X6RLN4_HUMAN Loading...

La ribonucleoprotein 4

AlphaFold DB , UniProt , Accession X6RLN4, Species HUMAN (Homo sapiens, Human), Gene LARP4, Length 491 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
1E87.3Confident88.4Confident166 Ų16684.6 Ų84.678%0.77643%0.426SS*.  0-69.60-69.3167.6-127.600114.1K3 G4 F49 Q50E1-K3 VanDerWaalsContact C-N 3.32Å; E1-K3 PolarHBondContact O-N 3.37Å; E1-K3 VanDerWaalsContact O-N 3.11Å; E1-G4 WeakPolarHBondContact O-CA 3.44Å; E1-G4 PolarHBondContact O-N 2.91Å; E1-F49 HydrophobicContact CB-CE2 3.9Å; E1-F49 HydrophobicContact CB-CZ 3.7Å; E1-F49 WeakPolarHBondContact OE2-CZ 3.49Å; E1-Q50 PolarHBondContact OE2-NE2 3.32Å
2V90Very high88.8Confident20 Ų2078.8 Ų78.812%0.12140%0.398CS..G310 helixtrans-50.8-41.3-171.2176.90000114.9G4 L5 F6 W25 I27 F49V2-G4 PolarHBondContact O-N 3.14Å; V2-L5 WeakPolarHBondContact O-CB 3.48Å; V2-L5 PolarHBondContact O-N 3.29Å; V2-F6 HydrophobicContact CG1-CE2 4.22Å; V2-F6 WeakPolarHBondContact O-CD2 3.48Å; V2-W25 HydrophobicContact CB-CD2 4.34Å; V2-W25 HydrophobicContact CB-CZ2 4.47Å; V2-W25 HydrophobicContact CG1-CD2 4.06Å; V2-W25 HydrophobicContact CG1-CE3 4.44Å; V2-W25 HydrophobicContact CG1-CG 4.1Å; V2-W25 HydrophobicContact CG2-CD2 4.27Å; V2-W25 HydrophobicContact CG2-CZ2 3.92Å; V2-I27 HydrophobicContact CG1-CD1 4.45Å; V2-F49 HydrophobicContact CG2-CE1 4.07Å; V2-F49 HydrophobicContact CG2-CZ 4.07Å
3K89.1Confident89.1Confident138 Ų13887.2 Ų87.260%0.643%0.43SS*.G310 helixtrans-55.8-22.3172.4-73.6-175.9175.4178.10114.5E1 C17E1-K3 VanDerWaalsContact C-N 3.32Å; E1-K3 PolarHBondContact O-N 3.37Å; E1-K3 VanDerWaalsContact O-N 3.11Å; K3-C17 HydrophobicContact CD-CB 4.33Å; K3-C17 HydrophobicContact CG-CB 3.69Å
4G89.9Confident89.5Confident41 Ų4183.4 Ų83.442%0.42341%0.414SS..G310 helixtrans-78.8-22.2176.700000114.3E1 V2 F6 K7E1-G4 WeakPolarHBondContact O-CA 3.44Å; E1-G4 PolarHBondContact O-N 2.91Å; V2-G4 PolarHBondContact O-N 3.14Å; G4-F6 PolarHBondContact O-N 2.73Å; G4-F6 VanDerWaalsContact O-N 3.1Å; G4-K7 PolarHBondContact O-N 3.21Å; G4-K7 VanDerWaalsContact O-N 3.07Å
5L88.9Confident89.9Confident34 Ų3484.3 Ų84.318%0.17842%0.42CS..G310 helixtrans-63.9-13.3172.3-65.9179000113.2V2 Y41 V46 F49 I54V2-L5 WeakPolarHBondContact O-CB 3.48Å; V2-L5 PolarHBondContact O-N 3.29Å; L5-Y41 WeakPolarHBondContact O-CE1 3.09Å; L5-V46 HydrophobicContact CD2-CG1 3.81Å; L5-F49 HydrophobicContact CD1-CB 4.13Å; L5-F49 HydrophobicContact CD1-CD2 3.93Å; L5-F49 HydrophobicContact CD1-CG 3.98Å; L5-F49 HydrophobicContact CD2-CB 4.41Å; L5-F49 HydrophobicContact CD2-CD2 3.79Å; L5-F49 HydrophobicContact CD2-CG 4.42Å; L5-F49 HydrophobicContact CG-CD2 4.09Å; L5-I54 HydrophobicContact CD1-CD1 3.94Å
6F90.4Very high90.1Very high18 Ų1881.9 Ų81.98%0.07941%0.414CS..G310 helixtrans-115.618.6179.4-48.9-91.3000111.5V2 G4 V14 I27 F29 L42V2-F6 HydrophobicContact CG1-CE2 4.22Å; V2-F6 WeakPolarHBondContact O-CD2 3.48Å; G4-F6 PolarHBondContact O-N 2.73Å; G4-F6 VanDerWaalsContact O-N 3.1Å; F6-V14 HydrophobicContact CB-CG2 3.41Å; F6-V14 VanDerWaalsContact CB-CG2 3.41Å; F6-V14 HydrophobicContact CD1-CG2 4.06Å; F6-V14 HydrophobicContact CD2-CG2 4.16Å; F6-V14 HydrophobicContact CG-CG2 3.63Å; F6-I27 HydrophobicContact CD1-CG2 4.49Å; F6-I27 HydrophobicContact CE1-CG1 4.43Å; F6-I27 HydrophobicContact CE1-CG2 4.16Å; F6-I27 HydrophobicContact CE2-CD1 3.97Å; F6-I27 HydrophobicContact CE2-CG1 4.05Å; F6-I27 HydrophobicContact CE2-CG2 4.33Å; F6-I27 HydrophobicContact CZ-CB 4.37Å; F6-I27 HydrophobicContact CZ-CD1 4.15Å; F6-I27 HydrophobicContact CZ-CG1 3.7Å; F6-I27 HydrophobicContact CZ-CG2 4.09Å; F6-F29 HydrophobicContact CD1-CE1 4.33Å; F6-F29 AromaticContact CD1-CZ 3.74Å; F6-F29 HydrophobicContact CD1-CZ 3.74Å; F6-F29 AromaticContact CE1-CZ 3.93Å; F6-F29 HydrophobicContact CE1-CZ 3.93Å; F6-L42 HydrophobicContact CD1-CD1 3.87Å; F6-L42 HydrophobicContact CE1-CD1 3.37Å; F6-L42 HydrophobicContact CE1-CD2 3.87Å; F6-L42 HydrophobicContact CE1-CG 4.28Å; F6-L42 HydrophobicContact CZ-CD1 3.95Å; F6-L42 HydrophobicContact CZ-CD2 3.83Å
7K88.4Confident90.4Very high180 Ų18078.2 Ų78.278%0.78340%0.397SS*.  trans-104.165.9173.1-72.9-170.7174.1-165.50110G4G4-K7 PolarHBondContact O-N 3.21Å; G4-K7 VanDerWaalsContact O-N 3.07Å
8S86.9Confident90.6Very high32 Ų3280.8 Ų80.822%0.22441%0.407CS..SBendtrans-139.3153.9176.156.80000109.2N10 C11 Y41S8-N10 VanDerWaalsContact C-N 3.25Å; S8-N10 PolarHBondContact O-N 3.46Å; S8-C11 PolarHBondContact O-N 3.31Å; S8-C11 VanDerWaalsContact O-N 3.1Å; S8-C11 VanDerWaalsContact O-O 3.13Å; S8-C11 WeakPolarHBondContact OG-CB 3.42Å; S8-Y41 VanDerWaalsContact CB-OH 3.26Å; S8-Y41 WeakPolarHBondContact CB-OH 3.24Å; S8-Y41 VanDerWaalsContact OG-CE1 3.27Å; S8-Y41 WeakPolarHBondContact OG-CE1 3.33Å; S8-Y41 WeakPolarHBondContact OG-CE2 3.14Å; S8-Y41 PolarHBondContact OG-OH 3.11Å
9E86.9Confident90.9Very high199 Ų19981.8 Ų81.893%0.9341%0.409SS*.THydrogen-bonded Turntrans-67.2-30.1-177.2-58.8-176.9163.300111.9C11E9-C11 VanDerWaalsContact C-N 3.27Å; E9-C11 PolarHBondContact O-N 3.48Å
10N85.3Confident90.6Very high91 Ų9179.1 Ų79.149%0.48740%0.399SS..THydrogen-bonded Turntrans-75.7-9.5175.1-63.6-9.7000113.7S8 Q37 Y41 E45S8-N10 VanDerWaalsContact C-N 3.25Å; S8-N10 PolarHBondContact O-N 3.46Å; N10-Q37 PolarHBondContact O-NE2 3.41Å; N10-Y41 HydrophobicContact CB-CD2 3.72Å; N10-Y41 HydrophobicContact CB-CE2 3.83Å; N10-E45 PolarHBondContact ND2-OE1 3.07Å
11C89.4Confident90.5Very high12 Ų1281.5 Ų81.58%0.08141%0.409CS..SBendtrans-110.4127.4-178.3-175.50000111.9S8 E9 Y41S8-C11 PolarHBondContact O-N 3.31Å; S8-C11 VanDerWaalsContact O-N 3.1Å; S8-C11 VanDerWaalsContact O-O 3.13Å; S8-C11 WeakPolarHBondContact OG-CB 3.42Å; E9-C11 VanDerWaalsContact C-N 3.27Å; E9-C11 PolarHBondContact O-N 3.48Å; C11-Y41 HydrophobicContact CB-CD1 3.89Å; C11-Y41 HydrophobicContact CB-CE1 4.25Å; C11-Y41 HydrophobicContact CB-CG 4.08Å
12P92.4Very high90.6Very high15 Ų1580.7 Ų80.710%0.09741%0.41CS..PPolyproline II helixtrans-67.8159.2177.427.2-33.7000112.6V14 F29 D34 Q37 A38P12-V14 PolarHBondContact O-N 3.32Å; P12-F29 HydrophobicContact CG-CD1 4.2Å; P12-F29 HydrophobicContact CG-CE1 4.39Å; P12-F29 WeakPolarHBondContact O-CE1 3.42Å; P12-D34 HydrophobicContact CB-CB 3.79Å; P12-D34 VanDerWaalsContact CB-OD1 3.25Å; P12-D34 WeakPolarHBondContact CB-OD1 3.34Å; P12-D34 HydrophobicContact CG-CB 3.68Å; P12-D34 WeakPolarHBondContact CG-O 3.32Å; P12-Q37 HydrophobicContact CG-CB 4.22Å; P12-Q37 HydrophobicContact CG-CG 4.45Å; P12-A38 HydrophobicContact CG-CB 4.18Å
13K93.5Very high90.6Very high187 Ų18784.8 Ų84.881%0.81344%0.44SS*.PPolyproline II helixtrans-68.6121.3-171.6-171.9177.8-179.3-179.90112.3
14V94.9Very high90.8Very high34 Ų3481.7 Ų81.721%0.20643%0.43CS..PPolyproline II helixtrans-66.5131.1172.2175.40000111.1F6 P12 S16 C17 I27 F29F6-V14 HydrophobicContact CB-CG2 3.41Å; F6-V14 VanDerWaalsContact CB-CG2 3.41Å; F6-V14 HydrophobicContact CD1-CG2 4.06Å; F6-V14 HydrophobicContact CD2-CG2 4.16Å; F6-V14 HydrophobicContact CG-CG2 3.63Å; P12-V14 PolarHBondContact O-N 3.32Å; V14-S16 WeakPolarHBondContact CG1-O 3.39Å; V14-C17 HydrophobicContact CG1-CB 4.19Å; V14-I27 HydrophobicContact CB-CG2 4.39Å; V14-I27 HydrophobicContact CG1-CG2 3.75Å; V14-I27 HydrophobicContact CG2-CG2 3.72Å; V14-F29 HydrophobicContact CB-CE1 4.44Å; V14-F29 HydrophobicContact CG2-CD1 4.32Å; V14-F29 HydrophobicContact CG2-CE1 3.53Å; V14-F29 HydrophobicContact CG2-CZ 3.84Å
15I95.2Very high91.1Very high98 Ų9885 Ų8550%0.50343%0.43SS..SBendtrans-82.6-54.6169.1-64.6-175.6000110.1T28 Q30I15-T28 WeakPolarHBondContact CB-O 3.28Å; I15-T28 PolarHBondContact N-O 2.72Å; I15-Q30 HydrophobicContact CD1-CB 3.94Å; I15-Q30 HydrophobicContact CD1-CG 4.49Å
16S93.7Very high91.3Very high46 Ų4688.4 Ų88.432%0.32244%0.441SS..EExtended strand (participates in β ladder)trans-135.4151.1179.276.40000112.1V14 I27 T28V14-S16 WeakPolarHBondContact CG1-O 3.39Å; S16-I27 WeakPolarHBondContact O-CA 3.16Å; S16-T28 PolarHBondContact N-O 3.39Å; S16-T28 PolarHBondContact O-N 3.4Å; S16-T28 WeakPolarHBondContact OG-CB 3.38Å; S16-T28 PolarHBondContact OG-OG1 3.16Å
17C94.4Very high91.6Very high19 Ų1989.5 Ų89.513%0.12845%0.447CS..EExtended strand (participates in β ladder)trans-141.7101.2175.8161.60000106.4K3 V14 Y26 I27K3-C17 HydrophobicContact CD-CB 4.33Å; K3-C17 HydrophobicContact CG-CB 3.69Å; V14-C17 HydrophobicContact CG1-CB 4.19Å; C17-Y26 WeakPolarHBondContact CA-O 3.33Å; C17-I27 HydrophobicContact CB-CD1 3.71Å; C17-I27 WeakPolarHBondContact SG-CD1 3.41Å
18E94.9Very high91.9Very high124 Ų12484.2 Ų84.258%0.57943%0.43SS*.EExtended strand (participates in β ladder)trans-111.6142.9-173.4-177.2175.8-15300109.9W25 Y26E18-W25 CarbonylContact O-C 3.55Å; E18-W25 WeakPolarHBondContact O-CA 3.33Å; E18-Y26 PolarHBondContact N-O 3.45Å; E18-Y26 PolarHBondContact O-N 3.26Å
19F94.6Very high92.2Very high101 Ų10183.9 Ų83.944%0.44343%0.425SS..EExtended strand (participates in β ladder)trans-84.9123.4177.3179.3-113.6000110.2H21 W25F19-H21 HydrophobicContact CE1-CB 4.48Å; F19-W25 HydrophobicContact CB-CE3 4.09Å; F19-W25 HydrophobicContact CB-CH2 4.17Å; F19-W25 HydrophobicContact CB-CZ3 3.86Å; F19-W25 HydrophobicContact CD2-CD2 4.09Å; F19-W25 AromaticContact CD2-CE2 3.74Å; F19-W25 HydrophobicContact CD2-CE3 4.39Å; F19-W25 HydrophobicContact CD2-CH2 4.1Å; F19-W25 AromaticContact CD2-CZ2 3.76Å; F19-W25 HydrophobicContact CD2-CZ2 3.76Å; F19-W25 HydrophobicContact CD2-CZ3 4.4Å; F19-W25 HydrophobicContact CE2-CZ2 4.41Å; F19-W25 HydrophobicContact CG-CH2 4.5Å
20A86.1Confident92.6Very high26 Ų2681.6 Ų81.622%0.21541%0.414CS..  trans-10517-171.400000113.7N24 Y26A20-N24 HydrophobicContact CB-CB 4.07Å; A20-N24 PolarHBondContact N-O 3.37Å; A20-Y26 HydrophobicContact CB-CD1 4.23Å; A20-Y26 HydrophobicContact CB-CD2 3.67Å; A20-Y26 HydrophobicContact CB-CE1 4.16Å; A20-Y26 HydrophobicContact CB-CE2 3.6Å; A20-Y26 HydrophobicContact CB-CG 3.99Å
21H87.6Confident93Very high130 Ų13079.4 Ų79.460%0.60241%0.406SS*.SBendtrans64.3167.9-170.5-54-87000115F19 S23 N24F19-H21 HydrophobicContact CE1-CB 4.48Å; H21-S23 VanDerWaalsContact C-N 3.27Å; H21-S23 PolarHBondContact O-N 3.07Å; H21-N24 VanDerWaalsContact O-CB 3.32Å; H21-N24 WeakPolarHBondContact O-CB 3.45Å; H21-N24 PolarHBondContact O-N 3.38Å; H21-N24 PolarHBondContact O-ND2 3.22Å; H21-N24 VanDerWaalsContact O-ND2 3.07Å
22N90.8Very high93.3Very high149 Ų14984.1 Ų84.180%0.79743%0.43SS*.THydrogen-bonded Turntrans52.240.8-179.7-57.9-8.4000113.7N24N22-N24 PolarHBondContact O-N 3.35Å; N22-N24 VanDerWaalsContact O-N 3.1Å; N22-N24 PolarHBondContact O-ND2 3.31Å
23S89.6Confident93.4Very high106 Ų10687.6 Ų87.674%0.74145%0.451SS*.THydrogen-bonded Turntrans60.69.9-174.2-56.20000115.9H21H21-S23 VanDerWaalsContact C-N 3.27Å; H21-S23 PolarHBondContact O-N 3.07Å
