų7030%0.30439%0.391SS..EExtended strand (participates in β ladder)trans-104.3103.4169.5-179.863.9000108.3C14 F97 F130 F132C14-L143 HydrophobicContact CB-CD2 4.17Å; C14-L143 WeakPolarHBondContact SG-CD2 3.11Å; F97-L143 HydrophobicContact CD2-CD1 4.35Å; F97-L143 HydrophobicContact CE2-CD1 3.69Å; F130-L143 HydrophobicContact CB-CD1 4.27Å; F130-L143 HydrophobicContact CD1-CD1 4.19Å; F130-L143 HydrophobicContact CD1-CD2 4.34Å; F130-L143 HydrophobicContact CD1-CG 4.36Å; F132-L143 HydrophobicContact CB-CD1 4.28Å
144E96.3Very high88.8Confident90 Ų9078.4 Ų78.442%0.42142%0.419SS..EExtended strand (participates in β ladder)trans-92.6143.7176.2-67.9-179.1175.200110Q103 F130 S131Q103-E144 HydrophobicContact CG-CB 4.22Å; Q103-E144 VanDerWaalsContact CG-OE2 3.29Å; Q103-E144 WeakPolarHBondContact CG-OE2 3.49Å; Q103-E144 PolarHBondContact NE2-O 3.48Å; F130-E144 CarbonylContact C-O 3.48Å; F130-E144 WeakPolarHBondContact CA-O 3.44Å; S131-E144 PolarHBondContact N-O 2.85Å; S131-E144 PolarHBondContact O-N 2.91Å
145Y96.9Very high87.8Confident88 Ų8884.9 Ų84.935%0.34544%0.439SS..EExtended strand (participates in β ladder)trans-139.9145.9177.760.9-86.7000111.5F10 L129 L161F10-Y145 AromaticContact CE2-CD1 3.8Å; F10-Y145 HydrophobicContact CE2-CD1 3.8Å; F10-Y145 HydrophobicContact CE2-CD2 4.16Å; F10-Y145 AromaticContact CE2-CE1 4Å; F10-Y145 HydrophobicContact CE2-CE1 4Å; F10-Y145 HydrophobicContact CE2-CE2 4.34Å; F10-Y145 AromaticContact CE2-CG 3.88Å; F10-Y145 HydrophobicContact CE2-CG 3.88Å; F10-Y145 AromaticContact CZ-CD1 3.56Å; F10-Y145 HydrophobicContact CZ-CD1 3.56Å; F10-Y145 AromaticContact CZ-CE1 3.7Å; F10-Y145 HydrophobicContact CZ-CE1 3.7Å; F10-Y145 HydrophobicContact CZ-CG 4.12Å; L129-Y145 CarbonylContact O-C 3.52Å; L129-Y145 WeakPolarHBondContact O-CA 3.18Å; Y145-L161 HydrophobicContact CD2-CD2 4.03Å; Y145-L161 HydrophobicContact CE2-CB 4.26Å; Y145-L161 HydrophobicContact CE2-CD2 4.11Å
146V96.8Very high87.3Confident23 Ų2384.9 Ų84.914%0.13944%0.437CS..EExtended strand (participates in β ladder)trans-140.5127.2176.3-179.40000109.7Q103 L129 F148 R158Q103-V146 HydrophobicContact CB-CG2 4Å; Q103-V146 HydrophobicContact CG-CG2 4.16Å; L129-V146 PolarHBondContact N-O 3.08Å; L129-V146 PolarHBondContact O-N 2.87Å; V146-F148 HydrophobicContact CB-CD2 4.36Å; V146-F148 HydrophobicContact CB-CE2 3.75Å; V146-F148 HydrophobicContact CB-CZ 4.03Å; V146-F148 HydrophobicContact CG1-CD1 4.27Å; V146-F148 HydrophobicContact CG1-CD2 3.99Å; V146-F148 HydrophobicContact CG1-CE1 3.89Å; V146-F148 HydrophobicContact CG1-CE2 3.56Å; V146-F148 HydrophobicContact CG1-CG 4.33Å; V146-F148 HydrophobicContact CG1-CZ 3.51Å; V146-R158 HydrophobicContact CG1-CB 4.25Å; V146-R158 HydrophobicContact CG1-CG 3.7Å
147L97Very high87Confident2 Ų283.6 Ų83.61%0.0141%0.411CS..EExtended strand (participates in β ladder)trans-91114.7170.9-170.768.9000109.7A3 V126 L128 R158 I159 L161A3-L147 HydrophobicContact CB-CD2 3.29Å; V126-L147 HydrophobicContact CB-CD1 3.83Å; V126-L147 HydrophobicContact CB-CG 4.27Å; V126-L147 HydrophobicContact CG2-CD1 3.86Å; L128-L147 HydrophobicContact CB-CD1 3.83Å; L128-L147 HydrophobicContact CD1-CB 4.24Å; L128-L147 HydrophobicContact CD1-CD1 4.17Å; L147-R158 WeakPolarHBondContact O-CA 3.23Å; L147-I159 HydrophobicContact CD2-CB 4.2Å; L147-I159 HydrophobicContact CD2-CG2 4.32Å; L147-I159 PolarHBondContact O-N 3.25Å; L147-L161 HydrophobicContact CB-CB 4.4Å; L147-L161 HydrophobicContact CD2-CD1 4.35Å
148F95.3Very high86.8Confident5 Ų585.7 Ų85.72%0.02241%0.41CS..EExtended strand (participates in β ladder)trans-95.5139.2174.8-65.4-82000110.6M105 F127 L129 V146 P150 N156 Q157 R158M105-F148 HydrophobicContact CG-CD1 4.39Å; M105-F148 HydrophobicContact CG-CD2 3.92Å; M105-F148 HydrophobicContact CG-CE2 4.16Å; M105-F148 HydrophobicContact CG-CG 4.03Å; M105-F148 HydrophobicContact CG-CZ 4.48Å; M105-F148 HydrophobicContact SD-CB 3.97Å; M105-F148 HydrophobicContact SD-CD1 4.5Å; M105-F148 HydrophobicContact SD-CD2 4.43Å; M105-F148 HydrophobicContact SD-CG 4.06Å; F127-F148 HydrophobicContact CB-CB 4.33Å; F127-F148 HydrophobicContact CD1-CB 4.37Å; F127-F148 AromaticContact CD1-CD2 3.94Å; F127-F148 HydrophobicContact CD1-CD2 3.94Å; F127-F148 HydrophobicContact CE1-CD2 4.43Å; F127-F148 PolarHBondContact N-O 3.15Å; F127-F148 PolarHBondContact O-N 2.89Å; L129-F148 HydrophobicContact CB-CD2 4.25Å; L129-F148 HydrophobicContact CB-CE2 3.91Å; L129-F148 HydrophobicContact CD2-CE2 4.03Å; V146-F148 HydrophobicContact CB-CD2 4.36Å; V146-F148 HydrophobicContact CB-CE2 3.75Å; V146-F148 HydrophobicContact CB-CZ 4.03Å; V146-F148 HydrophobicContact CG1-CD1 4.27Å; V146-F148 HydrophobicContact CG1-CD2 3.99Å; V146-F148 HydrophobicContact CG1-CE1 3.89Å; V146-F148 HydrophobicContact CG1-CE2 3.56Å; V146-F148 HydrophobicContact CG1-CG 4.33Å; V146-F148 HydrophobicContact CG1-CZ 3.51Å; F148-P150 HydrophobicContact CB-CG 4.38Å; F148-N156 HydrophobicContact CD1-CB 3.91Å; F148-N156 HydrophobicContact CE1-CB 4.3Å; F148-Q157 CarbonylContact C-O 3.54Å; F148-Q157 WeakPolarHBondContact CA-O 3.21Å; F148-R158 HydrophobicContact CD1-CG 4.03Å; F148-R158 HydrophobicContact CE1-CG 3.8Å
149R91.2Very high86.7Confident37 Ų3782.8 Ų82.814%0.1439%0.389CS..EExtended strand (participates in β ladder)trans-114.894.5156.6177.6-167.2-170.3-178.49.9107.5D124 N151 Q157 I159D124-R149 IonicContact OD1-CZ 2.89Å; D124-R149 IonicContact OD1-NE 2.82Å; D124-R149 PolarHBondContact OD1-NE 2.76Å; D124-R149 IonicContact OD1-NH2 3.85Å; D124-R149 PolarHBondContact OD1-NH2 3.41Å; D124-R149 IonicContact OD2-NH2 3.72Å; D124-R149 PolarHBondContact OD2-NH2 2.74Å; R149-N151 VanDerWaalsContact C-N 3.26Å; R149-N151 PolarHBondContact O-N 2.8Å; R149-Q157 PolarHBondContact N-O 2.95Å; R149-Q157 WeakPolarHBondContact O-CB 3.36Å; R149-Q157 PolarHBondContact O-N 2.87Å; R149-I159 HydrophobicContact CB-CD1 3.4Å; R149-I159 VanDerWaalsContact CB-CD1 3.4Å; R149-I159 HydrophobicContact CB-CG1 4.24Å; R149-I159 HydrophobicContact CG-CD1 4.37Å
150P82.1Confident86.6Confident28 Ų2885.7 Ų85.718%0.18240%0.396CS..EExtended strand (participates in β ladder)trans-65.791.1169.4-18.334.1000108.3M105 H113 F148M105-P150 HydrophobicContact CE-CG 3.92Å; M105-P150 HydrophobicContact SD-CG 3.55Å; M105-P150 VanDerWaalsContact SD-CG 3.55Å; H113-P150 VanDerWaalsContact CD2-CG 3.49Å; H113-P150 WeakPolarHBondContact CD2-CG 3.46Å; H113-P150 WeakPolarHBondContact NE2-CD 3.32Å; H113-P150 WeakPolarHBondContact NE2-CG 3.46Å; F148-P150 HydrophobicContact CB-CG 4.38Å
151N69Low86.6Confident72 Ų7282.3 Ų82.339%0.38538%0.375SS..  trans-66.3168.3175.8-163.9-9.6000109.2R149 S153R149-N151 VanDerWaalsContact C-N 3.26Å; R149-N151 PolarHBondContact O-N 2.8Å; N151-S153 PolarHBondContact O-N 2.9Å
152R62.4Low86.6Confident231 Ų23181.1 Ų81.187%0.87238%0.375SS*.SBendtrans-59.3-8.6172.8-64.6-176.3178.7-177.20.1113.7
153S59.2Low86.6Confident65 Ų6581.4 Ų81.446%0.45537%0.37SS..SBendtrans-87.4164.1172.283.40000111.7N151 Y155N151-S153 PolarHBondContact O-N 2.9Å; S153-Y155 PolarHBondContact O-N 2.93Å
154R66.1Low86.4Confident234 Ų23482.4 Ų82.488%0.88338%0.38SS*.SBendtrans-67.85-177.3-67.5-168.5-72.6177.1-4114.9
155Y72.9Confident86.2Confident170 Ų17083.7 Ų83.767%0.66739%0.39SS*.SBendtrans-112.2127.1-173.2-58.9-78.5000111.2S153 Q157S153-Y155 PolarHBondContact O-N 2.93Å; Y155-Q157 PolarHBondContact O-N 2.92Å; Y155-Q157 VanDerWaalsContact O-N 3.08Å
156N82.2Confident85.8Confident56 Ų5686.9 Ų86.930%0.29941%0.412SS..EExtended strand (participates in β ladder)trans-79.489.8174.2-62.2-36.8000108.8F148 R158F148-N156 HydrophobicContact CD1-CB 3.91Å; F148-N156 HydrophobicContact CE1-CB 4.3Å; N156-R158 PolarHBondContact O-N 3.26Å
157Q89.3Confident85.1Confident92 Ų9289 Ų8943%0.4344%0.438SS..EExtended strand (participates in β ladder)trans-63.1133.6178.1-172.8176.221.700109.7F148 R149 Y155F148-Q157 CarbonylContact C-O 3.54Å; F148-Q157 WeakPolarHBondContact CA-O 3.21Å; R149-Q157 PolarHBondContact N-O 2.95Å; R149-Q157 WeakPolarHBondContact O-CB 3.36Å; R149-Q157 PolarHBondContact O-N 2.87Å; Y155-Q157 PolarHBondContact O-N 2.92Å; Y155-Q157 VanDerWaalsContact O-N 3.08Å
158R92.9Very high83.5Confident160 Ų16095.7 Ų95.760%0.60447%0.474SS*.EExtended strand (participates in β ladder)trans-96.2133172.7-64.3-179.1175.7172.6-3.1109Q103 V146 L147 F148 N156Q103-R158 PolarHBondContact O-NH2 2.94Å; Q103-R158 VanDerWaalsContact O-NH2 3.08Å; V146-R158 HydrophobicContact CG1-CB 4.25Å; V146-R158 HydrophobicContact CG1-CG 3.7Å; L147-R158 WeakPolarHBondContact O-CA 3.23Å; F148-R158 HydrophobicContact CD1-CG 4.03Å; F148-R158 HydrophobicContact CE1-CG 3.8Å; N156-R158 PolarHBondContact O-N 3.26Å
159I92.8Very high82.2Confident14 Ų1499 Ų997%0.07250%0.495CS..EExtended strand (participates in β ladder)trans-109.4138.5176.9-60.8159000108M1 A3 V126 L147 R149 L161M1-I159 HydrophobicContact CG-CD1 4.12Å; M1-I159 HydrophobicContact SD-CD1 3.26Å; M1-I159 WeakPolarHBondContact SD-CD1 3.22Å; M1-I159 HydrophobicContact SD-CG1 4.21Å; A3-I159 HydrophobicContact CB-CG2 3.91Å; V126-I159 HydrophobicContact CG1-CD1 4.46Å; L147-I159 HydrophobicContact CD2-CB 4.2Å; L147-I159 HydrophobicContact CD2-CG2 4.32Å; L147-I159 PolarHBondContact O-N 3.25Å; R149-I159 HydrophobicContact CB-CD1 3.4Å; R149-I159 VanDerWaalsContact CB-CD1 3.4Å; R149-I159 HydrophobicContact CB-CG1 4.24Å; R149-I159 HydrophobicContact CG-CD1 4.37Å; I159-L161 PolarHBondContact O-N 2.82Å
160I93.3Very high80.7Confident140 Ų140102.2 Ų102.272%0.71852%0.523SS*.  trans-69.6123.5173-60.3174.4000108A3A3-I160 PolarHBondContact N-O 3.09Å
