Starting phenix.real_space_refine (version: 1.21rc1) on Thu Apr 27 13:42:55 2023 by dcliebschner =============================================================================== Processing files: ------------------------------------------------------------------------------- Found model, /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384_updated.pdb Found real_map, /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384.map Processing PHIL parameters: ------------------------------------------------------------------------------- Adding command-line PHIL: ------------------------- refinement.macro_cycles=10 scattering_table=electron resolution=2.96 write_initial_geo_file=False Final processed PHIL parameters: ------------------------------------------------------------------------------- data_manager { real_map_files = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384.map" default_real_map = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384.map" model { file = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384_updated.pdb" } default_model = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7lis_23384/04_2023/7lis_23384_updated.pdb" } resolution = 2.96 write_initial_geo_file = False refinement { macro_cycles = 10 } Starting job =============================================================================== ------------------------------------------------------------------------------- Citation: ********* Afonine PV, Poon BK, Read RJ, Sobolev OV, Terwilliger TC, Urzhumtsev A, Adams PD. (2018) Real-space refinement in PHENIX for cryo-EM and crystallography. Acta Cryst. D74:531-544. Validating inputs ------------------------------------------------------------------------------- Processing inputs ***************** Set random seed Set to: 0 Set model cs if undefined Decide on map wrapping Map wrapping is set to: False Normalize map: mean=0, sd=1 Input map: mean= 0.003 sd= 0.191 Set stop_for_unknowns flag Set to: True Assert model is a single copy model Assert all atoms have isotropic ADPs Construct map_model_manager Extract box with map and model Check model and map are aligned Set scattering table Set to: electron Number of scattering types: 4 Type Number sf(0) Gaussians S 240 5.16 5 C 82560 2.51 5 N 21420 2.21 5 O 24660 1.98 5 sf(0) = scattering factor at diffraction angle 0. Process input model Symmetric amino acids flipped Residue "A PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A GLU 13": "OE1" <-> "OE2" Residue "A GLU 18": "OE1" <-> "OE2" Residue "A TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A GLU 63": "OE1" <-> "OE2" Residue "A PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A GLU 93": "OE1" <-> "OE2" Residue "A GLU 105": "OE1" <-> "OE2" Residue "A PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A GLU 140": "OE1" <-> "OE2" Residue "A PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "A ASP 207": "OD1" <-> "OD2" Residue "A ASP 225": "OD1" <-> "OD2" Residue "A PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B GLU 13": "OE1" <-> "OE2" Residue "B GLU 18": "OE1" <-> "OE2" Residue "B TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B GLU 63": "OE1" <-> "OE2" Residue "B PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B GLU 93": "OE1" <-> "OE2" Residue "B GLU 105": "OE1" <-> "OE2" Residue "B PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B GLU 140": "OE1" <-> "OE2" Residue "B PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "B ASP 207": "OD1" <-> "OD2" Residue "B ASP 225": "OD1" <-> "OD2" Residue "B PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C GLU 13": "OE1" <-> "OE2" Residue "C GLU 18": "OE1" <-> "OE2" Residue "C TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C GLU 63": "OE1" <-> "OE2" Residue "C PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C GLU 93": "OE1" <-> "OE2" Residue "C GLU 105": "OE1" <-> "OE2" Residue "C PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C GLU 140": "OE1" <-> "OE2" Residue "C PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "C ASP 207": "OD1" <-> "OD2" Residue "C ASP 225": "OD1" <-> "OD2" Residue "C PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D GLU 13": "OE1" <-> "OE2" Residue "D GLU 18": "OE1" <-> "OE2" Residue "D TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D GLU 63": "OE1" <-> "OE2" Residue "D PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D GLU 93": "OE1" <-> "OE2" Residue "D GLU 105": "OE1" <-> "OE2" Residue "D PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D GLU 140": "OE1" <-> "OE2" Residue "D PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "D ASP 207": "OD1" <-> "OD2" Residue "D ASP 225": "OD1" <-> "OD2" Residue "D PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E GLU 13": "OE1" <-> "OE2" Residue "E GLU 18": "OE1" <-> "OE2" Residue "E TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E GLU 63": "OE1" <-> "OE2" Residue "E PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E GLU 93": "OE1" <-> "OE2" Residue "E GLU 105": "OE1" <-> "OE2" Residue "E PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E GLU 140": "OE1" <-> "OE2" Residue "E PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "E ASP 207": "OD1" <-> "OD2" Residue "E ASP 225": "OD1" <-> "OD2" Residue "E PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F GLU 13": "OE1" <-> "OE2" Residue "F GLU 18": "OE1" <-> "OE2" Residue "F TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F GLU 63": "OE1" <-> "OE2" Residue "F PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F GLU 93": "OE1" <-> "OE2" Residue "F GLU 105": "OE1" <-> "OE2" Residue "F PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F GLU 140": "OE1" <-> "OE2" Residue "F PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "F ASP 207": "OD1" <-> "OD2" Residue "F ASP 225": "OD1" <-> "OD2" Residue "F PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G GLU 13": "OE1" <-> "OE2" Residue "G GLU 18": "OE1" <-> "OE2" Residue "G TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G GLU 63": "OE1" <-> "OE2" Residue "G PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G GLU 93": "OE1" <-> "OE2" Residue "G GLU 105": "OE1" <-> "OE2" Residue "G PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G GLU 140": "OE1" <-> "OE2" Residue "G PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "G ASP 207": "OD1" <-> "OD2" Residue "G ASP 225": "OD1" <-> "OD2" Residue "G PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H GLU 13": "OE1" <-> "OE2" Residue "H GLU 18": "OE1" <-> "OE2" Residue "H TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H GLU 63": "OE1" <-> "OE2" Residue "H PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H GLU 93": "OE1" <-> "OE2" Residue "H GLU 105": "OE1" <-> "OE2" Residue "H PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H GLU 140": "OE1" <-> "OE2" Residue "H PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "H ASP 207": "OD1" <-> "OD2" Residue "H ASP 225": "OD1" <-> "OD2" Residue "H PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I GLU 13": "OE1" <-> "OE2" Residue "I GLU 18": "OE1" <-> "OE2" Residue "I TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I GLU 63": "OE1" <-> "OE2" Residue "I PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I GLU 93": "OE1" <-> "OE2" Residue "I GLU 105": "OE1" <-> "OE2" Residue "I PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I GLU 140": "OE1" <-> "OE2" Residue "I PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "I ASP 207": "OD1" <-> "OD2" Residue "I ASP 225": "OD1" <-> "OD2" Residue "I PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J GLU 13": "OE1" <-> "OE2" Residue "J GLU 18": "OE1" <-> "OE2" Residue "J TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J GLU 63": "OE1" <-> "OE2" Residue "J PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J GLU 93": "OE1" <-> "OE2" Residue "J GLU 105": "OE1" <-> "OE2" Residue "J PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J GLU 140": "OE1" <-> "OE2" Residue "J PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "J ASP 207": "OD1" <-> "OD2" Residue "J ASP 225": "OD1" <-> "OD2" Residue "J PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K GLU 13": "OE1" <-> "OE2" Residue "K GLU 18": "OE1" <-> "OE2" Residue "K TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K GLU 63": "OE1" <-> "OE2" Residue "K PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K GLU 93": "OE1" <-> "OE2" Residue "K GLU 105": "OE1" <-> "OE2" Residue "K PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K GLU 140": "OE1" <-> "OE2" Residue "K PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "K ASP 207": "OD1" <-> "OD2" Residue "K ASP 225": "OD1" <-> "OD2" Residue "K PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L GLU 13": "OE1" <-> "OE2" Residue "L GLU 18": "OE1" <-> "OE2" Residue "L TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L GLU 63": "OE1" <-> "OE2" Residue "L PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L GLU 93": "OE1" <-> "OE2" Residue "L GLU 105": "OE1" <-> "OE2" Residue "L PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L GLU 140": "OE1" <-> "OE2" Residue "L PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "L ASP 207": "OD1" <-> "OD2" Residue "L ASP 225": "OD1" <-> "OD2" Residue "L PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M GLU 13": "OE1" <-> "OE2" Residue "M GLU 18": "OE1" <-> "OE2" Residue "M TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M GLU 63": "OE1" <-> "OE2" Residue "M PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M GLU 93": "OE1" <-> "OE2" Residue "M GLU 105": "OE1" <-> "OE2" Residue "M PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M GLU 140": "OE1" <-> "OE2" Residue "M PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "M ASP 207": "OD1" <-> "OD2" Residue "M ASP 225": "OD1" <-> "OD2" Residue "M PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N GLU 13": "OE1" <-> "OE2" Residue "N GLU 18": "OE1" <-> "OE2" Residue "N TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N GLU 63": "OE1" <-> "OE2" Residue "N PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N GLU 93": "OE1" <-> "OE2" Residue "N GLU 105": "OE1" <-> "OE2" Residue "N PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N GLU 140": "OE1" <-> "OE2" Residue "N PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "N ASP 207": "OD1" <-> "OD2" Residue "N ASP 225": "OD1" <-> "OD2" Residue "N PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O GLU 13": "OE1" <-> "OE2" Residue "O GLU 18": "OE1" <-> "OE2" Residue "O TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O GLU 63": "OE1" <-> "OE2" Residue "O PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O GLU 93": "OE1" <-> "OE2" Residue "O GLU 105": "OE1" <-> "OE2" Residue "O PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O GLU 140": "OE1" <-> "OE2" Residue "O PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "O ASP 207": "OD1" <-> "OD2" Residue "O ASP 225": "OD1" <-> "OD2" Residue "O PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P GLU 13": "OE1" <-> "OE2" Residue "P GLU 18": "OE1" <-> "OE2" Residue "P TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P GLU 63": "OE1" <-> "OE2" Residue "P PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P GLU 93": "OE1" <-> "OE2" Residue "P GLU 105": "OE1" <-> "OE2" Residue "P PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P GLU 140": "OE1" <-> "OE2" Residue "P PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "P ASP 207": "OD1" <-> "OD2" Residue "P ASP 225": "OD1" <-> "OD2" Residue "P PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q GLU 13": "OE1" <-> "OE2" Residue "Q GLU 18": "OE1" <-> "OE2" Residue "Q TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q GLU 63": "OE1" <-> "OE2" Residue "Q PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q GLU 93": "OE1" <-> "OE2" Residue "Q GLU 105": "OE1" <-> "OE2" Residue "Q PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q GLU 140": "OE1" <-> "OE2" Residue "Q PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Q ASP 207": "OD1" <-> "OD2" Residue "Q ASP 225": "OD1" <-> "OD2" Residue "Q PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R GLU 13": "OE1" <-> "OE2" Residue "R GLU 18": "OE1" <-> "OE2" Residue "R TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R GLU 63": "OE1" <-> "OE2" Residue "R PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R GLU 93": "OE1" <-> "OE2" Residue "R GLU 105": "OE1" <-> "OE2" Residue "R PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R GLU 140": "OE1" <-> "OE2" Residue "R PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "R ASP 207": "OD1" <-> "OD2" Residue "R ASP 225": "OD1" <-> "OD2" Residue "R PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S GLU 13": "OE1" <-> "OE2" Residue "S GLU 18": "OE1" <-> "OE2" Residue "S TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S GLU 63": "OE1" <-> "OE2" Residue "S PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S GLU 93": "OE1" <-> "OE2" Residue "S GLU 105": "OE1" <-> "OE2" Residue "S PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S GLU 140": "OE1" <-> "OE2" Residue "S PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "S ASP 207": "OD1" <-> "OD2" Residue "S ASP 225": "OD1" <-> "OD2" Residue "S PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T GLU 13": "OE1" <-> "OE2" Residue "T GLU 18": "OE1" <-> "OE2" Residue "T TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T GLU 63": "OE1" <-> "OE2" Residue "T PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T GLU 93": "OE1" <-> "OE2" Residue "T GLU 105": "OE1" <-> "OE2" Residue "T PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T GLU 140": "OE1" <-> "OE2" Residue "T PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "T ASP 207": "OD1" <-> "OD2" Residue "T ASP 225": "OD1" <-> "OD2" Residue "T PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U GLU 13": "OE1" <-> "OE2" Residue "U GLU 18": "OE1" <-> "OE2" Residue "U TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U GLU 63": "OE1" <-> "OE2" Residue "U PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U GLU 93": "OE1" <-> "OE2" Residue "U GLU 105": "OE1" <-> "OE2" Residue "U PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U GLU 140": "OE1" <-> "OE2" Residue "U PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "U ASP 207": "OD1" <-> "OD2" Residue "U ASP 225": "OD1" <-> "OD2" Residue "U PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V GLU 13": "OE1" <-> "OE2" Residue "V GLU 18": "OE1" <-> "OE2" Residue "V TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V GLU 63": "OE1" <-> "OE2" Residue "V PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V GLU 93": "OE1" <-> "OE2" Residue "V GLU 105": "OE1" <-> "OE2" Residue "V PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V GLU 140": "OE1" <-> "OE2" Residue "V PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "V ASP 207": "OD1" <-> "OD2" Residue "V ASP 225": "OD1" <-> "OD2" Residue "V PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W GLU 13": "OE1" <-> "OE2" Residue "W GLU 18": "OE1" <-> "OE2" Residue "W TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W GLU 63": "OE1" <-> "OE2" Residue "W PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W GLU 93": "OE1" <-> "OE2" Residue "W GLU 105": "OE1" <-> "OE2" Residue "W PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W GLU 140": "OE1" <-> "OE2" Residue "W PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "W ASP 207": "OD1" <-> "OD2" Residue "W ASP 225": "OD1" <-> "OD2" Residue "W PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X GLU 13": "OE1" <-> "OE2" Residue "X GLU 18": "OE1" <-> "OE2" Residue "X TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X GLU 63": "OE1" <-> "OE2" Residue "X PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X GLU 93": "OE1" <-> "OE2" Residue "X GLU 105": "OE1" <-> "OE2" Residue "X PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X GLU 140": "OE1" <-> "OE2" Residue "X PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "X ASP 207": "OD1" <-> "OD2" Residue "X ASP 225": "OD1" <-> "OD2" Residue "X PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y GLU 13": "OE1" <-> "OE2" Residue "Y GLU 18": "OE1" <-> "OE2" Residue "Y TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y GLU 63": "OE1" <-> "OE2" Residue "Y PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y GLU 93": "OE1" <-> "OE2" Residue "Y GLU 105": "OE1" <-> "OE2" Residue "Y PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y GLU 140": "OE1" <-> "OE2" Residue "Y PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Y ASP 207": "OD1" <-> "OD2" Residue "Y ASP 225": "OD1" <-> "OD2" Residue "Y PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z GLU 13": "OE1" <-> "OE2" Residue "Z GLU 18": "OE1" <-> "OE2" Residue "Z TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z GLU 63": "OE1" <-> "OE2" Residue "Z PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z GLU 93": "OE1" <-> "OE2" Residue "Z GLU 105": "OE1" <-> "OE2" Residue "Z PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z GLU 140": "OE1" <-> "OE2" Residue "Z PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Z ASP 207": "OD1" <-> "OD2" Residue "Z ASP 225": "OD1" <-> "OD2" Residue "Z PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 GLU 13": "OE1" <-> "OE2" Residue "0 GLU 18": "OE1" <-> "OE2" Residue "0 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 GLU 63": "OE1" <-> "OE2" Residue "0 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 GLU 93": "OE1" <-> "OE2" Residue "0 GLU 105": "OE1" <-> "OE2" Residue "0 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 GLU 140": "OE1" <-> "OE2" Residue "0 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "0 ASP 207": "OD1" <-> "OD2" Residue "0 ASP 225": "OD1" <-> "OD2" Residue "0 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 GLU 13": "OE1" <-> "OE2" Residue "1 GLU 18": "OE1" <-> "OE2" Residue "1 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 GLU 63": "OE1" <-> "OE2" Residue "1 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 GLU 93": "OE1" <-> "OE2" Residue "1 GLU 105": "OE1" <-> "OE2" Residue "1 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 GLU 140": "OE1" <-> "OE2" Residue "1 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "1 ASP 207": "OD1" <-> "OD2" Residue "1 ASP 225": "OD1" <-> "OD2" Residue "1 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 GLU 13": "OE1" <-> "OE2" Residue "2 GLU 18": "OE1" <-> "OE2" Residue "2 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 GLU 63": "OE1" <-> "OE2" Residue "2 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 GLU 93": "OE1" <-> "OE2" Residue "2 GLU 105": "OE1" <-> "OE2" Residue "2 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 GLU 140": "OE1" <-> "OE2" Residue "2 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "2 ASP 207": "OD1" <-> "OD2" Residue "2 ASP 225": "OD1" <-> "OD2" Residue "2 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 GLU 13": "OE1" <-> "OE2" Residue "3 GLU 18": "OE1" <-> "OE2" Residue "3 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 GLU 63": "OE1" <-> "OE2" Residue "3 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 GLU 93": "OE1" <-> "OE2" Residue "3 GLU 105": "OE1" <-> "OE2" Residue "3 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 GLU 140": "OE1" <-> "OE2" Residue "3 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "3 ASP 207": "OD1" <-> "OD2" Residue "3 ASP 225": "OD1" <-> "OD2" Residue "3 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 GLU 13": "OE1" <-> "OE2" Residue "4 GLU 18": "OE1" <-> "OE2" Residue "4 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 GLU 63": "OE1" <-> "OE2" Residue "4 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 GLU 93": "OE1" <-> "OE2" Residue "4 GLU 105": "OE1" <-> "OE2" Residue "4 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 GLU 140": "OE1" <-> "OE2" Residue "4 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "4 ASP 207": "OD1" <-> "OD2" Residue "4 ASP 225": "OD1" <-> "OD2" Residue "4 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 GLU 13": "OE1" <-> "OE2" Residue "5 GLU 18": "OE1" <-> "OE2" Residue "5 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 GLU 63": "OE1" <-> "OE2" Residue "5 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 GLU 93": "OE1" <-> "OE2" Residue "5 GLU 105": "OE1" <-> "OE2" Residue "5 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 GLU 140": "OE1" <-> "OE2" Residue "5 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "5 ASP 207": "OD1" <-> "OD2" Residue "5 ASP 225": "OD1" <-> "OD2" Residue "5 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 GLU 13": "OE1" <-> "OE2" Residue "6 GLU 18": "OE1" <-> "OE2" Residue "6 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 GLU 63": "OE1" <-> "OE2" Residue "6 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 GLU 93": "OE1" <-> "OE2" Residue "6 GLU 105": "OE1" <-> "OE2" Residue "6 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 GLU 140": "OE1" <-> "OE2" Residue "6 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "6 ASP 207": "OD1" <-> "OD2" Residue "6 ASP 225": "OD1" <-> "OD2" Residue "6 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 GLU 13": "OE1" <-> "OE2" Residue "7 GLU 18": "OE1" <-> "OE2" Residue "7 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 GLU 63": "OE1" <-> "OE2" Residue "7 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 GLU 93": "OE1" <-> "OE2" Residue "7 GLU 105": "OE1" <-> "OE2" Residue "7 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 GLU 140": "OE1" <-> "OE2" Residue "7 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "7 ASP 207": "OD1" <-> "OD2" Residue "7 ASP 225": "OD1" <-> "OD2" Residue "7 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 GLU 13": "OE1" <-> "OE2" Residue "8 GLU 18": "OE1" <-> "OE2" Residue "8 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 GLU 63": "OE1" <-> "OE2" Residue "8 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 GLU 93": "OE1" <-> "OE2" Residue "8 GLU 105": "OE1" <-> "OE2" Residue "8 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 GLU 140": "OE1" <-> "OE2" Residue "8 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "8 ASP 207": "OD1" <-> "OD2" Residue "8 ASP 225": "OD1" <-> "OD2" Residue "8 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 GLU 13": "OE1" <-> "OE2" Residue "9 GLU 18": "OE1" <-> "OE2" Residue "9 TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 GLU 63": "OE1" <-> "OE2" Residue "9 PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 GLU 93": "OE1" <-> "OE2" Residue "9 GLU 105": "OE1" <-> "OE2" Residue "9 PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 GLU 140": "OE1" <-> "OE2" Residue "9 PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "9 ASP 207": "OD1" <-> "OD2" Residue "9 ASP 225": "OD1" <-> "OD2" Residue "9 PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a GLU 13": "OE1" <-> "OE2" Residue "a GLU 18": "OE1" <-> "OE2" Residue "a TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a GLU 63": "OE1" <-> "OE2" Residue "a PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a GLU 93": "OE1" <-> "OE2" Residue "a GLU 105": "OE1" <-> "OE2" Residue "a PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a GLU 140": "OE1" <-> "OE2" Residue "a PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "a ASP 207": "OD1" <-> "OD2" Residue "a ASP 225": "OD1" <-> "OD2" Residue "a PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b GLU 13": "OE1" <-> "OE2" Residue "b GLU 18": "OE1" <-> "OE2" Residue "b TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b GLU 63": "OE1" <-> "OE2" Residue "b PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b GLU 93": "OE1" <-> "OE2" Residue "b GLU 105": "OE1" <-> "OE2" Residue "b PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b GLU 140": "OE1" <-> "OE2" Residue "b PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "b ASP 207": "OD1" <-> "OD2" Residue "b ASP 225": "OD1" <-> "OD2" Residue "b PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c GLU 13": "OE1" <-> "OE2" Residue "c GLU 18": "OE1" <-> "OE2" Residue "c TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c GLU 63": "OE1" <-> "OE2" Residue "c PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c GLU 93": "OE1" <-> "OE2" Residue "c GLU 105": "OE1" <-> "OE2" Residue "c PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c GLU 140": "OE1" <-> "OE2" Residue "c PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "c ASP 207": "OD1" <-> "OD2" Residue "c ASP 225": "OD1" <-> "OD2" Residue "c PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d GLU 13": "OE1" <-> "OE2" Residue "d GLU 18": "OE1" <-> "OE2" Residue "d TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d GLU 63": "OE1" <-> "OE2" Residue "d PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d GLU 93": "OE1" <-> "OE2" Residue "d GLU 105": "OE1" <-> "OE2" Residue "d PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d GLU 140": "OE1" <-> "OE2" Residue "d PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "d ASP 207": "OD1" <-> "OD2" Residue "d ASP 225": "OD1" <-> "OD2" Residue "d PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e GLU 13": "OE1" <-> "OE2" Residue "e GLU 18": "OE1" <-> "OE2" Residue "e TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e GLU 63": "OE1" <-> "OE2" Residue "e PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e GLU 93": "OE1" <-> "OE2" Residue "e GLU 105": "OE1" <-> "OE2" Residue "e PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e GLU 140": "OE1" <-> "OE2" Residue "e PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "e ASP 207": "OD1" <-> "OD2" Residue "e ASP 225": "OD1" <-> "OD2" Residue "e PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f GLU 13": "OE1" <-> "OE2" Residue "f GLU 18": "OE1" <-> "OE2" Residue "f TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f GLU 63": "OE1" <-> "OE2" Residue "f PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f GLU 93": "OE1" <-> "OE2" Residue "f GLU 105": "OE1" <-> "OE2" Residue "f PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f GLU 140": "OE1" <-> "OE2" Residue "f PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "f ASP 207": "OD1" <-> "OD2" Residue "f ASP 225": "OD1" <-> "OD2" Residue "f PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g GLU 13": "OE1" <-> "OE2" Residue "g GLU 18": "OE1" <-> "OE2" Residue "g TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g GLU 63": "OE1" <-> "OE2" Residue "g PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g GLU 93": "OE1" <-> "OE2" Residue "g GLU 105": "OE1" <-> "OE2" Residue "g PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g GLU 140": "OE1" <-> "OE2" Residue "g PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "g ASP 207": "OD1" <-> "OD2" Residue "g ASP 225": "OD1" <-> "OD2" Residue "g PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h GLU 13": "OE1" <-> "OE2" Residue "h GLU 18": "OE1" <-> "OE2" Residue "h TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h GLU 63": "OE1" <-> "OE2" Residue "h PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h GLU 93": "OE1" <-> "OE2" Residue "h GLU 105": "OE1" <-> "OE2" Residue "h PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h GLU 140": "OE1" <-> "OE2" Residue "h PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "h ASP 207": "OD1" <-> "OD2" Residue "h ASP 225": "OD1" <-> "OD2" Residue "h PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i GLU 13": "OE1" <-> "OE2" Residue "i GLU 18": "OE1" <-> "OE2" Residue "i TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i GLU 63": "OE1" <-> "OE2" Residue "i PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i GLU 93": "OE1" <-> "OE2" Residue "i GLU 105": "OE1" <-> "OE2" Residue "i PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i GLU 140": "OE1" <-> "OE2" Residue "i PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "i ASP 207": "OD1" <-> "OD2" Residue "i ASP 225": "OD1" <-> "OD2" Residue "i PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j GLU 13": "OE1" <-> "OE2" Residue "j GLU 18": "OE1" <-> "OE2" Residue "j TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j GLU 63": "OE1" <-> "OE2" Residue "j PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j GLU 93": "OE1" <-> "OE2" Residue "j GLU 105": "OE1" <-> "OE2" Residue "j PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j GLU 140": "OE1" <-> "OE2" Residue "j PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "j ASP 207": "OD1" <-> "OD2" Residue "j ASP 225": "OD1" <-> "OD2" Residue "j PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k GLU 13": "OE1" <-> "OE2" Residue "k GLU 18": "OE1" <-> "OE2" Residue "k TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k GLU 63": "OE1" <-> "OE2" Residue "k PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k GLU 93": "OE1" <-> "OE2" Residue "k GLU 105": "OE1" <-> "OE2" Residue "k PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k GLU 140": "OE1" <-> "OE2" Residue "k PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "k ASP 207": "OD1" <-> "OD2" Residue "k ASP 225": "OD1" <-> "OD2" Residue "k PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l GLU 13": "OE1" <-> "OE2" Residue "l GLU 18": "OE1" <-> "OE2" Residue "l TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l GLU 63": "OE1" <-> "OE2" Residue "l PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l GLU 93": "OE1" <-> "OE2" Residue "l GLU 105": "OE1" <-> "OE2" Residue "l PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l GLU 140": "OE1" <-> "OE2" Residue "l PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "l ASP 207": "OD1" <-> "OD2" Residue "l ASP 225": "OD1" <-> "OD2" Residue "l PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m GLU 13": "OE1" <-> "OE2" Residue "m GLU 18": "OE1" <-> "OE2" Residue "m TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m GLU 63": "OE1" <-> "OE2" Residue "m PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m GLU 93": "OE1" <-> "OE2" Residue "m GLU 105": "OE1" <-> "OE2" Residue "m PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m GLU 140": "OE1" <-> "OE2" Residue "m PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "m ASP 207": "OD1" <-> "OD2" Residue "m ASP 225": "OD1" <-> "OD2" Residue "m PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n GLU 13": "OE1" <-> "OE2" Residue "n GLU 18": "OE1" <-> "OE2" Residue "n TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n GLU 63": "OE1" <-> "OE2" Residue "n PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n GLU 93": "OE1" <-> "OE2" Residue "n GLU 105": "OE1" <-> "OE2" Residue "n PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n GLU 140": "OE1" <-> "OE2" Residue "n PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "n ASP 207": "OD1" <-> "OD2" Residue "n ASP 225": "OD1" <-> "OD2" Residue "n PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o GLU 13": "OE1" <-> "OE2" Residue "o GLU 18": "OE1" <-> "OE2" Residue "o TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o GLU 63": "OE1" <-> "OE2" Residue "o PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o GLU 93": "OE1" <-> "OE2" Residue "o GLU 105": "OE1" <-> "OE2" Residue "o PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o GLU 140": "OE1" <-> "OE2" Residue "o PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "o ASP 207": "OD1" <-> "OD2" Residue "o ASP 225": "OD1" <-> "OD2" Residue "o PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p GLU 13": "OE1" <-> "OE2" Residue "p GLU 18": "OE1" <-> "OE2" Residue "p TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p GLU 63": "OE1" <-> "OE2" Residue "p PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p GLU 93": "OE1" <-> "OE2" Residue "p GLU 105": "OE1" <-> "OE2" Residue "p PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p GLU 140": "OE1" <-> "OE2" Residue "p PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "p ASP 207": "OD1" <-> "OD2" Residue "p ASP 225": "OD1" <-> "OD2" Residue "p PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q GLU 13": "OE1" <-> "OE2" Residue "q GLU 18": "OE1" <-> "OE2" Residue "q TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q GLU 63": "OE1" <-> "OE2" Residue "q PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q GLU 93": "OE1" <-> "OE2" Residue "q GLU 105": "OE1" <-> "OE2" Residue "q PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q GLU 140": "OE1" <-> "OE2" Residue "q PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "q ASP 207": "OD1" <-> "OD2" Residue "q ASP 225": "OD1" <-> "OD2" Residue "q PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r GLU 13": "OE1" <-> "OE2" Residue "r GLU 18": "OE1" <-> "OE2" Residue "r TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r GLU 63": "OE1" <-> "OE2" Residue "r PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r GLU 93": "OE1" <-> "OE2" Residue "r GLU 105": "OE1" <-> "OE2" Residue "r PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r GLU 140": "OE1" <-> "OE2" Residue "r PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "r ASP 207": "OD1" <-> "OD2" Residue "r ASP 225": "OD1" <-> "OD2" Residue "r PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s GLU 13": "OE1" <-> "OE2" Residue "s GLU 18": "OE1" <-> "OE2" Residue "s TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s GLU 63": "OE1" <-> "OE2" Residue "s PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s GLU 93": "OE1" <-> "OE2" Residue "s GLU 105": "OE1" <-> "OE2" Residue "s PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s GLU 140": "OE1" <-> "OE2" Residue "s PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "s ASP 207": "OD1" <-> "OD2" Residue "s ASP 225": "OD1" <-> "OD2" Residue "s PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t GLU 13": "OE1" <-> "OE2" Residue "t GLU 18": "OE1" <-> "OE2" Residue "t TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t GLU 63": "OE1" <-> "OE2" Residue "t PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t GLU 93": "OE1" <-> "OE2" Residue "t GLU 105": "OE1" <-> "OE2" Residue "t PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t GLU 140": "OE1" <-> "OE2" Residue "t PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "t ASP 207": "OD1" <-> "OD2" Residue "t ASP 225": "OD1" <-> "OD2" Residue "t PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u GLU 13": "OE1" <-> "OE2" Residue "u GLU 18": "OE1" <-> "OE2" Residue "u TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u GLU 63": "OE1" <-> "OE2" Residue "u PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u GLU 93": "OE1" <-> "OE2" Residue "u GLU 105": "OE1" <-> "OE2" Residue "u PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u GLU 140": "OE1" <-> "OE2" Residue "u PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "u ASP 207": "OD1" <-> "OD2" Residue "u ASP 225": "OD1" <-> "OD2" Residue "u PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v GLU 13": "OE1" <-> "OE2" Residue "v GLU 18": "OE1" <-> "OE2" Residue "v TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v GLU 63": "OE1" <-> "OE2" Residue "v PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v GLU 93": "OE1" <-> "OE2" Residue "v GLU 105": "OE1" <-> "OE2" Residue "v PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v GLU 140": "OE1" <-> "OE2" Residue "v PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "v ASP 207": "OD1" <-> "OD2" Residue "v ASP 225": "OD1" <-> "OD2" Residue "v PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w GLU 13": "OE1" <-> "OE2" Residue "w GLU 18": "OE1" <-> "OE2" Residue "w TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w GLU 63": "OE1" <-> "OE2" Residue "w PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w GLU 93": "OE1" <-> "OE2" Residue "w GLU 105": "OE1" <-> "OE2" Residue "w PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w GLU 140": "OE1" <-> "OE2" Residue "w PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "w ASP 207": "OD1" <-> "OD2" Residue "w ASP 225": "OD1" <-> "OD2" Residue "w PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x PHE 3": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x PHE 8": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x GLU 13": "OE1" <-> "OE2" Residue "x GLU 18": "OE1" <-> "OE2" Residue "x TYR 32": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x PHE 36": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x TYR 43": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x GLU 63": "OE1" <-> "OE2" Residue "x PHE 82": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x GLU 93": "OE1" <-> "OE2" Residue "x GLU 105": "OE1" <-> "OE2" Residue "x PHE 114": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x PHE 120": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x GLU 140": "OE1" <-> "OE2" Residue "x PHE 159": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x TYR 168": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x PHE 180": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "x ASP 207": "OD1" <-> "OD2" Residue "x ASP 225": "OD1" <-> "OD2" Residue "x PHE 246": "CD1" <-> "CD2" "CE1" <-> "CE2" Time to flip residues: 0.39s Monomer Library directory: "/net/cci-filer2/raid1/xp/phenix/phenix-1.21rc1-4938/modules/chem_data/mon_lib" Total number of atoms: 128880 Number of models: 1 Model: "" Number of chains: 60 Chain: "A" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE A 261 " pdbres="RBF A 301 " Chain: "B" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE B 261 " pdbres="RBF B 301 " Chain: "C" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE C 261 " pdbres="RBF C 301 " Chain: "D" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE D 261 " pdbres="RBF D 301 " Chain: "E" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE E 261 " pdbres="RBF E 301 " Chain: "F" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE F 261 " pdbres="RBF F 301 " Chain: "G" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE G 261 " pdbres="RBF G 301 " Chain: "H" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE H 261 " pdbres="RBF H 301 " Chain: "I" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE I 261 " pdbres="RBF I 301 " Chain: "J" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE J 261 " pdbres="RBF J 301 " Chain: "K" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE K 261 " pdbres="RBF K 301 " Chain: "L" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE L 261 " pdbres="RBF L 301 " Chain: "M" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE M 261 " pdbres="RBF M 301 " Chain: "N" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE N 261 " pdbres="RBF N 301 " Chain: "O" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE O 261 " pdbres="RBF O 301 " Chain: "P" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE P 261 " pdbres="RBF P 301 " Chain: "Q" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE Q 261 " pdbres="RBF Q 301 " Chain: "R" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE R 261 " pdbres="RBF R 301 " Chain: "S" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE S 261 " pdbres="RBF S 301 " Chain: "T" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE T 261 " pdbres="RBF T 301 " Chain: "U" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE U 261 " pdbres="RBF U 301 " Chain: "V" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE V 261 " pdbres="RBF V 301 " Chain: "W" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE W 261 " pdbres="RBF W 301 " Chain: "X" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE X 261 " pdbres="RBF X 301 " Chain: "Y" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE Y 261 " pdbres="RBF Y 301 " Chain: "Z" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE Z 261 " pdbres="RBF Z 301 " Chain: "0" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 0 261 " pdbres="RBF 0 301 " Chain: "1" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 1 261 " pdbres="RBF 1 301 " Chain: "2" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 2 261 " pdbres="RBF 2 301 " Chain: "3" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 3 261 " pdbres="RBF 3 301 " Chain: "4" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 4 261 " pdbres="RBF 4 301 " Chain: "5" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 5 261 " pdbres="RBF 5 301 " Chain: "6" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 6 261 " pdbres="RBF 6 301 " Chain: "7" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 7 261 " pdbres="RBF 7 301 " Chain: "8" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 8 261 " pdbres="RBF 8 301 " Chain: "9" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE 9 261 " pdbres="RBF 9 301 " Chain: "a" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE a 261 " pdbres="RBF a 301 " Chain: "b" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE b 261 " pdbres="RBF b 301 " Chain: "c" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE c 261 " pdbres="RBF c 301 " Chain: "d" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE d 261 " pdbres="RBF d 301 " Chain: "e" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE e 261 " pdbres="RBF e 301 " Chain: "f" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE f 261 " pdbres="RBF f 301 " Chain: "g" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE g 261 " pdbres="RBF g 301 " Chain: "h" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE h 261 " pdbres="RBF h 301 " Chain: "i" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE i 261 " pdbres="RBF i 301 " Chain: "j" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE j 261 " pdbres="RBF j 301 " Chain: "k" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE k 261 " pdbres="RBF k 301 " Chain: "l" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE l 261 " pdbres="RBF l 301 " Chain: "m" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE m 261 " pdbres="RBF m 301 " Chain: "n" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE n 261 " pdbres="RBF n 301 " Chain: "o" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE o 261 " pdbres="RBF o 301 " Chain: "p" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE p 261 " pdbres="RBF p 301 " Chain: "q" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE q 261 " pdbres="RBF q 301 " Chain: "r" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE r 261 " pdbres="RBF r 301 " Chain: "s" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE s 261 " pdbres="RBF s 301 " Chain: "t" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE t 261 " pdbres="RBF t 301 " Chain: "u" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE u 261 " pdbres="RBF u 301 " Chain: "v" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE v 261 " pdbres="RBF v 301 " Chain: "w" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE w 261 " pdbres="RBF w 301 " Chain: "x" Number of atoms: 2148 Number of conformers: 1 Conformer: "" Number of residues, atoms: 262, 2148 Unusual residues: {'RBF': 1} Classifications: {'peptide': 261, 'undetermined': 1} Link IDs: {'PTRANS': 9, 'TRANS': 251, None: 1} Not