24N93.4Very high93.5Very high74 Ų7480.6 Ų80.640%0.39642%0.423SS..  trans-83.8149.7173.5-59.8-91.4000110.8A20 H21 N22A20-N24 HydrophobicContact CB-CB 4.07Å; A20-N24 PolarHBondContact N-O 3.37Å; H21-N24 VanDerWaalsContact O-CB 3.32Å; H21-N24 WeakPolarHBondContact O-CB 3.45Å; H21-N24 PolarHBondContact O-N 3.38Å; H21-N24 PolarHBondContact O-ND2 3.22Å; H21-N24 VanDerWaalsContact O-ND2 3.07Å; N22-N24 PolarHBondContact O-N 3.35Å; N22-N24 VanDerWaalsContact O-N 3.1Å; N22-N24 PolarHBondContact O-ND2 3.31Å
25W94.8Very high93.5Very high110 Ų11080.3 Ų80.342%0.41742%0.423SS..EExtended strand (participates in β ladder)trans-130.4138.7174.9-63.680.7000109.3V2 E18 F19 I27V2-W25 HydrophobicContact CB-CD2 4.34Å; V2-W25 HydrophobicContact CB-CZ2 4.47Å; V2-W25 HydrophobicContact CG1-CD2 4.06Å; V2-W25 HydrophobicContact CG1-CE3 4.44Å; V2-W25 HydrophobicContact CG1-CG 4.1Å; V2-W25 HydrophobicContact CG2-CD2 4.27Å; V2-W25 HydrophobicContact CG2-CZ2 3.92Å; E18-W25 CarbonylContact O-C 3.55Å; E18-W25 WeakPolarHBondContact O-CA 3.33Å; F19-W25 HydrophobicContact CB-CE3 4.09Å; F19-W25 HydrophobicContact CB-CH2 4.17Å; F19-W25 HydrophobicContact CB-CZ3 3.86Å; F19-W25 HydrophobicContact CD2-CD2 4.09Å; F19-W25 AromaticContact CD2-CE2 3.74Å; F19-W25 HydrophobicContact CD2-CE3 4.39Å; F19-W25 HydrophobicContact CD2-CH2 4.1Å; F19-W25 AromaticContact CD2-CZ2 3.76Å; F19-W25 HydrophobicContact CD2-CZ2 3.76Å; F19-W25 HydrophobicContact CD2-CZ3 4.4Å; F19-W25 HydrophobicContact CE2-CZ2 4.41Å; F19-W25 HydrophobicContact CG-CH2 4.5Å; W25-I27 HydrophobicContact CB-CD1 3.95Å
26Y94.9Very high93.5Very high106 Ų10680.3 Ų80.342%0.41642%0.421SS..EExtended strand (participates in β ladder)trans-98.9118.7167.4-66.9-35.3000108.8C17 E18 A20 K59C17-Y26 WeakPolarHBondContact CA-O 3.33Å; E18-Y26 PolarHBondContact N-O 3.45Å; E18-Y26 PolarHBondContact O-N 3.26Å; A20-Y26 HydrophobicContact CB-CD1 4.23Å; A20-Y26 HydrophobicContact CB-CD2 3.67Å; A20-Y26 HydrophobicContact CB-CE1 4.16Å; A20-Y26 HydrophobicContact CB-CE2 3.6Å; A20-Y26 HydrophobicContact CB-CG 3.99Å; Y26-K59 HydrophobicContact CD1-CD 3.99Å; Y26-K59 HydrophobicContact CE1-CD 3.69Å; Y26-K59 VanDerWaalsContact CE2-NZ 3.33Å; Y26-K59 VanDerWaalsContact CZ-NZ 3.28Å
27I95.1Very high93.6Very high41 Ų4182.3 Ų82.321%0.2143%0.426CS..EExtended strand (participates in β ladder)trans-113125.8179.2-42.6-62.8000107V2 F6 V14 S16 C17 W25 F29V2-I27 HydrophobicContact CG1-CD1 4.45Å; F6-I27 HydrophobicContact CD1-CG2 4.49Å; F6-I27 HydrophobicContact CE1-CG1 4.43Å; F6-I27 HydrophobicContact CE1-CG2 4.16Å; F6-I27 HydrophobicContact CE2-CD1 3.97Å; F6-I27 HydrophobicContact CE2-CG1 4.05Å; F6-I27 HydrophobicContact CE2-CG2 4.33Å; F6-I27 HydrophobicContact CZ-CB 4.37Å; F6-I27 HydrophobicContact CZ-CD1 4.15Å; F6-I27 HydrophobicContact CZ-CG1 3.7Å; F6-I27 HydrophobicContact CZ-CG2 4.09Å; V14-I27 HydrophobicContact CB-CG2 4.39Å; V14-I27 HydrophobicContact CG1-CG2 3.75Å; V14-I27 HydrophobicContact CG2-CG2 3.72Å; S16-I27 WeakPolarHBondContact O-CA 3.16Å; C17-I27 HydrophobicContact CB-CD1 3.71Å; C17-I27 WeakPolarHBondContact SG-CD1 3.41Å; W25-I27 HydrophobicContact CB-CD1 3.95Å; I27-F29 HydrophobicContact CB-CE2 4.09Å; I27-F29 HydrophobicContact CG2-CD2 4.42Å; I27-F29 HydrophobicContact CG2-CE1 4.46Å; I27-F29 HydrophobicContact CG2-CE2 3.57Å; I27-F29 HydrophobicContact CG2-CZ 3.59Å
28T94.6Very high93.6Very high69 Ų6981.5 Ų81.542%0.42342%0.42SS..EExtended strand (participates in β ladder)trans-114.4135.7-179.4-54.60000109.6I15 S16I15-T28 WeakPolarHBondContact CB-O 3.28Å; I15-T28 PolarHBondContact N-O 2.72Å; S16-T28 PolarHBondContact N-O 3.39Å; S16-T28 PolarHBondContact O-N 3.4Å; S16-T28 WeakPolarHBondContact OG-CB 3.38Å; S16-T28 PolarHBondContact OG-OG1 3.16Å
29F95.1Very high93.6Very high25 Ų2578 Ų7811%0.1140%0.403CS..  trans-117172.6178.7-61.8-90.3000110.6F6 P12 V14 I27 D34 A35 A38F6-F29 HydrophobicContact CD1-CE1 4.33Å; F6-F29 AromaticContact CD1-CZ 3.74Å; F6-F29 HydrophobicContact CD1-CZ 3.74Å; F6-F29 AromaticContact CE1-CZ 3.93Å; F6-F29 HydrophobicContact CE1-CZ 3.93Å; P12-F29 HydrophobicContact CG-CD1 4.2Å; P12-F29 HydrophobicContact CG-CE1 4.39Å; P12-F29 WeakPolarHBondContact O-CE1 3.42Å; V14-F29 HydrophobicContact CB-CE1 4.44Å; V14-F29 HydrophobicContact CG2-CD1 4.32Å; V14-F29 HydrophobicContact CG2-CE1 3.53Å; V14-F29 HydrophobicContact CG2-CZ 3.84Å; I27-F29 HydrophobicContact CB-CE2 4.09Å; I27-F29 HydrophobicContact CG2-CD2 4.42Å; I27-F29 HydrophobicContact CG2-CE1 4.46Å; I27-F29 HydrophobicContact CG2-CE2 3.57Å; I27-F29 HydrophobicContact CG2-CZ 3.59Å; F29-D34 HydrophobicContact CB-CB 3.63Å; F29-D34 HydrophobicContact CD1-CB 4.34Å; F29-D34 HydrophobicContact CG-CB 4.22Å; F29-A35 HydrophobicContact CB-CB 4.39Å; F29-A35 HydrophobicContact CD2-CB 3.93Å; F29-A35 HydrophobicContact CG-CB 4.46Å; F29-A38 HydrophobicContact CD1-CB 4.34Å; F29-A38 HydrophobicContact CE1-CB 3.56Å; F29-A38 HydrophobicContact CE2-CB 3.8Å; F29-A38 HydrophobicContact CZ-CB 3.25Å
30Q94.9Very high93.6Very high151 Ų15179 Ų7971%0.70641%0.408SS*.SBendtrans-74.1-32.4-175.4-173.457.485.200113.4I15I15-Q30 HydrophobicContact CD1-CB 3.94Å; I15-Q30 HydrophobicContact CD1-CG 4.49Å
31S94.1Very high94Very high45 Ų4579.6 Ų79.632%0.31540%0.404SS..SBendtrans-131.6169.317468.30000112.6T33 D34 A35S31-T33 VanDerWaalsContact C-N 3.31Å; S31-T33 PolarHBondContact OG-N 3.26Å; S31-D34 WeakPolarHBondContact CB-OD2 3.34Å; S31-D34 PolarHBondContact N-OD2 3.31Å; S31-D34 PolarHBondContact OG-N 3.47Å; S31-D34 PolarHBondContact OG-OD2 3.34Å; S31-A35 PolarHBondContact O-N 2.89Å
32D94.1Very high94.3Very high110 Ų11074.4 Ų74.459%0.58838%0.381SS*.Hα-helixtrans-67.3-32.5168.365.5-30.5000112.3A35 Q36D32-A35 PolarHBondContact O-N 2.98Å; D32-Q36 WeakPolarHBondContact O-CG 3.37Å; D32-Q36 PolarHBondContact O-N 3.28Å; D32-Q36 PolarHBondContact O-NE2 3.43Å
33T95.4Very high94.3Very high89 Ų8974.9 Ų74.955%0.54637%0.371SS..Hα-helixtrans-65.2-45174.9-600000110.6S31 A35 Q36 Q37S31-T33 VanDerWaalsContact C-N 3.31Å; S31-T33 PolarHBondContact OG-N 3.26Å; T33-A35 VanDerWaalsContact C-N 3.34Å; T33-A35 PolarHBondContact O-N 2.73Å; T33-Q36 WeakPolarHBondContact O-CB 3.48Å; T33-Q36 PolarHBondContact O-N 2.94Å; T33-Q37 PolarHBondContact O-N 3.31Å
34D95.4Very high94.3Very high40 Ų4075.6 Ų75.621%0.21436%0.363CS..Hα-helixtrans-59-46.7172.9-64.5-55.6000111.2P12 F29 S31 Q36 Q37 A38P12-D34 HydrophobicContact CB-CB 3.79Å; P12-D34 VanDerWaalsContact CB-OD1 3.25Å; P12-D34 WeakPolarHBondContact CB-OD1 3.34Å; P12-D34 HydrophobicContact CG-CB 3.68Å; P12-D34 WeakPolarHBondContact CG-O 3.32Å; F29-D34 HydrophobicContact CB-CB 3.63Å; F29-D34 HydrophobicContact CD1-CB 4.34Å; F29-D34 HydrophobicContact CG-CB 4.22Å; S31-D34 WeakPolarHBondContact CB-OD2 3.34Å; S31-D34 PolarHBondContact N-OD2 3.31Å; S31-D34 PolarHBondContact OG-N 3.47Å; S31-D34 PolarHBondContact OG-OD2 3.34Å; D34-Q36 VanDerWaalsContact C-N 3.25Å; D34-Q36 PolarHBondContact O-N 3.18Å; D34-Q37 PolarHBondContact O-N 3.13Å; D34-A38 WeakPolarHBondContact O-CB 3.45Å; D34-A38 PolarHBondContact O-N 2.91Å
35A94.8Very high94Very high27 Ų2776.9 Ų76.922%0.22337%0.367CS..Hα-helixtrans-62.6-32.9179.400000112.3F29 S31 D32 T33 F39F29-A35 HydrophobicContact CB-CB 4.39Å; F29-A35 HydrophobicContact CD2-CB 3.93Å; F29-A35 HydrophobicContact CG-CB 4.46Å; S31-A35 PolarHBondContact O-N 2.89Å; D32-A35 PolarHBondContact O-N 2.98Å; T33-A35 VanDerWaalsContact C-N 3.34Å; T33-A35 PolarHBondContact O-N 2.73Å; A35-F39 WeakPolarHBondContact O-CB 3.39Å; A35-F39 PolarHBondContact O-N 3.3Å
36Q95.3Very high93.7Very high98 Ų9872.8 Ų72.846%0.45835%0.354SS..Hα-helixtrans-70.7-43.3172.7-75.9175.869.400112.5D32 T33 D34 F39 K40 I58D32-Q36 WeakPolarHBondContact O-CG 3.37Å; D32-Q36 PolarHBondContact O-N 3.28Å; D32-Q36 PolarHBondContact O-NE2 3.43Å; T33-Q36 WeakPolarHBondContact O-CB 3.48Å; T33-Q36 PolarHBondContact O-N 2.94Å; D34-Q36 VanDerWaalsContact C-N 3.25Å; D34-Q36 PolarHBondContact O-N 3.18Å; Q36-F39 PolarHBondContact O-N 3.16Å; Q36-K40 PolarHBondContact O-N 2.98Å; Q36-I58 HydrophobicContact CG-CD1 3.82Å
37Q95.2Very high93.4Very high89 Ų8973.4 Ų73.442%0.41636%0.359SS..Hα-helixtrans-62.9-48.5176.7-179.6177.1-19.400111.1N10 P12 T33 D34 F39 K40 Y41N10-Q37 PolarHBondContact O-NE2 3.41Å; P12-Q37 HydrophobicContact CG-CB 4.22Å; P12-Q37 HydrophobicContact CG-CG 4.45Å; T33-Q37 PolarHBondContact O-N 3.31Å; D34-Q37 PolarHBondContact O-N 3.13Å; Q37-F39 VanDerWaalsContact C-N 3.28Å; Q37-F39 PolarHBondContact O-N 3.26Å; Q37-K40 PolarHBondContact O-N 3.1Å; Q37-Y41 PolarHBondContact O-N 2.88Å
38A95Very high93.1Very high1 Ų175.1 Ų75.11%0.00837%0.371CS..Hα-helixtrans-61.4-35.4175.100000112.5P12 F29 D34 Y41 L42P12-A38 HydrophobicContact CG-CB 4.18Å; F29-A38 HydrophobicContact CD1-CB 4.34Å; F29-A38 HydrophobicContact CE1-CB 3.56Å; F29-A38 HydrophobicContact CE2-CB 3.8Å; F29-A38 HydrophobicContact CZ-CB 3.25Å; D34-A38 WeakPolarHBondContact O-CB 3.45Å; D34-A38 PolarHBondContact O-N 2.91Å; A38-Y41 PolarHBondContact O-N 3.09Å; A38-L42 WeakPolarHBondContact O-CD1 3.19Å; A38-L42 PolarHBondContact O-N 2.93Å
39F95.2Very high93Very high50 Ų5074.4 Ų74.422%0.21936%0.362CS..Hα-helixtrans-66.2-38.4175.3175.7-114.1000113A35 Q36 Q37 R43 A56 I58A35-F39 WeakPolarHBondContact O-CB 3.39Å; A35-F39 PolarHBondContact O-N 3.3Å; Q36-F39 PolarHBondContact O-N 3.16Å; Q37-F39 VanDerWaalsContact C-N 3.28Å; Q37-F39 PolarHBondContact O-N 3.26Å; F39-R43 HydrophobicContact CE2-CG 4.41Å; F39-R43 WeakPolarHBondContact O-CG 3.27Å; F39-R43 PolarHBondContact O-N 3.22Å; F39-A56 HydrophobicContact CD2-CB 3.92Å; F39-A56 HydrophobicContact CE2-CB 3.95Å; F39-I58 HydrophobicContact CB-CD1 4.02Å; F39-I58 HydrophobicContact CB-CG1 3.9Å; F39-I58 HydrophobicContact CD1-CD1 3.66Å; F39-I58 HydrophobicContact CD1-CG1 3.82Å; F39-I58 HydrophobicContact CD2-CG1 4.03Å; F39-I58 HydrophobicContact CE1-CD1 4.29Å; F39-I58 HydrophobicContact CE1-CG1 4.31Å; F39-I58 HydrophobicContact CG-CD1 3.9Å; F39-I58 HydrophobicContact CG-CG1 3.64Å
40K94.1Very high92.7Very high124 Ų12479.1 Ų79.154%0.53939%0.385SS..Hα-helixtrans-64-51.8170.5-71.2-174.2-180-173.30110.9Q36 Q37 L42 R43 E44Q36-K40 PolarHBondContact O-N 2.98Å; Q37-K40 PolarHBondContact O-N 3.1Å; K40-L42 VanDerWaalsContact C-N 3.26Å; K40-L42 PolarHBondContact O-N 2.82Å; K40-R43 CarbonylContact O-C 3.59Å; K40-R43 WeakPolarHBondContact O-CA 3.41Å; K40-R43 PolarHBondContact O-N 3.11Å; K40-E44 WeakPolarHBondContact O-CB 3.45Å; K40-E44 PolarHBondContact O-N 3.02Å
41Y94.4Very high92.5Very high37 Ų3775.5 Ų75.515%0.14539%0.388CS..Hα-helixtrans-50.1-44.6178-177.1-98000112.6L5 S8 N10 C11 Q37 A38 R43 E45 V46L5-Y41 WeakPolarHBondContact O-CE1 3.09Å; S8-Y41 VanDerWaalsContact CB-OH 3.26Å; S8-Y41 WeakPolarHBondContact CB-OH 3.24Å; S8-Y41 VanDerWaalsContact OG-CE1 3.27Å; S8-Y41 WeakPolarHBondContact OG-CE1 3.33Å; S8-Y41 WeakPolarHBondContact OG-CE2 3.14Å; S8-Y41 PolarHBondContact OG-OH 3.11Å; N10-Y41 HydrophobicContact CB-CD2 3.72Å; N10-Y41 HydrophobicContact CB-CE2 3.83Å; C11-Y41 HydrophobicContact CB-CD1 3.89Å; C11-Y41 HydrophobicContact CB-CE1 4.25Å; C11-Y41 HydrophobicContact CB-CG 4.08Å; Q37-Y41 PolarHBondContact O-N 2.88Å; A38-Y41 PolarHBondContact O-N 3.09Å; Y41-R43 VanDerWaalsContact C-N 3.32Å; Y41-R43 PolarHBondContact O-N 3.07Å; Y41-E45 HydrophobicContact CD2-CB 4.01Å; Y41-E45 HydrophobicContact CD2-CG 4.09Å; Y41-E45 WeakPolarHBondContact CD2-OE1 3.2Å; Y41-E45 HydrophobicContact CE2-CB 3.74Å; Y41-E45 HydrophobicContact CE2-CG 3.99Å; Y41-E45 VanDerWaalsContact CE2-OE1 3.24Å; Y41-E45 WeakPolarHBondContact CE2-OE1 3.26Å; Y41-E45 WeakPolarHBondContact CE2-OE2 3.35Å; Y41-E45 PolarHBondContact O-N 3.1Å; Y41-V46 HydrophobicContact CD1-CG2 3.72Å; Y41-V46 HydrophobicContact CE1-CG2 3.3Å; Y41-V46 PolarHBondContact O-N 3.06Å; Y41-V46 VanDerWaalsContact O-N 3.07Å