161L95.9Very high80.2Confident14 Ų14109.4 Ų109.47%0.07355%0.554CS.*EExtended strand (participates in β ladder)trans-99.6110.8175.7-179.762.3000109A3 I5 I56 L128 Y145 L147 I159A3-L161 HydrophobicContact CB-CD1 3.95Å; I5-L161 HydrophobicContact CB-CD1 4.02Å; I5-L161 HydrophobicContact CG2-CD1 3.75Å; I5-L161 HydrophobicContact CG2-CD2 3.77Å; I5-L161 HydrophobicContact CG2-CG 3.76Å; I56-L161 HydrophobicContact CD1-CD1 4.27Å; L128-L161 HydrophobicContact CD1-CD2 3.89Å; L128-L161 HydrophobicContact CD2-CD2 4.31Å; Y145-L161 HydrophobicContact CD2-CD2 4.03Å; Y145-L161 HydrophobicContact CE2-CB 4.26Å; Y145-L161 HydrophobicContact CE2-CD2 4.11Å; L147-L161 HydrophobicContact CB-CB 4.4Å; L147-L161 HydrophobicContact CD2-CD1 4.35Å; I159-L161 PolarHBondContact O-N 2.82Å
162T95.1Very high80.5Confident80 Ų80112.9 Ų112.949%0.49157%0.568SS.*EExtended strand (participates in β ladder)trans-90134.6179.7-58.50000110.7A3 S4 I5 P164A3-T162 PolarHBondContact O-N 3.46Å; S4-T162 VanDerWaalsContact CA-O 3.24Å; S4-T162 WeakPolarHBondContact CA-O 3.46Å; I5-T162 PolarHBondContact N-O 2.99Å; I5-T162 VanDerWaalsContact N-O 3.11Å; T162-P164 WeakPolarHBondContact O-CD 3.11Å
163I95.7Very high81.6Confident50 Ų50110.8 Ų110.826%0.25657%0.568SS.*  trans-106.299.2173.2-55.4178.3000108I5 F10 N165I5-I163 HydrophobicContact CG2-CG1 3.95Å; F10-I163 HydrophobicContact CB-CD1 4.44Å; F10-I163 HydrophobicContact CD1-CD1 4.1Å; F10-I163 HydrophobicContact CD2-CD1 3.93Å; F10-I163 HydrophobicContact CE1-CD1 4.34Å; F10-I163 HydrophobicContact CE2-CD1 4.17Å; F10-I163 HydrophobicContact CG-CD1 3.89Å; F10-I163 HydrophobicContact CZ-CD1 4.38Å; I163-N165 PolarHBondContact O-ND2 3.12Å
164P92.6Very high83Confident79 Ų79117.6 Ų117.651%0.51359%0.585SS.*  trans-64139.1179.227.5-33000110.3I5 T162I5-P164 WeakPolarHBondContact O-CD 3.36Å; T162-P164 WeakPolarHBondContact O-CD 3.11Å
165N91Very high84.1Confident117 Ų117114.4 Ų114.463%0.62658%0.578SS**  trans-146.3166.8-179.167.580.5000110.7I163 G167I163-N165 PolarHBondContact O-ND2 3.12Å; N165-G167 VanDerWaalsContact C-N 3.26Å; N165-G167 PolarHBondContact O-N 3.46Å; N165-G167 WeakPolarHBondContact OD1-CA 3.37Å; N165-G167 PolarHBondContact OD1-N 3.2Å
166L89.1Confident84.9Confident156 Ų156114.7 Ų114.782%0.81759%0.59SS**THydrogen-bonded Turntrans-71.4-16-177-63.3175.6000114.2N168 T169L166-N168 PolarHBondContact O-N 3Å; L166-T169 WeakPolarHBondContact O-CG2 3.29Å; L166-T169 PolarHBondContact O-OG1 2.84Å
167G82.2Confident85.2Confident67 Ų67116.7 Ų116.769%0.69161%0.609SS**THydrogen-bonded Turntrans-68.8-14.1-173.200000114.6N165 T169N165-G167 VanDerWaalsContact C-N 3.26Å; N165-G167 PolarHBondContact O-N 3.46Å; N165-G167 WeakPolarHBondContact OD1-CA 3.37Å; N165-G167 PolarHBondContact OD1-N 3.2Å; G167-T169 PolarHBondContact O-N 3.45Å; G167-T169 VanDerWaalsContact O-N 3.17Å
168N64Low85.1Confident142 Ų142115.7 Ų115.776%0.75961%0.612SS**  trans-87.241.5175.8-163.718.7000112.8L166L166-N168 PolarHBondContact O-N 3Å
169T67.2Low85Confident75 Ų75114.5 Ų114.546%0.4662%0.622SS.*  trans-115.276.7179.552.20000110.3L166 G167 Q171 Q172L166-T169 WeakPolarHBondContact O-CG2 3.29Å; L166-T169 PolarHBondContact O-OG1 2.84Å; G167-T169 PolarHBondContact O-N 3.45Å; G167-T169 VanDerWaalsContact O-N 3.17Å; T169-Q171 PolarHBondContact O-N 3.32Å; T169-Q172 PolarHBondContact OG1-NE2 3.46Å
170S59.7Low84.6Confident105 Ų105119.1 Ų119.173%0.73465%0.653SS**  trans-68.914.9-178.950.70000115.2
171Q71.8Confident84.4Confident179 Ų179116.8 Ų116.884%0.83664%0.642SS**  trans-129.549.7-168.1-61.8-176.6-8.500112.9T169T169-Q171 PolarHBondContact O-N 3.32Å
172Q75.3Confident84.3Confident145 Ų145122.7 Ų122.768%0.67868%0.679SS**  trans-98.610178.5-61.9-175.5900113.8T169 Y174T169-Q172 PolarHBondContact OG1-NE2 3.46Å; Q172-Y174 PolarHBondContact O-N 2.59Å; Q172-Y174 VanDerWaalsContact O-N 3.17Å
173E86.2Confident84.3Confident187 Ų187121.1 Ų121.187%0.87467%0.671SS**  trans-74.4108.1-176.2-64.3-179-17900111.3
174Y88.4Confident84.2Confident207 Ų207125.7 Ų125.781%0.81270%0.695SS**  trans-83.4120.7167.6-69.2-81.2000109.9Q172 L176Q172-Y174 PolarHBondContact O-N 2.59Å; Q172-Y174 VanDerWaalsContact O-N 3.17Å; Y174-L176 PolarHBondContact O-N 3.36Å
175K89.8Confident84.4Confident168 Ų168128 Ų12873%0.7370%0.703SS**  trans-67.9101.7174.4-173.3174.5-174.2176.70110.2S177K175-S177 WeakPolarHBondContact CE-O 3.41Å; K175-S177 WeakPolarHBondContact CG-O 3.5Å
176L88.4Confident84.5Confident175 Ų175128.3 Ų128.392%0.91670%0.696SS**  trans-68.2-34.7-177.4-64.5177.6000113.5Y174Y174-L176 PolarHBondContact O-N 3.36Å
177S88.4Confident84.7Confident99 Ų99123 Ų12369%0.69268%0.675SS**  trans-148.2149.8178.7-1760000110.4K175K175-S177 WeakPolarHBondContact CE-O 3.41Å; K175-S177 WeakPolarHBondContact CG-O 3.5Å
178S87.2Confident85.2Confident70 Ų70126 Ų12649%0.4967%0.669SS.*  trans-117.3150.2172.5650000109.2P180S178-P180 VanDerWaalsContact O-CD 3.23Å; S178-P180 WeakPolarHBondContact O-CD 3.49Å; S178-P180 VanDerWaalsContact O-N 3.17Å
179V90.5Very high86.7Confident135 Ų135123 Ų12382%0.81866%0.656SS**PPolyproline II helixtrans-59.1119171.6-179.30000107.9N181V179-N181 PolarHBondContact O-N 2.76Å
180P85.5Confident87.8Confident111 Ų111123.4 Ų123.472%0.72165%0.654SS**PPolyproline II helixtrans-62.5126.3-178.9-23.134.3000110.8S178S178-P180 VanDerWaalsContact O-CD 3.23Å; S178-P180 WeakPolarHBondContact O-CD 3.49Å; S178-P180 VanDerWaalsContact O-N 3.17Å
181N88.6Confident89.3Confident91 Ų91126.8 Ų126.849%0.48766%0.656SS.*PPolyproline II helixtrans-86.3124.4175.2-167.1-32000109.7V179 S183 Y186V179-N181 PolarHBondContact O-N 2.76Å; N181-S183 VanDerWaalsContact C-N 3.34Å; N181-S183 WeakPolarHBondContact OD1-CB 3.31Å; N181-S183 PolarHBondContact OD1-N 2.86Å; N181-Y186 HydrophobicContact CB-CD1 3.75Å; N181-Y186 HydrophobicContact CB-CE1 4.03Å; N181-Y186 HydrophobicContact CB-CG 4.36Å
182T93.3Very high90.3Very high139 Ų139123.9 Ų123.985%0.85364%0.642SS**  trans-84.1-6.9179.654.60000113.6L184T182-L184 PolarHBondContact O-N 3.11Å
183S95.8Very high91.1Very high47 Ų47122.5 Ų122.533%0.32964%0.636SS.*  trans-73.5120.6-178.5-179.70000112.4N181 N185 Y186 A187N181-S183 VanDerWaalsContact C-N 3.34Å; N181-S183 WeakPolarHBondContact OD1-CB 3.31Å; N181-S183 PolarHBondContact OD1-N 2.86Å; S183-N185 VanDerWaalsContact C-N 3.29Å; S183-N185 PolarHBondContact O-N 3.45Å; S183-N185 PolarHBondContact OG-N 2.85Å; S183-Y186 PolarHBondContact O-N 2.93Å; S183-Y186 PolarHBondContact OG-N 2.83Å; S183-A187 PolarHBondContact O-N 2.65Å
184L94.1Very high91.3Very high146 Ų146114.1 Ų114.176%0.76460%0.599SS**Hα-helixtrans-64.9-32.8174.7-66.2171.9000112.6T182 A187 K188T182-L184 PolarHBondContact O-N 3.11Å; L184-A187 PolarHBondContact O-N 3.09Å; L184-K188 WeakPolarHBondContact O-CB 2.88Å; L184-K188 PolarHBondContact O-N 2.92Å
185N95.8Very high91.1Very high126 Ų126107.6 Ų107.667%0.67459%0.588SS**Hα-helixtrans-65.8-42.2178-69.6-19.4000110.9S183 K188 V189S183-N185 VanDerWaalsContact C-N 3.29Å; S183-N185 PolarHBondContact O-N 3.45Å; S183-N185 PolarHBondContact OG-N 2.85Å; N185-K188 PolarHBondContact O-N 2.66Å; N185-V189 WeakPolarHBondContact O-CG2 3.43Å; N185-V189 PolarHBondContact O-N 2.91Å; N185-V189 VanDerWaalsContact O-N 3.16Å
186Y94.1Very high91.1Very high124 Ų124105.9 Ų105.949%0.48658%0.583SS.*Hα-helixtrans-59.9-49.6174177-97.8000110.8N181 S183 K188 V189 I190N181-Y186 HydrophobicContact CB-CD1 3.75Å; N181-Y186 HydrophobicContact CB-CE1 4.03Å; N181-Y186 HydrophobicContact CB-CG 4.36Å; S183-Y186 PolarHBondContact O-N 2.93Å; S183-Y186 PolarHBondContact OG-N 2.83Å; Y186-K188 VanDerWaalsContact C-N 3.27Å; Y186-K188 PolarHBondContact O-N 2.98Å; Y186-V189 PolarHBondContact O-N 3.21Å; Y186-I190 HydrophobicContact CD1-CD1 4.2Å; Y186-I190 HydrophobicContact CD1-CG2 4.46Å; Y186-I190 HydrophobicContact CD2-CG2 4.44Å; Y186-I190 HydrophobicContact CE1-CD1 3.85Å; Y186-I190 HydrophobicContact CE1-CG2 4.04Å; Y186-I190 HydrophobicContact CE2-CG2 4.01Å; Y186-I190 WeakPolarHBondContact O-CG1 3.33Å; Y186-I190 PolarHBondContact O-N 3.2Å; Y186-I190 VanDerWaalsContact O-N 3.11Å
187A92.1Very high91.2Very high46 Ų46102.2 Ų102.238%0.3856%0.56SS.*Hα-helixtrans-59.4-35.8179.100000113.3S183 L184 I190 K191S183-A187 PolarHBondContact O-N 2.65Å; L184-A187 PolarHBondContact O-N 3.09Å; A187-I190 VanDerWaalsContact O-CG1 3.24Å; A187-I190 WeakPolarHBondContact O-CG1 3.21Å; A187-K191 WeakPolarHBondContact O-CB 3.39Å; A187-K191 PolarHBondContact O-N 3.21Å
188K94Very high91.4Very high128 Ų128102.1 Ų102.156%0.55755%0.547SS*.Hα-helixtrans-66.4-50.2177.1-175.3177.2173-176.50111.6L184 N185 Y186 I190 K191 E192L184-K188 WeakPolarHBondContact O-CB 2.88Å; L184-K188 PolarHBondContact O-N 2.92Å; N185-K188 PolarHBondContact O-N 2.66Å; Y186-K188 VanDerWaalsContact C-N 3.27Å; Y186-K188 PolarHBondContact O-N 2.98Å; K188-I190 PolarHBondContact O-N 3.45Å; K188-K191 PolarHBondContact O-N 3.39Å; K188-E192 WeakPolarHBondContact CE-OE1 3.47Å; K188-E192 HydrophobicContact CG-CG 4.46Å; K188-E192 WeakPolarHBondContact CG-OE1 3.36Å; K188-E192 IonicContact NZ-OE1 2.98Å; K188-E192 WeakPolarHBondContact O-CG 3.29Å; K188-E192 PolarHBondContact O-N 3.37Å
189V94.5Very high91.4Very high79 Ų79100.1 Ų100.148%0.47953%0.531SS..Hα-helixtrans-61.5-46.5-178.6173.80000111.5N185 Y186 K191 E192 H193N185-V189 WeakPolarHBondContact O-CG2 3.43Å; N185-V189 PolarHBondContact O-N 2.91Å; N185-V189 VanDerWaalsContact O-N 3.16Å; Y186-V189 PolarHBondContact O-N 3.21Å; V189-K191 PolarHBondContact O-N 2.99Å; V189-E192 PolarHBondContact O-N 2.96Å; V189-H193 PolarHBondContact O-CD2 2.88Å; V189-H193 PolarHBondContact O-N 3.38Å
190I91.3Very high91.2Very high84 Ų84103.9 Ų103.943%0.43154%0.536SS..Hα-helixtrans-65-29.6179.465.7177.7000112.4Y186 A187 K188 G194Y186-I190 HydrophobicContact CD1-CD1 4.2Å; Y186-I190 HydrophobicContact CD1-CG2 4.46Å; Y186-I190 HydrophobicContact CD2-CG2 4.44Å; Y186-I190 HydrophobicContact CE1-CD1 3.85Å; Y186-I190 HydrophobicContact CE1-CG2 4.04Å; Y186-I190 HydrophobicContact CE2-CG2 4.01Å; Y186-I190 WeakPolarHBondContact O-CG1 3.33Å; Y186-I190 PolarHBondContact O-N 3.2Å; Y186-I190 VanDerWaalsContact O-N 3.11Å; A187-I190 VanDerWaalsContact O-CG1 3.24Å; A187-I190 WeakPolarHBondContact O-CG1 3.21Å; K188-I190 PolarHBondContact O-N 3.45Å; I190-G194 WeakPolarHBondContact O-CA 3.23Å; I190-G194 PolarHBondContact O-N 3.18Å