linked: pdbres="PHE x 261 " pdbres="RBF x 301 " Time building chain proxies: 47.44, per 1000 atoms: 0.37 Number of scatterers: 128880 At special positions: 0 Unit cell: (253.402, 253.402, 253.402, 90, 90, 90) Space group: P 1 (No. 1) Number of sites at special positions: 0 Number of scattering types: 4 Type Number sf(0) S 240 16.00 O 24660 8.00 N 21420 7.00 C 82560 6.00 sf(0) = scattering factor at diffraction angle 0. Number of disulfides: simple=0, symmetry=0 Automatic linking Parameters for automatic linking Linking & cutoffs Metal : Auto - 3.50 Amino acid : False - 1.90 Carbohydrate : True - 1.99 Ligands : True - 1.99 Small molecules : False - 1.98 Amino acid - RNA/DNA : False Number of custom bonds: simple=0, symmetry=0 Time building additional restraints: 38.16 Conformation dependent library (CDL) restraints added in 12.2 seconds 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. Adding C-beta torsion restraints... Number of C-beta restraints generated: 29160 Finding SS restraints... Warning!!! ksdssp method is not applicable forstructures with more than 99999 atoms! Switching to from_ca. running find_ss_from_ca liberal... Secondary structure from input PDB file: 420 helices and 240 sheets defined 37.9% alpha, 29.5% beta 0 base pairs and 0 stacking pairs defined. Time for finding SS restraints: 9.39 Creating SS restraints... Processing helix chain 'A' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR A 29 " --> pdb=" O GLU A 25 " (cutoff:3.500A) Processing helix chain 'A' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE A 36 " --> pdb=" O TYR A 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL A 37 " --> pdb=" O GLY A 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'A' and resid 32 through 37' Processing helix chain 'A' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU A 92 " --> pdb=" O GLU A 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU A 93 " --> pdb=" O LEU A 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG A 94 " --> pdb=" O ASP A 90 " (cutoff:3.500A) Processing helix chain 'A' and resid 101 through 121 Processing helix chain 'A' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU A 148 " --> pdb=" O THR A 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU A 149 " --> pdb=" O PRO A 145 " (cutoff:3.500A) Processing helix chain 'A' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU A 183 " --> pdb=" O ASN A 179 " (cutoff:3.500A) Processing helix chain 'A' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU A 191 " --> pdb=" O GLU A 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU A 192 " --> pdb=" O LYS A 188 " (cutoff:3.500A) Processing helix chain 'B' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR B 29 " --> pdb=" O GLU B 25 " (cutoff:3.500A) Processing helix chain 'B' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE B 36 " --> pdb=" O TYR B 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL B 37 " --> pdb=" O GLY B 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'B' and resid 32 through 37' Processing helix chain 'B' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU B 92 " --> pdb=" O GLU B 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU B 93 " --> pdb=" O LEU B 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG B 94 " --> pdb=" O ASP B 90 " (cutoff:3.500A) Processing helix chain 'B' and resid 101 through 121 Processing helix chain 'B' and resid 144 through 163 removed outlier: 3.510A pdb=" N LEU B 148 " --> pdb=" O THR B 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU B 149 " --> pdb=" O PRO B 145 " (cutoff:3.500A) Processing helix chain 'B' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU B 183 " --> pdb=" O ASN B 179 " (cutoff:3.500A) Processing helix chain 'B' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU B 191 " --> pdb=" O GLU B 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU B 192 " --> pdb=" O LYS B 188 " (cutoff:3.500A) Processing helix chain 'C' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR C 29 " --> pdb=" O GLU C 25 " (cutoff:3.500A) Processing helix chain 'C' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE C 36 " --> pdb=" O TYR C 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL C 37 " --> pdb=" O GLY C 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'C' and resid 32 through 37' Processing helix chain 'C' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU C 92 " --> pdb=" O GLU C 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU C 93 " --> pdb=" O LEU C 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG C 94 " --> pdb=" O ASP C 90 " (cutoff:3.500A) Processing helix chain 'C' and resid 101 through 121 Processing helix chain 'C' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU C 148 " --> pdb=" O THR C 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU C 149 " --> pdb=" O PRO C 145 " (cutoff:3.500A) Processing helix chain 'C' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU C 183 " --> pdb=" O ASN C 179 " (cutoff:3.500A) Processing helix chain 'C' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU C 191 " --> pdb=" O GLU C 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU C 192 " --> pdb=" O LYS C 188 " (cutoff:3.500A) Processing helix chain 'D' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR D 29 " --> pdb=" O GLU D 25 " (cutoff:3.500A) Processing helix chain 'D' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE D 36 " --> pdb=" O TYR D 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL D 37 " --> pdb=" O GLY D 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'D' and resid 32 through 37' Processing helix chain 'D' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU D 92 " --> pdb=" O GLU D 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU D 93 " --> pdb=" O LEU D 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG D 94 " --> pdb=" O ASP D 90 " (cutoff:3.500A) Processing helix chain 'D' and resid 101 through 121 Processing helix chain 'D' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU D 148 " --> pdb=" O THR D 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU D 149 " --> pdb=" O PRO D 145 " (cutoff:3.500A) Processing helix chain 'D' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU D 183 " --> pdb=" O ASN D 179 " (cutoff:3.500A) Processing helix chain 'D' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU D 191 " --> pdb=" O GLU D 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU D 192 " --> pdb=" O LYS D 188 " (cutoff:3.500A) Processing helix chain 'E' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR E 29 " --> pdb=" O GLU E 25 " (cutoff:3.500A) Processing helix chain 'E' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE E 36 " --> pdb=" O TYR E 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL E 37 " --> pdb=" O GLY E 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'E' and resid 32 through 37' Processing helix chain 'E' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU E 92 " --> pdb=" O GLU E 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU E 93 " --> pdb=" O LEU E 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG E 94 " --> pdb=" O ASP E 90 " (cutoff:3.500A) Processing helix chain 'E' and resid 101 through 121 Processing helix chain 'E' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU E 148 " --> pdb=" O THR E 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU E 149 " --> pdb=" O PRO E 145 " (cutoff:3.500A) Processing helix chain 'E' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU E 183 " --> pdb=" O ASN E 179 " (cutoff:3.500A) Processing helix chain 'E' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU E 191 " --> pdb=" O GLU E 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU E 192 " --> pdb=" O LYS E 188 " (cutoff:3.500A) Processing helix chain 'F' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR F 29 " --> pdb=" O GLU F 25 " (cutoff:3.500A) Processing helix chain 'F' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE F 36 " --> pdb=" O TYR F 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL F 37 " --> pdb=" O GLY F 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'F' and resid 32 through 37' Processing helix chain 'F' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU F 92 " --> pdb=" O GLU F 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU F 93 " --> pdb=" O LEU F 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG F 94 " --> pdb=" O ASP F 90 " (cutoff:3.500A) Processing helix chain 'F' and resid 101 through 121 Processing helix chain 'F' and resid 144 through 163 removed outlier: 3.510A pdb=" N LEU F 148 " --> pdb=" O THR F 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU F 149 " --> pdb=" O PRO F 145 " (cutoff:3.500A) Processing helix chain 'F' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU F 183 " --> pdb=" O ASN F 179 " (cutoff:3.500A) Processing helix chain 'F' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU F 191 " --> pdb=" O GLU F 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU F 192 " --> pdb=" O LYS F 188 " (cutoff:3.500A) Processing helix chain 'G' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR G 29 " --> pdb=" O GLU G 25 " (cutoff:3.500A) Processing helix chain 'G' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE G 36 " --> pdb=" O TYR G 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL G 37 " --> pdb=" O GLY G 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'G' and resid 32 through 37' Processing helix chain 'G' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU G 92 " --> pdb=" O GLU G 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU G 93 " --> pdb=" O LEU G 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG G 94 " --> pdb=" O ASP G 90 " (cutoff:3.500A) Processing helix chain 'G' and resid 101 through 121 Processing helix chain 'G' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU G 148 " --> pdb=" O THR G 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU G 149 " --> pdb=" O PRO G 145 " (cutoff:3.500A) Processing helix chain 'G' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU G 183 " --> pdb=" O ASN G 179 " (cutoff:3.500A) Processing helix chain 'G' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU G 191 " --> pdb=" O GLU G 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU G 192 " --> pdb=" O LYS G 188 " (cutoff:3.500A) Processing helix chain 'H' and resid 12 through 31 removed outlier: 3.816A pdb=" N THR H 29 " --> pdb=" O GLU H 25 " (cutoff:3.500A) Processing helix chain 'H' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE H 36 " --> pdb=" O TYR H 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL H 37 " --> pdb=" O GLY H 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'H' and resid 32 through 37' Processing helix chain 'H' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU H 92 " --> pdb=" O GLU H 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU H 93 " --> pdb=" O LEU H 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG H 94 " --> pdb=" O ASP H 90 " (cutoff:3.500A) Processing helix chain 'H' and resid 101 through 121 Processing helix chain 'H' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU H 148 " --> pdb=" O THR H 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU H 149 " --> pdb=" O PRO H 145 " (cutoff:3.500A) Processing helix chain 'H' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU H 183 " --> pdb=" O ASN H 179 " (cutoff:3.500A) Processing helix chain 'H' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU H 191 " --> pdb=" O GLU H 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU H 192 " --> pdb=" O LYS H 188 " (cutoff:3.500A) Processing helix chain 'I' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR I 29 " --> pdb=" O GLU I 25 " (cutoff:3.500A) Processing helix chain 'I' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE I 36 " --> pdb=" O TYR I 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL I 37 " --> pdb=" O GLY I 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'I' and resid 32 through 37' Processing helix chain 'I' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU I 92 " --> pdb=" O GLU I 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU I 93 " --> pdb=" O LEU I 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG I 94 " --> pdb=" O ASP I 90 " (cutoff:3.500A) Processing helix chain 'I' and resid 101 through 121 Processing helix chain 'I' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU I 148 " --> pdb=" O THR I 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU I 149 " --> pdb=" O PRO I 145 " (cutoff:3.500A) Processing helix chain 'I' and resid 173 through 184 removed outlier: 3.595A pdb=" N GLU I 183 " --> pdb=" O ASN I 179 " (cutoff:3.500A) Processing helix chain 'I' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU I 191 " --> pdb=" O GLU I 187 " (cutoff:3.500A) removed outlier: 4.016A pdb=" N GLU I 192 " --> pdb=" O LYS I 188 " (cutoff:3.500A) Processing helix chain 'J' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR J 29 " --> pdb=" O GLU J 25 " (cutoff:3.500A) Processing helix chain 'J' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE J 36 " --> pdb=" O TYR J 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL J 37 " --> pdb=" O GLY J 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'J' and resid 32 through 37' Processing helix chain 'J' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU J 92 " --> pdb=" O GLU J 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU J 93 " --> pdb=" O LEU J 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG J 94 " --> pdb=" O ASP J 90 " (cutoff:3.500A) Processing helix chain 'J' and resid 101 through 121 Processing helix chain 'J' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU J 148 " --> pdb=" O THR J 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU J 149 " --> pdb=" O PRO J 145 " (cutoff:3.500A) Processing helix chain 'J' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU J 183 " --> pdb=" O ASN J 179 " (cutoff:3.500A) Processing helix chain 'J' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU J 191 " --> pdb=" O GLU J 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU J 192 " --> pdb=" O LYS J 188 " (cutoff:3.500A) Processing helix chain 'K' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR K 29 " --> pdb=" O GLU K 25 " (cutoff:3.500A) Processing helix chain 'K' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE K 36 " --> pdb=" O TYR K 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL K 37 " --> pdb=" O GLY K 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'K' and resid 32 through 37' Processing helix chain 'K' and resid 85 through 95 removed outlier: 4.177A pdb=" N LEU K 92 " --> pdb=" O GLU K 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU K 93 " --> pdb=" O LEU K 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG K 94 " --> pdb=" O ASP K 90 " (cutoff:3.500A) Processing helix chain 'K' and resid 101 through 121 Processing helix chain 'K' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU K 148 " --> pdb=" O THR K 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU K 149 " --> pdb=" O PRO K 145 " (cutoff:3.500A) Processing helix chain 'K' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU K 183 " --> pdb=" O ASN K 179 " (cutoff:3.500A) Processing helix chain 'K' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU K 191 " --> pdb=" O GLU K 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU K 192 " --> pdb=" O LYS K 188 " (cutoff:3.500A) Processing helix chain 'L' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR L 29 " --> pdb=" O GLU L 25 " (cutoff:3.500A) Processing helix chain 'L' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE L 36 " --> pdb=" O TYR L 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL L 37 " --> pdb=" O GLY L 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'L' and resid 32 through 37' Processing helix chain 'L' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU L 92 " --> pdb=" O GLU L 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU L 93 " --> pdb=" O LEU L 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG L 94 " --> pdb=" O ASP L 90 " (cutoff:3.500A) Processing helix chain 'L' and resid 101 through 121 Processing helix chain 'L' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU L 148 " --> pdb=" O THR L 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU L 149 " --> pdb=" O PRO L 145 " (cutoff:3.500A) Processing helix chain 'L' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU L 183 " --> pdb=" O ASN L 179 " (cutoff:3.500A) Processing helix chain 'L' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU L 191 " --> pdb=" O GLU L 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU L 192 " --> pdb=" O LYS L 188 " (cutoff:3.500A) Processing helix chain 'M' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR M 29 " --> pdb=" O GLU M 25 " (cutoff:3.500A) Processing helix chain 'M' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE M 36 " --> pdb=" O TYR M 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL M 37 " --> pdb=" O GLY M 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'M' and resid 32 through 37' Processing helix chain 'M' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU M 92 " --> pdb=" O GLU M 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU M 93 " --> pdb=" O LEU M 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG M 94 " --> pdb=" O ASP M 90 " (cutoff:3.500A) Processing helix chain 'M' and resid 101 through 121 Processing helix chain 'M' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU M 148 " --> pdb=" O THR M 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU M 149 " --> pdb=" O PRO M 145 " (cutoff:3.500A) Processing helix chain 'M' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU M 183 " --> pdb=" O ASN M 179 " (cutoff:3.500A) Processing helix chain 'M' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU M 191 " --> pdb=" O GLU M 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU M 192 " --> pdb=" O LYS M 188 " (cutoff:3.500A) Processing helix chain 'N' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR N 29 " --> pdb=" O GLU N 25 " (cutoff:3.500A) Processing helix chain 'N' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE N 36 " --> pdb=" O TYR N 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL N 37 " --> pdb=" O GLY N 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'N' and resid 32 through 37' Processing helix chain 'N' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU N 92 " --> pdb=" O GLU N 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU N 93 " --> pdb=" O LEU N 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG N 94 " --> pdb=" O ASP N 90 " (cutoff:3.500A) Processing helix chain 'N' and resid 101 through 121 Processing helix chain 'N' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU N 148 " --> pdb=" O THR N 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU N 149 " --> pdb=" O PRO N 145 " (cutoff:3.500A) Processing helix chain 'N' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU N 183 " --> pdb=" O ASN N 179 " (cutoff:3.500A) Processing helix chain 'N' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU N 191 " --> pdb=" O GLU N 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU N 192 " --> pdb=" O LYS N 188 " (cutoff:3.500A) Processing helix chain 'O' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR O 29 " --> pdb=" O GLU O 25 " (cutoff:3.500A) Processing helix chain 'O' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE O 36 " --> pdb=" O TYR O 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL O 37 " --> pdb=" O GLY O 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'O' and resid 32 through 37' Processing helix chain 'O' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU O 92 " --> pdb=" O GLU O 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU O 93 " --> pdb=" O LEU O 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG O 94 " --> pdb=" O ASP O 90 " (cutoff:3.500A) Processing helix chain 'O' and resid 101 through 121 Processing helix chain 'O' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU O 148 " --> pdb=" O THR O 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU O 149 " --> pdb=" O PRO O 145 " (cutoff:3.500A) Processing helix chain 'O' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU O 183 " --> pdb=" O ASN O 179 " (cutoff:3.500A) Processing helix chain 'O' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU O 191 " --> pdb=" O GLU O 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU O 192 " --> pdb=" O LYS O 188 " (cutoff:3.500A) Processing helix chain 'P' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR P 29 " --> pdb=" O GLU P 25 " (cutoff:3.500A) Processing helix chain 'P' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE P 36 " --> pdb=" O TYR P 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL P 37 " --> pdb=" O GLY P 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'P' and resid 32 through 37' Processing helix chain 'P' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU P 92 " --> pdb=" O GLU P 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU P 93 " --> pdb=" O LEU P 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG P 94 " --> pdb=" O ASP P 90 " (cutoff:3.500A) Processing helix chain 'P' and resid 101 through 121 Processing helix chain 'P' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU P 148 " --> pdb=" O THR P 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU P 149 " --> pdb=" O