42L94.1Very high92.5Very high21 Ų2180.1 Ų80.111%0.1140%0.402CS..Iπ-helixtrans-64-31.1176.9-101.765000114.3F6 A38 K40 V46 K47 A56F6-L42 HydrophobicContact CD1-CD1 3.87Å; F6-L42 HydrophobicContact CE1-CD1 3.37Å; F6-L42 HydrophobicContact CE1-CD2 3.87Å; F6-L42 HydrophobicContact CE1-CG 4.28Å; F6-L42 HydrophobicContact CZ-CD1 3.95Å; F6-L42 HydrophobicContact CZ-CD2 3.83Å; A38-L42 WeakPolarHBondContact O-CD1 3.19Å; A38-L42 PolarHBondContact O-N 2.93Å; K40-L42 VanDerWaalsContact C-N 3.26Å; K40-L42 PolarHBondContact O-N 2.82Å; L42-V46 HydrophobicContact CD1-CG2 4.21Å; L42-V46 HydrophobicContact CG-CG2 4.46Å; L42-K47 PolarHBondContact O-N 2.68Å; L42-A56 HydrophobicContact CB-CB 4.39Å; L42-A56 HydrophobicContact CD2-CB 4.06Å
43R91.1Very high92.5Very high159 Ų15980.3 Ų80.360%0.641%0.409SS*.Iπ-helixtrans-92.1-28.6-178.2-68.3-171.667.7155.63.6113.7F39 K40 Y41 K47F39-R43 HydrophobicContact CE2-CG 4.41Å; F39-R43 WeakPolarHBondContact O-CG 3.27Å; F39-R43 PolarHBondContact O-N 3.22Å; K40-R43 CarbonylContact O-C 3.59Å; K40-R43 WeakPolarHBondContact O-CA 3.41Å; K40-R43 PolarHBondContact O-N 3.11Å; Y41-R43 VanDerWaalsContact C-N 3.32Å; Y41-R43 PolarHBondContact O-N 3.07Å; R43-K47 WeakPolarHBondContact O-CE 3.35Å; R43-K47 WeakPolarHBondContact O-CG 3.32Å
44E89.9Confident92.4Very high122 Ų12278.9 Ų78.957%0.5740%0.398SS*.Iπ-helixtrans-101.1-40.1-171.6-69.2168.4-142.700111.9K40 K47K40-E44 WeakPolarHBondContact O-CB 3.45Å; K40-E44 PolarHBondContact O-N 3.02Å; E44-K47 WeakPolarHBondContact O-CE 3.41Å; E44-K47 PolarHBondContact O-NZ 2.73Å
45E87.4Confident92.3Very high100 Ų10086 Ų8647%0.46743%0.432SS..Iπ-helixtrans-102.3-58.7179.1-67.1-171.3-123.400112.1N10 Y41N10-E45 PolarHBondContact ND2-OE1 3.07Å; Y41-E45 HydrophobicContact CD2-CB 4.01Å; Y41-E45 HydrophobicContact CD2-CG 4.09Å; Y41-E45 WeakPolarHBondContact CD2-OE1 3.2Å; Y41-E45 HydrophobicContact CE2-CB 3.74Å; Y41-E45 HydrophobicContact CE2-CG 3.99Å; Y41-E45 VanDerWaalsContact CE2-OE1 3.24Å; Y41-E45 WeakPolarHBondContact CE2-OE1 3.26Å; Y41-E45 WeakPolarHBondContact CE2-OE2 3.35Å; Y41-E45 PolarHBondContact O-N 3.1Å
46V88.5Confident92.2Very high24 Ų2486.4 Ų86.415%0.14544%0.435CS..Iπ-helixtrans-62.2-63-172.1-178.10000111.3L5 Y41 L42 T48 I54L5-V46 HydrophobicContact CD2-CG1 3.81Å; Y41-V46 HydrophobicContact CD1-CG2 3.72Å; Y41-V46 HydrophobicContact CE1-CG2 3.3Å; Y41-V46 PolarHBondContact O-N 3.06Å; Y41-V46 VanDerWaalsContact O-N 3.07Å; L42-V46 HydrophobicContact CD1-CG2 4.21Å; L42-V46 HydrophobicContact CG-CG2 4.46Å; V46-T48 WeakPolarHBondContact CG1-O 3.5Å; V46-T48 PolarHBondContact O-N 3.06Å; V46-I54 HydrophobicContact CG1-CD1 3.55Å
47K87.2Confident92.2Very high119 Ų11991.6 Ų91.652%0.51745%0.451SS..  trans57.9-39.3-179.2-70159.3169.1151.90116.7L42 R43 E44 P53 I54L42-K47 PolarHBondContact O-N 2.68Å; R43-K47 WeakPolarHBondContact O-CE 3.35Å; R43-K47 WeakPolarHBondContact O-CG 3.32Å; E44-K47 WeakPolarHBondContact O-CE 3.41Å; E44-K47 PolarHBondContact O-NZ 2.73Å; K47-P53 WeakPolarHBondContact O-CA 3.42Å; K47-I54 PolarHBondContact O-N 2.85Å
48T90.2Very high92.1Very high77 Ų7791.5 Ų91.547%0.47245%0.452SS..EExtended strand (participates in β ladder)trans-134.4152.4-176.469.40000111.3V46 K52V46-T48 WeakPolarHBondContact CG1-O 3.5Å; V46-T48 PolarHBondContact O-N 3.06Å; T48-K52 CarbonylContact C-O 3.46Å; T48-K52 WeakPolarHBondContact CA-O 3.45Å
49F91Very high92Very high54 Ų5497.6 Ų97.624%0.23748%0.479CS..EExtended strand (participates in β ladder)trans-144.7134.3174167.5-112.4000108.4E1 V2 L5 G51 K52 I54E1-F49 HydrophobicContact CB-CE2 3.9Å; E1-F49 HydrophobicContact CB-CZ 3.7Å; E1-F49 WeakPolarHBondContact OE2-CZ 3.49Å; V2-F49 HydrophobicContact CG2-CE1 4.07Å; V2-F49 HydrophobicContact CG2-CZ 4.07Å; L5-F49 HydrophobicContact CD1-CB 4.13Å; L5-F49 HydrophobicContact CD1-CD2 3.93Å; L5-F49 HydrophobicContact CD1-CG 3.98Å; L5-F49 HydrophobicContact CD2-CB 4.41Å; L5-F49 HydrophobicContact CD2-CD2 3.79Å; L5-F49 HydrophobicContact CD2-CG 4.42Å; L5-F49 HydrophobicContact CG-CD2 4.09Å; F49-G51 PolarHBondContact O-N 3.07Å; F49-K52 PolarHBondContact N-O 2.9Å; F49-K52 PolarHBondContact O-N 2.92Å; F49-I54 HydrophobicContact CB-CD1 3.48Å; F49-I54 VanDerWaalsContact CB-CD1 3.48Å; F49-I54 HydrophobicContact CB-CG1 3.81Å
50Q89.5Confident91.6Very high125 Ų12599.3 Ų99.358%0.58450%0.502SS*.THydrogen-bonded Turntrans49.936.6-170.4-57177.6-9.100113.1E1 K52E1-Q50 PolarHBondContact OE2-NE2 3.32Å; Q50-K52 PolarHBondContact O-N 3.29Å
51G91.6Very high91Very high74 Ų74100.2 Ų100.276%0.76351%0.511SS*.THydrogen-bonded Turntrans725.9-176.600000115.8F49F49-G51 PolarHBondContact O-N 3.07Å
52K93.3Very high89.9Confident143 Ų143103.9 Ų103.962%0.62253%0.533SS*.EExtended strand (participates in β ladder)trans-110.4137.9-179.7-64172.6-176.4171.20110.7T48 F49 Q50T48-K52 CarbonylContact C-O 3.46Å; T48-K52 WeakPolarHBondContact CA-O 3.45Å; F49-K52 PolarHBondContact N-O 2.9Å; F49-K52 PolarHBondContact O-N 2.92Å; Q50-K52 PolarHBondContact O-N 3.29Å
53P94.1Very high88.1Confident114 Ų114109.1 Ų109.174%0.7457%0.566SS**EExtended strand (participates in β ladder)trans-64.1140.7176.727.4-34.4000111.5K47K47-P53 WeakPolarHBondContact O-CA 3.42Å
54I93.8Very high86.3Confident59 Ų59109.8 Ų109.830%0.30357%0.574SS.*PPolyproline II helixtrans-101.5136.2-179.2-38.9176.4000110L5 V46 K47 F49L5-I54 HydrophobicContact CD1-CD1 3.94Å; V46-I54 HydrophobicContact CG1-CD1 3.55Å; K47-I54 PolarHBondContact O-N 2.85Å; F49-I54 HydrophobicContact CB-CD1 3.48Å; F49-I54 VanDerWaalsContact CB-CD1 3.48Å; F49-I54 HydrophobicContact CB-CG1 3.81Å
55M92.1Very high84.5Confident188 Ų188113.5 Ų113.593%0.92659%0.588SS**PPolyproline II helixtrans-100.9124163.4-67-174.4-71.300110.1
56A93.8Very high82.9Confident36 Ų36110.6 Ų110.630%0.29858%0.581SS.*  trans-111.7156.6170.500000110.3F39 L42F39-A56 HydrophobicContact CD2-CB 3.92Å; F39-A56 HydrophobicContact CE2-CB 3.95Å; L42-A56 HydrophobicContact CB-CB 4.39Å; L42-A56 HydrophobicContact CD2-CB 4.06Å
57R94.3Very high81.5Confident208 Ų208117.9 Ų117.979%0.78561%0.611SS**  trans-152.2143.7168.458.3178.5173.8173.1-3.8110.4
58I94.5Very high79.9Confident86 Ų86120.7 Ų120.744%0.44163%0.632SS.*  trans-73.7128.5172.2-62.4-179.9000109Q36 F39Q36-I58 HydrophobicContact CG-CD1 3.82Å; F39-I58 HydrophobicContact CB-CD1 4.02Å; F39-I58 HydrophobicContact CB-CG1 3.9Å; F39-I58 HydrophobicContact CD1-CD1 3.66Å; F39-I58 HydrophobicContact CD1-CG1 3.82Å; F39-I58 HydrophobicContact CD2-CG1 4.03Å; F39-I58 HydrophobicContact CE1-CD1 4.29Å; F39-I58 HydrophobicContact CE1-CG1 4.31Å; F39-I58 HydrophobicContact CG-CD1 3.9Å; F39-I58 HydrophobicContact CG-CG1 3.64Å
59K92.1Very high78.1Confident130 Ų130120.1 Ų120.157%0.56564%0.641SS**  trans-102.285.5173.4177.6-175.2165.9-173.60108.4Y26 I61Y26-K59 HydrophobicContact CD1-CD 3.99Å; Y26-K59 HydrophobicContact CE1-CD 3.69Å; Y26-K59 VanDerWaalsContact CE2-NZ 3.33Å; Y26-K59 VanDerWaalsContact CZ-NZ 3.28Å; K59-I61 PolarHBondContact O-N 2.85Å
60A86.6Confident76.3Confident86 Ų86127.2 Ų127.271%0.71167%0.668SS**  trans-66.3129.8172.300000110.1N62A60-N62 PolarHBondContact O-N 3.07Å
61I80.8Confident74.5Confident142 Ų142131.7 Ų131.773%0.72868%0.679SS**  trans-81.8112.8165.2-60176000105.9K59 T63K59-I61 PolarHBondContact O-N 2.85Å; I61-T63 PolarHBondContact O-N 3.03Å
62N72.9Confident72.7Confident115 Ų115135.4 Ų135.462%0.61568%0.68SS**  trans-73.2102.1-179.3-169.2-12.5000109.7A60 F64 A66A60-N62 PolarHBondContact O-N 3.07Å; N62-F64 PolarHBondContact O-N 2.97Å; N62-A66 WeakPolarHBondContact ND2-CB 3.19Å
63T56.4Low70.6Confident130 Ų130136.3 Ų136.380%0.79869%0.689SS**  trans-79.826.6-170.842.50000114.4I61I61-T63 PolarHBondContact O-N 3.03Å
64F51.6Low68Low174 Ų174137 Ų13776%0.76369%0.687SS**SBendtrans-148.4166168-134.9-100.8000112.3N62 A66N62-F64 PolarHBondContact O-N 2.97Å; F64-A66 PolarHBondContact O-N 3.36Å
65F52.5Low65.5Low200 Ų200139.3 Ų139.388%0.87771%0.708SS**  trans-71.365.5-179.1-67.2-91.1000112.8K67F65-K67 PolarHBondContact O-N 2.68Å
66A55Low62.9Low38 Ų38134.5 Ų134.531%0.31469%0.693SS.*  trans-7487.1-179.600000111.6N62 F64 N68N62-A66 WeakPolarHBondContact ND2-CB 3.19Å; F64-A66 PolarHBondContact O-N 3.36Å; A66-N68 PolarHBondContact O-N 3.17Å
67K58.5Low60.4Low178 Ų178140 Ų14077%0.77472%0.716SS**  trans-34.9127.7161.359.3-157.4173.2-171.80111.5F65 G69F65-K67 PolarHBondContact O-N 2.68Å; K67-G69 VanDerWaalsContact C-N 3.3Å; K67-G69 PolarHBondContact O-N 3.1Å
68N52.6Low57.9Low178 Ų178139.9 Ų139.995%0.95272%0.716SS**SBendtrans-64.272.9-164.5-61.5-12.5000114.3A66A66-N68 PolarHBondContact O-N 3.17Å
69G53.9Low55.1Low64 Ų64140 Ų14066%0.6673%0.725SS**  trans-140.1-12.6-178.300000115.6K67 R71K67-G69 VanDerWaalsContact C-N 3.3Å; K67-G69 PolarHBondContact O-N 3.1Å; G69-R71 PolarHBondContact O-N 3.37Å
70Y51.9Low52.4Low204 Ų204140.7 Ų140.780%0.873%0.73SS**  trans-79.8101.9175-75.3-84.5000110.5
71R52.5Low50.2Low219 Ų219143 Ų14383%0.82674%0.738SS**  trans-63.5136.3154.5-53.8-179.2-163.7-95.60.4106.7G69 M73G69-R71 PolarHBondContact O-N 3.37Å; R71-M73 PolarHBondContact O-N 3.45Å
72L54.6Low48.1Very low151 Ų151143.8 Ų143.879%0.79174%0.742SS**  trans-58.9121.6171.1-177.665.1000107.2
73M48.5Very low46.5Very low163 Ų163146.2 Ų146.280%0.80375%0.749SS**  trans-89.2110178.8-157.363.560.900107.6R71 S75R71-M73 PolarHBondContact O-N 3.45Å; M73-S75 PolarHBondContact O-N 3.48Å
74D39.6Very low45.5Very low129 Ų129146.7 Ų146.769%0.6975%0.753SS**  trans-64.4123.8-172.7-61.9-53.6000110.7S76D74-S76 VanDerWaalsContact C-N 3.26Å; D74-S76 PolarHBondContact O-N 3.01Å
75S39.9Very low44.7Very low107 Ų107146.4 Ų146.475%0.74875%0.754SS**  trans-80.174.4-175.5-162.80000110.9M73 I77M73-S75 PolarHBondContact O-N 3.48Å; S75-I77 VanDerWaalsContact C-N 3.27Å; S75-I77 PolarHBondContact O-N 2.95Å
76S38.3Very low43.9Very low87 Ų87141.2 Ų141.261%0.60875%0.748SS**  trans-77.369.2-177.5630000112.4D74 Y78D74-S76 VanDerWaalsContact C-N 3.26Å; D74-S76 PolarHBondContact O-N 3.01Å; S76-Y78 VanDerWaalsContact C-N 3.29Å
77I40.9Very low43.3Very low152 Ų152147.4 Ų147.478%0.77977%0.77SS**SBendtrans-84-7.4172.4-62.4179.3000111.5S75S75-I77 VanDerWaalsContact C-N 3.27Å; S75-I77 PolarHBondContact O-N 2.95Å
78Y41.8Very low42.1Very low204 Ų204149.6 Ų149.680%0.878%0.775SS**SBendtrans-136.589.9170.7-135-95.5000111.1S76 H80S76-Y78 VanDerWaalsContact C-N 3.29Å; Y78-H80 AromaticContact CE1-NE2 3.99Å