191K89.5Confident91.2Very high177 Ų177105 Ų10577%0.7754%0.536SS*.Hα-helixtrans-78.7-39.1178.7-171.8177.8-180-179.90111.6A187 K188 V189A187-K191 WeakPolarHBondContact O-CB 3.39Å; A187-K191 PolarHBondContact O-N 3.21Å; K188-K191 PolarHBondContact O-N 3.39Å; V189-K191 PolarHBondContact O-N 2.99Å
192E92.7Very high91.1Very high117 Ų117103.1 Ų103.155%0.54754%0.538SS..Hα-helixtrans-64.6-45.8177.5-75.2175.1175.400111.6K188 V189K188-E192 WeakPolarHBondContact CE-OE1 3.47Å; K188-E192 HydrophobicContact CG-CG 4.46Å; K188-E192 WeakPolarHBondContact CG-OE1 3.36Å; K188-E192 IonicContact NZ-OE1 2.98Å; K188-E192 WeakPolarHBondContact O-CG 3.29Å; K188-E192 PolarHBondContact O-N 3.37Å; V189-E192 PolarHBondContact O-N 2.96Å
193H92.9Very high90.9Very high117 Ų11799.9 Ų99.954%0.54252%0.518SS..Hα-helixtrans-89.7-16.5178.7-65.6-73.2000114V189 A195 E196V189-H193 PolarHBondContact O-CD2 2.88Å; V189-H193 PolarHBondContact O-N 3.38Å; H193-A195 PolarHBondContact O-N 3.27Å; H193-E196 VanDerWaalsContact O-CB 3.29Å; H193-E196 WeakPolarHBondContact O-CB 3.36Å; H193-E196 PolarHBondContact O-N 3.36Å; H193-E196 VanDerWaalsContact O-N 3.11Å
194G89.5Confident90.7Very high11 Ų11101.1 Ų101.111%0.11352%0.519CS..Hα-helixtrans-62.7-26.3-17700000114.2I190 E196 F197 F198I190-G194 WeakPolarHBondContact O-CA 3.23Å; I190-G194 PolarHBondContact O-N 3.18Å; G194-E196 PolarHBondContact O-N 2.9Å; G194-E196 VanDerWaalsContact O-N 3.11Å; G194-F197 PolarHBondContact O-N 3.35Å; G194-F198 VanDerWaalsContact O-CD2 3.32Å; G194-F198 WeakPolarHBondContact O-CD2 3.5Å; G194-F198 PolarHBondContact O-N 3.07Å
195A86.2Confident90.6Very high70 Ų7097.8 Ų97.858%0.57950%0.498SS*.THydrogen-bonded Turntrans-62.5-16176.400000113.6H193 K205H193-A195 PolarHBondContact O-N 3.27Å; A195-K205 PolarHBondContact O-NZ 3.34Å
196E89.5Confident90.5Very high131 Ų13196.4 Ų96.461%0.61249%0.491SS*.THydrogen-bonded Turntrans-67.1-43.2171.9-171.6173.3176.100111.3H193 G194 K205H193-E196 VanDerWaalsContact O-CB 3.29Å; H193-E196 WeakPolarHBondContact O-CB 3.36Å; H193-E196 PolarHBondContact O-N 3.36Å; H193-E196 VanDerWaalsContact O-N 3.11Å; G194-E196 PolarHBondContact O-N 2.9Å; G194-E196 VanDerWaalsContact O-N 3.11Å; E196-K205 PolarHBondContact O-NZ 2.98Å
197F90.3Very high90.5Very high99 Ų9995.3 Ų95.343%0.43449%0.493SS..THydrogen-bonded Turntrans-96.1-37.3-172.9-57.4-81.9000113.6G194 M204 K205G194-F197 PolarHBondContact O-N 3.35Å; F197-M204 WeakPolarHBondContact O-CA 3.4Å; F197-K205 WeakPolarHBondContact O-CG 3.43Å; F197-K205 PolarHBondContact O-N 3.24Å
198F91.1Very high90.3Very high97 Ų9799.6 Ų99.643%0.42550%0.499SS..BIsolated β-bridgetrans-93.9140.6-178.4-61.3-76.6000111.1G194 G202 V203 K205G194-F198 VanDerWaalsContact O-CD2 3.32Å; G194-F198 WeakPolarHBondContact O-CD2 3.5Å; G194-F198 PolarHBondContact O-N 3.07Å; F198-G202 WeakPolarHBondContact CD1-O 3.29Å; F198-V203 CarbonylContact C-O 3.5Å; F198-V203 WeakPolarHBondContact CA-O 3.47Å; F198-K205 WeakPolarHBondContact O-CE 3.4Å
199D88.4Confident90.3Very high27 Ų2797 Ų9714%0.14449%0.494CS..  trans-80.6-176.3168.369.216000111.8D201 G202 V203 K205 R208D199-D201 PolarHBondContact O-N 3.39Å; D199-D201 WeakPolarHBondContact OD1-CA 3.27Å; D199-D201 PolarHBondContact OD1-N 3.48Å; D199-G202 PolarHBondContact O-N 2.89Å; D199-G202 VanDerWaalsContact O-N 3.14Å; D199-G202 PolarHBondContact OD1-N 3.39Å; D199-G202 VanDerWaalsContact OD1-N 3.1Å; D199-V203 PolarHBondContact N-O 3.35Å; D199-V203 PolarHBondContact OD1-N 3.32Å; D199-K205 HydrophobicContact CB-CG 4.16Å; D199-R208 IonicContact OD2-NH1 3.91Å
200K86.6Confident90.4Very high214 Ų21498.7 Ų98.793%0.9350%0.499SS*.THydrogen-bonded Turntrans-66.1-19.8-178.1-62.9-178.2-178.3177.90113
201D85.9Confident90.6Very high136 Ų136100.5 Ų100.573%0.72750%0.504SS*.THydrogen-bonded Turntrans-94.8-0.2-179.3-54.9-46.3000111.4D199 V203D199-D201 PolarHBondContact O-N 3.39Å; D199-D201 WeakPolarHBondContact OD1-CA 3.27Å; D199-D201 PolarHBondContact OD1-N 3.48Å; D201-V203 VanDerWaalsContact C-N 3.35Å; D201-V203 HydrophobicContact CB-CG2 4.49Å
202G84.8Confident90.9Very high50 Ų5097.5 Ų97.552%0.51549%0.493SS..SBendtrans8112.9-178.900000113.8F198 D199F198-G202 WeakPolarHBondContact CD1-O 3.29Å; D199-G202 PolarHBondContact O-N 2.89Å; D199-G202 VanDerWaalsContact O-N 3.14Å; D199-G202 PolarHBondContact OD1-N 3.39Å; D199-G202 VanDerWaalsContact OD1-N 3.1Å
203V89.2Confident91.2Very high71 Ų7196.2 Ų96.243%0.4349%0.493SS..  trans-93143.6178.1-176.80000109.8F198 D199 D201 K205F198-V203 CarbonylContact C-O 3.5Å; F198-V203 WeakPolarHBondContact CA-O 3.47Å; D199-V203 PolarHBondContact N-O 3.35Å; D199-V203 PolarHBondContact OD1-N 3.32Å; D201-V203 VanDerWaalsContact C-N 3.35Å; D201-V203 HydrophobicContact CB-CG2 4.49Å; V203-K205 PolarHBondContact O-N 2.94Å
204M92.4Very high91.4Very high74 Ų7497 Ų9737%0.36549%0.492SS..BIsolated β-bridgetrans-69.2124.8176.4-173.9177.8-73.200110.6F197 D206 I207F197-M204 WeakPolarHBondContact O-CA 3.4Å; M204-D206 VanDerWaalsContact C-N 3.25Å; M204-D206 HydrophobicContact CG-CB 4.32Å; M204-D206 PolarHBondContact O-N 3.4Å; M204-I207 HydrophobicContact CB-CD1 3.83Å; M204-I207 HydrophobicContact CB-CG1 3.98Å; M204-I207 HydrophobicContact CG-CG1 4.33Å; M204-I207 PolarHBondContact O-N 2.78Å; M204-I207 HydrophobicContact SD-CD1 4.42Å; M204-I207 HydrophobicContact SD-CG1 4.23Å
205K92.6Very high91.8Very high75 Ų7599.1 Ų99.133%0.32650%0.501SS..Hα-helixtrans-60-35.4-177.3-65.8173.3-167.7159.20112.5A195 E196 F197 F198 D199 V203 I207 R208 T209A195-K205 PolarHBondContact O-NZ 3.34Å; E196-K205 PolarHBondContact O-NZ 2.98Å; F197-K205 WeakPolarHBondContact O-CG 3.43Å; F197-K205 PolarHBondContact O-N 3.24Å; F198-K205 WeakPolarHBondContact O-CE 3.4Å; D199-K205 HydrophobicContact CB-CG 4.16Å; V203-K205 PolarHBondContact O-N 2.94Å; K205-I207 PolarHBondContact O-N 3.41Å; K205-R208 PolarHBondContact O-N 3.47Å; K205-T209 PolarHBondContact O-N 3.43Å; K205-T209 PolarHBondContact O-OG1 2.74Å
206D92.9Very high92.4Very high98 Ų9898.7 Ų98.752%0.52450%0.497SS..Hα-helixtrans-67.5-35.3-177.6-63.9-23.4000112.6M204 R208 T209 I210M204-D206 VanDerWaalsContact C-N 3.25Å; M204-D206 HydrophobicContact CG-CB 4.32Å; M204-D206 PolarHBondContact O-N 3.4Å; D206-R208 VanDerWaalsContact C-N 3.28Å; D206-R208 PolarHBondContact O-N 3.31Å; D206-T209 PolarHBondContact O-N 3.43Å; D206-T209 VanDerWaalsContact O-N 3.16Å; D206-I210 WeakPolarHBondContact O-CG2 3.27Å; D206-I210 PolarHBondContact O-N 2.82Å
207I93.2Very high92.8Very high101 Ų10197.7 Ų97.752%0.51850%0.496SS..Hα-helixtrans-58.9-44.4175.5-63.5176.7000109.9M204 K205 I210 F211M204-I207 HydrophobicContact CB-CD1 3.83Å; M204-I207 HydrophobicContact CB-CG1 3.98Å; M204-I207 HydrophobicContact CG-CG1 4.33Å; M204-I207 PolarHBondContact O-N 2.78Å; M204-I207 HydrophobicContact SD-CD1 4.42Å; M204-I207 HydrophobicContact SD-CG1 4.23Å; K205-I207 PolarHBondContact O-N 3.41Å; I207-I210 WeakPolarHBondContact O-CG2 3.29Å; I207-F211 WeakPolarHBondContact O-CB 3.34Å; I207-F211 PolarHBondContact O-N 3.15Å; I207-F211 VanDerWaalsContact O-N 3.07Å
208R89.7Confident93.2Very high135 Ų13597.2 Ų97.251%0.50950%0.495SS..Hα-helixtrans-67.9-40178.3-166.6166.671.5-167.81.4111.5D199 K205 D206 F211 Q212D199-R208 IonicContact OD2-NH1 3.91Å; K205-R208 PolarHBondContact O-N 3.47Å; D206-R208 VanDerWaalsContact C-N 3.28Å; D206-R208 PolarHBondContact O-N 3.31Å; R208-F211 PolarHBondContact O-N 3.01Å; R208-Q212 VanDerWaalsContact O-CG 3.28Å; R208-Q212 WeakPolarHBondContact O-CG 3.33Å; R208-Q212 PolarHBondContact O-N 3.28Å
209T93.7Very high93.5Very high74 Ų7498 Ų9845%0.45450%0.503SS..Hα-helixtrans-65-49.2-179.7-54.50000111.5K205 D206 F211 Q212 V213K205-T209 PolarHBondContact O-N 3.43Å; K205-T209 PolarHBondContact O-OG1 2.74Å; D206-T209 PolarHBondContact O-N 3.43Å; D206-T209 VanDerWaalsContact O-N 3.16Å; T209-F211 VanDerWaalsContact C-N 3.31Å; T209-F211 PolarHBondContact O-N 3Å; T209-Q212 WeakPolarHBondContact O-CB 3.21Å; T209-Q212 PolarHBondContact O-N 3.26Å; T209-V213 WeakPolarHBondContact O-CG2 3.45Å; T209-V213 PolarHBondContact O-N 3.16Å; T209-V213 VanDerWaalsContact O-N 3.11Å
210I95.8Very high94Very high114 Ų114102.6 Ų102.659%0.58552%0.522SS*.Hα-helixtrans-65.3-36.6178.3-16760.6000111.5D206 I207 Q212 V213 Y214D206-I210 WeakPolarHBondContact O-CG2 3.27Å; D206-I210 PolarHBondContact O-N 2.82Å; I207-I210 WeakPolarHBondContact O-CG2 3.29Å; I210-Q212 VanDerWaalsContact C-N 3.34Å; I210-Q212 PolarHBondContact O-N 2.83Å; I210-V213 PolarHBondContact O-N 3.25Å; I210-Y214 WeakPolarHBondContact O-CB 3.28Å; I210-Y214 PolarHBondContact O-N 2.76Å
211F95.8Very high94.6Very high122 Ų12295.7 Ų95.754%0.53550%0.498SS..Hα-helixtrans-65.5-37.3176.3-169.8-108.5000112.2I207 R208 T209 Y214 N215I207-F211 WeakPolarHBondContact O-CB 3.34Å; I207-F211 PolarHBondContact O-N 3.15Å; I207-F211 VanDerWaalsContact O-N 3.07Å; R208-F211 PolarHBondContact O-N 3.01Å; T209-F211 VanDerWaalsContact C-N 3.31Å; T209-F211 PolarHBondContact O-N 3Å; F211-Y214 PolarHBondContact O-N 2.84Å; F211-N215 WeakPolarHBondContact CD1-ND2 3.36Å; F211-N215 WeakPolarHBondContact CE1-ND2 3.47Å; F211-N215 WeakPolarHBondContact CZ-ND2 3.32Å; F211-N215 WeakPolarHBondContact O-CB 3.36Å; F211-N215 VanDerWaalsContact O-CG 3.27Å; F211-N215 PolarHBondContact O-N 3.48Å; F211-N215 PolarHBondContact O-ND2 3.01Å; F211-N215 VanDerWaalsContact O-ND2 3.11Å