PRO P 145 " (cutoff:3.500A) Processing helix chain 'P' and resid 173 through 184 removed outlier: 3.595A pdb=" N GLU P 183 " --> pdb=" O ASN P 179 " (cutoff:3.500A) Processing helix chain 'P' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU P 191 " --> pdb=" O GLU P 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU P 192 " --> pdb=" O LYS P 188 " (cutoff:3.500A) Processing helix chain 'Q' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR Q 29 " --> pdb=" O GLU Q 25 " (cutoff:3.500A) Processing helix chain 'Q' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE Q 36 " --> pdb=" O TYR Q 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL Q 37 " --> pdb=" O GLY Q 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'Q' and resid 32 through 37' Processing helix chain 'Q' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU Q 92 " --> pdb=" O GLU Q 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU Q 93 " --> pdb=" O LEU Q 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG Q 94 " --> pdb=" O ASP Q 90 " (cutoff:3.500A) Processing helix chain 'Q' and resid 101 through 121 Processing helix chain 'Q' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU Q 148 " --> pdb=" O THR Q 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU Q 149 " --> pdb=" O PRO Q 145 " (cutoff:3.500A) Processing helix chain 'Q' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU Q 183 " --> pdb=" O ASN Q 179 " (cutoff:3.500A) Processing helix chain 'Q' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU Q 191 " --> pdb=" O GLU Q 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU Q 192 " --> pdb=" O LYS Q 188 " (cutoff:3.500A) Processing helix chain 'R' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR R 29 " --> pdb=" O GLU R 25 " (cutoff:3.500A) Processing helix chain 'R' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE R 36 " --> pdb=" O TYR R 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL R 37 " --> pdb=" O GLY R 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'R' and resid 32 through 37' Processing helix chain 'R' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU R 92 " --> pdb=" O GLU R 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU R 93 " --> pdb=" O LEU R 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG R 94 " --> pdb=" O ASP R 90 " (cutoff:3.500A) Processing helix chain 'R' and resid 101 through 121 Processing helix chain 'R' and resid 144 through 163 removed outlier: 3.510A pdb=" N LEU R 148 " --> pdb=" O THR R 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU R 149 " --> pdb=" O PRO R 145 " (cutoff:3.500A) Processing helix chain 'R' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU R 183 " --> pdb=" O ASN R 179 " (cutoff:3.500A) Processing helix chain 'R' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU R 191 " --> pdb=" O GLU R 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU R 192 " --> pdb=" O LYS R 188 " (cutoff:3.500A) Processing helix chain 'S' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR S 29 " --> pdb=" O GLU S 25 " (cutoff:3.500A) Processing helix chain 'S' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE S 36 " --> pdb=" O TYR S 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL S 37 " --> pdb=" O GLY S 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'S' and resid 32 through 37' Processing helix chain 'S' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU S 92 " --> pdb=" O GLU S 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU S 93 " --> pdb=" O LEU S 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG S 94 " --> pdb=" O ASP S 90 " (cutoff:3.500A) Processing helix chain 'S' and resid 101 through 121 Processing helix chain 'S' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU S 148 " --> pdb=" O THR S 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU S 149 " --> pdb=" O PRO S 145 " (cutoff:3.500A) Processing helix chain 'S' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU S 183 " --> pdb=" O ASN S 179 " (cutoff:3.500A) Processing helix chain 'S' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU S 191 " --> pdb=" O GLU S 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU S 192 " --> pdb=" O LYS S 188 " (cutoff:3.500A) Processing helix chain 'T' and resid 12 through 31 removed outlier: 3.816A pdb=" N THR T 29 " --> pdb=" O GLU T 25 " (cutoff:3.500A) Processing helix chain 'T' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE T 36 " --> pdb=" O TYR T 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL T 37 " --> pdb=" O GLY T 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'T' and resid 32 through 37' Processing helix chain 'T' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU T 92 " --> pdb=" O GLU T 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU T 93 " --> pdb=" O LEU T 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG T 94 " --> pdb=" O ASP T 90 " (cutoff:3.500A) Processing helix chain 'T' and resid 101 through 121 Processing helix chain 'T' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU T 148 " --> pdb=" O THR T 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU T 149 " --> pdb=" O PRO T 145 " (cutoff:3.500A) Processing helix chain 'T' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU T 183 " --> pdb=" O ASN T 179 " (cutoff:3.500A) Processing helix chain 'T' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU T 191 " --> pdb=" O GLU T 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU T 192 " --> pdb=" O LYS T 188 " (cutoff:3.500A) Processing helix chain 'U' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR U 29 " --> pdb=" O GLU U 25 " (cutoff:3.500A) Processing helix chain 'U' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE U 36 " --> pdb=" O TYR U 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL U 37 " --> pdb=" O GLY U 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'U' and resid 32 through 37' Processing helix chain 'U' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU U 92 " --> pdb=" O GLU U 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU U 93 " --> pdb=" O LEU U 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG U 94 " --> pdb=" O ASP U 90 " (cutoff:3.500A) Processing helix chain 'U' and resid 101 through 121 Processing helix chain 'U' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU U 148 " --> pdb=" O THR U 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU U 149 " --> pdb=" O PRO U 145 " (cutoff:3.500A) Processing helix chain 'U' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU U 183 " --> pdb=" O ASN U 179 " (cutoff:3.500A) Processing helix chain 'U' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU U 191 " --> pdb=" O GLU U 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU U 192 " --> pdb=" O LYS U 188 " (cutoff:3.500A) Processing helix chain 'V' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR V 29 " --> pdb=" O GLU V 25 " (cutoff:3.500A) Processing helix chain 'V' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE V 36 " --> pdb=" O TYR V 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL V 37 " --> pdb=" O GLY V 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'V' and resid 32 through 37' Processing helix chain 'V' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU V 92 " --> pdb=" O GLU V 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU V 93 " --> pdb=" O LEU V 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG V 94 " --> pdb=" O ASP V 90 " (cutoff:3.500A) Processing helix chain 'V' and resid 101 through 121 Processing helix chain 'V' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU V 148 " --> pdb=" O THR V 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU V 149 " --> pdb=" O PRO V 145 " (cutoff:3.500A) Processing helix chain 'V' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU V 183 " --> pdb=" O ASN V 179 " (cutoff:3.500A) Processing helix chain 'V' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU V 191 " --> pdb=" O GLU V 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU V 192 " --> pdb=" O LYS V 188 " (cutoff:3.500A) Processing helix chain 'W' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR W 29 " --> pdb=" O GLU W 25 " (cutoff:3.500A) Processing helix chain 'W' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE W 36 " --> pdb=" O TYR W 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL W 37 " --> pdb=" O GLY W 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'W' and resid 32 through 37' Processing helix chain 'W' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU W 92 " --> pdb=" O GLU W 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU W 93 " --> pdb=" O LEU W 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG W 94 " --> pdb=" O ASP W 90 " (cutoff:3.500A) Processing helix chain 'W' and resid 101 through 121 Processing helix chain 'W' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU W 148 " --> pdb=" O THR W 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU W 149 " --> pdb=" O PRO W 145 " (cutoff:3.500A) Processing helix chain 'W' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU W 183 " --> pdb=" O ASN W 179 " (cutoff:3.500A) Processing helix chain 'W' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU W 191 " --> pdb=" O GLU W 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU W 192 " --> pdb=" O LYS W 188 " (cutoff:3.500A) Processing helix chain 'X' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR X 29 " --> pdb=" O GLU X 25 " (cutoff:3.500A) Processing helix chain 'X' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE X 36 " --> pdb=" O TYR X 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL X 37 " --> pdb=" O GLY X 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'X' and resid 32 through 37' Processing helix chain 'X' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU X 92 " --> pdb=" O GLU X 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU X 93 " --> pdb=" O LEU X 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG X 94 " --> pdb=" O ASP X 90 " (cutoff:3.500A) Processing helix chain 'X' and resid 101 through 121 Processing helix chain 'X' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU X 148 " --> pdb=" O THR X 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU X 149 " --> pdb=" O PRO X 145 " (cutoff:3.500A) Processing helix chain 'X' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU X 183 " --> pdb=" O ASN X 179 " (cutoff:3.500A) Processing helix chain 'X' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU X 191 " --> pdb=" O GLU X 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU X 192 " --> pdb=" O LYS X 188 " (cutoff:3.500A) Processing helix chain 'Y' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR Y 29 " --> pdb=" O GLU Y 25 " (cutoff:3.500A) Processing helix chain 'Y' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE Y 36 " --> pdb=" O TYR Y 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL Y 37 " --> pdb=" O GLY Y 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'Y' and resid 32 through 37' Processing helix chain 'Y' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU Y 92 " --> pdb=" O GLU Y 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU Y 93 " --> pdb=" O LEU Y 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG Y 94 " --> pdb=" O ASP Y 90 " (cutoff:3.500A) Processing helix chain 'Y' and resid 101 through 121 Processing helix chain 'Y' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU Y 148 " --> pdb=" O THR Y 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU Y 149 " --> pdb=" O PRO Y 145 " (cutoff:3.500A) Processing helix chain 'Y' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU Y 183 " --> pdb=" O ASN Y 179 " (cutoff:3.500A) Processing helix chain 'Y' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU Y 191 " --> pdb=" O GLU Y 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU Y 192 " --> pdb=" O LYS Y 188 " (cutoff:3.500A) Processing helix chain 'Z' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR Z 29 " --> pdb=" O GLU Z 25 " (cutoff:3.500A) Processing helix chain 'Z' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE Z 36 " --> pdb=" O TYR Z 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL Z 37 " --> pdb=" O GLY Z 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'Z' and resid 32 through 37' Processing helix chain 'Z' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU Z 92 " --> pdb=" O GLU Z 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU Z 93 " --> pdb=" O LEU Z 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG Z 94 " --> pdb=" O ASP Z 90 " (cutoff:3.500A) Processing helix chain 'Z' and resid 101 through 121 Processing helix chain 'Z' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU Z 148 " --> pdb=" O THR Z 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU Z 149 " --> pdb=" O PRO Z 145 " (cutoff:3.500A) Processing helix chain 'Z' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU Z 183 " --> pdb=" O ASN Z 179 " (cutoff:3.500A) Processing helix chain 'Z' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU Z 191 " --> pdb=" O GLU Z 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU Z 192 " --> pdb=" O LYS Z 188 " (cutoff:3.500A) Processing helix chain '0' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 0 29 " --> pdb=" O GLU 0 25 " (cutoff:3.500A) Processing helix chain '0' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE 0 36 " --> pdb=" O TYR 0 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 0 37 " --> pdb=" O GLY 0 33 " (cutoff:3.500A) No H-bonds generated for 'chain '0' and resid 32 through 37' Processing helix chain '0' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU 0 92 " --> pdb=" O GLU 0 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU 0 93 " --> pdb=" O LEU 0 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG 0 94 " --> pdb=" O ASP 0 90 " (cutoff:3.500A) Processing helix chain '0' and resid 101 through 121 Processing helix chain '0' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 0 148 " --> pdb=" O THR 0 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 0 149 " --> pdb=" O PRO 0 145 " (cutoff:3.500A) Processing helix chain '0' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU 0 183 " --> pdb=" O ASN 0 179 " (cutoff:3.500A) Processing helix chain '0' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 0 191 " --> pdb=" O GLU 0 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 0 192 " --> pdb=" O LYS 0 188 " (cutoff:3.500A) Processing helix chain '1' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 1 29 " --> pdb=" O GLU 1 25 " (cutoff:3.500A) Processing helix chain '1' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE 1 36 " --> pdb=" O TYR 1 32 " (cutoff:3.500A) removed outlier: 3.781A pdb=" N VAL 1 37 " --> pdb=" O GLY 1 33 " (cutoff:3.500A) No H-bonds generated for 'chain '1' and resid 32 through 37' Processing helix chain '1' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 1 92 " --> pdb=" O GLU 1 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU 1 93 " --> pdb=" O LEU 1 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG 1 94 " --> pdb=" O ASP 1 90 " (cutoff:3.500A) Processing helix chain '1' and resid 101 through 121 Processing helix chain '1' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU 1 148 " --> pdb=" O THR 1 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 1 149 " --> pdb=" O PRO 1 145 " (cutoff:3.500A) Processing helix chain '1' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU 1 183 " --> pdb=" O ASN 1 179 " (cutoff:3.500A) Processing helix chain '1' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU 1 191 " --> pdb=" O GLU 1 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU 1 192 " --> pdb=" O LYS 1 188 " (cutoff:3.500A) Processing helix chain '2' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 2 29 " --> pdb=" O GLU 2 25 " (cutoff:3.500A) Processing helix chain '2' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE 2 36 " --> pdb=" O TYR 2 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 2 37 " --> pdb=" O GLY 2 33 " (cutoff:3.500A) No H-bonds generated for 'chain '2' and resid 32 through 37' Processing helix chain '2' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU 2 92 " --> pdb=" O GLU 2 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 2 93 " --> pdb=" O LEU 2 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG 2 94 " --> pdb=" O ASP 2 90 " (cutoff:3.500A) Processing helix chain '2' and resid 101 through 121 Processing helix chain '2' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 2 148 " --> pdb=" O THR 2 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 2 149 " --> pdb=" O PRO 2 145 " (cutoff:3.500A) Processing helix chain '2' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU 2 183 " --> pdb=" O ASN 2 179 " (cutoff:3.500A) Processing helix chain '2' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 2 191 " --> pdb=" O GLU 2 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 2 192 " --> pdb=" O LYS 2 188 " (cutoff:3.500A) Processing helix chain '3' and resid 12 through 31 removed outlier: 3.816A pdb=" N THR 3 29 " --> pdb=" O GLU 3 25 " (cutoff:3.500A) Processing helix chain '3' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE 3 36 " --> pdb=" O TYR 3 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 3 37 " --> pdb=" O GLY 3 33 " (cutoff:3.500A) No H-bonds generated for 'chain '3' and resid 32 through 37' Processing helix chain '3' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU 3 92 " --> pdb=" O GLU 3 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 3 93 " --> pdb=" O LEU 3 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG 3 94 " --> pdb=" O ASP 3 90 " (cutoff:3.500A) Processing helix chain '3' and resid 101 through 121 Processing helix chain '3' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 3 148 " --> pdb=" O THR 3 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 3 149 " --> pdb=" O PRO 3 145 " (cutoff:3.500A) Processing helix chain '3' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU 3 183 " --> pdb=" O ASN 3 179 " (cutoff:3.500A) Processing helix chain '3' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 3 191 " --> pdb=" O GLU 3 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU 3 192 " --> pdb=" O LYS 3 188 " (cutoff:3.500A) Processing helix chain '4' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 4 29 " --> pdb=" O GLU 4 25 " (cutoff:3.500A) Processing helix chain '4' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE 4 36 " --> pdb=" O TYR 4 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL 4 37 " --> pdb=" O GLY 4 33 " (cutoff:3.500A) No H-bonds generated for 'chain '4' and resid 32 through 37' Processing helix chain '4' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 4 92 " --> pdb=" O GLU 4 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 4 93 " --> pdb=" O LEU 4 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG 4 94 " --> pdb=" O ASP 4 90 " (cutoff:3.500A) Processing helix chain '4' and resid 101 through 121 Processing helix chain '4' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU 4 148 " --> pdb=" O THR 4 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 4 149 " --> pdb=" O PRO 4 145 " (cutoff:3.500A) Processing helix chain '4' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU 4 183 " --> pdb=" O ASN 4 179 " (cutoff:3.500A) Processing helix chain '4' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 4 191 " --> pdb=" O GLU 4 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 4 192 " --> pdb=" O LYS 4 188 " (cutoff:3.500A) Processing helix chain '5' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 5 29 " --> pdb=" O GLU 5 25 " (cutoff:3.500A) Processing helix chain '5' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE 5 36 " --> pdb=" O TYR 5 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 5 37 " --> pdb=" O GLY 5 33 " (cutoff:3.500A) No H-bonds generated for 'chain '5' and resid 32 through 37' Processing helix chain '5' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 5 92 " --> pdb=" O GLU 5 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 5 93 " --> pdb=" O LEU 5 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG 5 94 " --> pdb=" O ASP 5 90 " (cutoff:3.500A) Processing helix chain '5' and resid 101 through 121 Processing helix chain '5' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 5 148 " --> pdb=" O THR 5 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 5 149 " --> pdb=" O PRO 5 145 " (cutoff:3.500A) Processing helix chain '5' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU 5 183 " --> pdb=" O ASN 5 179 " (cutoff:3.500A) Processing helix chain '5' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 5 191 " --> pdb=" O GLU 5 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 5 192 " --> pdb=" O LYS 5 188 " (cutoff:3.500A) Processing helix chain '6' and resid 12 through 31 removed outlier: 3.816A pdb=" N THR 6 29 " --> pdb=" O GLU 6 25 " (cutoff:3.500A) Processing helix chain '6' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE 6 36 " --> pdb=" O TYR 6 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 6 37 " --> pdb=" O GLY 6 33 " (cutoff:3.500A) No H-bonds generated for 'chain '6' and resid 32 through 37' Processing helix chain '6' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 6 92 " --> pdb=" O GLU 6 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 6 93 " --> pdb=" O LEU 6 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG 6 94 " --> pdb=" O ASP 