79S36.3Very low41.3Very low90 Ų90145.5 Ų145.563%0.62977%0.766SS**  trans-124.6113.6173580000110
80H35.2Very low40.2Very low143 Ų143147.5 Ų147.566%0.66277%0.77SS**  trans-61.4149.3169-62.6-84000110.2Y78 I82Y78-H80 AromaticContact CE1-NE2 3.99Å; H80-I82 PolarHBondContact O-N 3.2Å
81P40.5Very low40Very low134 Ų134143.4 Ų143.487%0.8777%0.768SS**  trans-70.8103.5-172.928.1-34.9000111.6
82I36.4Very low39.6Very low160 Ų160138.9 Ų138.982%0.82177%0.765SS**  trans-98.8131.7166.2-66.4-179.2000109.2H80 T84H80-I82 PolarHBondContact O-N 3.2Å; I82-T84 PolarHBondContact O-N 2.99Å
83Q38.8Very low39Very low165 Ų165141.2 Ų141.277%0.77177%0.768SS**  trans-73.3108.8-167.6-173.4178.521.200112.4Q85Q83-Q85 PolarHBondContact O-N 2.9Å
84T36.7Very low39.1Very low141 Ų141141.2 Ų141.287%0.86577%0.769SS**  trans-83.999.2172390000111.3I82I82-T84 PolarHBondContact O-N 2.99Å
85Q33.9Very low39.1Very low168 Ų168144 Ų14479%0.78578%0.777SS**  trans-73.2158161.3-71.1-158.522.200111.3Q83Q83-Q85 PolarHBondContact O-N 2.9Å
86A37Very low39.5Very low91 Ų91144.9 Ų144.975%0.75278%0.781SS**  trans-88.6161.6-169.800000114.3
87Q40.7Very low39.4Very low167 Ų167147.5 Ų147.578%0.7879%0.793SS**  trans-4.3130.9152.7-56.5174.4-21.500118.1
88Y33.4Very low39.1Very low225 Ų225149.7 Ų149.788%0.88279%0.793SS**  -153.2130.6123.2-77.4-56.1000107
89A35.9Very low39Very low91 Ų91147.1 Ų147.175%0.75279%0.793SS**  80137.862.200000113
90S31.6Very low39.6Very low107 Ų107145.6 Ų145.675%0.74878%0.781SS**  trans-65.8140.8-164-170.90000113.5
91P48Very low39.8Very low117 Ų117146.2 Ų146.276%0.7678%0.783SS**  trans-66.6136166.129.7-33.9000110.1
92V42.8Very low39.9Very low125 Ų125147.3 Ų147.376%0.75878%0.777SS**  trans-111128.7164.5174.70000106.8M94V92-M94 PolarHBondContact O-N 3.19Å
93F43.5Very low40Very low199 Ų199147 Ų14787%0.87377%0.772SS**  trans-66.1124.6176.8-99.3-101.6000110.7
94M49.1Very low39.9Very low164 Ų164148.4 Ų148.481%0.80877%0.772SS**  trans-130.6136.2162.6-75.3-81.39200108V92V92-M94 PolarHBondContact O-N 3.19Å
95Q41.3Very low40Very low186 Ų186147.5 Ų147.587%0.86977%0.771SS**PPolyproline II helixtrans-76.2137.9180-70.1-177.9-68.800110.8
96P46.8Very low40.5Very low127 Ų127144.6 Ų144.683%0.82577%0.765SS**PPolyproline II helixtrans-69.6126.9162.8-12.928.5000109.8
97V36.9Very low40.5Very low141 Ų141149.9 Ų149.986%0.85577%0.766SS**PPolyproline II helixtrans-82133.3161.4176.30000108
98Y35.3Very low40.3Very low199 Ų199148 Ų14878%0.7877%0.772SS**PPolyproline II helixtrans-73.5129.5-177.7178.4-95000111.6P100Y98-P100 HydrophobicContact CE1-CB 4.33Å; Y98-P100 HydrophobicContact CE1-CG 3.79Å
99N38.3Very low40.8Very low150 Ų150144 Ų14480%0.80277%0.765SS**  trans-145.9118.8165.9-167.928000110.2
100P50.3Low41.5Very low58 Ų58145.9 Ų145.938%0.37777%0.766SS.*  trans-90.8174.9178.333.8-29.7000113Y98Y98-P100 HydrophobicContact CE1-CB 4.33Å; Y98-P100 HydrophobicContact CE1-CG 3.79Å
101H39Very low42.1Very low155 Ų155146 Ų14672%0.71876%0.764SS**  trans71.7111.4-177.1-60.1-109.6000113.7
102Q43Very low42Very low158 Ų158150 Ų15074%0.73877%0.773SS**  118.1146.780.1-95-173.623.400108
103Q37.4Very low42Very low154 Ų154148.7 Ų148.772%0.7277%0.769SS**  cis-138.2175.1-1.1-64.2-161.7-66.300112.4
104Y37Very low42.2Very low194 Ų194151 Ų15176%0.76177%0.772SS**  trans-17.1134.9173.6-64.7-83.2000122.9
105S39.3Very low41.7Very low121 Ų121148.7 Ų148.785%0.84677%0.772SS**  trans-164.486.8132.3-78.30000108.5
106V43.6Very low42Very low108 Ų108145.5 Ų145.566%0.65577%0.767SS**  67.298.588.5-179.40000112.7
107Y36.8Very low41.5Very low201 Ų201146.4 Ų146.479%0.78877%0.765SS**  trans46.7110.1167.1-57.4-63.9000120.3I109Y107-I109 HydrophobicContact CD1-CD1 4.3Å; Y107-I109 HydrophobicContact CD1-CG1 4.47Å; Y107-I109 HydrophobicContact CG-CD1 4.46Å
108S36.6Very low42.3Very low129 Ų129144.9 Ų144.990%0.90276%0.758SS**  trans-109116.8146.8-71.60000108.8
109I44.5Very low43Very low141 Ų141141.1 Ų141.172%0.72376%0.756SS**  trans-116.399.5-178.7-60.6172.3000109.4Y107Y107-I109 HydrophobicContact CD1-CD1 4.3Å; Y107-I109 HydrophobicContact CD1-CG1 4.47Å; Y107-I109 HydrophobicContact CG-CD1 4.46Å
110V50.4Low43.7Very low130 Ų130140.3 Ų140.379%0.78876%0.759SS**  trans-141.9127.1158.2179.50000107Q112V110-Q112 PolarHBondContact O-N 3.45Å
111P43.7Very low43.3Very low108 Ų108148.3 Ų148.370%0.70178%0.784SS**  trans-72.9116.8-179.628.2-33.4000111.4S113P111-S113 PolarHBondContact O-N 3.28Å; P111-S113 VanDerWaalsContact O-N 3.09Å
112Q46.2Very low43.7Very low202 Ų202150.2 Ų150.294%0.94479%0.79SS**  trans-81.285.4177.6-173.4165.1-23.900110.8V110 W114V110-Q112 PolarHBondContact O-N 3.45Å; Q112-W114 PolarHBondContact O-N 3.35Å
113S42.9Very low43.7Very low97 Ų97150.7 Ų150.768%0.67879%0.792SS**  trans-96.156.9-162.450.70000116.1P111P111-S113 PolarHBondContact O-N 3.28Å; P111-S113 VanDerWaalsContact O-N 3.09Å
114W47.5Very low44.3Very low249 Ų249149.7 Ų149.794%0.94380%0.797SS**  trans-136.596.5163.4-75.486.9000111.2Q112Q112-W114 PolarHBondContact O-N 3.35Å
115S39.5Very low45.2Very low114 Ų114145.1 Ų145.180%0.79779%0.791SS**PPolyproline II helixtrans-95.6128.8171.846.40000111.1
116P46.6Very low45.5Very low119 Ų119147.3 Ų147.377%0.77379%0.792SS**PPolyproline II helixtrans-73.3132.7164.630.4-31.6000109.5P118P116-P118 WeakPolarHBondContact O-CD 3.14Å
117N37.1Very low45.6Very low147 Ų147146 Ų14679%0.78679%0.793SS**PPolyproline II helixtrans-70.2120.1-178.7179.714.9000111.8
118P53.1Low46.3Very low108 Ų108142.1 Ų142.170%0.70179%0.793SS**PPolyproline II helixtrans-81.8117.4172.532.6-31.2000111.1P116P116-P118 WeakPolarHBondContact O-CD 3.14Å
119T51.3Low46.7Very low120 Ų120146.1 Ų146.174%0.73679%0.794SS**PPolyproline II helixtrans-66.1132.1168.446.80000110.6Y121T119-Y121 PolarHBondContact O-N 3.02Å
120P51.2Low47.1Very low134 Ų134144.2 Ų144.287%0.8779%0.791SS**PPolyproline II helixtrans-70.1122176.328.9-33.5000110.1
121Y41.8Very low46.5Very low226 Ų226145.7 Ų145.789%0.88679%0.794SS**  trans-118.8147.8165.9-158.2-95.5000109.2T119T119-Y121 PolarHBondContact O-N 3.02Å
122F48.5Very low46.4Very low194 Ų194144.1 Ų144.185%0.85180%0.798SS**  trans-76.9157.1-164-133-98.7000113.6
123E42.2Very low46Very low168 Ų168139.9 Ų139.979%0.78579%0.791SS**  trans-77.2134.8-171.6-175.6174.6-163.100112.7
124T49.9Very low46.2Very low134 Ų134144.2 Ų144.282%0.82280%0.797SS**  trans-156.9121.3165.9-58.90000109.9
125P57.2Low45.9Very low98 Ų98139.6 Ų139.664%0.63680%0.796SS**  trans-107.4177.5-171.440.9-36.7000114.9
126L44.7Very low46.1Very low166 Ų166141.8 Ų141.887%0.86980%0.799SS**  trans76.5140.3165.8-59.5163.7000116.9
127A45.9Very low45.4Very low82 Ų82139.3 Ų139.368%0.67880%0.795SS**  cis-154.3-149.2-13.700000110.9
128P51.3Low45.5Very low119 Ų119140.9 Ų140.977%0.77380%0.796SS**  -120161.8-12134-13.7000117.1
129F44.6Very low44.6Very low212 Ų212142.8 Ų142.893%0.9380%0.8SS**  trans-90.7137.5170.2-66.2-82.6000112.5
130P53Low43.8Very low102 Ų102142.2 Ų142.266%0.66280%0.801SS**  trans-118116.4167.234.8-22.3000113.7
131N38.3Very low43.6Very low161 Ų161141.9 Ų141.986%0.86180%0.798SS**  trans63.1149.3147.1-45.6-32.9000119.2
132G42.7Very low43.2Very low75 Ų75134.5 Ų134.577%0.77379%0.791SS**  cis113.889-2.400000113.7
133S36.3Very low42.5Very low113 Ų113131 Ų13179%0.7979%0.791SS**  trans-161.4158.7161.2-164.20000112.6
134F47.8Very low42.3Very low187 Ų187133.6 Ų133.682%0.8280%0.795SS**  trans-80.3150.8-169.6-41.7-93.9000113.5
135V41.4Very low41.8Very low152 Ų152136.6 Ų136.692%0.92180%0.796SS**  -170.3151.9113-91.30000111.6
136N43.4Very low40.8Very low160 Ų160139.1 Ų139.186%0.85681%0.81SS**  trans-112.9133164.6172.923.2000107.8
137G32.9Very low40.3Very low67 Ų67139.1 Ų139.169%0.69181%0.811SS**  trans-171.975.6-17000000116.9
138F37.8Very low39.9Very low181 Ų181138.3 Ų138.379%0.79480%0.804SS**  trans41.8145.3141.1-94.2-90.3000123.9
139N34.5Very low39.1Very low147 Ų147137.7 Ų137.779%0.78681%0.809SS**  trans92.3128.7154.5-63.6-40.9000121.1
140S35Very low39Very low109 Ų109132 Ų13276%0.76280%0.802SS**  trans-80.2-171.6169.5-20.90000111.8
141P46.7Very low38.4Very low126 Ų126134 Ų13482%0.81880%0.804SS**  cis-135163.2-23.633.3-15.6000114.9
142G32.8Very low38.2Very low71 Ų71133.2 Ų133.273%0.73280%0.8SS**  trans109151.9138.300000119.2
143S33.6Very low37.9Very low121 Ų121138.6 Ų138.685%0.84681%0.807SS**  trans63.7140.2178-70.70000116.3
144Y38.2Very low37.8Very low223 Ų223135.9 Ų135.988%0.87580%0.797SS**  cis-146176.9643.1-96.1000112.7
145K39.1Very low37.5Very low196 Ų196138.5 Ų138.585%0.85280%0.801SS**  trans-70.9138.3-162.9-54160.5-177.9170.90115
146T37Very low38Very low151 Ų151136.1 Ų136.193%0.92679%0.789SS**  -135144.5128.436.60000108.7
147N33.7Very low37.6Very low166 Ų166137.1 Ų137.189%0.88879%0.787SS**  trans-95.5148.8-163.7-162.913.7000113
148A37.8Very low37.8Very low65 Ų65141.6 Ų141.654%0.53779%0.789SS.*  trans-106149.117700000111.8
149A34.5Very low38Very low106 Ų106141.2 Ų141.288%0.87679%0.787SS**  trans-137.873.4176.200000111
150A42.4Very low38Very low93 Ų93142.4 Ų142.477%0.76979%0.794SS**  trans-139.951.5-176.400000112.4
151M39.8Very low38.5Very low144 Ų144148.8 Ų148.871%0.70980%0.801SS**  trans-153.5158.3178.338.5-90-17800109.1
152N35.6Very low38.1Very low144 Ų144149.2 Ų149.277%0.7780%0.801SS**  cis-147.5163.922.4-175.4-91.5000112.4G154N152-G154 PolarHBondContact OD1-N 3.44Å
153M36.7Very low39Very low188 Ų188155.1 Ų155.193%0.92681%0.807SS**  trans-138.6104.9169.1-162.666.5147.500112
154G33.8Very low39.4Very low57 Ų57154.5 Ų154.559%0.58880%0.8SS**  trans118.374.614300000122.9N152N152-G154 PolarHBondContact OD1-N 3.44Å
155R41.7Very low39.3Very low241 Ų241151.9 Ų151.991%0.90980%0.796SS**  trans67.4179143.8-50.8-167.8-171.9-75.60.3116.2
156P50.1Low39.3Very low103 Ų103151.6 Ų151.667%0.66980%0.795SS**  cis-131.4-173-2.327.1-1.6000117
157F35.6Very low39.4Very low181 Ų181155.7 Ų155.779%0.79479%0.793SS**  trans92.8118.4166-64.2-78.9000120.9
158Q37.9Very low39.3Very low161 Ų161153.8 Ų153.875%0.75279%0.793SS**  34.7138.7126.3-51.4-63.8-2.500118.7
159K40.8Very low39.3Very low173 Ų173156.7 Ų156.775%0.75281%0.809SS**  cis-173.5137.819.730-179.5168.7177.90110.2
160N35Very low39.2Very low171 Ų171155.4 Ų155.491%0.91481%0.806SS**  trans168.5160.8137.1-91.4-28000114
161R45Very low38.7Very low243 Ų243154.3 Ų154.392%0.91780%0.804SS**  trans-78149.6175.8-67.8171.4168.1169-5.6111.9
162V39Very low38.3Very low136 Ų136152.6 Ų152.682%0.82481%0.806SS**  -174.8146.5113.8147.80000108.8
163K51.3Low38.3Very low194 Ų194153.2 Ų153.284%0.84381%0.805SS**  trans-84.6127.5172.1-81.1-179.1171.4-179.10110.4
164P42.6Very low38.1Very low108 Ų108152.3 Ų152.370%0.70180%0.798SS**  trans-80.8115161.5-3.521.8000109.5F166P164-F166 PolarHBondContact O-N 2.83Å
165Q36Very low37.9Very low169 Ų169154.8 Ų154.879%0.7981%0.806SS**  trans-78.9106.6168-174.879.2-900108.1R167Q165-R167 PolarHBondContact O-N 2.88Å
166F38.5Very low37.5Very low190 Ų190148.1 Ų148.183%0.83379%0.792SS**PPolyproline II helixtrans-68.1126.2172.8-94.8-87.6000110.1P164P164-F166 PolarHBondContact O-N 2.83Å