212Q96.2Very high95.2Very high115 Ų11595.3 Ų95.354%0.53749%0.491SS..Hα-helixtrans-63.9-45.2173.6-75.7173.1-4.300112R208 T209 I210 Y214 N215 A216R208-Q212 VanDerWaalsContact O-CG 3.28Å; R208-Q212 WeakPolarHBondContact O-CG 3.33Å; R208-Q212 PolarHBondContact O-N 3.28Å; T209-Q212 WeakPolarHBondContact O-CB 3.21Å; T209-Q212 PolarHBondContact O-N 3.26Å; I210-Q212 VanDerWaalsContact C-N 3.34Å; I210-Q212 PolarHBondContact O-N 2.83Å; Q212-Y214 VanDerWaalsContact C-N 3.34Å; Q212-N215 PolarHBondContact O-N 2.84Å; Q212-A216 WeakPolarHBondContact O-CB 3.44Å; Q212-A216 PolarHBondContact O-N 3.42Å
213V98.1Very high95.8Very high89 Ų8995.1 Ų95.154%0.53949%0.485SS..Hα-helixtrans-61.4-45.2175.8175.30000110.7T209 I210 A216 L217T209-V213 WeakPolarHBondContact O-CG2 3.45Å; T209-V213 PolarHBondContact O-N 3.16Å; T209-V213 VanDerWaalsContact O-N 3.11Å; I210-V213 PolarHBondContact O-N 3.25Å; V213-A216 PolarHBondContact O-N 3.38Å; V213-L217 WeakPolarHBondContact O-CB 3.31Å; V213-L217 PolarHBondContact O-N 3.08Å
214Y97.9Very high96.3Very high133 Ų13394.8 Ų94.852%0.52248%0.483SS..Hα-helixtrans-58.3-48.9176.9174.4-94.5000112.1I210 F211 Q212 L217 Q218I210-Y214 WeakPolarHBondContact O-CB 3.28Å; I210-Y214 PolarHBondContact O-N 2.76Å; F211-Y214 PolarHBondContact O-N 2.84Å; Q212-Y214 VanDerWaalsContact C-N 3.34Å; Y214-L217 PolarHBondContact O-N 2.98Å; Y214-Q218 WeakPolarHBondContact O-CB 3.46Å; Y214-Q218 PolarHBondContact O-N 2.91Å
215N98.3Very high96.6Very high56 Ų5694.2 Ų94.230%0.29949%0.486SS..Hα-helixtrans-64.4-43.5179.3-70.8-32.8000112F211 Q212 L217 Q218 D219F211-N215 WeakPolarHBondContact CD1-ND2 3.36Å; F211-N215 WeakPolarHBondContact CE1-ND2 3.47Å; F211-N215 WeakPolarHBondContact CZ-ND2 3.32Å; F211-N215 WeakPolarHBondContact O-CB 3.36Å; F211-N215 VanDerWaalsContact O-CG 3.27Å; F211-N215 PolarHBondContact O-N 3.48Å; F211-N215 PolarHBondContact O-ND2 3.01Å; F211-N215 VanDerWaalsContact O-ND2 3.11Å; Q212-N215 PolarHBondContact O-N 2.84Å; N215-L217 VanDerWaalsContact C-N 3.26Å; N215-L217 PolarHBondContact O-N 3.38Å; N215-Q218 PolarHBondContact O-N 3.34Å; N215-Q218 VanDerWaalsContact O-N 3.15Å; N215-D219 VanDerWaalsContact O-CG 3.3Å; N215-D219 PolarHBondContact O-N 3.5Å
216A98.3Very high96.8Very high62 Ų6292.3 Ų92.351%0.51249%0.488SS..Hα-helixtrans-60.5-38.2176.900000111.9Q212 V213 K220Q212-A216 WeakPolarHBondContact O-CB 3.44Å; Q212-A216 PolarHBondContact O-N 3.42Å; V213-A216 PolarHBondContact O-N 3.38Å; A216-K220 PolarHBondContact O-N 2.72Å
217L98.4Very high97.1Very high110 Ų11093.8 Ų93.858%0.57649%0.491SS*.Hα-helixtrans-67-44.6173.9-178.861.5000111.6V213 Y214 N215 D219 K220 V221V213-L217 WeakPolarHBondContact O-CB 3.31Å; V213-L217 PolarHBondContact O-N 3.08Å; Y214-L217 PolarHBondContact O-N 2.98Å; N215-L217 VanDerWaalsContact C-N 3.26Å; N215-L217 PolarHBondContact O-N 3.38Å; L217-D219 PolarHBondContact O-N 3.19Å; L217-K220 PolarHBondContact O-N 2.88Å; L217-V221 WeakPolarHBondContact O-CG2 3.06Å; L217-V221 PolarHBondContact O-N 3.25Å
218Q98.3Very high97.3Very high89 Ų8992.5 Ų92.542%0.41649%0.488SS..Hα-helixtrans-60.8-44.1178.3-173.366.623.500111.7Y214 N215 K220 V221 Q222Y214-Q218 WeakPolarHBondContact O-CB 3.46Å; Y214-Q218 PolarHBondContact O-N 2.91Å; N215-Q218 PolarHBondContact O-N 3.34Å; N215-Q218 VanDerWaalsContact O-N 3.15Å; Q218-K220 VanDerWaalsContact C-N 3.28Å; Q218-K220 PolarHBondContact O-N 2.92Å; Q218-V221 PolarHBondContact O-N 3.47Å; Q218-Q222 PolarHBondContact O-N 3.23Å
219D98.3Very high97.8Very high113 Ų11390.9 Ų90.960%0.60449%0.486SS*.Hα-helixtrans-60.5-40.8175.9-71.5-20.4000110.9N215 L217 Q222 A223N215-D219 VanDerWaalsContact O-CG 3.3Å; N215-D219 PolarHBondContact O-N 3.5Å; L217-D219 PolarHBondContact O-N 3.19Å; D219-Q222 PolarHBondContact O-N 3.17Å; D219-A223 PolarHBondContact O-N 3.03Å
220K98.4Very high98Very high124 Ų12492.4 Ų92.454%0.53949%0.488SS..Hα-helixtrans-67.3-40.3176.8-173.656.6178.8169.70112.2A216 L217 Q218 Q222 A223 V224A216-K220 PolarHBondContact O-N 2.72Å; L217-K220 PolarHBondContact O-N 2.88Å; Q218-K220 VanDerWaalsContact C-N 3.28Å; Q218-K220 PolarHBondContact O-N 2.92Å; K220-Q222 VanDerWaalsContact C-N 3.35Å; K220-A223 PolarHBondContact O-N 2.77Å; K220-V224 WeakPolarHBondContact O-CG2 3.47Å; K220-V224 PolarHBondContact O-N 3.14Å
221V98.4Very high98.1Very high69 Ų6989.9 Ų89.942%0.41848%0.481SS..Hα-helixtrans-60.2-46.5173.8170.20000110.2L217 Q218 A223 V224 C225L217-V221 WeakPolarHBondContact O-CG2 3.06Å; L217-V221 PolarHBondContact O-N 3.25Å; Q218-V221 PolarHBondContact O-N 3.47Å; V221-A223 VanDerWaalsContact C-N 3.32Å; V221-A223 PolarHBondContact O-N 3.16Å; V221-V224 PolarHBondContact O-N 3.44Å; V221-C225 PolarHBondContact O-N 3.48Å; V221-C225 PolarHBondContact O-SG 2.99Å
222Q98.4Very high98.2Very high127 Ų12788 Ų8859%0.59347%0.473SS*.Hα-helixtrans-60.5-41.3178.3-173.962.431.500112.3Q218 D219 K220 C225 G226Q218-Q222 PolarHBondContact O-N 3.23Å; D219-Q222 PolarHBondContact O-N 3.17Å; K220-Q222 VanDerWaalsContact C-N 3.35Å; Q222-C225 WeakPolarHBondContact O-CB 3.5Å; Q222-C225 PolarHBondContact O-N 2.81Å; Q222-G226 PolarHBondContact O-N 3.41Å
223A98.3Very high98.3Very high47 Ų4788.6 Ų88.639%0.38847%0.471SS..Hα-helixtrans-61.4-46.7175.500000111.8D219 K220 V221 C225 G226 E227D219-A223 PolarHBondContact O-N 3.03Å; K220-A223 PolarHBondContact O-N 2.77Å; V221-A223 VanDerWaalsContact C-N 3.32Å; V221-A223 PolarHBondContact O-N 3.16Å; A223-C225 VanDerWaalsContact C-N 3.33Å; A223-C225 PolarHBondContact O-N 3.35Å; A223-G226 PolarHBondContact O-N 2.71Å; A223-E227 PolarHBondContact O-N 2.83Å
224V98.5Very high98.3Very high63 Ų6387.8 Ų87.838%0.38247%0.466SS..Hα-helixtrans-64.3-37.6177.4173.90000111.4K220 V221 G226 E227 V228K220-V224 WeakPolarHBondContact O-CG2 3.47Å; K220-V224 PolarHBondContact O-N 3.14Å; V221-V224 PolarHBondContact O-N 3.44Å; V224-G226 VanDerWaalsContact C-N 3.3Å; V224-G226 PolarHBondContact O-N 3.48Å; V224-E227 PolarHBondContact O-N 3.21Å; V224-V228 HydrophobicContact CG1-CG2 4.16Å; V224-V228 WeakPolarHBondContact O-CG2 3.25Å; V224-V228 PolarHBondContact O-N 3.2Å
225C98.4Very high98.3Very high63 Ų6387.8 Ų87.843%0.42647%0.465SS..Hα-helixtrans-56.8-43.4173.7-72.20000111.9V221 Q222 A223 E227 V228 E229V221-C225 PolarHBondContact O-N 3.48Å; V221-C225 PolarHBondContact O-SG 2.99Å; Q222-C225 WeakPolarHBondContact O-CB 3.5Å; Q222-C225 PolarHBondContact O-N 2.81Å; A223-C225 VanDerWaalsContact C-N 3.33Å; A223-C225 PolarHBondContact O-N 3.35Å; C225-E227 PolarHBondContact O-N 3.33Å; C225-V228 PolarHBondContact O-N 2.91Å; C225-E229 VanDerWaalsContact O-CB 3.32Å; C225-E229 WeakPolarHBondContact O-CB 3.43Å; C225-E229 PolarHBondContact O-N 3.4Å
226G98.3Very high98.2Very high35 Ų3591.1 Ų91.136%0.36148%0.479SS..Hα-helixtrans-63.3-39.4176.500000113.3Q222 A223 V224 Q230Q222-G226 PolarHBondContact O-N 3.41Å; A223-G226 PolarHBondContact O-N 2.71Å; V224-G226 VanDerWaalsContact C-N 3.3Å; V224-G226 PolarHBondContact O-N 3.48Å; G226-Q230 PolarHBondContact O-N 3.34Å
227E98.4Very high98.2Very high128 Ų12894.6 Ų94.660%0.59848%0.482SS*.Hα-helixtrans-65.6-44.7175.1-67.8176.1-155.100111.9A223 V224 C225 Q230 S231A223-E227 PolarHBondContact O-N 2.83Å; V224-E227 PolarHBondContact O-N 3.21Å; C225-E227 PolarHBondContact O-N 3.33Å; E227-Q230 PolarHBondContact O-N 2.69Å; E227-S231 PolarHBondContact O-N 3.49Å
228V98.4Very high98.2Very high74 Ų7494 Ų9445%0.44848%0.479SS..Hα-helixtrans-63.5-46.2178.5171.70000110.7V224 C225 Q230 S231 E232V224-V228 HydrophobicContact CG1-CG2 4.16Å; V224-V228 WeakPolarHBondContact O-CG2 3.25Å; V224-V228 PolarHBondContact O-N 3.2Å; C225-V228 PolarHBondContact O-N 2.91Å; V228-Q230 VanDerWaalsContact C-N 3.29Å; V228-Q230 PolarHBondContact O-N 3.14Å; V228-S231 WeakPolarHBondContact CA-OG 3.39Å; V228-S231 PolarHBondContact O-N 3.34Å; V228-S231 VanDerWaalsContact O-N 3.08Å; V228-S231 PolarHBondContact O-OG 2.86Å; V228-E232 HydrophobicContact CG1-CG 4.3Å; V228-E232 WeakPolarHBondContact O-CG 3.29Å; V228-E232 PolarHBondContact O-N 3Å
229E98.3Very high98.1Very high101 Ų10194.2 Ų94.247%0.47248%0.48SS..Hα-helixtrans-55.4-44.5176.5-173.4-168.1147.900111.8C225 E232 R233C225-E229 VanDerWaalsContact O-CB 3.32Å; C225-E229 WeakPolarHBondContact O-CB 3.43Å; C225-E229 PolarHBondContact O-N 3.4Å; E229-E232 PolarHBondContact O-N 2.87Å; E229-R233 WeakPolarHBondContact O-CG 3.4Å; E229-R233 PolarHBondContact O-N 2.87Å; E229-R233 VanDerWaalsContact O-N 3.16Å; E229-R233 IonicContact OE1-CZ 3.62Å; E229-R233 IonicContact OE1-NH1 3.05Å; E229-R233 PolarHBondContact OE1-NH1 3.16Å; E229-R233 IonicContact OE1-NH2 3.94Å; E229-R233 PolarHBondContact OE1-NH2 3.32Å
230Q98.3Very high98.1Very high106 Ų10693.5 Ų93.550%0.49548%0.476SS..Hα-helixtrans-65.1-42176.3-176.958.326.500111.9G226 E227 V228 E232 R233 V234G226-Q230 PolarHBondContact O-N 3.34Å; E227-Q230 PolarHBondContact O-N 2.69Å; V228-Q230 VanDerWaalsContact C-N 3.29Å; V228-Q230 PolarHBondContact O-N 3.14Å; Q230-E232 VanDerWaalsContact C-N 3.34Å; Q230-E232 PolarHBondContact O-N 3.42Å; Q230-R233 PolarHBondContact O-N 3.43Å; Q230-V234 WeakPolarHBondContact O-CG2 3.42Å; Q230-V234 PolarHBondContact O-N 3.45Å; Q230-V234 VanDerWaalsContact O-N 3.14Å
231S98.3Very high98Very high62 Ų6292 Ų9243%0.43447%0.471SS..Hα-helixtrans-64.6-37.3178.476.70000112.6E227 V228 V234 R235E227-S231 PolarHBondContact O-N 3.49Å; V228-S231 WeakPolarHBondContact CA-OG 3.39Å; V228-S231 PolarHBondContact O-N 3.34Å; V228-S231 VanDerWaalsContact O-N 3.08Å; V228-S231 PolarHBondContact O-OG 2.86Å; S231-V234 PolarHBondContact O-N 2.69Å; S231-R235 WeakPolarHBondContact O-CB 3.35Å; S231-R235 PolarHBondContact O-N 3.14Å
232E97.8Very high98Very high81 Ų8191.8 Ų91.838%0.37947%0.47SS..Hα-helixtrans-66.4-42.3177.2-76.2-61.1144.600111.7V228 E229 Q230 V234 R235 E236V228-E232 HydrophobicContact CG1-CG 4.3Å; V228-E232 WeakPolarHBondContact O-CG 3.29Å; V228-E232 PolarHBondContact O-N 3Å; E229-E232 PolarHBondContact O-N 2.87Å; Q230-E232 VanDerWaalsContact C-N 3.34Å; Q230-E232 PolarHBondContact O-N 3.42Å; E232-V234 VanDerWaalsContact C-N 3.32Å; E232-V234 PolarHBondContact O-N 2.61Å; E232-R235 WeakPolarHBondContact O-CB 3.48Å; E232-R235 PolarHBondContact O-N 2.85Å; E232-R235 IonicContact OE1-CZ 3.17Å; E232-R235 IonicContact OE1-NE 2.63Å; E232-R235 IonicContact OE1-NH2 3.87Å; E232-R235 IonicContact OE2-CZ 3.61Å; E232-R235 IonicContact OE2-NE 2.63Å; E232-R235 PolarHBondContact OE2-NE 3Å; E232-R235 IonicContact OE2-NH2 3.11Å; E232-R235 PolarHBondContact OE2-NH2 3.07Å; E232-E236 WeakPolarHBondContact O-CB 3.46Å; E232-E236 PolarHBondContact O-N 3.24Å