6 90 " (cutoff:3.500A) Processing helix chain '6' and resid 101 through 121 Processing helix chain '6' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 6 148 " --> pdb=" O THR 6 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 6 149 " --> pdb=" O PRO 6 145 " (cutoff:3.500A) Processing helix chain '6' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU 6 183 " --> pdb=" O ASN 6 179 " (cutoff:3.500A) Processing helix chain '6' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 6 191 " --> pdb=" O GLU 6 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU 6 192 " --> pdb=" O LYS 6 188 " (cutoff:3.500A) Processing helix chain '7' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 7 29 " --> pdb=" O GLU 7 25 " (cutoff:3.500A) Processing helix chain '7' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE 7 36 " --> pdb=" O TYR 7 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 7 37 " --> pdb=" O GLY 7 33 " (cutoff:3.500A) No H-bonds generated for 'chain '7' and resid 32 through 37' Processing helix chain '7' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 7 92 " --> pdb=" O GLU 7 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 7 93 " --> pdb=" O LEU 7 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG 7 94 " --> pdb=" O ASP 7 90 " (cutoff:3.500A) Processing helix chain '7' and resid 101 through 121 Processing helix chain '7' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU 7 148 " --> pdb=" O THR 7 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 7 149 " --> pdb=" O PRO 7 145 " (cutoff:3.500A) Processing helix chain '7' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU 7 183 " --> pdb=" O ASN 7 179 " (cutoff:3.500A) Processing helix chain '7' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 7 191 " --> pdb=" O GLU 7 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 7 192 " --> pdb=" O LYS 7 188 " (cutoff:3.500A) Processing helix chain '8' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR 8 29 " --> pdb=" O GLU 8 25 " (cutoff:3.500A) Processing helix chain '8' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE 8 36 " --> pdb=" O TYR 8 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 8 37 " --> pdb=" O GLY 8 33 " (cutoff:3.500A) No H-bonds generated for 'chain '8' and resid 32 through 37' Processing helix chain '8' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU 8 92 " --> pdb=" O GLU 8 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU 8 93 " --> pdb=" O LEU 8 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG 8 94 " --> pdb=" O ASP 8 90 " (cutoff:3.500A) Processing helix chain '8' and resid 101 through 121 Processing helix chain '8' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 8 148 " --> pdb=" O THR 8 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 8 149 " --> pdb=" O PRO 8 145 " (cutoff:3.500A) Processing helix chain '8' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU 8 183 " --> pdb=" O ASN 8 179 " (cutoff:3.500A) Processing helix chain '8' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 8 191 " --> pdb=" O GLU 8 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU 8 192 " --> pdb=" O LYS 8 188 " (cutoff:3.500A) Processing helix chain '9' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR 9 29 " --> pdb=" O GLU 9 25 " (cutoff:3.500A) Processing helix chain '9' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE 9 36 " --> pdb=" O TYR 9 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL 9 37 " --> pdb=" O GLY 9 33 " (cutoff:3.500A) No H-bonds generated for 'chain '9' and resid 32 through 37' Processing helix chain '9' and resid 85 through 95 removed outlier: 4.177A pdb=" N LEU 9 92 " --> pdb=" O GLU 9 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU 9 93 " --> pdb=" O LEU 9 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG 9 94 " --> pdb=" O ASP 9 90 " (cutoff:3.500A) Processing helix chain '9' and resid 101 through 121 Processing helix chain '9' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU 9 148 " --> pdb=" O THR 9 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU 9 149 " --> pdb=" O PRO 9 145 " (cutoff:3.500A) Processing helix chain '9' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU 9 183 " --> pdb=" O ASN 9 179 " (cutoff:3.500A) Processing helix chain '9' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU 9 191 " --> pdb=" O GLU 9 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU 9 192 " --> pdb=" O LYS 9 188 " (cutoff:3.500A) Processing helix chain 'a' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR a 29 " --> pdb=" O GLU a 25 " (cutoff:3.500A) Processing helix chain 'a' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE a 36 " --> pdb=" O TYR a 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL a 37 " --> pdb=" O GLY a 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'a' and resid 32 through 37' Processing helix chain 'a' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU a 92 " --> pdb=" O GLU a 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU a 93 " --> pdb=" O LEU a 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG a 94 " --> pdb=" O ASP a 90 " (cutoff:3.500A) Processing helix chain 'a' and resid 101 through 121 Processing helix chain 'a' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU a 148 " --> pdb=" O THR a 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU a 149 " --> pdb=" O PRO a 145 " (cutoff:3.500A) Processing helix chain 'a' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU a 183 " --> pdb=" O ASN a 179 " (cutoff:3.500A) Processing helix chain 'a' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU a 191 " --> pdb=" O GLU a 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU a 192 " --> pdb=" O LYS a 188 " (cutoff:3.500A) Processing helix chain 'b' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR b 29 " --> pdb=" O GLU b 25 " (cutoff:3.500A) Processing helix chain 'b' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE b 36 " --> pdb=" O TYR b 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL b 37 " --> pdb=" O GLY b 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'b' and resid 32 through 37' Processing helix chain 'b' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU b 92 " --> pdb=" O GLU b 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU b 93 " --> pdb=" O LEU b 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG b 94 " --> pdb=" O ASP b 90 " (cutoff:3.500A) Processing helix chain 'b' and resid 101 through 121 Processing helix chain 'b' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU b 148 " --> pdb=" O THR b 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU b 149 " --> pdb=" O PRO b 145 " (cutoff:3.500A) Processing helix chain 'b' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU b 183 " --> pdb=" O ASN b 179 " (cutoff:3.500A) Processing helix chain 'b' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU b 191 " --> pdb=" O GLU b 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU b 192 " --> pdb=" O LYS b 188 " (cutoff:3.500A) Processing helix chain 'c' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR c 29 " --> pdb=" O GLU c 25 " (cutoff:3.500A) Processing helix chain 'c' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE c 36 " --> pdb=" O TYR c 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL c 37 " --> pdb=" O GLY c 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'c' and resid 32 through 37' Processing helix chain 'c' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU c 92 " --> pdb=" O GLU c 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU c 93 " --> pdb=" O LEU c 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG c 94 " --> pdb=" O ASP c 90 " (cutoff:3.500A) Processing helix chain 'c' and resid 101 through 121 Processing helix chain 'c' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU c 148 " --> pdb=" O THR c 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU c 149 " --> pdb=" O PRO c 145 " (cutoff:3.500A) Processing helix chain 'c' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU c 183 " --> pdb=" O ASN c 179 " (cutoff:3.500A) Processing helix chain 'c' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU c 191 " --> pdb=" O GLU c 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU c 192 " --> pdb=" O LYS c 188 " (cutoff:3.500A) Processing helix chain 'd' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR d 29 " --> pdb=" O GLU d 25 " (cutoff:3.500A) Processing helix chain 'd' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE d 36 " --> pdb=" O TYR d 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL d 37 " --> pdb=" O GLY d 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'd' and resid 32 through 37' Processing helix chain 'd' and resid 85 through 95 removed outlier: 4.177A pdb=" N LEU d 92 " --> pdb=" O GLU d 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU d 93 " --> pdb=" O LEU d 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG d 94 " --> pdb=" O ASP d 90 " (cutoff:3.500A) Processing helix chain 'd' and resid 101 through 121 Processing helix chain 'd' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU d 148 " --> pdb=" O THR d 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU d 149 " --> pdb=" O PRO d 145 " (cutoff:3.500A) Processing helix chain 'd' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU d 183 " --> pdb=" O ASN d 179 " (cutoff:3.500A) Processing helix chain 'd' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU d 191 " --> pdb=" O GLU d 187 " (cutoff:3.500A) removed outlier: 4.016A pdb=" N GLU d 192 " --> pdb=" O LYS d 188 " (cutoff:3.500A) Processing helix chain 'e' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR e 29 " --> pdb=" O GLU e 25 " (cutoff:3.500A) Processing helix chain 'e' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE e 36 " --> pdb=" O TYR e 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL e 37 " --> pdb=" O GLY e 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'e' and resid 32 through 37' Processing helix chain 'e' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU e 92 " --> pdb=" O GLU e 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU e 93 " --> pdb=" O LEU e 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG e 94 " --> pdb=" O ASP e 90 " (cutoff:3.500A) Processing helix chain 'e' and resid 101 through 121 Processing helix chain 'e' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU e 148 " --> pdb=" O THR e 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU e 149 " --> pdb=" O PRO e 145 " (cutoff:3.500A) Processing helix chain 'e' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU e 183 " --> pdb=" O ASN e 179 " (cutoff:3.500A) Processing helix chain 'e' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU e 191 " --> pdb=" O GLU e 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU e 192 " --> pdb=" O LYS e 188 " (cutoff:3.500A) Processing helix chain 'f' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR f 29 " --> pdb=" O GLU f 25 " (cutoff:3.500A) Processing helix chain 'f' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE f 36 " --> pdb=" O TYR f 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL f 37 " --> pdb=" O GLY f 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'f' and resid 32 through 37' Processing helix chain 'f' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU f 92 " --> pdb=" O GLU f 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU f 93 " --> pdb=" O LEU f 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG f 94 " --> pdb=" O ASP f 90 " (cutoff:3.500A) Processing helix chain 'f' and resid 101 through 121 Processing helix chain 'f' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU f 148 " --> pdb=" O THR f 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU f 149 " --> pdb=" O PRO f 145 " (cutoff:3.500A) Processing helix chain 'f' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU f 183 " --> pdb=" O ASN f 179 " (cutoff:3.500A) Processing helix chain 'f' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU f 191 " --> pdb=" O GLU f 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU f 192 " --> pdb=" O LYS f 188 " (cutoff:3.500A) Processing helix chain 'g' and resid 12 through 31 removed outlier: 3.814A pdb=" N THR g 29 " --> pdb=" O GLU g 25 " (cutoff:3.500A) Processing helix chain 'g' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE g 36 " --> pdb=" O TYR g 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL g 37 " --> pdb=" O GLY g 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'g' and resid 32 through 37' Processing helix chain 'g' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU g 92 " --> pdb=" O GLU g 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU g 93 " --> pdb=" O LEU g 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG g 94 " --> pdb=" O ASP g 90 " (cutoff:3.500A) Processing helix chain 'g' and resid 101 through 121 Processing helix chain 'g' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU g 148 " --> pdb=" O THR g 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU g 149 " --> pdb=" O PRO g 145 " (cutoff:3.500A) Processing helix chain 'g' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU g 183 " --> pdb=" O ASN g 179 " (cutoff:3.500A) Processing helix chain 'g' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU g 191 " --> pdb=" O GLU g 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU g 192 " --> pdb=" O LYS g 188 " (cutoff:3.500A) Processing helix chain 'h' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR h 29 " --> pdb=" O GLU h 25 " (cutoff:3.500A) Processing helix chain 'h' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE h 36 " --> pdb=" O TYR h 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL h 37 " --> pdb=" O GLY h 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'h' and resid 32 through 37' Processing helix chain 'h' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU h 92 " --> pdb=" O GLU h 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU h 93 " --> pdb=" O LEU h 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG h 94 " --> pdb=" O ASP h 90 " (cutoff:3.500A) Processing helix chain 'h' and resid 101 through 121 Processing helix chain 'h' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU h 148 " --> pdb=" O THR h 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU h 149 " --> pdb=" O PRO h 145 " (cutoff:3.500A) Processing helix chain 'h' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU h 183 " --> pdb=" O ASN h 179 " (cutoff:3.500A) Processing helix chain 'h' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU h 191 " --> pdb=" O GLU h 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU h 192 " --> pdb=" O LYS h 188 " (cutoff:3.500A) Processing helix chain 'i' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR i 29 " --> pdb=" O GLU i 25 " (cutoff:3.500A) Processing helix chain 'i' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE i 36 " --> pdb=" O TYR i 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL i 37 " --> pdb=" O GLY i 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'i' and resid 32 through 37' Processing helix chain 'i' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU i 92 " --> pdb=" O GLU i 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU i 93 " --> pdb=" O LEU i 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG i 94 " --> pdb=" O ASP i 90 " (cutoff:3.500A) Processing helix chain 'i' and resid 101 through 121 Processing helix chain 'i' and resid 144 through 163 removed outlier: 3.510A pdb=" N LEU i 148 " --> pdb=" O THR i 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU i 149 " --> pdb=" O PRO i 145 " (cutoff:3.500A) Processing helix chain 'i' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU i 183 " --> pdb=" O ASN i 179 " (cutoff:3.500A) Processing helix chain 'i' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU i 191 " --> pdb=" O GLU i 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU i 192 " --> pdb=" O LYS i 188 " (cutoff:3.500A) Processing helix chain 'j' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR j 29 " --> pdb=" O GLU j 25 " (cutoff:3.500A) Processing helix chain 'j' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE j 36 " --> pdb=" O TYR j 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL j 37 " --> pdb=" O GLY j 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'j' and resid 32 through 37' Processing helix chain 'j' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU j 92 " --> pdb=" O GLU j 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU j 93 " --> pdb=" O LEU j 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG j 94 " --> pdb=" O ASP j 90 " (cutoff:3.500A) Processing helix chain 'j' and resid 101 through 121 Processing helix chain 'j' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU j 148 " --> pdb=" O THR j 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU j 149 " --> pdb=" O PRO j 145 " (cutoff:3.500A) Processing helix chain 'j' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU j 183 " --> pdb=" O ASN j 179 " (cutoff:3.500A) Processing helix chain 'j' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU j 191 " --> pdb=" O GLU j 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU j 192 " --> pdb=" O LYS j 188 " (cutoff:3.500A) Processing helix chain 'k' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR k 29 " --> pdb=" O GLU k 25 " (cutoff:3.500A) Processing helix chain 'k' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE k 36 " --> pdb=" O TYR k 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL k 37 " --> pdb=" O GLY k 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'k' and resid 32 through 37' Processing helix chain 'k' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU k 92 " --> pdb=" O GLU k 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU k 93 " --> pdb=" O LEU k 89 " (cutoff:3.500A) removed outlier: 3.773A pdb=" N ARG k 94 " --> pdb=" O ASP k 90 " (cutoff:3.500A) Processing helix chain 'k' and resid 101 through 121 Processing helix chain 'k' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU k 148 " --> pdb=" O THR k 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU k 149 " --> pdb=" O PRO k 145 " (cutoff:3.500A) Processing helix chain 'k' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU k 183 " --> pdb=" O ASN k 179 " (cutoff:3.500A) Processing helix chain 'k' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU k 191 " --> pdb=" O GLU k 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU k 192 " --> pdb=" O LYS k 188 " (cutoff:3.500A) Processing helix chain 'l' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR l 29 " --> pdb=" O GLU l 25 " (cutoff:3.500A) Processing helix chain 'l' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE l 36 " --> pdb=" O TYR l 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL l 37 " --> pdb=" O GLY l 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'l' and resid 32 through 37' Processing helix chain 'l' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU l 92 " --> pdb=" O GLU l 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU l 93 " --> pdb=" O LEU l 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG l 94 " --> pdb=" O ASP l 90 " (cutoff:3.500A) Processing helix chain 'l' and resid 101 through 121 Processing helix chain 'l' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU l 148 " --> pdb=" O THR l 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU l 149 " --> pdb=" O PRO l 145 " (cutoff:3.500A) Processing helix chain 'l' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU l 183 " --> pdb=" O ASN l 179 " (cutoff:3.500A) Processing helix chain 'l' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU l 191 " --> pdb=" O GLU l 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU l 192 " --> pdb=" O LYS l 188 " (cutoff:3.500A) Processing helix chain 'm' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR m 29 " --> pdb=" O GLU m 25 " (cutoff:3.500A) Processing helix chain 'm' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE m 36 " --> pdb=" O TYR m 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL m 37 " --> pdb=" O GLY m 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'm' and resid 32 through 37' Processing helix chain 'm' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU m 92 " --> pdb=" O GLU m 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU m 93 " --> pdb=" O LEU m 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG m 94 " --> pdb=" O ASP m 90 " (cutoff:3.500A) Processing helix chain 'm' and resid 101 through 121 Processing helix chain 'm' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU m 148 " --> pdb=" O THR m 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU m 149 " --> pdb=" O PRO m 145 " (cutoff:3.500A) Processing helix chain 'm' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU m 183 " --> pdb=" O ASN m 179 " (cutoff:3.500A) Processing helix chain 'm' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU m 191 " --> pdb=" O GLU m 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU m 192 " --> pdb=" O LYS m 188 " (cutoff:3.500A) Processing helix chain 'n' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR n 29 " --> pdb=" O GLU n 25 " (cutoff:3.500A) Processing helix chain 'n' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE n 36 " --> pdb=" O TYR n 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL n 37 " --> pdb=" O GLY n 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'n' and resid 32 