167R39.1Very low36.6Very low236 Ų236151.9 Ų151.989%0.89180%0.801SS**PPolyproline II helixtrans-84.7128.1173.2-64.3177.7178-122.83108.6Q165Q165-R167 PolarHBondContact O-N 2.88Å
168S33.1Very low36.5Very low126 Ų126147.4 Ų147.488%0.88181%0.805SS**PPolyproline II helixtrans-67.7129.9161.8-57.50000108.8
169S36.3Very low36.3Very low126 Ų126145.2 Ų145.288%0.88181%0.808SS**PPolyproline II helixtrans-95.3143.2162.4-172.50000108.1
170G32.4Very low35.9Very low79 Ų79143.8 Ų143.881%0.81481%0.814SS**  trans-136.2160.1176.300000110.6
171G31.7Very low36Very low71 Ų71141.2 Ų141.273%0.73281%0.809SS**  trans167.7143.6175.600000111.7
172S33Very low35.8Very low107 Ų107138.4 Ų138.475%0.74881%0.811SS**  trans66.7129.8173.5-1630000117.2
173E34.4Very low35.5Very low158 Ų158135.4 Ų135.474%0.73881%0.808SS**  cis-164.6175.4-26.5-113139.3169.200109.2
174H33.1Very low34.7Very low169 Ų169134.7 Ų134.778%0.78281%0.813SS**  trans-20.2151.1175.6-50.7-75.7000118.7
175S29.8Very low34.2Very low108 Ų108133.1 Ų133.176%0.75582%0.817SS**  cis-165.4-170.515.6-136.90000109.1
176T33.8Very low34.1Very low102 Ų102133.4 Ų133.463%0.62682%0.819SS**  cis-136.4-179.84.949.10000111.6
177E31.1Very low34.1Very low182 Ų182133 Ų13385%0.8582%0.824SS**  trans46.9130.2144.8-70.5156.3-99.900122.4
178G32.3Very low33.8Very low86 Ų86127.9 Ų127.989%0.88781%0.814SS**  trans14979.2164.600000115.2
179S33Very low33.8Very low116 Ų116133 Ų13381%0.81182%0.815SS**  trans-101.1132.3179-179.20000112.9
180V34.3Very low33.6Very low143 Ų143137.5 Ų137.587%0.86781%0.813SS**  trans-167.5147.6131.2-95.40000110.2
181S37.2Very low33.4Very low117 Ų117137.4 Ų137.482%0.81880%0.801SS**  trans-129.8126.3172.7-65.50000111.8
182L40.7Very low33.3Very low183 Ų183139 Ų13996%0.95880%0.8SS**  trans-154.6132162.8-78.3177.7000106.9
183G32.3Very low33.6Very low74 Ų74144.5 Ų144.576%0.76381%0.805SS**  cis-166.1176.4-600000111
184D34.6Very low33.7Very low178 Ų178143.3 Ų143.395%0.95280%0.804SS**  trans-69.9160.7-176-84.1-70.8000115.3
185G31.1Very low33.7Very low76 Ų76144.2 Ų144.278%0.78481%0.805SS**  trans-177.438.6179.600000117.7
186Q34.7Very low34.9Very low175 Ų175144.6 Ų144.682%0.81881%0.805SS**  trans-94.5109174.6-140.8-140.7110.700112.2
187L38Very low34.7Very low180 Ų180144 Ų14494%0.94281%0.811SS**  trans-137.3130.6165.8-81.5179.9000111.5
188N32.2Very low34.7Very low130 Ų130142.7 Ų142.770%0.69581%0.805SS**  trans-139.7107.5-172.3-169.3-2.7000109.6
189R33.7Very low34.7Very low234 Ų234147.6 Ų147.688%0.88380%0.796SS**  trans173.3125.3158.8-106.2167.6-74.7-171.8-1.7113.8
190Y31.5Very low34.7Very low219 Ų219149.7 Ų149.786%0.85979%0.793SS**  -174.7107.9124.5-117.7-101.5000105.7
191S29.1Very low34.5Very low78 Ų78149.7 Ų149.755%0.54579%0.788SS.*  67.3130.285.8-1570000112.5
192S30.6Very low34.9Very low103 Ų103150.3 Ų150.372%0.7279%0.79SS**  cis-153.9137.341.6-64.70000118.4
193R37.4Very low34.6Very low223 Ų223147.2 Ų147.284%0.84278%0.778SS**  trans27.399.3133.5-44.7-178.9-155.1-166.66122.3
194N36.4Very low34.6Very low134 Ų134150.1 Ų150.172%0.71778%0.781SS**  25.9143.2113.4-65.6-10.6000125.5
195F33.4Very low34.5Very low187 Ų187148.2 Ų148.282%0.8278%0.776SS**  trans78.7157.3142.8-67.7-37.3000121.9
196P54.7Low34.3Very low116 Ų116147.8 Ų147.875%0.75377%0.772SS**  cis-143.3-171.8-2838.8-19.1000116.8
197A30.3Very low34Very low90 Ų90148.3 Ų148.374%0.74477%0.774SS**  trans89.8102.314400000124
198E31.9Very low33.5Very low155 Ų155147.5 Ų147.572%0.72477%0.765SS**  31.7118.5123.9-148-161.7124.700122
199R32.2Very low33.4Very low188 Ų188147.4 Ų147.471%0.70976%0.76SS**  163.5160.9109.4-90.1-159.1177.1-165.20.6118
200H31.6Very low33.3Very low161 Ų161143.7 Ų143.775%0.74575%0.753SS**  trans87.4128.2151.8-61.8133.3000122.5
201N31.3Very low33.1Very low143 Ų143139.3 Ų139.377%0.76575%0.749SS**  trans-74.2172.3151.7-70.3-30.5000110.8
202P46Very low33.2Very low130 Ų130144.9 Ų144.984%0.84476%0.76SS**  -119.4166.5128.535.7-32.2000112.9
203T32.6Very low33.2Very low118 Ų118146.7 Ų146.772%0.72476%0.76SS**  trans-155.3158.5-179.1-51.20000109
204V33.1Very low32.9Very low134 Ų134143.1 Ų143.181%0.81275%0.754SS**  trans73.3140.6-178.2-164.60000111.4
205T32.6Very low32.7Very low139 Ų139144 Ų14485%0.85375%0.751SS**  cis-114.1177.617.949.50000113.3
206G27.9Very low32.5Very low67 Ų67142 Ų14269%0.69174%0.744SS**  cis159.8119.8-1300000114.5
207H27Very low31.4Very low186 Ų186142.4 Ų142.486%0.86175%0.745SS**  trans52.1134.9156-88.9-77.5000125.1
208Q27.9Very low31.3Very low162 Ų162143 Ų14376%0.75774%0.743SS**  trans90.5121.8138.2-77.7-163-51.800124.8
209E29.7Very low31.2Very low128 Ų128141.1 Ų141.160%0.59874%0.743SS**  trans63.8109133.7-53.2-49.798.300124.7
210Q31.6Very low31.3Very low157 Ų157139.1 Ų139.173%0.73475%0.745SS**  51126.2128.1-53.1-17042.300122.7
211T28.5Very low31.2Very low127 Ų127139.3 Ų139.378%0.77975%0.746SS**  -178.9113.7120.3-77.90000114.4
212Y30.4Very low31.3Very low195 Ų195139.3 Ų139.377%0.76575%0.751SS**  trans59126.3144.3-80.6-118.1000125.7
213L31.4Very low31.4Very low140 Ų140139.7 Ų139.773%0.73374%0.742SS**  trans66.7154.3143.3-58.1175.3000121.7
214Q30.5Very low31.6Very low149 Ų149142.9 Ų142.970%0.69675%0.749SS**  cis-173150.3-26.1169.51702900111.6
215K31.3Very low31.7Very low153 Ų153143 Ų14367%0.66575%0.745SS**  trans68.6142.8161.2-91.6-164.9172.2-88.80117.6
216E31Very low31.9Very low144 Ų144140 Ų14067%0.67374%0.742SS**  cis-150.3176.3-21-60.3-169.2118.700107.5
217T30.5Very low32.3Very low125 Ų125143.7 Ų143.777%0.76775%0.745SS**  cis-147.6151.418.730.20000113.4
218S29.6Very low32.9Very low101 Ų101145 Ų14571%0.70674%0.744SS**  trans32.4102.6147.8-61.50000121.7
219T29.2Very low33.3Very low117 Ų117140.9 Ų140.972%0.71875%0.745SS**  74.9113.794.657.10000116.7
220L33.2Very low33.7Very low145 Ų145146.7 Ų146.776%0.75976%0.762SS**  72.914169.9-69.2-179.3000114
221Q29.8Very low33.8Very low165 Ų165143 Ų14377%0.77177%0.765SS**  cis-170159.2-16.6-163.8175.317.100108.9
222V34Very low34.6Very low144 Ų144148 Ų14887%0.87377%0.77SS**  trans-140.9109.8163.7171.80000110.6
223E47.9Very low35.2Very low137 Ų137149.8 Ų149.864%0.6478%0.775SS**  trans-168.3138.9149.8-146.8-172.5108.500111.8N225E223-N225 PolarHBondContact OE1-ND2 3.32Å
224Q37.1Very low36Very low186 Ų186148.8 Ų148.887%0.86978%0.775SS**  -174.6113.5123-102.6165.4101.700114.1
225N33.8Very low36.9Very low136 Ų136149.7 Ų149.773%0.72778%0.784SS**  trans0149.1151-54.5-69.7000121.9E223E223-N225 PolarHBondContact OE1-ND2 3.32Å
226G37.1Very low37.5Very low77 Ų77152.3 Ų152.379%0.79480%0.795SS**  trans-178.855.9174.600000119
227D36.9Very low38.3Very low143 Ų143157 Ų15777%0.76581%0.807SS**  trans37.1171.1149.7-115.721.1000125.7
228Y38.6Very low38.8Very low214 Ų214154.8 Ų154.884%0.83981%0.809SS**  trans-55.7153.1-167.5-48.3-95000118.7
229G37.6Very low39.6Very low75 Ų75160.4 Ų160.477%0.77381%0.814SS**  trans165.2103.2146.700000121.2
230R37.4Very low40.8Very low251 Ų251166.1 Ų166.195%0.94782%0.823SS**  trans-5.7118.2149.8179.2-136.4-67-93.46118
231G35Very low41.8Very low78 Ų78169.2 Ų169.280%0.80482%0.824SS**  trans-170.4130.8163.100000117.8
232R43.9Very low43.1Very low232 Ų232172.2 Ų172.288%0.87583%0.829SS**  trans-86.4139.9166.2-63179.1178.3-1465.5110.7
233R44.2Very low43.7Very low234 Ų234173 Ų17388%0.88382%0.823SS**  172.4153.4111.5-94.4164-66.5177.25113.3
234T48.3Very low43.6Very low119 Ų119174.3 Ų174.373%0.7383%0.834SS**  trans-71.4142.716647.20000111.6
235L48.8Very low44.3Very low167 Ų167172.6 Ų172.687%0.87483%0.831SS**  trans-129.399.6169-72.8176.6000111.3R237L235-R237 PolarHBondContact O-N 2.83Å
236F43.8Very low45.2Very low208 Ų208177.1 Ų177.191%0.91284%0.838SS**  trans-87.493.7163.4-85.5-83.1000110
237R47.1Very low45.6Very low244 Ų244181.6 Ų181.692%0.92184%0.842SS**  trans-144.3132.3148.2-83-168.3177.3-145.91.2106.6L235L235-R237 PolarHBondContact O-N 2.83Å
238G41.3Very low45.6Very low78 Ų78179.8 Ų179.880%0.80484%0.841SS**  cis112.573.512.500000110.3
239R45.8Very low45.6Very low218 Ų218180.7 Ų180.782%0.82384%0.842SS**  trans-140.2123167.5-145-176.5-160.1-68.20.2109.7
240R54.7Low45.5Very low238 Ų238182.8 Ų182.890%0.89884%0.842SS**  trans-72.6137.7167.6-61.3172179.6161.7-2.3108.4
241R53.7Low45.6Very low209 Ų209178.5 Ų178.579%0.78983%0.833SS**  trans-134.7114143-89.1-166.7164.1152.3-2.4108.3
242R57.8Low46.2Very low228 Ų228180.6 Ų180.686%0.8683%0.832SS**  trans-103.7102.4160.3164-153.4-69.3149.4-6.4103.1
243E47.8Very low46Very low160 Ų160174.5 Ų174.575%0.74883%0.825SS**  trans-174.991.6174.6-104.2157.3-8700106.9
244D45.2Very low45.7Very low165 Ų165170.5 Ų170.588%0.88283%0.827SS**  trans-153.929163.6-107.4-35000111.3R246D244-R246 PolarHBondContact O-N 2.93Å
245D50.6Low45.2Very low151 Ų151169.1 Ų169.181%0.80783%0.828SS**  trans-88.277170.7-82.4-60.7000110.1
246R53.2Low45.1Very low230 Ų230170.2 Ų170.287%0.86883%0.829SS**  trans-179.6105.5159-90.9136.5-163.3-152.16.7110.3D244D244-R246 PolarHBondContact O-N 2.93Å
247I45.2Very low44.8Very low172 Ų172166.4 Ų166.488%0.88283%0.827SS**  trans-165.3131.9135.5-96.5144.9000110
248S38.7Very low44.5Very low105 Ų105164.6 Ų164.673%0.73483%0.826SS**  trans-12.3128.1171.5-49.30000120.7P250S248-P250 WeakPolarHBondContact O-CD 3.42Å
249R37.8Very low44.5Very low232 Ų232165.1 Ų165.188%0.87582%0.823SS**  trans-68.9136.1155.8169.5-167.8-71.5-167-2.8111
250P36.2Very low44.7Very low119 Ų119160.5 Ų160.577%0.77382%0.822SS**  trans-121.4148.7143.436.4-28000111.8S248S248-P250 WeakPolarHBondContact O-CD 3.42Å
251H38.4Very low44.6Very low161 Ų161154.9 Ų154.975%0.74581%0.813SS**  trans-150.4135.2167.8-149.8-22.2000107.8
252P47Very low45.1Very low122 Ų122150.1 Ų150.179%0.79281%0.81SS**  -133.5-175.912536.1-25.3000111.6
253S40.8Very low45.5Very low104 Ų104147.6 Ų147.673%0.72781%0.805SS**  trans-107.5148.6-163.2530000114.9
254T38.3Very low46.3Very low151 Ų151148.5 Ų148.593%0.92681%0.807SS**  trans-135.4169.9150.650.10000109.6
255A37.6Very low47.7Very low90 Ų90144.4 Ų144.474%0.74479%0.785SS**  trans-106.4156.6-153.900000116.4
256E46Very low48.9Very low190 Ų190143.8 Ų143.889%0.88878%0.781SS**  trans43.2113.1150.9-63.8-171.8152.400121.6
257S37.6Very low50Low127 Ų127137.7 Ų137.789%0.88877%0.765SS**  -163.5170.5106.454.30000111.2
258K39.9Very low51.1Low206 Ų206133.8 Ų133.890%0.89676%0.758SS**  trans-84.5133.8-164.2-69.6179.8179.6174.90114.7
259A43.2Very low52.8Low89 Ų89133.8 Ų133.874%0.73676%0.758SS**  -137.3120.2126.100000108.4T261A259-T261 PolarHBondContact O-N 2.78Å; A259-T261 VanDerWaalsContact O-N 3.14Å
260P50Low54.8Low122 Ų122127.7 Ų127.779%0.79274%0.743SS**  trans-73.2107.8176.729.3-31.8000109.2
261T50.8Low57.2Low119 Ų119128.3 Ų128.373%0.7373%0.734SS**  trans-61.5138.616645.20000109.1A259 K263A259-T261 PolarHBondContact O-N 2.78Å; A259-T261 VanDerWaalsContact O-N 3.14Å; T261-K263 PolarHBondContact O-N 3.34Å
262P64.2Low59.3Low110 Ų110125.8 Ų125.871%0.71473%0.732SS**  trans-65.3111.7177.526.2-32.9000108.8F264P262-F264 PolarHBondContact O-N 3.4Å