233R98.1Very high97.9Very high129 Ų12988.6 Ų88.649%0.48746%0.457SS..Hα-helixtrans-61.2-40173.3-72.3-173.7-179.2109.66112.9E229 Q230 K237E229-R233 WeakPolarHBondContact O-CG 3.4Å; E229-R233 PolarHBondContact O-N 2.87Å; E229-R233 VanDerWaalsContact O-N 3.16Å; E229-R233 IonicContact OE1-CZ 3.62Å; E229-R233 IonicContact OE1-NH1 3.05Å; E229-R233 PolarHBondContact OE1-NH1 3.16Å; E229-R233 IonicContact OE1-NH2 3.94Å; E229-R233 PolarHBondContact OE1-NH2 3.32Å; Q230-R233 PolarHBondContact O-N 3.43Å; R233-K237 PolarHBondContact O-N 3.36Å; R233-K237 VanDerWaalsContact O-N 3.08Å
234V98.4Very high97.9Very high72 Ų7292.7 Ų92.744%0.43647%0.466SS..Hα-helixtrans-65.2-43.3176172.40000110.2Q230 S231 E232 K237 L238Q230-V234 WeakPolarHBondContact O-CG2 3.42Å; Q230-V234 PolarHBondContact O-N 3.45Å; Q230-V234 VanDerWaalsContact O-N 3.14Å; S231-V234 PolarHBondContact O-N 2.69Å; E232-V234 VanDerWaalsContact C-N 3.32Å; E232-V234 PolarHBondContact O-N 2.61Å; V234-K237 PolarHBondContact O-N 2.66Å; V234-L238 HydrophobicContact CG1-CD1 3.93Å; V234-L238 HydrophobicContact CG1-CG 4.45Å; V234-L238 WeakPolarHBondContact O-CG 3.5Å; V234-L238 PolarHBondContact O-N 3.31Å
235R96.9Very high97.9Very high133 Ų13394.3 Ų94.350%0.50247%0.472SS..Hα-helixtrans-59.8-45.8176.3-173.9-179.873.8117.9-2.2111.8S231 E232 L238 Q239S231-R235 WeakPolarHBondContact O-CB 3.35Å; S231-R235 PolarHBondContact O-N 3.14Å; E232-R235 WeakPolarHBondContact O-CB 3.48Å; E232-R235 PolarHBondContact O-N 2.85Å; E232-R235 IonicContact OE1-CZ 3.17Å; E232-R235 IonicContact OE1-NE 2.63Å; E232-R235 IonicContact OE1-NH2 3.87Å; E232-R235 IonicContact OE2-CZ 3.61Å; E232-R235 IonicContact OE2-NE 2.63Å; E232-R235 PolarHBondContact OE2-NE 3Å; E232-R235 IonicContact OE2-NH2 3.11Å; E232-R235 PolarHBondContact OE2-NH2 3.07Å; R235-L238 PolarHBondContact O-N 3.35Å; R235-Q239 VanDerWaalsContact O-CB 3.29Å; R235-Q239 WeakPolarHBondContact O-CB 3.5Å; R235-Q239 PolarHBondContact O-N 2.99Å
236E97.3Very high97.8Very high125 Ų12597.4 Ų97.458%0.58448%0.478SS*.Hα-helixtrans-57.1-52.8176.5-177.9179.8-159.300111.1E232 L238 Q239 D240E232-E236 WeakPolarHBondContact O-CB 3.46Å; E232-E236 PolarHBondContact O-N 3.24Å; E236-L238 VanDerWaalsContact C-N 3.34Å; E236-L238 PolarHBondContact O-N 3.38Å; E236-Q239 WeakPolarHBondContact O-CB 3.44Å; E236-Q239 PolarHBondContact O-N 2.91Å; E236-Q239 VanDerWaalsContact O-N 3.12Å; E236-D240 PolarHBondContact O-N 3.48Å
237K98.3Very high97.7Very high136 Ų136102.4 Ų102.459%0.59149%0.492SS*.Hα-helixtrans-57.6-45.5178.7-175.5-177.7175.8-173.40112.5R233 V234 Q239 D240 E241R233-K237 PolarHBondContact O-N 3.36Å; R233-K237 VanDerWaalsContact O-N 3.08Å; V234-K237 PolarHBondContact O-N 2.66Å; K237-Q239 VanDerWaalsContact C-N 3.34Å; K237-D240 PolarHBondContact O-N 2.96Å; K237-E241 VanDerWaalsContact CE-OE1 3.28Å; K237-E241 WeakPolarHBondContact CE-OE1 3.49Å; K237-E241 WeakPolarHBondContact O-CG 3.48Å; K237-E241 PolarHBondContact O-N 3.46Å
238L98.2Very high97.7Very high96 Ų96100.1 Ų100.150%0.50348%0.481SS..Hα-helixtrans-65.1-39.6178.1-72.6172.3000111.6V234 R235 E236 D240 E241 V242V234-L238 HydrophobicContact CG1-CD1 3.93Å; V234-L238 HydrophobicContact CG1-CG 4.45Å; V234-L238 WeakPolarHBondContact O-CG 3.5Å; V234-L238 PolarHBondContact O-N 3.31Å; R235-L238 PolarHBondContact O-N 3.35Å; E236-L238 VanDerWaalsContact C-N 3.34Å; E236-L238 PolarHBondContact O-N 3.38Å; L238-D240 VanDerWaalsContact C-N 3.31Å; L238-D240 PolarHBondContact O-N 3.06Å; L238-E241 PolarHBondContact O-N 3.38Å; L238-V242 WeakPolarHBondContact O-CB 3.29Å; L238-V242 VanDerWaalsContact O-CG2 3.29Å; L238-V242 WeakPolarHBondContact O-CG2 3.46Å; L238-V242 PolarHBondContact O-N 3.24Å
239Q96.3Very high97.6Very high95 Ų95100.9 Ų100.944%0.44448%0.482SS..Hα-helixtrans-62.7-40.1177.6-173.358.165.300111.4R235 E236 K237 V242 N243R235-Q239 VanDerWaalsContact O-CB 3.29Å; R235-Q239 WeakPolarHBondContact O-CB 3.5Å; R235-Q239 PolarHBondContact O-N 2.99Å; E236-Q239 WeakPolarHBondContact O-CB 3.44Å; E236-Q239 PolarHBondContact O-N 2.91Å; E236-Q239 VanDerWaalsContact O-N 3.12Å; K237-Q239 VanDerWaalsContact C-N 3.34Å; Q239-V242 PolarHBondContact O-N 3.49Å; Q239-N243 PolarHBondContact NE2-OD1 3.45Å; Q239-N243 VanDerWaalsContact NE2-OD1 3.07Å; Q239-N243 WeakPolarHBondContact O-CB 3.34Å; Q239-N243 PolarHBondContact O-N 3.37Å; Q239-N243 PolarHBondContact O-ND2 3.4Å; Q239-N243 PolarHBondContact O-OD1 2.93Å
240D97.5Very high97.5Very high97 Ų9798.6 Ų98.652%0.51948%0.48SS..Hα-helixtrans-65.5-43.8175.6-77.4-14.3000112.7E236 K237 L238 V242 N243 K244E236-D240 PolarHBondContact O-N 3.48Å; K237-D240 PolarHBondContact O-N 2.96Å; L238-D240 VanDerWaalsContact C-N 3.31Å; L238-D240 PolarHBondContact O-N 3.06Å; D240-V242 PolarHBondContact O-N 3.12Å; D240-N243 PolarHBondContact O-N 3.46Å; D240-K244 WeakPolarHBondContact O-CB 3.33Å; D240-K244 PolarHBondContact O-N 3.3Å
241E98.1Very high97.4Very high94 Ų9498.1 Ų98.144%0.43948%0.481SS..Hα-helixtrans-60.5-45.2175.3-73.3178.3-168.800111.3K237 L238 N243 K244 L245K237-E241 VanDerWaalsContact CE-OE1 3.28Å; K237-E241 WeakPolarHBondContact CE-OE1 3.49Å; K237-E241 WeakPolarHBondContact O-CG 3.48Å; K237-E241 PolarHBondContact O-N 3.46Å; L238-E241 PolarHBondContact O-N 3.38Å; E241-N243 VanDerWaalsContact C-N 3.34Å; E241-N243 PolarHBondContact O-N 2.97Å; E241-K244 PolarHBondContact O-N 3.07Å; E241-L245 WeakPolarHBondContact O-CG 3.35Å; E241-L245 PolarHBondContact O-N 3.23Å
242V97.6Very high97.3Very high63 Ų63103.5 Ų103.538%0.38249%0.492SS..Hα-helixtrans-61.2-42.6175.3169.80000111.2L238 Q239 D240 L245 K246L238-V242 WeakPolarHBondContact O-CB 3.29Å; L238-V242 VanDerWaalsContact O-CG2 3.29Å; L238-V242 WeakPolarHBondContact O-CG2 3.46Å; L238-V242 PolarHBondContact O-N 3.24Å; Q239-V242 PolarHBondContact O-N 3.49Å; D240-V242 PolarHBondContact O-N 3.12Å; V242-L245 PolarHBondContact O-N 3.08Å; V242-K246 HydrophobicContact CG1-CD 4.14Å; V242-K246 HydrophobicContact CG1-CG 4.5Å; V242-K246 WeakPolarHBondContact O-CB 3.37Å; V242-K246 WeakPolarHBondContact O-CG 3.41Å; V242-K246 PolarHBondContact O-N 2.98Å
243N96.4Very high97.2Very high61 Ų61106.8 Ų106.833%0.32650%0.504SS..Hα-helixtrans-64.1-44.7178.7-72.9-18.9000111.6Q239 D240 E241 L245 K246 Q247Q239-N243 PolarHBondContact NE2-OD1 3.45Å; Q239-N243 VanDerWaalsContact NE2-OD1 3.07Å; Q239-N243 WeakPolarHBondContact O-CB 3.34Å; Q239-N243 PolarHBondContact O-N 3.37Å; Q239-N243 PolarHBondContact O-ND2 3.4Å; Q239-N243 PolarHBondContact O-OD1 2.93Å; D240-N243 PolarHBondContact O-N 3.46Å; E241-N243 VanDerWaalsContact C-N 3.34Å; E241-N243 PolarHBondContact O-N 2.97Å; N243-L245 PolarHBondContact O-N 3.4Å; N243-K246 PolarHBondContact O-N 3.5Å; N243-Q247 WeakPolarHBondContact O-CG 3.33Å; N243-Q247 PolarHBondContact O-N 3.42Å
244K97.9Very high97.1Very high132 Ų132109 Ų10957%0.57451%0.513SS*.Hα-helixtrans-60.5-44.3176-174.9177.4-179.3178.40111.7D240 E241 Q247 Q248D240-K244 WeakPolarHBondContact O-CB 3.33Å; D240-K244 PolarHBondContact O-N 3.3Å; E241-K244 PolarHBondContact O-N 3.07Å; K244-Q247 PolarHBondContact O-N 3.34Å; K244-Q248 WeakPolarHBondContact O-CG 3.28Å; K244-Q248 PolarHBondContact O-N 2.93Å
245L98.2Very high96.9Very high97 Ų97110.3 Ų110.351%0.50852%0.517SS..Hα-helixtrans-63.8-43.2176.7-72.4170.8000111.9E241 V242 N243 Q247 Q248 I249E241-L245 WeakPolarHBondContact O-CG 3.35Å; E241-L245 PolarHBondContact O-N 3.23Å; V242-L245 PolarHBondContact O-N 3.08Å; N243-L245 PolarHBondContact O-N 3.4Å; L245-Q247 VanDerWaalsContact C-N 3.33Å; L245-Q247 PolarHBondContact O-N 2.98Å; L245-Q248 PolarHBondContact O-N 2.94Å; L245-I249 WeakPolarHBondContact O-CG1 3.44Å; L245-I249 PolarHBondContact O-N 3.29Å
246K96.8Very high96.7Very high128 Ų128106.6 Ų106.656%0.55752%0.515SS*.Hα-helixtrans-58.9-42.9175-76.9176.1178.6177.50111.9V242 N243 I249 A250V242-K246 HydrophobicContact CG1-CD 4.14Å; V242-K246 HydrophobicContact CG1-CG 4.5Å; V242-K246 WeakPolarHBondContact O-CB 3.37Å; V242-K246 WeakPolarHBondContact O-CG 3.41Å; V242-K246 PolarHBondContact O-N 2.98Å; N243-K246 PolarHBondContact O-N 3.5Å; K246-I249 PolarHBondContact O-N 3.25Å; K246-A250 WeakPolarHBondContact O-CB 3.4Å; K246-A250 PolarHBondContact O-N 3.01Å
247Q96.9Very high96.4Very high140 Ų140103.3 Ų103.365%0.65451%0.509SS*.Hα-helixtrans-63.3-43.3176.4-72174.6-0.100112.1N243 K244 L245 I249 A250 L251N243-Q247 WeakPolarHBondContact O-CG 3.33Å; N243-Q247 PolarHBondContact O-N 3.42Å; K244-Q247 PolarHBondContact O-N 3.34Å; L245-Q247 VanDerWaalsContact C-N 3.33Å; L245-Q247 PolarHBondContact O-N 2.98Å; Q247-I249 PolarHBondContact O-N 3.47Å; Q247-A250 PolarHBondContact O-N 2.89Å; Q247-L251 WeakPolarHBondContact O-CB 3.38Å; Q247-L251 PolarHBondContact O-N 2.63Å
248Q97.2Very high96Very high80 Ų80100 Ų10037%0.37450%0.496SS..Hα-helixtrans-62.6-42.7176.2-72.6-179-2.800112.3K244 L245 L251 R252K244-Q248 WeakPolarHBondContact O-CG 3.28Å; K244-Q248 PolarHBondContact O-N 2.93Å; L245-Q248 PolarHBondContact O-N 2.94Å; Q248-L251 PolarHBondContact O-N 3.02Å; Q248-R252 WeakPolarHBondContact O-CG 3.35Å; Q248-R252 PolarHBondContact O-N 2.95Å
249I97.1Very high95.6Very high90 Ų90101.5 Ų101.546%0.46250%0.5SS..Hα-helixtrans-62.6-44.7175.8-68166.8000110.3L245 K246 Q247 L251 R252 K253L245-I249 WeakPolarHBondContact O-CG1 3.44Å; L245-I249 PolarHBondContact O-N 3.29Å; K246-I249 PolarHBondContact O-N 3.25Å; Q247-I249 PolarHBondContact O-N 3.47Å; I249-L251 PolarHBondContact O-N 3.47Å; I249-R252 PolarHBondContact O-N 3.45Å; I249-K253 HydrophobicContact CG2-CD 4.16Å; I249-K253 HydrophobicContact CG2-CG 4.46Å; I249-K253 WeakPolarHBondContact O-CB 3.29Å; I249-K253 WeakPolarHBondContact O-CG 3.46Å; I249-K253 PolarHBondContact O-N 3.39Å