through 37' Processing helix chain 'n' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU n 92 " --> pdb=" O GLU n 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU n 93 " --> pdb=" O LEU n 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG n 94 " --> pdb=" O ASP n 90 " (cutoff:3.500A) Processing helix chain 'n' and resid 101 through 121 Processing helix chain 'n' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU n 148 " --> pdb=" O THR n 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU n 149 " --> pdb=" O PRO n 145 " (cutoff:3.500A) Processing helix chain 'n' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU n 183 " --> pdb=" O ASN n 179 " (cutoff:3.500A) Processing helix chain 'n' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU n 191 " --> pdb=" O GLU n 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU n 192 " --> pdb=" O LYS n 188 " (cutoff:3.500A) Processing helix chain 'o' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR o 29 " --> pdb=" O GLU o 25 " (cutoff:3.500A) Processing helix chain 'o' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE o 36 " --> pdb=" O TYR o 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL o 37 " --> pdb=" O GLY o 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'o' and resid 32 through 37' Processing helix chain 'o' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU o 92 " --> pdb=" O GLU o 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU o 93 " --> pdb=" O LEU o 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG o 94 " --> pdb=" O ASP o 90 " (cutoff:3.500A) Processing helix chain 'o' and resid 101 through 121 Processing helix chain 'o' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU o 148 " --> pdb=" O THR o 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU o 149 " --> pdb=" O PRO o 145 " (cutoff:3.500A) Processing helix chain 'o' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU o 183 " --> pdb=" O ASN o 179 " (cutoff:3.500A) Processing helix chain 'o' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU o 191 " --> pdb=" O GLU o 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU o 192 " --> pdb=" O LYS o 188 " (cutoff:3.500A) Processing helix chain 'p' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR p 29 " --> pdb=" O GLU p 25 " (cutoff:3.500A) Processing helix chain 'p' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE p 36 " --> pdb=" O TYR p 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL p 37 " --> pdb=" O GLY p 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'p' and resid 32 through 37' Processing helix chain 'p' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU p 92 " --> pdb=" O GLU p 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU p 93 " --> pdb=" O LEU p 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG p 94 " --> pdb=" O ASP p 90 " (cutoff:3.500A) Processing helix chain 'p' and resid 101 through 121 Processing helix chain 'p' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU p 148 " --> pdb=" O THR p 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU p 149 " --> pdb=" O PRO p 145 " (cutoff:3.500A) Processing helix chain 'p' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU p 183 " --> pdb=" O ASN p 179 " (cutoff:3.500A) Processing helix chain 'p' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU p 191 " --> pdb=" O GLU p 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU p 192 " --> pdb=" O LYS p 188 " (cutoff:3.500A) Processing helix chain 'q' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR q 29 " --> pdb=" O GLU q 25 " (cutoff:3.500A) Processing helix chain 'q' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE q 36 " --> pdb=" O TYR q 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL q 37 " --> pdb=" O GLY q 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'q' and resid 32 through 37' Processing helix chain 'q' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU q 92 " --> pdb=" O GLU q 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU q 93 " --> pdb=" O LEU q 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG q 94 " --> pdb=" O ASP q 90 " (cutoff:3.500A) Processing helix chain 'q' and resid 101 through 121 Processing helix chain 'q' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU q 148 " --> pdb=" O THR q 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU q 149 " --> pdb=" O PRO q 145 " (cutoff:3.500A) Processing helix chain 'q' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU q 183 " --> pdb=" O ASN q 179 " (cutoff:3.500A) Processing helix chain 'q' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU q 191 " --> pdb=" O GLU q 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU q 192 " --> pdb=" O LYS q 188 " (cutoff:3.500A) Processing helix chain 'r' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR r 29 " --> pdb=" O GLU r 25 " (cutoff:3.500A) Processing helix chain 'r' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE r 36 " --> pdb=" O TYR r 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL r 37 " --> pdb=" O GLY r 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'r' and resid 32 through 37' Processing helix chain 'r' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU r 92 " --> pdb=" O GLU r 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU r 93 " --> pdb=" O LEU r 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG r 94 " --> pdb=" O ASP r 90 " (cutoff:3.500A) Processing helix chain 'r' and resid 101 through 121 Processing helix chain 'r' and resid 144 through 163 removed outlier: 3.510A pdb=" N LEU r 148 " --> pdb=" O THR r 144 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N LEU r 149 " --> pdb=" O PRO r 145 " (cutoff:3.500A) Processing helix chain 'r' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU r 183 " --> pdb=" O ASN r 179 " (cutoff:3.500A) Processing helix chain 'r' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU r 191 " --> pdb=" O GLU r 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU r 192 " --> pdb=" O LYS r 188 " (cutoff:3.500A) Processing helix chain 's' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR s 29 " --> pdb=" O GLU s 25 " (cutoff:3.500A) Processing helix chain 's' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE s 36 " --> pdb=" O TYR s 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL s 37 " --> pdb=" O GLY s 33 " (cutoff:3.500A) No H-bonds generated for 'chain 's' and resid 32 through 37' Processing helix chain 's' and resid 85 through 95 removed outlier: 4.177A pdb=" N LEU s 92 " --> pdb=" O GLU s 88 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N GLU s 93 " --> pdb=" O LEU s 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG s 94 " --> pdb=" O ASP s 90 " (cutoff:3.500A) Processing helix chain 's' and resid 101 through 121 Processing helix chain 's' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU s 148 " --> pdb=" O THR s 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU s 149 " --> pdb=" O PRO s 145 " (cutoff:3.500A) Processing helix chain 's' and resid 173 through 184 removed outlier: 3.595A pdb=" N GLU s 183 " --> pdb=" O ASN s 179 " (cutoff:3.500A) Processing helix chain 's' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU s 191 " --> pdb=" O GLU s 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU s 192 " --> pdb=" O LYS s 188 " (cutoff:3.500A) Processing helix chain 't' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR t 29 " --> pdb=" O GLU t 25 " (cutoff:3.500A) Processing helix chain 't' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE t 36 " --> pdb=" O TYR t 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL t 37 " --> pdb=" O GLY t 33 " (cutoff:3.500A) No H-bonds generated for 'chain 't' and resid 32 through 37' Processing helix chain 't' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU t 92 " --> pdb=" O GLU t 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU t 93 " --> pdb=" O LEU t 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG t 94 " --> pdb=" O ASP t 90 " (cutoff:3.500A) Processing helix chain 't' and resid 101 through 121 Processing helix chain 't' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU t 148 " --> pdb=" O THR t 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU t 149 " --> pdb=" O PRO t 145 " (cutoff:3.500A) Processing helix chain 't' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU t 183 " --> pdb=" O ASN t 179 " (cutoff:3.500A) Processing helix chain 't' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU t 191 " --> pdb=" O GLU t 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU t 192 " --> pdb=" O LYS t 188 " (cutoff:3.500A) Processing helix chain 'u' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR u 29 " --> pdb=" O GLU u 25 " (cutoff:3.500A) Processing helix chain 'u' and resid 32 through 37 removed outlier: 4.676A pdb=" N PHE u 36 " --> pdb=" O TYR u 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL u 37 " --> pdb=" O GLY u 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'u' and resid 32 through 37' Processing helix chain 'u' and resid 85 through 95 removed outlier: 4.179A pdb=" N LEU u 92 " --> pdb=" O GLU u 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU u 93 " --> pdb=" O LEU u 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG u 94 " --> pdb=" O ASP u 90 " (cutoff:3.500A) Processing helix chain 'u' and resid 101 through 121 Processing helix chain 'u' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU u 148 " --> pdb=" O THR u 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU u 149 " --> pdb=" O PRO u 145 " (cutoff:3.500A) Processing helix chain 'u' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU u 183 " --> pdb=" O ASN u 179 " (cutoff:3.500A) Processing helix chain 'u' and resid 187 through 195 removed outlier: 6.208A pdb=" N GLU u 191 " --> pdb=" O GLU u 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU u 192 " --> pdb=" O LYS u 188 " (cutoff:3.500A) Processing helix chain 'v' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR v 29 " --> pdb=" O GLU v 25 " (cutoff:3.500A) Processing helix chain 'v' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE v 36 " --> pdb=" O TYR v 32 " (cutoff:3.500A) removed outlier: 3.783A pdb=" N VAL v 37 " --> pdb=" O GLY v 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'v' and resid 32 through 37' Processing helix chain 'v' and resid 85 through 95 removed outlier: 4.177A pdb=" N LEU v 92 " --> pdb=" O GLU v 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU v 93 " --> pdb=" O LEU v 89 " (cutoff:3.500A) removed outlier: 3.771A pdb=" N ARG v 94 " --> pdb=" O ASP v 90 " (cutoff:3.500A) Processing helix chain 'v' and resid 101 through 121 Processing helix chain 'v' and resid 144 through 163 removed outlier: 3.511A pdb=" N LEU v 148 " --> pdb=" O THR v 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU v 149 " --> pdb=" O PRO v 145 " (cutoff:3.500A) Processing helix chain 'v' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU v 183 " --> pdb=" O ASN v 179 " (cutoff:3.500A) Processing helix chain 'v' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU v 191 " --> pdb=" O GLU v 187 " (cutoff:3.500A) removed outlier: 4.017A pdb=" N GLU v 192 " --> pdb=" O LYS v 188 " (cutoff:3.500A) Processing helix chain 'w' and resid 12 through 31 removed outlier: 3.815A pdb=" N THR w 29 " --> pdb=" O GLU w 25 " (cutoff:3.500A) Processing helix chain 'w' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE w 36 " --> pdb=" O TYR w 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL w 37 " --> pdb=" O GLY w 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'w' and resid 32 through 37' Processing helix chain 'w' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU w 92 " --> pdb=" O GLU w 88 " (cutoff:3.500A) removed outlier: 4.485A pdb=" N GLU w 93 " --> pdb=" O LEU w 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG w 94 " --> pdb=" O ASP w 90 " (cutoff:3.500A) Processing helix chain 'w' and resid 101 through 121 Processing helix chain 'w' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU w 148 " --> pdb=" O THR w 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU w 149 " --> pdb=" O PRO w 145 " (cutoff:3.500A) Processing helix chain 'w' and resid 173 through 184 removed outlier: 3.597A pdb=" N GLU w 183 " --> pdb=" O ASN w 179 " (cutoff:3.500A) Processing helix chain 'w' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU w 191 " --> pdb=" O GLU w 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU w 192 " --> pdb=" O LYS w 188 " (cutoff:3.500A) Processing helix chain 'x' and resid 12 through 31 removed outlier: 3.816A pdb=" N THR x 29 " --> pdb=" O GLU x 25 " (cutoff:3.500A) Processing helix chain 'x' and resid 32 through 37 removed outlier: 4.675A pdb=" N PHE x 36 " --> pdb=" O TYR x 32 " (cutoff:3.500A) removed outlier: 3.782A pdb=" N VAL x 37 " --> pdb=" O GLY x 33 " (cutoff:3.500A) No H-bonds generated for 'chain 'x' and resid 32 through 37' Processing helix chain 'x' and resid 85 through 95 removed outlier: 4.178A pdb=" N LEU x 92 " --> pdb=" O GLU x 88 " (cutoff:3.500A) removed outlier: 4.486A pdb=" N GLU x 93 " --> pdb=" O LEU x 89 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ARG x 94 " --> pdb=" O ASP x 90 " (cutoff:3.500A) Processing helix chain 'x' and resid 101 through 121 Processing helix chain 'x' and resid 144 through 163 removed outlier: 3.512A pdb=" N LEU x 148 " --> pdb=" O THR x 144 " (cutoff:3.500A) removed outlier: 3.743A pdb=" N LEU x 149 " --> pdb=" O PRO x 145 " (cutoff:3.500A) Processing helix chain 'x' and resid 173 through 184 removed outlier: 3.596A pdb=" N GLU x 183 " --> pdb=" O ASN x 179 " (cutoff:3.500A) Processing helix chain 'x' and resid 187 through 195 removed outlier: 6.209A pdb=" N GLU x 191 " --> pdb=" O GLU x 187 " (cutoff:3.500A) removed outlier: 4.018A pdb=" N GLU x 192 " --> pdb=" O LYS x 188 " (cutoff:3.500A) Processing sheet with id= 1, first strand: chain 'A' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA A 48 " --> pdb=" O LEU A 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS A 71 " --> pdb=" O LEU A 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU A 54 " --> pdb=" O LYS A 71 " (cutoff:3.500A) Processing sheet with id= 2, first strand: chain 'A' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG A 137 " --> pdb=" O LEU A 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA A 255 " --> pdb=" O SER A 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA A 208 " --> pdb=" O LEU A 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS A 198 " --> pdb=" O TYR A 168 " (cutoff:3.500A) Processing sheet with id= 3, first strand: chain 'A' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP A 217 " --> pdb=" O VAL A 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR A 245 " --> pdb=" O GLY A 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG A 239 " --> pdb=" O GLU A 231 " (cutoff:3.500A) Processing sheet with id= 4, first strand: chain 'A' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU A 244 " --> pdb=" O LEU A 78 " (cutoff:3.500A) Processing sheet with id= 5, first strand: chain 'B' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA B 48 " --> pdb=" O LEU B 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS B 71 " --> pdb=" O LEU B 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU B 54 " --> pdb=" O LYS B 71 " (cutoff:3.500A) Processing sheet with id= 6, first strand: chain 'B' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG B 137 " --> pdb=" O LEU B 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA B 255 " --> pdb=" O SER B 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA B 208 " --> pdb=" O LEU B 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS B 198 " --> pdb=" O TYR B 168 " (cutoff:3.500A) Processing sheet with id= 7, first strand: chain 'B' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP B 217 " --> pdb=" O VAL B 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR B 245 " --> pdb=" O GLY B 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG B 239 " --> pdb=" O GLU B 231 " (cutoff:3.500A) Processing sheet with id= 8, first strand: chain 'B' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU B 244 " --> pdb=" O LEU B 78 " (cutoff:3.500A) Processing sheet with id= 9, first strand: chain 'C' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA C 48 " --> pdb=" O LEU C 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS C 71 " --> pdb=" O LEU C 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU C 54 " --> pdb=" O LYS C 71 " (cutoff:3.500A) Processing sheet with id= 10, first strand: chain 'C' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG C 137 " --> pdb=" O LEU C 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA C 255 " --> pdb=" O SER C 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA C 208 " --> pdb=" O LEU C 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS C 198 " --> pdb=" O TYR C 168 " (cutoff:3.500A) Processing sheet with id= 11, first strand: chain 'C' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP C 217 " --> pdb=" O VAL C 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR C 245 " --> pdb=" O GLY C 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG C 239 " --> pdb=" O GLU C 231 " (cutoff:3.500A) Processing sheet with id= 12, first strand: chain 'C' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU C 244 " --> pdb=" O LEU C 78 " (cutoff:3.500A) Processing sheet with id= 13, first strand: chain 'D' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA D 48 " --> pdb=" O LEU D 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS D 71 " --> pdb=" O LEU D 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU D 54 " --> pdb=" O LYS D 71 " (cutoff:3.500A) Processing sheet with id= 14, first strand: chain 'D' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG D 137 " --> pdb=" O LEU D 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA D 255 " --> pdb=" O SER D 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA D 208 " --> pdb=" O LEU D 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS D 198 " --> pdb=" O TYR D 168 " (cutoff:3.500A) Processing sheet with id= 15, first strand: chain 'D' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP D 217 " --> pdb=" O VAL D 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR D 245 " --> pdb=" O GLY D 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG D 239 " --> pdb=" O GLU D 231 " (cutoff:3.500A) Processing sheet with id= 16, first strand: chain 'D' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU D 244 " --> pdb=" O LEU D 78 " (cutoff:3.500A) Processing sheet with id= 17, first strand: chain 'E' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA E 48 " --> pdb=" O LEU E 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS E 71 " --> pdb=" O LEU E 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU E 54 " --> pdb=" O LYS E 71 " (cutoff:3.500A) Processing sheet with id= 18, first strand: chain 'E' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG E 137 " --> pdb=" O LEU E 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA E 255 " --> pdb=" O SER E 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA E 208 " --> pdb=" O LEU E 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS E 198 " --> pdb=" O TYR E 168 " (cutoff:3.500A) Processing sheet with id= 19, first strand: chain 'E' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP E 217 " --> pdb=" O VAL E 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR E 245 " --> pdb=" O GLY E 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG E 239 " --> pdb=" O GLU E 231 " (cutoff:3.500A) Processing sheet with id= 20, first strand: chain 'E' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU E 244 " --> pdb=" O LEU E 78 " (cutoff:3.500A) Processing sheet with id= 21, first strand: chain 'F' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA F 48 " --> pdb=" O LEU F 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS F 71 " --> pdb=" O LEU F 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU F 54 " --> pdb=" O LYS F 71 " (cutoff:3.500A) Processing sheet with id= 22, first strand: chain 'F' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG F 137 " --> pdb=" O LEU F 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA F 255 " --> pdb=" O SER F 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA F 208 " --> pdb=" O LEU F 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS F 198 " --> pdb=" O TYR F 168 " (cutoff:3.500A) Processing sheet with id= 23, first strand: chain 'F' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP F 217 " --> pdb=" O VAL F 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR F 245 " --> pdb=" O GLY F 223 " (cutoff:3.500A) removed outlier: 6.939A pdb=" N ARG F 239 " --> pdb=" O GLU F 231 " (cutoff:3.500A) Processing sheet with id= 24, first strand: chain 'F' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU F 244 " --> pdb=" O LEU F 78 " (cutoff:3.500A) Processing sheet with id= 25, first strand: chain 'G' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA G 48 " --> pdb=" O LEU G 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS G 71 " --> pdb=" O LEU G 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU G 54 " --> pdb=" O LYS G 71 " (cutoff:3.500A) Processing sheet with id= 26, first strand: chain 'G' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG G 137 " --> pdb=" O LEU G 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA G 255 " --> pdb=" O SER G 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA G 208 " --> pdb=" O LEU G 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS G 198 " --> pdb=" O TYR G 168 " (cutoff:3.500A) Processing sheet with id= 27, first strand: chain 'G' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP G 217 " --> pdb=" O VAL G 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR G 245 " --> pdb=" O GLY G 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG G 239 " --> pdb=" O GLU G 231 " (cutoff:3.500A) Processing sheet with id= 28, first strand: chain 'G' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU G 244 " --> pdb=" O LEU G 78 " (cutoff:3.500A) Processing sheet with id= 29, first strand: chain 'H' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA H 48 " --> pdb=" O LEU H 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS H 71 " --> pdb=" O LEU H 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU H 54 " --> pdb=" O LYS H 71 " (cutoff:3.500A) Processing sheet with id= 30, first strand: chain 'H' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG H 137 " --> pdb=" O LEU H 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA H 255 " --> pdb=" O SER H 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA H 208 " --> pdb=" O LEU H 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS H 198 " --> pdb=" O TYR H 168 " (cutoff:3.500A) Processing sheet with id= 31, first strand: chain 'H' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP H 217 " --> pdb=" O VAL H 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR H 245 " --> pdb=" O GLY H 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG H 239 " --> pdb=" O GLU H 231 " (cutoff:3.500A) Processing sheet with id= 32, first strand: chain 'H' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU H 244 " --> pdb=" O LEU H 78 " (cutoff:3.500A) Processing sheet with id= 33, first strand: chain 'I' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA I 48 " --> pdb=" O LEU I 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS I 71 " --> pdb=" O LEU I 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU I 54 " --> pdb=" O LYS I 71 " (cutoff:3.500A) Processing sheet with id= 34, first strand: chain 'I' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG I 137 " --> pdb=" O LEU I 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA I 255 " --> pdb=" O SER I 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA I 208 " --> pdb=" O LEU I 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS I 198 " --> pdb=" O TYR I 168 " (cutoff:3.500A) Processing sheet with id= 35, first strand: chain 'I' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP I 217 " --> pdb=" O VAL I 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR I 245 " --> pdb=" O GLY I 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG I 239 " --> pdb=" O GLU I 231 " (cutoff:3.500A) Processing sheet with id= 36, first strand: chain 'I' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU I 244 " --> pdb=" O LEU I 78 " (cutoff:3.500A) Processing sheet with id= 37, first strand: chain 'J' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA J 48 " --> pdb=" O LEU J 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS J 71 " --> pdb=" O LEU J 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU J 54 " --> pdb=" O LYS J 71 " (cutoff:3.500A) Processing sheet with id= 38, first strand: chain 'J' and resid 137 through 140 removed outlier: 6.005A pdb=" N ARG J 137 " --> pdb=" O LEU J 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA J 255 " --> pdb=" O SER J 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA J 208 " --> pdb=" O LEU J 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS J 198 " --> pdb=" O TYR J 168 " (cutoff:3.500A) Processing sheet with id= 39, first strand: chain 'J' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP J 217 " --> pdb=" O VAL J 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR J 245 " --> pdb=" O GLY J 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG J 239 " --> pdb=" O GLU J 231 " (cutoff:3.500A) Processing sheet with id= 40, first strand: chain 'J' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU J 244 " --> pdb=" O LEU J 78 " (cutoff:3.500A) Processing sheet with id= 41, first strand: chain 'K' and resid 48 through 52 removed outlier: 7.421A pdb=" N ALA K 48 " --> pdb=" O LEU K 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS K 71 " --> pdb=" O LEU K 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU K 54 " --> pdb=" O LYS K 71 " (cutoff:3.500A) Processing sheet with id= 42, first strand: chain 'K' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG K 137 " --> pdb=" O LEU K 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA K 255 " --> pdb=" O SER K 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA K 208 " --> pdb=" O LEU K 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS K 198 " --> pdb=" O TYR K 168 " (cutoff:3.500A) Processing sheet with id= 43, first strand: chain 'K' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP K 217 " --> pdb=" O VAL K 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR K 245 " --> pdb=" O GLY K 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG K 239 " --> pdb=" O GLU K 231 " (cutoff:3.500A) Processing sheet with id= 44, first strand: chain 'K' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU K 244 " --> pdb=" O LEU K 78 " (cutoff:3.500A) Processing sheet with id= 45, first strand: chain 'L' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA L 48 " --> pdb=" O LEU L 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS L 71 " --> pdb=" O LEU L 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU L 54 " --> pdb=" O LYS L 71 " (cutoff:3.500A) Processing sheet with id= 46, first strand: chain 'L' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG L 137 " --> pdb=" O LEU L 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA L 255 " --> pdb=" O SER L 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA L 208 " --> pdb=" O LEU L 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS L 198 " --> pdb=" O TYR L 168 " (cutoff:3.500A) Processing sheet with id= 47, first strand: chain 'L' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP L 217 " --> pdb=" O VAL L 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR L 245 " --> pdb=" O GLY L 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG L 239 " --> pdb=" O GLU L 231 " (cutoff:3.500A) Processing sheet with id= 48, first strand: chain 'L' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU L 244 " --> pdb=" O LEU L 78 " (cutoff:3.500A) Processing sheet with id= 49, first strand: chain 'M' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA M 48 " --> pdb=" O LEU M 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS M 71 " --> pdb=" O LEU M 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU M 54 " --> pdb=" O LYS M 71 " (cutoff:3.500A) Processing sheet with id= 50, first strand: chain 'M' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG M 137 " --> pdb=" O LEU M 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA M 255 " --> pdb=" O SER M 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA M 208 " --> pdb=" O LEU M 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS M 198 " --> pdb=" O TYR M 168 " (cutoff:3.500A) Processing sheet with id= 51, first strand: chain 'M' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP M 217 " --> pdb=" O VAL M 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR M 245 " --> pdb=" O GLY M 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG M 239 " --> pdb=" O GLU M 231 " (cutoff:3.500A) Processing sheet with id= 52, first strand: chain 'M' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU M 244 " --> pdb=" O LEU M 78 " (cutoff:3.500A) Processing sheet with id= 53, first strand: chain 'N' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA N 48 " --> pdb=" O LEU N 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS N 71 " --> pdb=" O LEU N 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU N 54 " --> pdb=" O LYS N 71 " (cutoff:3.500A) Processing sheet with id= 54, first strand: chain 'N' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG N 137 " --> pdb=" O LEU N 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA N 255 " --> pdb=" O SER N 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA N 208 " --> pdb=" O LEU N 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS N 198 " --> pdb=" O TYR N 168 " (cutoff:3.500A) Processing sheet with id= 55, first strand: chain 'N' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP N 217 " --> pdb=" O VAL N 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR N 245 " --> pdb=" O GLY N 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG N 239 " --> pdb=" O GLU N 231 " (cutoff:3.500A) Processing sheet with id= 56, first strand: chain 'N' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU N 244 " --> pdb=" O LEU N 78 " (cutoff:3.500A) Processing sheet with id= 57, first strand: chain 'O' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA O 48 " --> pdb=" O LEU O 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS O 71 " --> pdb=" O LEU O 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU O 54 " --> pdb=" O LYS O 71 " (cutoff:3.500A) Processing sheet with id= 58, first strand: chain 'O' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG O 137 " --> pdb=" O LEU O 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA O 255 " --> pdb=" O SER O 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA O 208 " --> pdb=" O LEU O 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS O 198 " --> pdb=" O TYR O 168 " (cutoff:3.500A) Processing sheet with id= 59, first strand: chain 'O' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP O 217 " --> pdb=" O VAL O 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR O 245 " --> pdb=" O GLY O 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG O 239 " --> pdb=" O GLU O 231 " (cutoff:3.500A) Processing sheet with id= 60, first strand: chain 'O' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU O 244 " --> pdb=" O LEU O 78 " (cutoff:3.500A) Processing sheet with id= 61, first strand: chain 'P' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA P 48 " --> pdb=" O LEU P 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS P 71 " --> pdb=" O LEU P 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU P 54 " --> pdb=" O LYS P 71 " (cutoff:3.500A) Processing sheet with id= 62, first strand: chain 'P' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG P 137 " --> pdb=" O LEU P 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA P 255 " --> pdb=" O SER P 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA P 208 " --> pdb=" O LEU P 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS P 198 " --> pdb=" O TYR P 168 " (cutoff:3.500A) Processing sheet with id= 63, first strand: chain 'P' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP P 217 " --> pdb=" O VAL P 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR P 245 " --> pdb=" O GLY P 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG P 239 " --> pdb=" O GLU P 231 " (cutoff:3.500A) Processing sheet with id= 64, first strand: chain 'P' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU P 244 " --> pdb=" O LEU P 78 " (cutoff:3.500A) Processing sheet with id= 65, first strand: chain 'Q' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA Q 48 " --> pdb=" O LEU Q 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS Q 71 " --> pdb=" O LEU Q 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU Q 54 " --> pdb=" O LYS Q 71 " (cutoff:3.500A) Processing sheet with id= 66, first strand: chain 'Q' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG Q 137 " --> pdb=" O LEU Q 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA Q 255 " --> pdb=" O SER Q 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA Q 208 " --> pdb=" O LEU Q 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS Q 198 " --> pdb=" O TYR Q 168 " (cutoff:3.500A) Processing sheet with id= 67, first strand: chain 'Q' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP Q 217 " --> pdb=" O VAL Q 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR Q 245 " --> pdb=" O GLY Q 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG Q 239 " --> pdb=" O GLU Q 231 " (cutoff:3.500A) Processing sheet with id= 68, first strand: chain 'Q' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU Q 244 " --> pdb=" O LEU Q 78 " (cutoff:3.500A) Processing sheet with id= 69, first strand: chain 'R' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA R 48 " --> pdb=" O LEU R 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS R 71 " --> pdb=" O LEU R 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU R 54 " --> pdb=" O LYS R 71 " (cutoff:3.500A) Processing sheet with id= 70, first strand: chain 'R' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG R 137 " --> pdb=" O LEU R 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA R 255 " --> pdb=" O SER R 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA R 208 " --> pdb=" O LEU R 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS R 198 " --> pdb=" O TYR R 168 " (cutoff:3.500A) Processing sheet with id= 71, first strand: chain 'R' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP R 217 " --> pdb=" O VAL R 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR R 245 " --> pdb=" O GLY R 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG R 239 " --> pdb=" O GLU R 231 " (cutoff:3.500A) Processing sheet with id= 72, first strand: chain 'R' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU R 244 " --> pdb=" O LEU R 78 " (cutoff:3.500A) Processing sheet with id= 73, first strand: chain 'S' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA S 48 " --> pdb=" O LEU S 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS S 71 " --> pdb=" O LEU S 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU S 54 " --> pdb=" O LYS S 71 " (cutoff:3.500A) Processing sheet with id= 74, first strand: chain 'S' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG S 137 " --> pdb=" O LEU S 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA S 255 " --> pdb=" O SER S 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA S 208 " --> pdb=" O LEU S 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS S 198 " --> pdb=" O TYR S 168 " (cutoff:3.500A) Processing sheet with id= 75, first strand: chain 'S' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP S 217 " --> pdb=" O VAL S 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR S 245 " --> pdb=" O GLY S 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG S 239 " --> pdb=" O GLU S 231 " (cutoff:3.500A) Processing sheet with id= 76, first strand: chain 'S' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU S 244 " --> pdb=" O LEU S 78 " (cutoff:3.500A) Processing sheet with id= 77, first strand: chain 'T' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA T 48 " --> pdb=" O LEU T 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS T 71 " --> pdb=" O LEU T 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU T 54 " --> pdb=" O LYS T 71 " (cutoff:3.500A) Processing sheet with id= 78, first strand: chain 'T' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG T 137 " --> pdb=" O LEU T 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA T 255 " --> pdb=" O SER T 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA T 208 " --> pdb=" O LEU T 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS T 198 " --> pdb=" O TYR T 168 " (cutoff:3.500A) Processing sheet with id= 79, first strand: chain 'T' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP T 217 " --> pdb=" O VAL T 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR T 245 " --> pdb=" O GLY T 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG T 239 " --> pdb=" O GLU T 231 " (cutoff:3.500A) Processing sheet with id= 80, first strand: chain 'T' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU T 244 " --> pdb=" O LEU T 78 " (cutoff:3.500A) Processing sheet with id= 81, first strand: chain 'U' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA U 48 " --> pdb=" O LEU U 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS U 71 " --> pdb=" O LEU U 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU U 54 " --> pdb=" O LYS U 71 " (cutoff:3.500A) Processing sheet with id= 82, first strand: chain 'U' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG U 137 " --> pdb=" O LEU U 256 " (cutoff:3.500A) removed outlier: 6.902A pdb=" N ALA U 255 " --> pdb=" O SER U 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA U 208 " --> pdb=" O LEU U 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS U 198 " --> pdb=" O TYR U 168 " (cutoff:3.500A) Processing sheet with id= 83, first strand: chain 'U' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP U 217 " --> pdb=" O VAL U 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR U 245 " --> pdb=" O GLY U 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG U 239 " --> pdb=" O GLU U 231 " (cutoff:3.500A) Processing sheet with id= 84, first strand: chain 'U' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU U 244 " --> pdb=" O LEU U 78 " (cutoff:3.500A) Processing sheet with id= 85, first strand: chain 'V' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA V 48 " --> pdb=" O LEU V 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS V 71 " --> pdb=" O LEU V 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU V 54 " --> pdb=" O LYS V 71 " (cutoff:3.500A) Processing sheet with id= 86, first strand: chain 'V' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG V 137 " --> pdb=" O LEU V 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA V 255 " --> pdb=" O SER V 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA V 208 " --> pdb=" O LEU V 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS V 198 " --> pdb=" O TYR V 168 " (cutoff:3.500A) Processing sheet with id= 87, first strand: chain 'V' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP V 217 " --> pdb=" O VAL V 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR V 245 " --> pdb=" O GLY V 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG V 239 " --> pdb=" O GLU V 231 " (cutoff:3.500A) Processing sheet with id= 88, first strand: chain 'V' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU V 244 " --> pdb=" O LEU V 78 " (cutoff:3.500A) Processing sheet with id= 89, first strand: chain 'W' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA W 48 " --> pdb=" O LEU W 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS W 71 " --> pdb=" O LEU W 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU W 54 " --> pdb=" O LYS W 71 " (cutoff:3.500A) Processing sheet with id= 90, first strand: chain 'W' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG W 137 " --> pdb=" O LEU W 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA W 255 " --> pdb=" O SER W 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA W 208 " --> pdb=" O LEU W 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS W 198 " --> pdb=" O TYR W 168 " (cutoff:3.500A) Processing sheet with id= 91, first strand: chain 'W' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP W 217 " --> pdb=" O VAL W 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR W 245 " --> pdb=" O GLY W 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG W 239 " --> pdb=" O GLU W 231 " (cutoff:3.500A) Processing sheet with id= 92, first strand: chain 'W' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU W 244 " --> pdb=" O LEU W 78 " (cutoff:3.500A) Processing sheet with id= 93, first strand: chain 'X' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA X 48 " --> pdb=" O LEU X 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS X 71 " --> pdb=" O LEU X 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU X 54 " --> pdb=" O LYS X 71 " (cutoff:3.500A) Processing sheet with id= 94, first strand: chain 'X' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG X 137 " --> pdb=" O LEU X 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA X 255 " --> pdb=" O SER X 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA X 208 " --> pdb=" O LEU X 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS X 198 " --> pdb=" O TYR X 168 " (cutoff:3.500A) Processing sheet with id= 95, first strand: chain 'X' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP X 217 " --> pdb=" O VAL X 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR X 245 " --> pdb=" O GLY X 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG X 239 " --> pdb=" O GLU X 231 " (cutoff:3.500A) Processing sheet with id= 96, first strand: chain 'X' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU X 244 " --> pdb=" O LEU X 78 " (cutoff:3.500A) Processing sheet with id= 97, first strand: chain 'Y' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA Y 48 " --> pdb=" O LEU Y 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS Y 71 " --> pdb=" O LEU Y 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU Y 54 " --> pdb=" O LYS Y 71 " (cutoff:3.500A) Processing sheet with id= 98, first strand: chain 'Y' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG Y 137 " --> pdb=" O LEU Y 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA Y 255 " --> pdb=" O SER Y 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA Y 208 " --> pdb=" O LEU Y 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS Y 198 " --> pdb=" O TYR Y 168 " (cutoff:3.500A) Processing sheet with id= 99, first strand: chain 