263K66.7Low60.7Low175 Ų175125 Ų12576%0.76173%0.727SS**  trans-65.7102.9171.5-69.4-173.7179.1-175.50108.4T261 D265T261-K263 PolarHBondContact O-N 3.34Å; K263-D265 PolarHBondContact O-N 2.84Å
264F65.1Low62.4Low179 Ų179126.6 Ų126.679%0.78573%0.727SS**  trans-69.979.4159.6-96.5-93000108.1P262 L266P262-F264 PolarHBondContact O-N 3.4Å; F264-L266 VanDerWaalsContact C-N 3.34Å; F264-L266 WeakPolarHBondContact O-CD1 3.16Å; F264-L266 PolarHBondContact O-N 3.46Å
265D74.3Confident63.9Low79 Ų79126 Ų12642%0.42273%0.725SS.*  trans-69.894.3167.4-91.2-44000107.9K263 L267 N270K263-D265 PolarHBondContact O-N 2.84Å; D265-L267 HydrophobicContact CB-CD1 4.49Å; D265-L267 HydrophobicContact CB-CG 4.37Å; D265-L267 PolarHBondContact O-N 2.92Å; D265-N270 WeakPolarHBondContact CB-ND2 3.18Å; D265-N270 WeakPolarHBondContact O-CB 3.23Å; D265-N270 PolarHBondContact O-ND2 3.01Å
266L76.2Confident65.2Low137 Ų137125.6 Ų125.672%0.71773%0.729SS**  trans-68.320.2175.1-71.5114.5000113.5F264F264-L266 VanDerWaalsContact C-N 3.34Å; F264-L266 WeakPolarHBondContact O-CD1 3.16Å; F264-L266 PolarHBondContact O-N 3.46Å
267L76.6Confident65.7Low103 Ų103120.1 Ų120.154%0.53971%0.712SS.*  trans-63.8140.1173.2-59.6178.5000109.3D265 S269 N270D265-L267 HydrophobicContact CB-CD1 4.49Å; D265-L267 HydrophobicContact CB-CG 4.37Å; D265-L267 PolarHBondContact O-N 2.92Å; L267-S269 PolarHBondContact O-N 3Å; L267-N270 PolarHBondContact O-N 2.97Å
268A68.1Low66.5Low89 Ų89119.6 Ų119.674%0.73671%0.709SS**G310 helixtrans-57.1-24.5-177.100000113.5N270A268-N270 VanDerWaalsContact C-N 3.34Å; A268-N270 PolarHBondContact O-N 2.96Å
269S73.8Confident67Low105 Ų105115 Ų11573%0.73470%0.702SS**G310 helixtrans-71.1-17.2175.7490000115.4L267L267-S269 PolarHBondContact O-N 3Å
270N81.2Confident67.2Low105 Ų105122.3 Ų122.356%0.56171%0.711SS**G310 helixtrans-89.9-7.2177.8-98.4-19.2000113.7D265 L267 A268D265-N270 WeakPolarHBondContact CB-ND2 3.18Å; D265-N270 WeakPolarHBondContact O-CB 3.23Å; D265-N270 PolarHBondContact O-ND2 3.01Å; L267-N270 PolarHBondContact O-N 2.97Å; A268-N270 VanDerWaalsContact C-N 3.34Å; A268-N270 PolarHBondContact O-N 2.96Å
271F84.6Confident66.7Low131 Ų131123.4 Ų123.458%0.57571%0.707SS**SBendtrans-81.4128.8170.4-68.3-89.9000108.7
272P83.1Confident66.3Low108 Ų108124.1 Ų124.170%0.70171%0.714SS**PPolyproline II helixtrans-60.7137.7176.326.1-33.7000109.4L274P272-L274 PolarHBondContact O-N 3.21Å
273P77.1Confident65.3Low107 Ų107121.8 Ų121.870%0.69571%0.71SS**PPolyproline II helixtrans-59.7130.1-176.424-33.6000110.2
274L76.6Confident64.5Low137 Ų137121.8 Ų121.872%0.71771%0.713SS**PPolyproline II helixtrans-59.7138.3-179.1-64.2178.6000110.2P272 G276 S277P272-L274 PolarHBondContact O-N 3.21Å; L274-G276 PolarHBondContact O-N 3.33Å; L274-G276 VanDerWaalsContact O-N 3.07Å; L274-S277 WeakPolarHBondContact O-CB 3.25Å; L274-S277 PolarHBondContact O-N 3.19Å
275P69.2Low63.6Low138 Ų138121.1 Ų121.190%0.89672%0.716SS**THydrogen-bonded Turntrans-53.9117177.3-27.135.3000111.6
276G64.6Low62.4Low81 Ų81123.4 Ų123.484%0.83573%0.733SS**THydrogen-bonded Turntrans102.4-8.9-175.100000115.6L274 S278L274-G276 PolarHBondContact O-N 3.33Å; L274-G276 VanDerWaalsContact O-N 3.07Å; G276-S278 PolarHBondContact O-N 3Å; G276-S278 VanDerWaalsContact O-N 3.13Å
277S56.4Low61Low75 Ų75125.1 Ų125.152%0.52474%0.742SS.*  trans-82.386.3177.7-167.20000112.2L274 S279L274-S277 WeakPolarHBondContact O-CB 3.25Å; L274-S277 PolarHBondContact O-N 3.19Å; S277-S279 PolarHBondContact O-N 3.46Å; S277-S279 VanDerWaalsContact O-N 3.11Å
278S55.8Low59.7Low116 Ų116126.7 Ų126.781%0.81175%0.746SS**  trans-79.382.5170.9-70.50000111.5G276 R280G276-S278 PolarHBondContact O-N 3Å; G276-S278 VanDerWaalsContact O-N 3.13Å; S278-R280 PolarHBondContact O-N 3.2Å
279S49.9Very low59Low109 Ų109127.3 Ų127.376%0.76274%0.737SS**  trans-71.583.617660.60000112.5S277S277-S279 PolarHBondContact O-N 3.46Å; S277-S279 VanDerWaalsContact O-N 3.11Å
280R46.8Very low58.5Low243 Ų243133.1 Ų133.192%0.91774%0.743SS**  trans-90.2113.9157-84.8-167178.3-1661.6109.8S278S278-R280 PolarHBondContact O-N 3.2Å
281M38.9Very low57Low146 Ų146135.2 Ų135.272%0.71975%0.751SS**  trans-117.6143144.4-66-126.674.700105G283M281-G283 WeakPolarHBondContact CE-O 3.42Å
282P43.5Very low55.6Low134 Ų134133.1 Ų133.187%0.8775%0.753SS**SBendcis-111.516946.539.7-35.6000114.5
283G42.6Very low54.5Low61 Ų61133.7 Ų133.763%0.62975%0.75SS**  trans104.9106.5176.900000112.2M281 L285M281-G283 WeakPolarHBondContact CE-O 3.42Å; G283-L285 PolarHBondContact O-N 2.88Å
284E49.7Very low53.6Low175 Ų175134.9 Ų134.982%0.81876%0.755SS**  trans-72.9116.1168.7175.7-177.9179.800109.6
285L47.3Very low52.7Low164 Ų164134.8 Ų134.886%0.85976%0.76SS**  trans-139.2130.9157.4-77.1-178.7000109G283 L287G283-L285 PolarHBondContact O-N 2.88Å; L285-L287 PolarHBondContact O-N 3.19Å
286V47.9Very low52.3Low127 Ų127137 Ų13777%0.7776%0.755SS**  trans-64.6118.7-176.6175.80000110E288V286-E288 VanDerWaalsContact C-N 3.31Å; V286-E288 PolarHBondContact O-N 2.96Å
287L48Very low51.7Low173 Ų173136.7 Ų136.791%0.90675%0.753SS**  trans-72.692.1163.8-75.8177.9000108.7L285 N289L285-L287 PolarHBondContact O-N 3.19Å; L287-N289 PolarHBondContact O-N 2.96Å
288E48.7Very low51.4Low137 Ų137140.1 Ų140.164%0.6477%0.77SS**  trans-52.5126.8176.5-175.8180-147.900111.2V286 R290V286-E288 VanDerWaalsContact C-N 3.31Å; V286-E288 PolarHBondContact O-N 2.96Å; E288-R290 VanDerWaalsContact C-N 3.34Å; E288-R290 PolarHBondContact O-N 3.34Å
289N52.4Low50.7Low101 Ų101144.7 Ų144.754%0.5477%0.771SS.*  trans-73.584.2-179.1178.938.8000110.6L287 M291 S292L287-N289 PolarHBondContact O-N 2.96Å; N289-M291 PolarHBondContact O-N 3.02Å; N289-M291 VanDerWaalsContact OD1-CE 3.28Å; N289-M291 WeakPolarHBondContact OD1-CE 3.35Å; N289-S292 PolarHBondContact O-N 3.44Å; N289-S292 PolarHBondContact O-OG 2.93Å
290R63.8Low50.5Low227 Ų227147.1 Ų147.186%0.85777%0.768SS**THydrogen-bonded Turntrans-64.739.3-176.2-72.6-177.4167.9-173.7-4.7116.2E288E288-R290 VanDerWaalsContact C-N 3.34Å; E288-R290 PolarHBondContact O-N 3.34Å
291M49.4Very low50.2Low149 Ų149144.2 Ų144.273%0.73476%0.764SS**THydrogen-bonded Turntrans-122.4-0.9168.9-69.4177.9-7500112.1N289N289-M291 PolarHBondContact O-N 3.02Å; N289-M291 VanDerWaalsContact OD1-CE 3.28Å; N289-M291 WeakPolarHBondContact OD1-CE 3.35Å
292S56.5Low50.7Low87 Ų87146.5 Ų146.561%0.60877%0.77SS**SBendtrans-87.7-12.4-17750.30000115.9N289N289-S292 PolarHBondContact O-N 3.44Å; N289-S292 PolarHBondContact O-OG 2.93Å
293D58.7Low50.6Low121 Ų121146.6 Ų146.665%0.64776%0.764SS**  trans-118.873.8-177.6-16319.4000113.3
294V59.9Low50.1Low132 Ų132150.8 Ų150.880%0.877%0.772SS**SBendtrans-126.221.1169.2-157.40000110.2
295V57.3Low49.8Very low135 Ų135149.6 Ų149.682%0.81877%0.766SS**SBendtrans-132.11-170-163.80000112.8
296K59.6Low49.3Very low184 Ų184150.1 Ų150.180%0.876%0.764SS**SBendtrans-123.2104.3173-85.3-171.3172.2-178.50114.5
297G53.1Low49Very low75 Ų75151.2 Ų151.277%0.77377%0.765SS**  65.997.713000000118.2Y299G297-Y299 PolarHBondContact O-N 3.3Å
298V49.8Very low48Very low146 Ų146147.9 Ų147.989%0.88575%0.752SS**  trans-55.1124.1161177.10000110.4
299Y40.1Very low46.9Very low212 Ų212148.8 Ų148.883%0.83176%0.759SS**  trans-139.399162.2-154.7-93000113.9G297G297-Y299 PolarHBondContact O-N 3.3Å
300K45.5Very low45.7Very low161 Ų161149.1 Ų149.170%0.777%0.77SS**  trans30.794.8149.4-58-56.6-173.8178.70118.5
301E42Very low44.1Very low181 Ų181143.7 Ų143.785%0.84677%0.765SS**  -46.3135129.7174.2-179.5-132.300110.7
302K48.4Very low43.5Very low195 Ų195142.4 Ų142.485%0.84877%0.768SS**  trans-161.8123.2159.9-162.5-169.6177-163.40110.1
303D41.3Very low42.2Very low136 Ų136144.5 Ų144.573%0.72778%0.777SS**  trans-68.1152.8173.6-44.6-91.9000112.3
304N31.8Very low41.1Very low149 Ų149144.6 Ų144.680%0.79778%0.784SS**  trans-153.9147.8149.4-167.4-149.8000109.8
305E43.5Very low39.6Very low149 Ų149142 Ų14270%0.69678%0.776SS**  trans-100.2165.6-166.554.3-96.177.100115.4
306E38.6Very low38.3Very low176 Ų176142.8 Ų142.882%0.82278%0.776SS**  trans76.6165157.8-159.3159-141.400119.2
307L39.9Very low37.1Very low149 Ų149141.1 Ų141.178%0.7877%0.771SS**  trans83.183.4-178.8-56.2172.7000116.1
308T27.1Very low36Very low104 Ų104145.1 Ų145.164%0.63877%0.769SS**  89.5121.170.557.40000116.1
309I26.9Very low35.1Very low156 Ų156143.6 Ų143.680%0.876%0.76SS**  trans81.4120138.1-65.5167.1000120
310S26.7Very low34.4Very low108 Ų108141.7 Ų141.776%0.75576%0.759SS**  trans70.3126.3150.8-145.10000121.5
311C29.7Very low33.4Very low112 Ų112138.9 Ų138.976%0.75776%0.759SS**  trans-65.5162.4148.4-49.90000110.4
312P37.4Very low32.7Very low122 Ų122136.4 Ų136.479%0.79276%0.756SS**  -134.5157.9121.837.3-29.4000114
313V29.6Very low31.7Very low132 Ų132132.2 Ų132.280%0.875%0.751SS**  trans-85.2146167171.60000109.3
314P34.1Very low31.2Very low123 Ų123129.5 Ų129.580%0.79975%0.748SS**  trans-115.3154.3142.635.3-28.5000111.4
315A28.9Very low31.2Very low76 Ų76130.3 Ų130.363%0.62875%0.747SS**  trans-119.3-17517900000110.8
316D30.9Very low30.6Very low152 Ų152131.2 Ų131.281%0.81375%0.751SS**  trans71.1141.9169.8-52.4-25.5000115.7
317E32.9Very low30.2Very low150 Ų150130.2 Ų130.270%0.70175%0.751SS**  cis-159.5168.1-3.3-133.8-166.7170.400112.3
318Q31.2Very low29.6Very low158 Ų158129.3 Ų129.374%0.73875%0.747SS**  trans67.6144.7160.3-61.8166.948.400117.3
319T30.2Very low29.8Very low114 Ų114131 Ų13170%0.69975%0.749SS**  cis-146.4138.86.5-31.10000112.7
320E26Very low29.9Very low172 Ų172127.9 Ų127.980%0.80474%0.741SS**  trans36.1136.8152.3-68.3-173.7117.500126.5
321C25.6Very low30.1Very low103 Ų103129 Ų12970%0.69674%0.743SS**  trans87.293133.9-81.10000124.1
322T26.3Very low30.2Very low129 Ų129129.8 Ų129.879%0.79175%0.75SS**  103122.6105.4-65.20000121.7
323S28.3Very low30Very low106 Ų106129 Ų12974%0.74175%0.747SS**  trans8792.7146.3-171.50000122.4
324A30Very low30.5Very low80 Ų80128.7 Ų128.766%0.66175%0.748SS**  91.5147.6118.600000123
325Q32.4Very low30.1Very low166 Ų166128.9 Ų128.978%0.77675%0.751SS**  trans69.6105.3160.6-71.8162.75.800117.1
326Q29.5Very low30.1Very low167 Ų167129.5 Ų129.578%0.7876%0.756SS**  73.9134.682.7-74.2-176-1700112.6
327L30.7Very low30Very low155 Ų155126.9 Ų126.981%0.81276%0.756SS**  cis-153.9164.5-5.1-116.7165.8000108.7
328N27.7Very low29.6Very low130 Ų130128.6 Ų128.670%0.69576%0.764SS**  trans-135.4168.1-175.9-165.514.6000112
329M30.8Very low29.5Very low141 Ų141128.4 Ų128.470%0.69577%0.767SS**  trans77.497.8165.8-56.5-79.871.800119.8
330S29.9Very low29.2Very low89 Ų89129.2 Ų129.262%0.62277%0.772SS**  4.3139.7119.6-46.10000121
331T30.1Very low29.3Very low132 Ų132124.8 Ų124.881%0.8177%0.765SS**  trans56.6111.4137.256.50000121.3
332S31.7Very low29.5Very low128 Ų128127.3 Ų127.390%0.89577%0.771SS**  -179.9176.1117.545.70000111.5
333S33Very low29.6Very low105 Ų105125.9 Ų125.973%0.73477%0.766SS**  trans-127.5149.1175.5164.40000109.7
334P39.8Very low29.9Very low127 Ų127127.8 Ų127.883%0.82577%0.773SS**  -134.1-150.8126.238.4-26.9000112.3