250A96.8Very high95.1Very high53 Ų53101.6 Ų101.644%0.43850%0.5SS..Hα-helixtrans-62.4-41.8178.600000112.2K246 Q247 K253 R254K246-A250 WeakPolarHBondContact O-CB 3.4Å; K246-A250 PolarHBondContact O-N 3.01Å; Q247-A250 PolarHBondContact O-N 2.89Å; A250-K253 PolarHBondContact O-N 2.98Å; A250-R254 PolarHBondContact O-N 2.96Å
251L96.5Very high94.6Very high96 Ų96103.8 Ų103.850%0.50350%0.502SS..Hα-helixtrans-63.5-47.4176.4-178.364000111.6Q247 Q248 I249 K253 R254 L255Q247-L251 WeakPolarHBondContact O-CB 3.38Å; Q247-L251 PolarHBondContact O-N 2.63Å; Q248-L251 PolarHBondContact O-N 3.02Å; I249-L251 PolarHBondContact O-N 3.47Å; L251-K253 VanDerWaalsContact C-N 3.34Å; L251-K253 PolarHBondContact O-N 3.16Å; L251-R254 PolarHBondContact O-N 3.31Å; L251-R254 VanDerWaalsContact O-N 3.16Å; L251-L255 HydrophobicContact CD1-CD1 4.48Å; L251-L255 HydrophobicContact CD1-CG 4.48Å; L251-L255 HydrophobicContact CG-CD1 4.22Å; L251-L255 WeakPolarHBondContact O-CG 3.38Å; L251-L255 PolarHBondContact O-N 3.44Å
252R95.5Very high94Very high176 Ų176106.3 Ų106.366%0.66451%0.507SS*.Hα-helixtrans-60.5-42.7177.3-73.4-179.7-174.7170.13.2112.1Q248 I249 R254 L255 A256Q248-R252 WeakPolarHBondContact O-CG 3.35Å; Q248-R252 PolarHBondContact O-N 2.95Å; I249-R252 PolarHBondContact O-N 3.45Å; R252-R254 VanDerWaalsContact C-N 3.3Å; R252-R254 PolarHBondContact O-N 3.44Å; R252-L255 PolarHBondContact O-N 2.96Å; R252-A256 WeakPolarHBondContact O-CB 3.47Å; R252-A256 PolarHBondContact O-N 3.41Å
253K95.6Very high93.2Very high149 Ų149108.3 Ų108.365%0.64852%0.515SS*.Hα-helixtrans-61.1-39.1175.4-75.7-178.4177-173.30112.1I249 A250 L251 A257I249-K253 HydrophobicContact CG2-CD 4.16Å; I249-K253 HydrophobicContact CG2-CG 4.46Å; I249-K253 WeakPolarHBondContact O-CB 3.29Å; I249-K253 WeakPolarHBondContact O-CG 3.46Å; I249-K253 PolarHBondContact O-N 3.39Å; A250-K253 PolarHBondContact O-N 2.98Å; L251-K253 VanDerWaalsContact C-N 3.34Å; L251-K253 PolarHBondContact O-N 3.16Å; K253-A257 VanDerWaalsContact O-CB 3.29Å; K253-A257 WeakPolarHBondContact O-CB 3.47Å; K253-A257 PolarHBondContact O-N 3.41Å
254R94.9Very high92.2Very high176 Ų176113.5 Ų113.566%0.66453%0.53SS*.Hα-helixtrans-67-47.3177.3-172.7-175.8-61.4171.60.1111.9A250 L251 R252 A257 E258A250-R254 PolarHBondContact O-N 2.96Å; L251-R254 PolarHBondContact O-N 3.31Å; L251-R254 VanDerWaalsContact O-N 3.16Å; R252-R254 VanDerWaalsContact C-N 3.3Å; R252-R254 PolarHBondContact O-N 3.44Å; R254-A257 PolarHBondContact O-N 2.91Å; R254-E258 WeakPolarHBondContact O-CB 3.32Å; R254-E258 PolarHBondContact O-N 3.11Å
255L94.2Very high91Very high99 Ų99112.5 Ų112.552%0.51853%0.528SS..Hα-helixtrans-61.7-44.9178.4-69.4173.3000111.4L251 R252 A257 E258 E259L251-L255 HydrophobicContact CD1-CD1 4.48Å; L251-L255 HydrophobicContact CD1-CG 4.48Å; L251-L255 HydrophobicContact CG-CD1 4.22Å; L251-L255 WeakPolarHBondContact O-CG 3.38Å; L251-L255 PolarHBondContact O-N 3.44Å; R252-L255 PolarHBondContact O-N 2.96Å; L255-A257 PolarHBondContact O-N 3.03Å; L255-E258 PolarHBondContact O-N 3.48Å; L255-E259 WeakPolarHBondContact O-CB 3.35Å; L255-E259 PolarHBondContact O-N 3.2Å
256A92.6Very high89.4Confident56 Ų56113.8 Ų113.846%0.46354%0.535SS..Hα-helixtrans-62.4-41.4176.400000112.5R252 E259 E260R252-A256 WeakPolarHBondContact O-CB 3.47Å; R252-A256 PolarHBondContact O-N 3.41Å; A256-E259 PolarHBondContact O-N 2.93Å; A256-E260 WeakPolarHBondContact O-CB 3.45Å; A256-E260 PolarHBondContact O-N 3.45Å
257A92.4Very high87.7Confident56 Ų56113.9 Ų113.946%0.46355%0.546SS..Hα-helixtrans-67.1-34.917600000112.7K253 R254 L255 R261K253-A257 VanDerWaalsContact O-CB 3.29Å; K253-A257 WeakPolarHBondContact O-CB 3.47Å; K253-A257 PolarHBondContact O-N 3.41Å; R254-A257 PolarHBondContact O-N 2.91Å; L255-A257 PolarHBondContact O-N 3.03Å; A257-R261 WeakPolarHBondContact O-CB 3.48Å; A257-R261 PolarHBondContact O-N 2.89Å
258E89.9Confident85.9Confident66 Ų66117.9 Ų117.931%0.30856%0.555SS.*Hα-helixtrans-70.9-40.6175.4-169.9179.3165.400111.7R254 L255 R261 R262R254-E258 WeakPolarHBondContact O-CB 3.32Å; R254-E258 PolarHBondContact O-N 3.11Å; L255-E258 PolarHBondContact O-N 3.48Å; E258-R261 PolarHBondContact O-N 3.25Å; E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.35Å; E258-R262 IonicContact OE1-CZ 3.39Å; E258-R262 IonicContact OE1-NE 2.78Å; E258-R262 PolarHBondContact OE1-NE 3.23Å; E258-R262 IonicContact OE1-NH2 3.31Å; E258-R262 PolarHBondContact OE1-NH2 3.03Å
259E88.8Confident83.5Confident128 Ų128117.8 Ų117.860%0.59856%0.563SS**Hα-helixtrans-62.7-44.3173.9-172.2175.8-174.100111.5L255 A256 R261 R262 L263L255-E259 WeakPolarHBondContact O-CB 3.35Å; L255-E259 PolarHBondContact O-N 3.2Å; A256-E259 PolarHBondContact O-N 2.93Å; E259-R261 VanDerWaalsContact C-N 3.29Å; E259-R261 PolarHBondContact O-N 3.24Å; E259-R262 PolarHBondContact O-N 3.38Å; E259-L263 HydrophobicContact CG-CD1 4.28Å; E259-L263 WeakPolarHBondContact O-CG 3.42Å; E259-L263 PolarHBondContact O-N 2.93Å
260E87.3Confident81.2Confident96 Ų96118.7 Ų118.745%0.44958%0.575SS.*Hα-helixtrans-60.7-38.2173.4-170.5-174.8165.500111.8A256 R264A256-E260 WeakPolarHBondContact O-CB 3.45Å; A256-E260 PolarHBondContact O-N 3.45Å; E260-R264 VanDerWaalsContact O-CG 3.32Å; E260-R264 WeakPolarHBondContact O-CG 3.37Å; E260-R264 PolarHBondContact O-N 2.89Å; E260-R264 VanDerWaalsContact O-N 3.11Å; E260-R264 IonicContact OE1-CZ 3.5Å; E260-R264 IonicContact OE1-NE 3.44Å; E260-R264 IonicContact OE1-NH1 2.76Å; E260-R264 IonicContact OE1-NH2 3.75Å; E260-R264 PolarHBondContact OE1-NH2 3.44Å
261R86.3Confident78.9Confident144 Ų144122.1 Ų122.154%0.54359%0.592SS.*Hα-helixtrans-66.8-43.7175.7-166.7-175.871.2177.80.2111.7A257 E258 E259 R264 E265A257-R261 WeakPolarHBondContact O-CB 3.48Å; A257-R261 PolarHBondContact O-N 2.89Å; E258-R261 PolarHBondContact O-N 3.25Å; E259-R261 VanDerWaalsContact C-N 3.29Å; E259-R261 PolarHBondContact O-N 3.24Å; R261-R264 PolarHBondContact O-N 2.91Å; R261-E265 IonicContact NE-OE1 3.87Å; R261-E265 PolarHBondContact O-N 3.05Å
262R84.2Confident76.6Confident146 Ų146127.1 Ų127.155%0.55161%0.613SS**Hα-helixtrans-62.4-43.5177-72179.7-172.9-155.23.1111.7E258 E259 R264 E265 D266E258-R262 WeakPolarHBondContact O-CG 3.43Å; E258-R262 PolarHBondContact O-N 3.35Å; E258-R262 IonicContact OE1-CZ 3.39Å; E258-R262 IonicContact OE1-NE 2.78Å; E258-R262 PolarHBondContact OE1-NE 3.23Å; E258-R262 IonicContact OE1-NH2 3.31Å; E258-R262 PolarHBondContact OE1-NH2 3.03Å; E259-R262 PolarHBondContact O-N 3.38Å; R262-R264 VanDerWaalsContact C-N 3.27Å; R262-R264 PolarHBondContact O-N 3.35Å; R262-E265 PolarHBondContact O-N 3.02Å; R262-E265 VanDerWaalsContact O-N 3.14Å; R262-D266 PolarHBondContact O-N 2.98Å
263L81.4Confident73.8Confident106 Ų106127.5 Ų127.556%0.55562%0.623SS**Hα-helixtrans-63.4-31.6175.5-71167.8000112.7E259 V267E259-L263 HydrophobicContact CG-CD1 4.28Å; E259-L263 WeakPolarHBondContact O-CG 3.42Å; E259-L263 PolarHBondContact O-N 2.93Å; L263-V267 WeakPolarHBondContact O-CG2 3.32Å; L263-V267 PolarHBondContact O-N 2.76Å
264R75.6Confident71.4Confident169 Ų169128 Ų12864%0.63863%0.633SS**Hα-helixtrans-74.6-29.1174-75.1177178.4-179.53.8113.4E260 R261 R262E260-R264 VanDerWaalsContact O-CG 3.32Å; E260-R264 WeakPolarHBondContact O-CG 3.37Å; E260-R264 PolarHBondContact O-N 2.89Å; E260-R264 VanDerWaalsContact O-N 3.11Å; E260-R264 IonicContact OE1-CZ 3.5Å; E260-R264 IonicContact OE1-NE 3.44Å; E260-R264 IonicContact OE1-NH1 2.76Å; E260-R264 IonicContact OE1-NH2 3.75Å; E260-R264 PolarHBondContact OE1-NH2 3.44Å; R261-R264 PolarHBondContact O-N 2.91Å; R262-R264 VanDerWaalsContact C-N 3.27Å; R262-R264 PolarHBondContact O-N 3.35Å
265E73.2Confident68.6Low112 Ų112126.4 Ų126.452%0.52364%0.643SS.*Hα-helixtrans-75.7-39.9175.5-75.4169.1-176.400111.2R261 R262 V267 R268R261-E265 IonicContact NE-OE1 3.87Å; R261-E265 PolarHBondContact O-N 3.05Å; R262-E265 PolarHBondContact O-N 3.02Å; R262-E265 VanDerWaalsContact O-N 3.14Å; E265-V267 VanDerWaalsContact C-N 3.3Å; E265-V267 PolarHBondContact O-N 3.44Å; E265-R268 PolarHBondContact O-N 3.34Å
266D64.2Low65.7Low123 Ų123130.3 Ų130.366%0.65866%0.658SS**Hα-helixtrans-66.9-24.4176.8-90.2-9000114.2R262 R268 S269R262-D266 PolarHBondContact O-N 2.98Å; D266-R268 VanDerWaalsContact C-N 3.27Å; D266-S269 PolarHBondContact O-OG 3.14Å
267V61.2Low63.3Low130 Ų130133.3 Ų133.379%0.78867%0.673SS**THydrogen-bonded Turntrans-79.6-12.3173.3175.60000111.8L263 E265L263-V267 WeakPolarHBondContact O-CG2 3.32Å; L263-V267 PolarHBondContact O-N 2.76Å; E265-V267 VanDerWaalsContact C-N 3.3Å; E265-V267 PolarHBondContact O-N 3.44Å
268R58.9Low60.3Low225 Ų225142.5 Ų142.585%0.84970%0.695SS**SBendtrans-102.1-3.4-174.1-141.9174.3-164.2-175.33114.6E265 D266E265-R268 PolarHBondContact O-N 3.34Å; D266-R268 VanDerWaalsContact C-N 3.27Å
269S47Very low57.5Low77 Ų77148.6 Ų148.654%0.53872%0.724SS.*PPolyproline II helixtrans-92117.1172.731.10000111.1D266D266-S269 PolarHBondContact O-OG 3.14Å
270P49.6Very low54.8Low109 Ų109146.7 Ų146.771%0.70873%0.73SS**PPolyproline II helixtrans-78.9160.2167.733.7-30.4000110.4E272P270-E272 PolarHBondContact O-N 3.23Å
271P48.1Very low52.2Low125 Ų125147.6 Ų147.681%0.81275%0.747SS**PPolyproline II helixtrans-67.7132.9178.428.5-31.4000110.1E273P271-E273 PolarHBondContact O-N 3.45Å
272E47.2Very low49.6Very low201 Ų201145.3 Ų145.394%0.93975%0.753SS**  trans-61.3115.1175.1-66.3-177152.800110.4P270P270-E272 PolarHBondContact O-N 3.23Å
273E38.3Very low47.3Very low185 Ų185145.1 Ų145.186%0.86476%0.762SS**  trans-114.1123163.7-165.6172.2-167.300109P271 T275P271-E273 PolarHBondContact O-N 3.45Å; E273-T275 PolarHBondContact O-N 3.4Å