335C26Very low29.9Very low126 Ų126129.1 Ų129.185%0.85177%0.773SS**  trans-144.7169.1-156-164.80000114
336A28.7Very low29.8Very low89 Ų89128.7 Ų128.774%0.73677%0.771SS**  trans85.4134159.600000121
337A28.1Very low29.9Very low98 Ų98127.3 Ų127.381%0.8177%0.765SS**  trans53.9143.6155.200000119.4
338E25Very low29.8Very low186 Ų186126 Ų12687%0.86975%0.754SS**  cis-143.1-167.326.4-95.4-154.7100.200114.2
339L28.6Very low30.3Very low153 Ų153127.3 Ų127.380%0.80175%0.754SS**  trans-81.1-176175.6-55171.8000111.9
340T24.8Very low30.1Very low132 Ų132127.2 Ų127.281%0.8176%0.756SS**  cis-157.9167.66.2-16.40000106.3
341A28.2Very low30.1Very low79 Ų79130.1 Ų130.165%0.65376%0.764SS**  cis-134.6-136.6-0.900000108.4
342L29.4Very low30.2Very low156 Ų156130.3 Ų130.382%0.81776%0.759SS**  cis-138.3136.15.2-81.9173000106.4
343S28.1Very low30.3Very low98 Ų98132.8 Ų132.869%0.68576%0.756SS**  89.894.265.8-61.10000115.8
344T35.1Very low30.1Very low147 Ų147134.5 Ų134.590%0.90276%0.757SS**  trans-136145.3140.6-44.70000108.4
345T29.9Very low29.7Very low108 Ų108133.3 Ų133.366%0.66375%0.752SS**  trans-95.1143.1-160.737.10000114.1
346Q30.8Very low29.8Very low156 Ų156132.9 Ų132.973%0.72975%0.75SS**  65.2152.297.1-55.8176.1-5000115.4
347Q31.5Very low29.9Very low139 Ų139134.8 Ų134.865%0.6575%0.752SS**  cis-159.1179.3-0.2-130.9165.4-41.100113
348E28.3Very low30.1Very low127 Ų127139.4 Ų139.459%0.59376%0.757SS**  trans-6.2162.3149.5-75.3172.286.800121.1
349K37.6Very low30.6Very low158 Ų158138.7 Ų138.769%0.68775%0.751SS**  cis-145.1-146.320.5-136.4173.6175.478.50110.4
350D26.5Very low30.5Very low138 Ų138138.5 Ų138.574%0.73875%0.751SS**  cis-154-1614.2-138.3-32.1000114
351L30.3Very low30.6Very low151 Ų151135.4 Ų135.479%0.79175%0.745SS**  trans-119.4170.6-169.3-160.789.9000114.3
352I33.4Very low30.7Very low136 Ų136139 Ų13970%0.69775%0.753SS**  trans138.8130.9141.2-73.7167.8000116.1
353E32.3Very low30.7Very low179 Ų179137.6 Ų137.684%0.83675%0.746SS**  trans32.6154148.3-67.9174.3162.800123.4
354D28.7Very low30.9Very low142 Ų142140.6 Ų140.676%0.75975%0.749SS**  cis-168.8170.2-16.6-172.116.1000109
355S32.6Very low30.6Very low101 Ų101139.1 Ų139.171%0.70674%0.74SS**  trans172.1132.5138.4420000117.1
356S28.7Very low30.6Very low117 Ų117139.7 Ų139.782%0.81874%0.743SS**  trans64.4105.7151.959.70000120.5
357V30.3Very low30.8Very low129 Ų129139.9 Ų139.978%0.78275%0.748SS**  trans-83.4149.5166.91680000111.8
358Q31.5Very low31.3Very low196 Ų196138.4 Ų138.492%0.91675%0.75SS**  trans-146.4141.7138.4-117.4171.331.600113.3
359K34.9Very low31.4Very low170 Ų170138.9 Ų138.974%0.73976%0.762SS**  trans-85.5-178.2170.4-61.7168.4142.4-166.10109.3
360D27.9Very low31.2Very low149 Ų149136.1 Ų136.180%0.79776%0.762SS**  cis-143.5174.714.8-78-75.9000108.7
361G26.2Very low32.2Very low67 Ų67135 Ų13569%0.69176%0.763SS**  cis168.5134.7-8.400000113.8
362L31Very low33.1Very low156 Ų156133.4 Ų133.482%0.81776%0.761SS**  trans68.7146157-12273.4000122.9
363N28.6Very low32.9Very low125 Ų125132.8 Ų132.867%0.66877%0.769SS**  trans77.6134.7163.2-55.4-47.9000118.2
364Q33.2Very low32.9Very low162 Ų162130.6 Ų130.676%0.75777%0.768SS**  cis-158.1155.2-5.2-127.617774.700111.3
365T27.9Very low33.1Very low116 Ų116130 Ų13071%0.71277%0.77SS**  trans31.6135.3151.86.70000120.7
366T30.2Very low33.4Very low119 Ų119134.8 Ų134.873%0.7378%0.778SS**  cis-156.7152.725.9-560000111.7
367I34.6Very low33.8Very low161 Ų161135.1 Ų135.183%0.82678%0.777SS**  trans-123.3137.8171.8-79.3174.4000106.4
368P42.9Very low34Very low107 Ų107134.7 Ų134.770%0.69578%0.78SS**  -159.1174.792.641.6-19.4000120.1
369V29.3Very low34.3Very low137 Ų137135.5 Ų135.583%0.8377%0.774SS**  trans82.6105.6159.7-164.40000119.5
370S33.7Very low34.7Very low100 Ų100134.1 Ų134.170%0.69977%0.77SS**  trans-106.4-175.8141.466.80000107.5
371P47.4Very low35.7Very low115 Ų115132.8 Ų132.875%0.74777%0.77SS**  cis-137.4-127.41332.6-5.3000113.3
372P49.6Very low37.4Very low117 Ų117141 Ų14176%0.7678%0.78SS**  -119.6167.5-83.231.1-14.4000115.1
373S29.1Very low38.7Very low123 Ų123143.4 Ų143.486%0.8678%0.784SS**  trans-154.8124.815064.50000113.8
374T33.3Very low40.5Very low133 Ų133143.4 Ų143.482%0.81678%0.783SS**  trans-78.4134.3177-62.80000112.4
375T31.4Very low42.4Very low130 Ų130138.8 Ų138.880%0.79877%0.769SS**  trans-172.9143.3134.113.40000113.4
376K39.8Very low44.2Very low202 Ų202142.3 Ų142.388%0.87877%0.771SS**  trans-88.6144.4152.5-66.7177179.61750108
377P36.2Very low46Very low124 Ų124139.7 Ų139.781%0.80576%0.761SS**  trans-133.8154.113336.6-27.7000113
378S36.3Very low47.7Very low119 Ų119137.1 Ų137.183%0.83275%0.746SS**  trans-94.4122.9168.3175.70000109.8
379R37.7Very low48.8Very low213 Ų213137 Ų13780%0.80474%0.743SS**  trans-170.2142.7150.8-117.4175.7147.1109.61.1114.7
380E41.3Very low50.8Low141 Ų141134.1 Ų134.166%0.65973%0.728SS**  trans62.2138.4150.9-74.4162.9-142.600121R382E380-R382 PolarHBondContact O-N 3.49Å
381P50.3Low52.6Low122 Ų122136.5 Ų136.579%0.79273%0.728SS**  trans-72.1127.1173.230.7-33.2000110.2K383P381-K383 PolarHBondContact O-N 3.06Å
382R62.2Low53Low239 Ų239140.4 Ų140.490%0.90273%0.733SS**  trans-60.4126.6177-67.7-177.5178.4125.71110.2E380 L384E380-R382 PolarHBondContact O-N 3.49Å; R382-L384 PolarHBondContact O-N 2.9Å
383K57.3Low53.7Low207 Ų207140.2 Ų140.290%0.973%0.732SS**  trans-68.3112.1170.4-64.3173.4-175.6171.30107.7P381P381-K383 PolarHBondContact O-N 3.06Å
384L67.6Low55Low124 Ų124140.4 Ų140.465%0.64973%0.73SS**  trans-58.7140.3174.8-66.8171.7000110.1R382 E388 V389R382-L384 PolarHBondContact O-N 2.9Å; L384-E388 WeakPolarHBondContact CA-OE2 3.43Å; L384-V389 HydrophobicContact CB-CG2 4.37Å
385S72.8Confident55.6Low65 Ų65143.9 Ų143.946%0.45573%0.734SS.*  trans-67.5146.5175.1-177.70000110.4A387 E388 V389S385-A387 PolarHBondContact O-N 3.38Å; S385-A387 VanDerWaalsContact O-N 3.14Å; S385-E388 WeakPolarHBondContact CB-OE2 3.5Å; S385-E388 PolarHBondContact N-OE2 3.46Å; S385-E388 WeakPolarHBondContact O-CB 3.37Å; S385-E388 PolarHBondContact O-N 2.99Å; S385-V389 PolarHBondContact O-N 2.83Å
386Y65.5Low55.9Low190 Ų190146.4 Ų146.475%0.74574%0.737SS**Hα-helixtrans-56.3-32.5176.9-170.2-96.8000112E388 V389 C390Y386-E388 VanDerWaalsContact C-N 3.28Å; Y386-E388 PolarHBondContact O-N 3.02Å; Y386-V389 PolarHBondContact O-N 3.44Å; Y386-C390 PolarHBondContact O-N 2.61Å; Y386-C390 PolarHBondContact O-SG 3.35Å
387A67.4Low56.2Low65 Ų65142.7 Ų142.754%0.53773%0.733SS.*Hα-helixtrans-66.7-23175.600000114.3S385 Q391S385-A387 PolarHBondContact O-N 3.38Å; S385-A387 VanDerWaalsContact O-N 3.14Å; A387-Q391 WeakPolarHBondContact O-CG 3.23Å
388E70.1Confident56.1Low107 Ų107142 Ų14250%0.573%0.731SS.*Hα-helixtrans-82.8-38.5176.5-6217212100110.6L384 S385 Y386 C390 Q391L384-E388 WeakPolarHBondContact CA-OE2 3.43Å; S385-E388 WeakPolarHBondContact CB-OE2 3.5Å; S385-E388 PolarHBondContact N-OE2 3.46Å; S385-E388 WeakPolarHBondContact O-CB 3.37Å; S385-E388 PolarHBondContact O-N 2.99Å; Y386-E388 VanDerWaalsContact C-N 3.28Å; Y386-E388 PolarHBondContact O-N 3.02Å; E388-C390 VanDerWaalsContact C-N 3.29Å; E388-C390 PolarHBondContact O-N 3.36Å; E388-Q391 PolarHBondContact O-N 2.73Å
389V66.5Low56.1Low104 Ų104142.1 Ų142.163%0.6373%0.732SS**Hα-helixtrans-67.5-28.2178.9-178.40000112.5L384 S385 Y386L384-V389 HydrophobicContact CB-CG2 4.37Å; S385-V389 PolarHBondContact O-N 2.83Å; Y386-V389 PolarHBondContact O-N 3.44Å
390C71.2Confident56Low77 Ų77137.8 Ų137.852%0.5273%0.729SS.*THydrogen-bonded Turntrans-83.9-4.4-179.5-70.20000115.2Y386 E388 K392Y386-C390 PolarHBondContact O-N 2.61Å; Y386-C390 PolarHBondContact O-SG 3.35Å; E388-C390 VanDerWaalsContact C-N 3.29Å; E388-C390 PolarHBondContact O-N 3.36Å; C390-K392 PolarHBondContact O-N 3.33Å
391Q71Confident55.8Low149 Ų149138.7 Ų138.770%0.69674%0.738SS**  trans-77.8114.1178.6-64.1-169.441.400111.2A387 E388A387-Q391 WeakPolarHBondContact O-CG 3.23Å; E388-Q391 PolarHBondContact O-N 2.73Å
392K55.7Low55.2Low197 Ų197138.4 Ų138.486%0.85773%0.733SS**PPolyproline II helixtrans-67.4132.7166.1-75.9175.8177.3168.90108.9C390C390-K392 PolarHBondContact O-N 3.33Å
393P65.9Low54.2Low114 Ų114134.7 Ų134.774%0.7473%0.726SS**PPolyproline II helixtrans-60.2145.7170.626.1-33.7000110.2
394P56Low53.5Low126 Ų126130.9 Ų130.982%0.81872%0.723SS**PPolyproline II helixtrans-53.7145.4172.5-26.835.8000111.9E396P394-E396 PolarHBondContact O-N 3.18Å
395K44.8Very low52.1Low207 Ų207131.8 Ų131.890%0.973%0.727SS**  trans-91.798.7-174.3-168.4175.8-176-178.70110.1
396E38.9Very low50.6Low182 Ų182139.2 Ų139.285%0.8575%0.746SS**PPolyproline II helixtrans-57.6136.6175.6-64.8-175.4150.900111.5P394P394-E396 PolarHBondContact O-N 3.18Å
397P44.8Very low49.5Very low124 Ų124138.8 Ų138.881%0.80575%0.751SS**PPolyproline II helixtrans-76.2140.8173.831.5-33.4000110.7S399P397-S399 PolarHBondContact O-N 3.41Å
398S35.1Very low48Very low109 Ų109141.4 Ų141.476%0.76276%0.755SS**PPolyproline II helixtrans-66.5125.8-179.554.50000112.3V400S398-V400 PolarHBondContact O-N 2.76Å
399S36Very low46.6Very low122 Ų122147.2 Ų147.285%0.85377%0.772SS**PPolyproline II helixtrans-66.8126.2165.946.30000110.5P397P397-S399 PolarHBondContact O-N 3.41Å
400V35.1Very low45.1Very low123 Ų123147.3 Ų147.375%0.74578%0.777SS**PPolyproline II helixtrans-83.7118.9-179176.70000109.5S398 V402S398-V400 PolarHBondContact O-N 2.76Å; V400-V402 PolarHBondContact O-N 2.89Å
401L37.5Very low43.4Very low160 Ų160151.5 Ų151.584%0.83880%0.795SS**  trans-82.4110.6170.3-161.1163.3000109
402V37.3Very low41.6Very low115 Ų115151 Ų15170%0.69780%0.801SS**PPolyproline II helixtrans-77.6131.2-176.1175.10000111.2V400V400-V402 PolarHBondContact O-N 2.89Å
403Q42.3Very low40.5Very low161 Ų161147.5 Ų147.575%0.75280%0.796SS**PPolyproline II helixtrans-85.5137.4165.9-67.2-178.1-1400111
404P42.7Very low39Very low128 Ų128147.2 Ų147.283%0.83180%0.797SS**PPolyproline II helixtrans-88.8139.2145.833.1-27.7000110.2
405L38.3Very low38.5Very low142 Ų142147 Ų14774%0.74380%0.795SS**  trans-136.1150.5174.9176.764.7000108.8
406R40.3Very low38.1Very low222 Ų222143.1 Ų143.184%0.83879%0.789SS**  trans87.5147.5-169.1-50.8156.2-166.2-165.93.8111.1
407E42.4Very low37.9Very low181 Ų181144.2 Ų144.285%0.84679%0.791SS**  cis-120.1-159.58.8-78.8-164.7135.500113.4
408L36.6Very low37.3Very low119 Ų119144.4 Ų144.462%0.62379%0.786SS**  -162.9111.3-81.8-177.2129.4000111.3
409R39.4Very low37.2Very low230 Ų230147.4 Ų147.487%0.86879%0.787SS**  trans68.7148.7-179.1-51.1-178.1-166.5179.97113.4
410S34.8Very low37.1Very low106 Ų106147.7 Ų147.774%0.74178%0.779SS**  cis-158.3165.549.851.50000114.7
411N35.5Very low36.8Very low165 Ų165148.8 Ų148.888%0.88278%0.781SS**  trans-107.8127.5168.1-67.3-56.6000109.4
412V33.9Very low36.4Very low138 Ų138145.3 Ų145.384%0.83678%0.784SS**  trans-145156.9162.9-173.70000108.6
413V32.5Very low36Very low124 Ų124144.4 Ų144.475%0.75279%0.788SS**  trans-132.1142.8-168.5159.20000111.8
414S33.6Very low36.2Very low108 Ų108142.2 Ų142.276%0.75579%0.788SS**  trans68.4172.6163.980.50000116.3
415P46Very low35.7Very low120 Ų120143.5 Ų143.578%0.77978%0.783SS**  cis-133.3-179.1542.8-25.2000117.1
416T37.8Very low35.3Very low126 Ų126144 Ų14477%0.77379%0.787SS**  trans-79.4154.6171.749.20000114
417K33.9Very low35Very low205 Ų205138.7 Ų138.789%0.89178%0.783SS**  trans-164.8175.1148.8-108.7161.3-170.3-1740112.2
418N31.4Very low34.6Very low129 Ų129136.5 Ų136.569%0.6978%0.782SS**  trans-110.9-180-158.9-48.3-13.8000114.6
419E32.7Very low34.3Very low171 Ų171139.4 Ų139.480%0.79979%0.793SS**  trans71.8147147.3-78.4156.591.300117.1
420D34.3Very low34.2Very low128 Ų128137.6 Ų137.668%0.68479%0.791SS**  cis-165.8174.9-8.1178.3-141.7000110.1
421N29.9Very low34.7Very low146 Ų146137.7 Ų137.778%0.78179%0.789SS**  trans88.4125.9165-63.4-85.3000119.6
422G29.4Very low34.4Very low87 Ų87137.6 Ų137.690%0.89778%0.783SS**  trans152.977.7169.500000115.7
423A28.2Very low34.2Very low96 Ų96138.7 Ų138.779%0.79378%0.779SS**  trans-136.1173.4173.400000108.8
424P47Very low34.3Very low116 Ų116140.7 Ų140.775%0.75378%0.778SS**  cis-113.2-149.65.123.62.7000110.5
425E31Very low34.8Very low154 Ų154141.8 Ų141.872%0.7278%0.783SS**  cis-151.114212.3-65.7176.2170.900112.3
426N31.3Very low33.9Very low153 Ų153144 Ų14482%0.81878%0.783SS**  171.1143.7112.4-98.7-82.8000111.3
427S32.5Very low33.7Very low110 Ų110142.2 Ų142.277%0.76978%0.78SS**  trans-151.8139.6-170.558.30000113.3
428V34.6Very low33.7Very low136 Ų136144.3 Ų144.382%0.82478%0.782SS**  trans-178.4143.8159.8135.90000106.8
429E29.7Very low33.6Very low179 Ų179142.8 Ų142.884%0.83679%0.787SS**  cis-153.7-168.3-31.8-148.1176.4138.500108.8
430K37.6Very low33.6Very low192 Ų192139.8 Ų139.884%0.83579%0.785SS**  trans-118.4-171.1-171.6-102178.5-177.4175.70110.1
431P45.2Very low33.6Very low109 Ų109142.5 Ų142.571%0.70879%0.791SS**  cis-135.8-169.3-30.933-12.2000113.7
432H30Very low33.7Very low163 Ų163141 Ų14176%0.75578%0.783SS**  trans69.4164.6150.3-10814.4000118.8
433E30.1Very low33.9Very low160 Ų160146.4 Ų146.475%0.74878%0.778SS**  cis-146.9-179-4.9-154.4166.1164.400111.2
434K34.3Very low34.3Very low166 Ų166146.8 Ų146.872%0.72277%0.774SS**  trans-78.5159170.7-90.3-171.6170-168.70112.5
435P43.1Very low33.7Very low132 Ų132144.8 Ų144.886%0.85778%0.775SS**  -141.7-173.4105.837.8-23.7000114.4
436E28.7Very low33.9Very low167 Ų167146.7 Ų146.778%0.7878%0.781SS**  trans-118.3157.1-173.2-69.8-176.194.600115.5
437A32.8Very low34.2Very low87 Ų87151 Ų15172%0.71979%0.786SS**  trans83.9144.7142.900000122.4
438R33.5Very low34.2Very low250 Ų250148 Ų14894%0.94377%0.772SS**  trans76.8142.6170.5-51.9-179.9-178.6133.51.7115.1
439A30.7Very low34.1Very low96 Ų96148.7 Ų148.779%0.79377%0.772SS**  cis-133.9159.86.300000114.1
440S31.7Very low34.3Very low108 Ų108147 Ų14776%0.75577%0.767SS**  trans-46.7141178.149.80000117.9
441K33.5Very low34.7Very low186 Ų186145.4 Ų145.481%0.80977%0.766SS**  -151.2117.9115.8-154.9156.2-170.5168.90113.7
442D33.7Very low35Very low115 Ų115145.4 Ų145.462%0.61577%0.766SS**  trans13.9136.1139.1-44.9-42.1000119.3
443Y33.1Very low35.4Very low200 Ų200149.5 Ų149.578%0.78478%0.775SS**  cis-153.5136.4-2.9-129.5-117.4000104.9
444S36.1Very low35.3Very low103 Ų103145.7 Ų145.772%0.7278%0.778SS**  53.113377.8167.20000113.5
445G33.9Very low35.3Very low74 Ų74142.5 Ų142.576%0.76378%0.783SS**  cis-138.3156.327.100000117.5
446F36.3Very low35Very low194 Ų194140.1 Ų140.185%0.85177%0.774SS**  trans-108.9153.2-177.7-152.8-92.1000109.8
447R36.8Very low35.8Very low243 Ų243136 Ų13692%0.91778%0.776SS**  trans-171.1128.2144.9-87.1-136.7-94.8-87.26.1107.8
448G31.8Very low36.2Very low47 Ų47140.7 Ų140.749%0.48578%0.78SS.*  cis80.8129.111.200000111.6
449N33.6Very low36.8Very low151 Ų151137.2 Ų137.281%0.80778%0.779SS**  cis-158.8161.83.2-161.82.5000106.2
450I34.7Very low37.1Very low144 Ų144143.9 Ų143.974%0.73878%0.783SS**  172.215585.7-74.8-174.1000107.5
451I44.2Very low37.9Very low158 Ų158147 Ų14781%0.8179%0.786SS**  trans-128.6138.6178.1-72.6166.2000108.3
452P51.8Low38.2Very low109 Ų109145.1 Ų145.171%0.70878%0.78SS**  -158.8149.1105.339.3-18.5000120.6
453R38.1Very low38.7Very low250 Ų250148.6 Ų148.694%0.94379%0.785SS**  trans53129.6140.3-70.7-174.9171-166.5-1.7122.7
454G29.1Very low39.1Very low80 Ų80147.1 Ų147.183%0.82578%0.778SS**  trans119.8143148.300000114.8
455A33.6Very low39.4Very low98 Ų98149.1 Ų149.181%0.8178%0.776SS**  cis-160.2163.3-11.100000111.9
456A37.5Very low39.6Very low83 Ų83153.8 Ų153.869%0.68678%0.775SS**  trans4299154.300000119.9K458A456-K458 PolarHBondContact O-N 3.05Å
457G45.1Very low39.7Very low79 Ų79149.7 Ų149.781%0.81477%0.771SS**  trans-66.1125.4158.300000112
458K42.3Very low39.8Very low186 Ų186147.1 Ų147.181%0.80977%0.769SS**  trans-145.460175.6-64.9-67.8-178.11790111.3A456 R460A456-K458 PolarHBondContact O-N 3.05Å; K458-R460 PolarHBondContact O-N 3.14Å
459I46.2Very low40.1Very low178 Ų178156.5 Ų156.591%0.91379%0.789SS**  trans-68.3103.4169.2-60.8-178.8000107.5E461I459-E461 PolarHBondContact O-N 3.2Å
460R37.1Very low40.3Very low235 Ų235153.9 Ų153.989%0.88779%0.789SS**  trans-64.8123.6-171.9-177.2175.4179.4133.3-4.6110.7K458 Q462K458-R460 PolarHBondContact O-N 3.14Å; R460-Q462 PolarHBondContact O-N 2.95Å
461E47.3Very low40.6Very low175 Ų175154 Ų15482%0.81879%0.789SS**  trans-55.6100.9174-174.4-175.3171.100110.7I459 R463I459-E461 PolarHBondContact O-N 3.2Å; E461-R463 VanDerWaalsContact C-N 3.26Å; E461-R463 PolarHBondContact O-N 3.3Å
462Q39.4Very low40.4Very low146 Ų146152.4 Ų152.468%0.68279%0.789SS**  trans-79.180.8175.1-167.2-178.348.100109.5R460 R464R460-Q462 PolarHBondContact O-N 2.95Å; Q462-R464 VanDerWaalsContact C-N 3.35Å; Q462-R464 PolarHBondContact O-N 3.4Å; Q462-R464 VanDerWaalsContact OE1-NH2 3.1Å
463R44.5Very low39.9Very low188 Ų188156 Ų15671%0.70980%0.797SS**  trans-41.989.1167.2-178.7-172.5-178-1287.6111.8E461 Q465E461-R463 VanDerWaalsContact C-N 3.26Å; E461-R463 PolarHBondContact O-N 3.3Å; R463-Q465 PolarHBondContact O-N 3.03Å
464R42.1Very low39.7Very low168 Ų168147.4 Ų147.463%0.63479%0.786SS**  trans-84.699.4169-74-173.9-176.9-99.3-9.4108.7Q462 F466Q462-R464 VanDerWaalsContact C-N 3.35Å; Q462-R464 PolarHBondContact O-N 3.4Å; Q462-R464 VanDerWaalsContact OE1-NH2 3.1Å; R464-F466 HydrophobicContact CB-CD2 3.95Å; R464-F466 HydrophobicContact CB-CE2 3.73Å; R464-F466 HydrophobicContact CB-CZ 4.46Å; R464-F466 HydrophobicContact CG-CE2 4.45Å; R464-F466 PolarHBondContact O-N 3.36Å
465Q42.5Very low40Very low145 Ų145150.5 Ų150.568%0.67879%0.788SS**  trans-65.5102.1157.9-69.3-172-63.700107.6R463 S467R463-Q465 PolarHBondContact O-N 3.03Å; Q465-S467 PolarHBondContact O-N 2.78Å
466F37.8Very low40.3Very low172 Ų172151.9 Ų151.975%0.75479%0.787SS**  trans-80102.2168.5-84.3-77.5000108.5R464R464-F466 HydrophobicContact CB-CD2 3.95Å; R464-F466 HydrophobicContact CB-CE2 3.73Å; R464-F466 HydrophobicContact CB-CZ 4.46Å; R464-F466 HydrophobicContact CG-CE2 4.45Å; R464-F466 PolarHBondContact O-N 3.36Å
467S39.2Very low40.5Very low108 Ų108159 Ų15976%0.75580%0.796SS**  trans-53.5140.4171.6-54.70000110.9Q465 R469Q465-S467 PolarHBondContact O-N 2.78Å; S467-R469 PolarHBondContact O-N 2.93Å
468H38.9Very low40.5Very low190 Ų190166.6 Ų166.688%0.8880%0.8SS**  trans-35.8124.1-174-53-89000114.9
469R37.3Very low40.5Very low243 Ų243165.4 Ų165.492%0.91780%0.803SS**PPolyproline II helixtrans-78130.6161.8-139-178.7-163.8-159.13.9108.3S467 I471S467-R469 PolarHBondContact O-N 2.93Å; R469-I471 PolarHBondContact O-N 2.93Å
470A38Very low40.1Very low97 Ų97159.7 Ų159.780%0.80279%0.787SS**PPolyproline II helixtrans-60.6133.8-179.100000111.8
471I41.3Very low40.8Very low145 Ų145158.9 Ų158.974%0.74479%0.79SS**PPolyproline II helixtrans-81.3129.6171-60.9167.3000107.6R469 Q473R469-I471 PolarHBondContact O-N 2.93Å; I471-Q473 PolarHBondContact O-N 3.37Å
472P39.6Very low40.9Very low125 Ų125159.3 Ų159.381%0.81279%0.792SS**  trans-67.4102.216428.6-31.4000108.1
473Q40.9Very low41.5Very low186 Ų186160.8 Ų160.887%0.86980%0.799SS**PPolyproline II helixtrans-63.1144-179.6-71.2-172.8-14.300110.9I471I471-Q473 PolarHBondContact O-N 3.37Å
474G34.9Very low41.2Very low69 Ų69163.2 Ų163.271%0.71181%0.81SS**PPolyproline II helixtrans-73.4149.1-170.800000113.8T476G474-T476 PolarHBondContact O-N 3.43Å
475V35.3Very low41.9Very low144 Ų144160.7 Ų160.787%0.87381%0.813SS**PPolyproline II helixtrans-64.3130.2166.7178.80000109.1R477V475-R477 PolarHBondContact O-N 3.27Å
476T39.3Very low42.7Very low127 Ų127158.9 Ų158.978%0.77981%0.814SS**PPolyproline II helixtrans-64.7120.2-17539.50000112.1G474 R478G474-T476 PolarHBondContact O-N 3.43Å; T476-R478 PolarHBondContact O-N 2.97Å
477R41.9Very low43.7Very low232 Ų232156.8 Ų156.888%0.87582%0.817SS**  trans-7397.9165.2-74.6-168177.4-132.90.3109.2V475 N479V475-R477 PolarHBondContact O-N 3.27Å; R477-N479 PolarHBondContact O-N 3.43Å
478R45.5Very low44.3Very low240 Ų240163.2 Ų163.291%0.90683%0.825SS**  trans-59.5116.9166.153.6-177.8177.1174.50.6109.6T476 G480T476-R478 PolarHBondContact O-N 2.97Å; R478-G480 PolarHBondContact O-N 3.36Å; R478-G480 VanDerWaalsContact O-N 3.16Å
479N41.8Very low44.7Very low161 Ų161159.4 Ų159.486%0.86182%0.82SS**  trans-84.983.3-178.8-69.5-33000110.3R477R477-N479 PolarHBondContact O-N 3.43Å
480G38Very low45.9Very low57 Ų57154 Ų15459%0.58882%0.817SS**  trans-96.3120.8171.700000111.5R478 E482R478-G480 PolarHBondContact O-N 3.36Å; R478-G480 VanDerWaalsContact O-N 3.16Å; G480-E482 VanDerWaalsContact C-N 3.33Å; G480-E482 PolarHBondContact O-N 3.38Å
481K52.1Low46.3Very low218 Ų218162.7 Ų162.795%0.94884%0.836SS**  trans-84.177.5166.9-72.7-175.2179.4179.70109.1
482E48.9Very low46.5Very low184 Ų184163.6 Ų163.686%0.8684%0.841SS**  trans-84125.7176.8-74.2175-148.700110.7G480G480-E482 VanDerWaalsContact C-N 3.33Å; G480-E482 PolarHBondContact O-N 3.38Å
483Q51.1Low46.9Very low178 Ų178165.6 Ų165.683%0.83284%0.842SS**  trans-86.9122.6-167.8-173.2171.1-6.400109.9V485Q483-V485 PolarHBondContact O-N 2.75Å
484Y38.8Very low47.2Very low238 Ų238164.4 Ų164.493%0.93384%0.841SS**  trans-67.8107.2-175.2-124.9-100.7000111
485V56.1Low48Very low115 Ų115170.1 Ų170.170%0.69785%0.848SS**  trans-121.3122169.8-178.40000107.6Q483Q483-V485 PolarHBondContact O-N 2.75Å
486P59.3Low48.8Very low107 Ų107171.7 Ų171.770%0.69585%0.847SS**PPolyproline II helixtrans-72.2143.8179.829.8-34.2000110.9
487P60Low49.4Very low128 Ų128174.7 Ų174.783%0.83185%0.851SS**PPolyproline II helixtrans-66.6135.2175.928.2-34000110.5
488R52.1Low49.9Very low244 Ų244170.6 Ų170.692%0.92185%0.849SS**PPolyproline II helixtrans-69.7139.8166.1-91.1-176165.7-173.9-4109.8
489S47.4Very low50.3Low109 Ų109165.2 Ų165.276%0.76285%0.845SS**PPolyproline II helixtrans-63.7151.1169.132.40000111.5
490P61Low51Low131 Ų131165.6 Ų165.685%0.85184%0.844SS**PPolyproline II helixtrans-69.7156.8-179.130.5-36.2000112
491K47Very low52.1Low278 Ų278175.5 Ų175.5100%1.20987%0.867SS**  trans-149.80172.3-151.4-178.5-172.4-174.30109.3

Retrieved 491 of 491 residues in 58.1 ms (Link to these results)