274N44.1Very low44.9Very low160 Ų160146 Ų14686%0.85677%0.766SS**  trans-51.4122.9178.8-67.5-67.7000112.7
275T35.8Very low42.9Very low142 Ų142144 Ų14487%0.87178%0.779SS**  trans-155.8127.8146.3-37.90000111.6E273E273-T275 PolarHBondContact O-N 3.4Å
276E33.9Very low41.1Very low181 Ų181148.8 Ų148.885%0.84679%0.792SS**  trans-66.7163.3176-86-148.2158.200114.7
277P42.7Very low39.7Very low119 Ų119150.4 Ų150.477%0.77380%0.799SS**  trans-89.5143.6-16134.5-31.9000113.1
278R28.3Very low38.1Very low248 Ų248148.9 Ų148.994%0.93680%0.8SS**  trans-138.4110.6166.3-133.8176.9-175.6-179.81.5111.6
279E32.6Very low36.8Very low194 Ų194147.9 Ų147.991%0.90780%0.802SS**  trans-60.1138.8163.8-63.8176.8152.800110.8
280A32Very low36.1Very low89 Ų89152.3 Ų152.374%0.73682%0.82SS**  trans154.8107.2130.400000111.2
281S32Very low35.3Very low114 Ų114151.5 Ų151.580%0.79782%0.822SS**  49.6121.6128.7-52.40000121.6
282S31.2Very low35Very low97 Ų97151.9 Ų151.968%0.67883%0.825SS**  108120.1128.993.10000116.3
283I35.9Very low34.3Very low141 Ų141148.3 Ų148.372%0.72382%0.822SS**  162.9130.1100.3-91.2152.8000111.7
284L32Very low34.2Very low124 Ų124143.7 Ų143.765%0.64982%0.816SS**  trans48125.1151.4-86.974.5000121.1R286L284-R286 HydrophobicContact CD2-CG 4.25Å
285S33.5Very low34.3Very low129 Ų129142 Ų14290%0.90281%0.813SS**  trans-131.9120.3131-740000109.8
286R33.8Very low34.1Very low212 Ų212143.8 Ų143.880%0.881%0.812SS**  trans-72.1143.1169.1-67.2176.2178.4-174.4-1.5108.7L284L284-R286 HydrophobicContact CD2-CG 4.25Å
287I34.9Very low34.1Very low156 Ų156146.6 Ų146.680%0.881%0.814SS**  -174.5121.1115.9-83.9148000106.4F289I287-F289 HydrophobicContact CG2-CD2 4.36Å; I287-F289 HydrophobicContact CG2-CE2 4.48Å
288A29Very low34Very low99 Ų99146.1 Ų146.182%0.81881%0.811SS**  trans-105.3141.317300000109
289F31.3Very low34.2Very low204 Ų204139.1 Ų139.190%0.89580%0.801SS**  trans-117129.5160.2-94.7-82.8000107.9I287I287-F289 HydrophobicContact CG2-CD2 4.36Å; I287-F289 HydrophobicContact CG2-CE2 4.48Å
290D31.8Very low34.3Very low170 Ų170137 Ų13791%0.90980%0.801SS**  trans-83.6137.6-178.2-112-29.1000111.8
291A33.7Very low34.5Very low91 Ų91138.1 Ų138.175%0.75280%0.804SS**  trans-154.1145.9154.400000110.4
292P40.1Very low35.2Very low134 Ų134138 Ų13887%0.8780%0.8SS**  trans-88.9171.6-151.934.7-36.1000116.7
293S33.6Very low35.7Very low126 Ų126140.7 Ų140.788%0.88181%0.807SS**  trans-80.2165.3-157.7-49.40000118.8
294A35.3Very low35.9Very low88 Ų88139.7 Ų139.773%0.72781%0.809SS**  trans-69.4-172.3-168.600000118.1
295P46.1Very low36.5Very low125 Ų125139.9 Ų139.981%0.81282%0.818SS**  -138.4137.8104.633.9-18.7000117.7
296E32.3Very low36.5Very low179 Ų179139.1 Ų139.184%0.83681%0.813SS**  trans47.1106.3140.3-60-170.4136.900125.8
297R33.2Very low36.5Very low239 Ų239140 Ų14090%0.90282%0.818SS**  53.3157.1122.6-87.7-169-179.7-176.72122.7
298P41.5Very low36.4Very low109 Ų109138.1 Ų138.171%0.70881%0.814SS**  cis-138.5148.723.735.3-13000120.1
299S31.9Very low36.5Very low102 Ų102141 Ų14171%0.71382%0.815SS**  trans37.7115.4143.7630000123.4
300T35.1Very low36.6Very low149 Ų149138.5 Ų138.591%0.91481%0.811SS**  trans-149.2150.1138.247.10000111.2
301S36.2Very low36.8Very low113 Ų113137.8 Ų137.879%0.7981%0.806SS**  trans-73.7164.8-167.358.70000115.7
302P46Very low36.7Very low111 Ų111139 Ų13972%0.72181%0.809SS**  trans-98.2144.8-169.636.4-29.8000115.4
303N42Very low36.3Very low154 Ų154141.8 Ų141.882%0.82481%0.81SS**  trans70.6129.1151.5-60.4-11.7000121.7
304P41.4Very low36.3Very low119 Ų119143.1 Ų143.177%0.77381%0.807SS**PPolyproline II helixtrans-87.1157.9163.735.4-31.5000112.5
305P44.1Very low36.1Very low129 Ų129145.9 Ų145.984%0.83881%0.81SS**PPolyproline II helixtrans-79.5154.5-17431.2-34000114.6
306S32.5Very low35.5Very low113 Ų113146.4 Ų146.479%0.7981%0.806SS**PPolyproline II helixtrans-80139.9175.3-176.80000111.7
307Y34.8Very low35.5Very low230 Ų230145.3 Ų145.390%0.90281%0.805SS**  trans-100.2102.2-175-140.7-91.9000110.8
308T33.5Very low35.4Very low116 Ų116141.2 Ų141.271%0.71280%0.8SS**  trans-154.599.1162.223.90000106.9
309D29.9Very low34.8Very low159 Ų159141 Ų14185%0.8580%0.802SS**  -172131.8119.8-92.8-21.5000110.2
310L34.3Very low34.6Very low153 Ų153141.4 Ų141.480%0.80180%0.804SS**  trans-97.5142177.6-99-179.8000107.9
311L34.6Very low34.4Very low155 Ų155139.8 Ų139.881%0.81280%0.799SS**  trans84.9107.1155.1-53.6161.6000117.8
312S32.8Very low34.3Very low116 Ų116140.1 Ų140.181%0.81180%0.801SS**  -165.4134.7125.2-78.70000111.2
313Q30.6Very low33.7Very low192 Ų192140.8 Ų140.890%0.89781%0.806SS**  trans92.9106.2157.3-70.9174.2-27.100120.1
314D33.9Very low33.6Very low154 Ų154138.9 Ų138.982%0.82480%0.802SS**  trans-43.3140.3149.2-59.9-61.7000112.7
315D32.3Very low33.1Very low147 Ų147140 Ų14079%0.78681%0.807SS**  175.8158106.6-116.2-43.8000113
316N32.4Very low32.4Very low135 Ų135145.4 Ų145.472%0.72281%0.81SS**  trans-34145.6-179.7-69.2-76.6000119.7
317L32.3Very low32.4Very low156 Ų156144.7 Ų144.782%0.81781%0.812SS**  146.9122.4123.1-73.4176.9000114.9
318L31.2Very low32.4Very low154 Ų154138.6 Ų138.681%0.80681%0.808SS**  trans31.3127.7144.7-62.1169.6000123.1
319S28.3Very low32.7Very low105 Ų105141.1 Ų141.173%0.73482%0.817SS**  trans62115.5134.2-66.70000121.2
320S28.9Very low33.6Very low109 Ų109141.1 Ų141.176%0.76282%0.816SS**  149.6139.397.960.80000114.9
321S30.2Very low33.9Very low115 Ų115139.7 Ų139.780%0.80482%0.816SS**  trans75116.6152.574.20000120.3
322S34.1Very low34.1Very low120 Ų120143.6 Ų143.684%0.83982%0.82SS**  trans-132.2140.1154.6-52.70000108.3
323P34.4Very low34.4Very low126 Ų126143.8 Ų143.882%0.81882%0.818SS**  trans-85.2162.8-170.933.1-34.2000113.9
324P40.1Very low34.8Very low113 Ų113143.7 Ų143.773%0.73482%0.818SS**  trans-104.9138.8-168.137.2-28.1000113.4
325T30.8Very low35.1Very low144 Ų144141.1 Ų141.188%0.88382%0.818SS**  trans172.6142.2143.612.70000107.9
326R29.4Very low35.4Very low241 Ų241141 Ų14191%0.90982%0.822SS**  cis-164.1116.138.9-148.9173.8179.4174.8-0.7107.4
327A31.8Very low35.4Very low99 Ų99138.1 Ų138.182%0.81882%0.824SS**PPolyproline II helixtrans-90.3121.9173.700000109.4
328A35.2Very low35.5Very low101 Ų101136.1 Ų136.184%0.83582%0.824SS**PPolyproline II helixtrans-76123.9165.600000108.5
329L40.3Very low35.9Very low169 Ų169135.2 Ų135.289%0.88583%0.827SS**PPolyproline II helixtrans-68.4124.5180-67.5155.8000109.9
330L46.8Very low36.1Very low160 Ų160133.9 Ų133.984%0.83883%0.829SS**  trans-112.8142.3157.4-71.7176.3000108.8
331P40.6Very low36.3Very low122 Ų122137.4 Ų137.479%0.79283%0.834SS**PPolyproline II helixtrans-71137.9-171.527-32.2000112
332R39.6Very low36.6Very low237 Ų237137.4 Ų137.489%0.89483%0.831SS**PPolyproline II helixtrans-80.2127.6178.5-163.7178.5-168.2153.41.2109.1
333P38.6Very low36.5Very low121 Ų121137.3 Ų137.379%0.78683%0.83SS**PPolyproline II helixtrans-70.8132.7172.626.3-29.9000110.3
334Q40.4Very low36.6Very low189 Ų189137.3 Ų137.388%0.88383%0.83SS**PPolyproline II helixtrans-68.3136.4176-76.1173.7-46.700110.7
335A38.5Very low36.2Very low100 Ų100136.2 Ų136.283%0.82683%0.831SS**PPolyproline II helixtrans-80.1133169.900000109.8
336V39.9Very low36.3Very low144 Ų144135.5 Ų135.587%0.87383%0.829SS**PPolyproline II helixtrans-83.2126.7174.6-147.20000108
337G33Very low36.5Very low75 Ų75131 Ų13177%0.77383%0.828SS**PPolyproline II helixtrans-74.3162.1-171.100000115
338S33.8Very low36.4Very low115 Ų115135.1 Ų135.180%0.80483%0.83SS**  trans-120.9153.3163.7-55.70000109.4
339P39.4Very low36.1Very low135 Ų135136.7 Ų136.788%0.87783%0.829SS**  trans-76.6149.1-168.6-5.323000112.5
340G31.9Very low35.5Very low76 Ų76136.2 Ų136.278%0.78483%0.827SS**  trans-73166.2-161.900000117.8
341H32.7Very low34.8Very low184 Ų184136.2 Ų136.285%0.85283%0.827SS**  trans-135.3144.4161.6-133.9-77.4000108.3
342P36.5Very low34.2Very low114 Ų114133.4 Ų133.474%0.7482%0.821SS**PPolyproline II helixtrans-72.9143.1-169.9-11.527.3000112.7
343S32.7Very low33.9Very low118 Ų118131 Ų13183%0.82583%0.825SS**PPolyproline II helixtrans-75.4143.5174.4-51.80000112.2
344P36.2Very low33.4Very low127 Ų127128.6 Ų128.683%0.82582%0.822SS**PPolyproline II helixtrans-85.9139.516732.6-28.5000111.2
345A32.1Very low33Very low90 Ų90127.6 Ų127.674%0.74482%0.822SS**PPolyproline II helixtrans-72.5153.5175.200000112.2
346P33.8Very low32.7Very low129 Ų129134.3 Ų134.384%0.83883%0.825SS**PPolyproline II helixtrans-82.3135.7-174.631.7-32.1000112.4
347V32.5Very low32.3Very low147 Ų147136.7 Ų136.789%0.89183%0.827SS**PPolyproline II helixtrans-95.6131.9170.5-176.10000109.5
348Q28.9Very low32.2Very low185 Ų185137 Ų13786%0.86483%0.83SS**PPolyproline II helixtrans-69.1138.7-173.7-151.2168.7-1.500111.8
349T30.6Very low32.1Very low133 Ų133141 Ų14182%0.81684%0.838SS**PPolyproline II helixtrans-68132.217140.90000111.7
350D28Very low31.5Very low159 Ų159137.7 Ų137.785%0.8583%0.83SS**  trans-130140156.2-164.519000110.6
351L31.6Very low31.4Very low160 Ų160142.8 Ų142.884%0.83884%0.838SS**  trans-82.9148-176.5-89.282.5000110.8
352G27.8Very low31.2Very low63 Ų63137.8 Ų137.865%0.64984%0.836SS**  trans140116.713500000118.7
353L32.2Very low30.9Very low188 Ų188136.7 Ų136.798%0.98484%0.836SS**  trans68.7124.8146.1-78.894.8000121.2
354G29.3Very low30.7Very low70 Ų70136 Ų13672%0.72283%0.831SS**  133.3101.2119.700000117.7
355L31Very low30.5Very low168 Ų168137.4 Ų137.488%0.8883%0.831SS**  trans-6.5132.6155.5-76.974.1000118.5
356R33.1Very low30.3Very low240 Ų240138.3 Ų138.391%0.90683%0.832SS**  179.3147100.8-112.7-177.7163.1-142.7-2.1114
357Q32.4Very low30.8Very low194 Ų194137.4 Ų137.491%0.90783%0.826SS**  trans-62.7158.9174.2-68.2158-27.300114.4
358G29.1Very low30.7Very low81 Ų81136.5 Ų136.584%0.83582%0.821SS**  trans169.9117.3153.500000115.2
359M31.6Very low30.7Very low199 Ų199132.9 Ų132.998%0.9882%0.816SS**  trans-81.5167.9-175.5-60.9159.594.700114.4
360G28Very low30.8Very low67 Ų67133 Ų13369%0.69182%0.817SS**  trans113.4105.6145.200000114.7
361L30.1Very low31.1Very low183 Ų183131.2 Ų131.296%0.95881%0.813SS**  74.212075.2-79.4173.4000115.9
362G27.4Very low31.1Very low78 Ų78129 Ų12980%0.80481%0.811SS**  trans78.4153150.400000116.3
363A30Very low31.4Very low91 Ų91132.6 Ų132.675%0.75282%0.821SS**  cis-176.2160.7-1300000106
364S29.3Very low31.9Very low103 Ų103129.3 Ų129.372%0.7281%0.811SS**  trans79114.9151.666.60000122.2
365L30.9Very low31.9Very low158 Ų158136.7 Ų136.783%0.82782%0.818SS**  62.8103.2120.2-61.3165.9000120
366S28.6Very low31.9Very low109 Ų109135.8 Ų135.876%0.76281%0.814SS**  39.6161.2120.4-57.40000121.8
367P45.1Very low31.7Very low110 Ų110127.2 Ų127.271%0.71480%0.8SS**  cis-141.1-175.5-30.938.7-19000114.1
368V29.3Very low31.7Very low128 Ų128126.2 Ų126.278%0.77680%0.801SS**  trans66.3120.7158.3-173.50000118.4
369S29.4Very low31.7Very low108 Ų108125.4 Ų125.476%0.75579%0.793SS**  175.1115.9118.4-73.20000111.1
370T33.3Very low31.9Very low137 Ų137124.4 Ų124.484%0.8479%0.791SS**  trans-65145.7160.245.80000110.6
371P33.9Very low32Very low120 Ų120124.7 Ų124.778%0.77980%0.795SS**  trans-127.5127.1140.632.3-18.7000111.4
372S32.3Very low32.2Very low114 Ų114121.7 Ų121.780%0.79779%0.789SS**  trans-72.8129.6161.142.20000110.7
373T32.5Very low32.5Very low138 Ų138123.6 Ų123.685%0.84779%0.79SS**  trans-152.3154.2148.931.20000111.3
374P42.7Very low32.7Very low120 Ų120124.4 Ų124.478%0.77979%0.79SS**  trans-99157.7-156.538-31.4000112.6
375Y28.9Very low32.8Very low224 Ų224126.6 Ų126.688%0.87879%0.794SS**  trans-146.3138.8157.7-160.6-103000113
376L32.4Very low33.1Very low149 Ų149123.9 Ų123.978%0.7879%0.788SS**  trans-76.2141.9-176-77128.3000112.1
377G28.6Very low33.4Very low60 Ų60126.1 Ų126.162%0.61979%0.791SS**  63.6116.6118.700000120
378N32.1Very low33.1Very low174 Ų174128.2 Ų128.293%0.9380%0.796SS**  trans142.2122.6137-68.8-10.8000106.7
379G29.9Very low33.5Very low64 Ų64133.9 Ų133.966%0.6680%0.803SS**  cis131.8144.424.900000106.3
380D34.8Very low33.7Very low177 Ų177137.4 Ų137.495%0.94781%0.808SS**  trans83.1145-175.690.627.2000115.6
381G30.9Very low33.8Very low74 Ų74135.8 Ų135.876%0.76381%0.809SS**  cis-157137.9-4.100000108.6
382S33.8Very low33.8Very low120 Ų120134.8 Ų134.884%0.83981%0.81SS**  trans-82.8136.9178.6-168.30000110.3
383S33.4Very low33.8Very low117 Ų117133 Ų13382%0.81881%0.809SS**  trans-148.2103151.463.10000109.7
384S33.8Very low34Very low109 Ų109135.3 Ų135.376%0.76281%0.811SS**  trans-67.2135.1157.6-53.70000108.9
385D32.2Very low33.8Very low148 Ų148137.9 Ų137.979%0.79181%0.813SS**  trans-131.2122.1158.4-160.213000109.4
386S37.8Very low34.4Very low102 Ų102133.8 Ų133.871%0.71381%0.806SS**  trans-105.3124.7-179.5-570000106.3
387L34.7Very low34.6Very low156 Ų156133.4 Ų133.482%0.81781%0.805SS**  trans-142.9112.8159.3-74.6-179.6000111.4
388D38Very low35Very low154 Ų154137 Ų13782%0.82481%0.81SS**  trans-39.5143.5147.4-77.5-59.5000111.8
389R37.3Very low35.5Very low247 Ų247136.9 Ų136.993%0.93281%0.809SS**  trans-151130.8144.6-113.7168.5-171.9-154.5-0.1112.7
390Q33.3Very low36.1Very low181 Ų181142.3 Ų142.385%0.84682%0.817SS**  trans-75.2163-168.9-66.2160.4-69.700113
391A37Very low36.4Very low104 Ų104143.1 Ų143.186%0.8682%0.815SS**  trans-52139.4157.800000111.7
392A34.2Very low36.9Very low98 Ų98147.6 Ų147.681%0.8182%0.816SS**  trans-124.3116.9161.100000107.1
393G31.5Very low37.2Very low76 Ų76148.1 Ų148.178%0.78481%0.81SS**  trans-76.5157.4159.300000109.8
394Q36.5Very low37.4Very low188 Ų188149.8 Ų149.888%0.87981%0.805SS**  trans-146.7116.1164.7-161.8134.85.800107
395E39.5Very low37.5Very low174 Ų174150.7 Ų150.781%0.81380%0.801SS**  trans-87.1-175.1169.7-66177.2173.200109.3
396D40.1Very low38.1Very low137 Ų137151.1 Ų151.173%0.73380%0.803SS**  trans101.2126.7176.7-47.4-12.8000112.3
397D36.8Very low38.1Very low142 Ų142155.1 Ų155.176%0.75981%0.81SS**  cis-164.8166.72.6-104.3-26.2000108.8
398D37.1Very low38.4Very low136 Ų136155.3 Ų155.373%0.72781%0.812SS**  trans-58154-174.9-56.2-56.7000117.2
399D41.9Very low38.5Very low171 Ų171152.5 Ų152.591%0.91481%0.805SS**  trans-151.3110.7139.3-89.2-35.2000108.2
400E42.8Very low38.6Very low178 Ų178145.8 Ų145.883%0.83280%0.796SS**  trans-69.3147.5167-64.3173.415800109.8
401E41.5Very low38.9Very low193 Ų193146.4 Ų146.490%0.90280%0.799SS**  -162.4138.3127-79.6-128.5179.800109.7
402E40.8Very low38.8Very low168 Ų168151.2 Ų151.279%0.78580%0.796SS**  trans-74.2154.8-175.5-60.8170.7138.700111.4
403D40.5Very low39.2Very low131 Ų131155.3 Ų155.370%0.70180%0.798SS**  164.4126.3114-82.9-24.7000113.8
404E38.5Very low39.6Very low153 Ų153158.1 Ų158.172%0.71580%0.795SS**  trans75.7110.6134.3-64-178.4173.100121.6
405D36.1Very low39.7Very low128 Ų128156.9 Ų156.968%0.68479%0.794SS**  71.9113.4123.8-54.5-17.9000119.9
406D44.4Very low39.3Very low157 Ų157154.6 Ų154.684%0.8479%0.792SS**  -173.7137.896-93.9-31.5000112.4
407E38.3Very low39.2Very low185 Ų185153.4 Ų153.486%0.86479%0.794SS**  trans-60.1140.5174.4-56.5169.4141.700111.9
408D40.8Very low38.9Very low160 Ų160156.3 Ų156.386%0.85680%0.803SS**  -162.1143.2112.4-139.1-16.9000112.8
409S39Very low38.6Very low95 Ų95152.9 Ų152.966%0.66480%0.8SS**  trans-103.3142-166.448.50000112.9
410S40.5Very low38.1Very low106 Ų106149.8 Ų149.874%0.74179%0.791SS**  trans19.7134.214761.90000121.2
411E38.7Very low37.6Very low194 Ų194150.1 Ų150.191%0.90779%0.793SS**  -147.8129.1127.3-146.6168.6-165.400112.7
412Y34.9Very low37.2Very low205 Ų205148.7 Ų148.780%0.80479%0.791SS**  trans-85.9133.5171.9-108-104.4000108.6
413E42.8Very low37.1Very low185 Ų185146.8 Ų146.886%0.86479%0.792SS**  trans-140.8122.7146.5-89-149.7149.900111.6
414N40.5Very low36.6Very low134 Ų134148.7 Ų148.772%0.71780%0.802SS**  trans-86.2130.2166.2-92.9-40.7000109.1
415L38Very low36.3Very low162 Ų162147.4 Ų147.485%0.84880%0.804SS**  trans-151.4104.4145.5-77.5-173.8000112.4
416V32.1Very low36.2Very low127 Ų127147.1 Ų147.177%0.7781%0.812SS**  trans28.7123130.1-167.10000120.5
417S37.2Very low35.6Very low111 Ų111143.7 Ų143.778%0.77681%0.806SS**  trans-3.1127.7144.6-45.10000121.4
418E31.3Very low35.3Very low203 Ų203141 Ų14195%0.94981%0.807SS**  trans-170.7129.7135.7-105177.8163.800106
419G29.2Very low34.9Very low64 Ų64139.7 Ų139.766%0.6681%0.805SS**  103.6100.870.400000109.9
420S32Very low34.7Very low106 Ų106143.5 Ų143.574%0.74182%0.817SS**  trans50.7120.2155.250.10000120.3
421H31.5Very low34.3Very low185 Ų185142.3 Ų142.386%0.85681%0.813SS**  179.5117.6118.1-104-79.4000112.1
422L33.9Very low34.2Very low164 Ų164142.6 Ų142.686%0.85981%0.814SS**PPolyproline II helixtrans-73.3149.9159.1-69164.3000109.7
423P38Very low34Very low127 Ų127136.6 Ų136.683%0.82582%0.815SS**PPolyproline II helixtrans-100.7144.4151.719.9-2.7000112
424L31.4Very low33.9Very low172 Ų172139.4 Ų139.490%0.90182%0.818SS**PPolyproline II helixtrans-73.5144.6-168.9-170.972.1000113.2
425V32.3Very low34.1Very low126 Ų126139.2 Ų139.276%0.76482%0.824SS**PPolyproline II helixtrans-64.6133.6168.8173.10000111.2
426S33.2Very low34.1Very low121 Ų121136.3 Ų136.385%0.84682%0.823SS**PPolyproline II helixtrans-81118.5161.4-740000110
427A31.3Very low34.3Very low86 Ų86134.4 Ų134.471%0.71182%0.821SS**PPolyproline II helixtrans-71.4142.2176.500000112.2
428S32.5Very low34.2Very low128 Ų128137.4 Ų137.490%0.89583%0.827SS**  trans-147.2131.2148.7-76.10000109.9
429V32.4Very low34.5Very low132 Ų132131.1 Ų131.180%0.882%0.817SS**  trans-74136.8-167.5170.80000111.4
430L35.1Very low35.5Very low176 Ų176133.9 Ų133.992%0.92182%0.823SS**  trans-164.1129.2134.7-104.6161.4000110.6
431A32.4Very low35.7Very low80 Ų80136.8 Ų136.866%0.66183%0.83SS**  trans-97.8172.4-168.500000112.6
432Q36.3Very low35.8Very low200 Ų200131.6 Ų131.694%0.93583%0.827SS**  trans88124.4167.9-54179.9-13.100114.8
433G31.2Very low35.8Very low79 Ų79131 Ų13181%0.81483%0.825SS**  cis165.7122300000107.8
434R40.3Very low35.8Very low244 Ų244129.2 Ų129.292%0.92182%0.815SS**  trans-120.6148169.4-119.6-174.4-175.6-173.81.8107
435P45.2Very low36.1Very low130 Ų130132 Ų13284%0.84481%0.814SS**  trans-122136.6146.432.9-21.1000110.9
436A36.8Very low36.3Very low101 Ų101133.3 Ų133.384%0.83582%0.817SS**  trans-112.8135.2157.800000107.1
437A36.5Very low36.6Very low87 Ų87133 Ų13372%0.71981%0.814SS**  trans-154.3109.9161.500000106.7
438L35.3Very low37.1Very low174 Ų174137.2 Ų137.291%0.91182%0.819SS**  74.5118.499.9-68.3174.2000113.3
439G38Very low37.4Very low71 Ų71139.1 Ų139.173%0.73282%0.816SS**  trans-67178.8168.500000112.7
440P49.3Very low38.1Very low122 Ų122142.7 Ų142.779%0.79284%0.838SS**  -147.4174.39136.6-18.2000115.9
441D37.3Very low38.2Very low167 Ų167141 Ų14189%0.89383%0.834SS**  trans-20.1151.3165.3-57.8-54.7000119.7
442G33.2Very low38.5Very low77 Ų77144.2 Ų144.279%0.79484%0.843SS**  trans161.979.1158.600000117.5
443D34.5Very low38.7Very low152 Ų152141.1 Ų141.181%0.81384%0.838SS**  trans35.3122.5133.9-131.4-10.5000123
444S37.9Very low39.1Very low89 Ų89144.8 Ų144.862%0.62284%0.839SS**  trans35.5135.5137.866.40000124.9
445R37.3Very low39Very low231 Ų231138.6 Ų138.687%0.87283%0.834SS**  trans126.6115.6133.8-71.1-171.6160.9161.2-3.1116.5
446D35.7Very low38.6Very low153 Ų153139.1 Ų139.182%0.81883%0.834SS**  trans14130135.9-79.1-40.6000118.8
447S40.3Very low38.7Very low113 Ų113141.9 Ų141.979%0.7983%0.834SS**  -173.9110.5118-75.30000111.9
448Q41.8Very low38.9Very low176 Ų176146.1 Ų146.182%0.82284%0.842SS**  47.3145.3127.2-86.7-177.1-2.600124.1
449M38.8Very low39.2Very low167 Ų167143.8 Ų143.882%0.82384%0.837SS**  trans78.5119.6158.3-69.8167.289.600114.4
450T46.6Very low39.3Very low207 Ų207150.4 Ų150.4100%1.2785%0.846SS**  cis-149.1033.428.60000111.8

Retrieved 450 of 450 residues in 260.8 ms (Link to these results)

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