'Y' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP Y 217 " --> pdb=" O VAL Y 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR Y 245 " --> pdb=" O GLY Y 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG Y 239 " --> pdb=" O GLU Y 231 " (cutoff:3.500A) Processing sheet with id=100, first strand: chain 'Y' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU Y 244 " --> pdb=" O LEU Y 78 " (cutoff:3.500A) Processing sheet with id=101, first strand: chain 'Z' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA Z 48 " --> pdb=" O LEU Z 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS Z 71 " --> pdb=" O LEU Z 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU Z 54 " --> pdb=" O LYS Z 71 " (cutoff:3.500A) Processing sheet with id=102, first strand: chain 'Z' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG Z 137 " --> pdb=" O LEU Z 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA Z 255 " --> pdb=" O SER Z 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA Z 208 " --> pdb=" O LEU Z 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS Z 198 " --> pdb=" O TYR Z 168 " (cutoff:3.500A) Processing sheet with id=103, first strand: chain 'Z' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP Z 217 " --> pdb=" O VAL Z 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR Z 245 " --> pdb=" O GLY Z 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG Z 239 " --> pdb=" O GLU Z 231 " (cutoff:3.500A) Processing sheet with id=104, first strand: chain 'Z' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU Z 244 " --> pdb=" O LEU Z 78 " (cutoff:3.500A) Processing sheet with id=105, first strand: chain '0' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 0 48 " --> pdb=" O LEU 0 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS 0 71 " --> pdb=" O LEU 0 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU 0 54 " --> pdb=" O LYS 0 71 " (cutoff:3.500A) Processing sheet with id=106, first strand: chain '0' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 0 137 " --> pdb=" O LEU 0 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 0 255 " --> pdb=" O SER 0 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 0 208 " --> pdb=" O LEU 0 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 0 198 " --> pdb=" O TYR 0 168 " (cutoff:3.500A) Processing sheet with id=107, first strand: chain '0' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP 0 217 " --> pdb=" O VAL 0 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR 0 245 " --> pdb=" O GLY 0 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 0 239 " --> pdb=" O GLU 0 231 " (cutoff:3.500A) Processing sheet with id=108, first strand: chain '0' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 0 244 " --> pdb=" O LEU 0 78 " (cutoff:3.500A) Processing sheet with id=109, first strand: chain '1' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 1 48 " --> pdb=" O LEU 1 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 1 71 " --> pdb=" O LEU 1 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU 1 54 " --> pdb=" O LYS 1 71 " (cutoff:3.500A) Processing sheet with id=110, first strand: chain '1' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 1 137 " --> pdb=" O LEU 1 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 1 255 " --> pdb=" O SER 1 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 1 208 " --> pdb=" O LEU 1 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS 1 198 " --> pdb=" O TYR 1 168 " (cutoff:3.500A) Processing sheet with id=111, first strand: chain '1' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 1 217 " --> pdb=" O VAL 1 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR 1 245 " --> pdb=" O GLY 1 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 1 239 " --> pdb=" O GLU 1 231 " (cutoff:3.500A) Processing sheet with id=112, first strand: chain '1' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 1 244 " --> pdb=" O LEU 1 78 " (cutoff:3.500A) Processing sheet with id=113, first strand: chain '2' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA 2 48 " --> pdb=" O LEU 2 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 2 71 " --> pdb=" O LEU 2 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU 2 54 " --> pdb=" O LYS 2 71 " (cutoff:3.500A) Processing sheet with id=114, first strand: chain '2' and resid 137 through 140 removed outlier: 6.005A pdb=" N ARG 2 137 " --> pdb=" O LEU 2 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 2 255 " --> pdb=" O SER 2 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 2 208 " --> pdb=" O LEU 2 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 2 198 " --> pdb=" O TYR 2 168 " (cutoff:3.500A) Processing sheet with id=115, first strand: chain '2' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 2 217 " --> pdb=" O VAL 2 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR 2 245 " --> pdb=" O GLY 2 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 2 239 " --> pdb=" O GLU 2 231 " (cutoff:3.500A) Processing sheet with id=116, first strand: chain '2' and resid 75 through 84 removed outlier: 3.544A pdb=" N GLU 2 244 " --> pdb=" O LEU 2 78 " (cutoff:3.500A) Processing sheet with id=117, first strand: chain '3' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA 3 48 " --> pdb=" O LEU 3 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS 3 71 " --> pdb=" O LEU 3 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU 3 54 " --> pdb=" O LYS 3 71 " (cutoff:3.500A) Processing sheet with id=118, first strand: chain '3' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 3 137 " --> pdb=" O LEU 3 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA 3 255 " --> pdb=" O SER 3 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 3 208 " --> pdb=" O LEU 3 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 3 198 " --> pdb=" O TYR 3 168 " (cutoff:3.500A) Processing sheet with id=119, first strand: chain '3' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 3 217 " --> pdb=" O VAL 3 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR 3 245 " --> pdb=" O GLY 3 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG 3 239 " --> pdb=" O GLU 3 231 " (cutoff:3.500A) Processing sheet with id=120, first strand: chain '3' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 3 244 " --> pdb=" O LEU 3 78 " (cutoff:3.500A) Processing sheet with id=121, first strand: chain '4' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 4 48 " --> pdb=" O LEU 4 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 4 71 " --> pdb=" O LEU 4 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU 4 54 " --> pdb=" O LYS 4 71 " (cutoff:3.500A) Processing sheet with id=122, first strand: chain '4' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 4 137 " --> pdb=" O LEU 4 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 4 255 " --> pdb=" O SER 4 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 4 208 " --> pdb=" O LEU 4 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 4 198 " --> pdb=" O TYR 4 168 " (cutoff:3.500A) Processing sheet with id=123, first strand: chain '4' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP 4 217 " --> pdb=" O VAL 4 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR 4 245 " --> pdb=" O GLY 4 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 4 239 " --> pdb=" O GLU 4 231 " (cutoff:3.500A) Processing sheet with id=124, first strand: chain '4' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 4 244 " --> pdb=" O LEU 4 78 " (cutoff:3.500A) Processing sheet with id=125, first strand: chain '5' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 5 48 " --> pdb=" O LEU 5 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS 5 71 " --> pdb=" O LEU 5 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU 5 54 " --> pdb=" O LYS 5 71 " (cutoff:3.500A) Processing sheet with id=126, first strand: chain '5' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 5 137 " --> pdb=" O LEU 5 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA 5 255 " --> pdb=" O SER 5 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA 5 208 " --> pdb=" O LEU 5 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 5 198 " --> pdb=" O TYR 5 168 " (cutoff:3.500A) Processing sheet with id=127, first strand: chain '5' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP 5 217 " --> pdb=" O VAL 5 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR 5 245 " --> pdb=" O GLY 5 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 5 239 " --> pdb=" O GLU 5 231 " (cutoff:3.500A) Processing sheet with id=128, first strand: chain '5' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 5 244 " --> pdb=" O LEU 5 78 " (cutoff:3.500A) Processing sheet with id=129, first strand: chain '6' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 6 48 " --> pdb=" O LEU 6 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 6 71 " --> pdb=" O LEU 6 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU 6 54 " --> pdb=" O LYS 6 71 " (cutoff:3.500A) Processing sheet with id=130, first strand: chain '6' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 6 137 " --> pdb=" O LEU 6 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA 6 255 " --> pdb=" O SER 6 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 6 208 " --> pdb=" O LEU 6 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 6 198 " --> pdb=" O TYR 6 168 " (cutoff:3.500A) Processing sheet with id=131, first strand: chain '6' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 6 217 " --> pdb=" O VAL 6 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR 6 245 " --> pdb=" O GLY 6 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG 6 239 " --> pdb=" O GLU 6 231 " (cutoff:3.500A) Processing sheet with id=132, first strand: chain '6' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU 6 244 " --> pdb=" O LEU 6 78 " (cutoff:3.500A) Processing sheet with id=133, first strand: chain '7' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 7 48 " --> pdb=" O LEU 7 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 7 71 " --> pdb=" O LEU 7 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU 7 54 " --> pdb=" O LYS 7 71 " (cutoff:3.500A) Processing sheet with id=134, first strand: chain '7' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 7 137 " --> pdb=" O LEU 7 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 7 255 " --> pdb=" O SER 7 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 7 208 " --> pdb=" O LEU 7 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 7 198 " --> pdb=" O TYR 7 168 " (cutoff:3.500A) Processing sheet with id=135, first strand: chain '7' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP 7 217 " --> pdb=" O VAL 7 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR 7 245 " --> pdb=" O GLY 7 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG 7 239 " --> pdb=" O GLU 7 231 " (cutoff:3.500A) Processing sheet with id=136, first strand: chain '7' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 7 244 " --> pdb=" O LEU 7 78 " (cutoff:3.500A) Processing sheet with id=137, first strand: chain '8' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA 8 48 " --> pdb=" O LEU 8 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS 8 71 " --> pdb=" O LEU 8 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU 8 54 " --> pdb=" O LYS 8 71 " (cutoff:3.500A) Processing sheet with id=138, first strand: chain '8' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 8 137 " --> pdb=" O LEU 8 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA 8 255 " --> pdb=" O SER 8 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA 8 208 " --> pdb=" O LEU 8 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 8 198 " --> pdb=" O TYR 8 168 " (cutoff:3.500A) Processing sheet with id=139, first strand: chain '8' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 8 217 " --> pdb=" O VAL 8 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR 8 245 " --> pdb=" O GLY 8 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 8 239 " --> pdb=" O GLU 8 231 " (cutoff:3.500A) Processing sheet with id=140, first strand: chain '8' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU 8 244 " --> pdb=" O LEU 8 78 " (cutoff:3.500A) Processing sheet with id=141, first strand: chain '9' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA 9 48 " --> pdb=" O LEU 9 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS 9 71 " --> pdb=" O LEU 9 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU 9 54 " --> pdb=" O LYS 9 71 " (cutoff:3.500A) Processing sheet with id=142, first strand: chain '9' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG 9 137 " --> pdb=" O LEU 9 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA 9 255 " --> pdb=" O SER 9 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA 9 208 " --> pdb=" O LEU 9 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS 9 198 " --> pdb=" O TYR 9 168 " (cutoff:3.500A) Processing sheet with id=143, first strand: chain '9' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP 9 217 " --> pdb=" O VAL 9 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR 9 245 " --> pdb=" O GLY 9 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG 9 239 " --> pdb=" O GLU 9 231 " (cutoff:3.500A) Processing sheet with id=144, first strand: chain '9' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU 9 244 " --> pdb=" O LEU 9 78 " (cutoff:3.500A) Processing sheet with id=145, first strand: chain 'a' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA a 48 " --> pdb=" O LEU a 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS a 71 " --> pdb=" O LEU a 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU a 54 " --> pdb=" O LYS a 71 " (cutoff:3.500A) Processing sheet with id=146, first strand: chain 'a' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG a 137 " --> pdb=" O LEU a 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA a 255 " --> pdb=" O SER a 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA a 208 " --> pdb=" O LEU a 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS a 198 " --> pdb=" O TYR a 168 " (cutoff:3.500A) Processing sheet with id=147, first strand: chain 'a' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP a 217 " --> pdb=" O VAL a 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR a 245 " --> pdb=" O GLY a 223 " (cutoff:3.500A) removed outlier: 6.939A pdb=" N ARG a 239 " --> pdb=" O GLU a 231 " (cutoff:3.500A) Processing sheet with id=148, first strand: chain 'a' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU a 244 " --> pdb=" O LEU a 78 " (cutoff:3.500A) Processing sheet with id=149, first strand: chain 'b' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA b 48 " --> pdb=" O LEU b 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS b 71 " --> pdb=" O LEU b 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU b 54 " --> pdb=" O LYS b 71 " (cutoff:3.500A) Processing sheet with id=150, first strand: chain 'b' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG b 137 " --> pdb=" O LEU b 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA b 255 " --> pdb=" O SER b 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA b 208 " --> pdb=" O LEU b 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS b 198 " --> pdb=" O TYR b 168 " (cutoff:3.500A) Processing sheet with id=151, first strand: chain 'b' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP b 217 " --> pdb=" O VAL b 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR b 245 " --> pdb=" O GLY b 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG b 239 " --> pdb=" O GLU b 231 " (cutoff:3.500A) Processing sheet with id=152, first strand: chain 'b' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU b 244 " --> pdb=" O LEU b 78 " (cutoff:3.500A) Processing sheet with id=153, first strand: chain 'c' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA c 48 " --> pdb=" O LEU c 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS c 71 " --> pdb=" O LEU c 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU c 54 " --> pdb=" O LYS c 71 " (cutoff:3.500A) Processing sheet with id=154, first strand: chain 'c' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG c 137 " --> pdb=" O LEU c 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA c 255 " --> pdb=" O SER c 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA c 208 " --> pdb=" O LEU c 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS c 198 " --> pdb=" O TYR c 168 " (cutoff:3.500A) Processing sheet with id=155, first strand: chain 'c' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP c 217 " --> pdb=" O VAL c 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR c 245 " --> pdb=" O GLY c 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG c 239 " --> pdb=" O GLU c 231 " (cutoff:3.500A) Processing sheet with id=156, first strand: chain 'c' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU c 244 " --> pdb=" O LEU c 78 " (cutoff:3.500A) Processing sheet with id=157, first strand: chain 'd' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA d 48 " --> pdb=" O LEU d 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS d 71 " --> pdb=" O LEU d 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU d 54 " --> pdb=" O LYS d 71 " (cutoff:3.500A) Processing sheet with id=158, first strand: chain 'd' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG d 137 " --> pdb=" O LEU d 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA d 255 " --> pdb=" O SER d 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA d 208 " --> pdb=" O LEU d 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS d 198 " --> pdb=" O TYR d 168 " (cutoff:3.500A) Processing sheet with id=159, first strand: chain 'd' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP d 217 " --> pdb=" O VAL d 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR d 245 " --> pdb=" O GLY d 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG d 239 " --> pdb=" O GLU d 231 " (cutoff:3.500A) Processing sheet with id=160, first strand: chain 'd' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU d 244 " --> pdb=" O LEU d 78 " (cutoff:3.500A) Processing sheet with id=161, first strand: chain 'e' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA e 48 " --> pdb=" O LEU e 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS e 71 " --> pdb=" O LEU e 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU e 54 " --> pdb=" O LYS e 71 " (cutoff:3.500A) Processing sheet with id=162, first strand: chain 'e' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG e 137 " --> pdb=" O LEU e 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA e 255 " --> pdb=" O SER e 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA e 208 " --> pdb=" O LEU e 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS e 198 " --> pdb=" O TYR e 168 " (cutoff:3.500A) Processing sheet with id=163, first strand: chain 'e' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP e 217 " --> pdb=" O VAL e 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR e 245 " --> pdb=" O GLY e 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG e 239 " --> pdb=" O GLU e 231 " (cutoff:3.500A) Processing sheet with id=164, first strand: chain 'e' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU e 244 " --> pdb=" O LEU e 78 " (cutoff:3.500A) Processing sheet with id=165, first strand: chain 'f' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA f 48 " --> pdb=" O LEU f 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS f 71 " --> pdb=" O LEU f 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU f 54 " --> pdb=" O LYS f 71 " (cutoff:3.500A) Processing sheet with id=166, first strand: chain 'f' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG f 137 " --> pdb=" O LEU f 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA f 255 " --> pdb=" O SER f 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA f 208 " --> pdb=" O LEU f 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS f 198 " --> pdb=" O TYR f 168 " (cutoff:3.500A) Processing sheet with id=167, first strand: chain 'f' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP f 217 " --> pdb=" O VAL f 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR f 245 " --> pdb=" O GLY f 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG f 239 " --> pdb=" O GLU f 231 " (cutoff:3.500A) Processing sheet with id=168, first strand: chain 'f' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU f 244 " --> pdb=" O LEU f 78 " (cutoff:3.500A) Processing sheet with id=169, first strand: chain 'g' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA g 48 " --> pdb=" O LEU g 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS g 71 " --> pdb=" O LEU g 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU g 54 " --> pdb=" O LYS g 71 " (cutoff:3.500A) Processing sheet with id=170, first strand: chain 'g' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG g 137 " --> pdb=" O LEU g 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA g 255 " --> pdb=" O SER g 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA g 208 " --> pdb=" O LEU g 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS g 198 " --> pdb=" O TYR g 168 " (cutoff:3.500A) Processing sheet with id=171, first strand: chain 'g' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP g 217 " --> pdb=" O VAL g 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR g 245 " --> pdb=" O GLY g 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG g 239 " --> pdb=" O GLU g 231 " (cutoff:3.500A) Processing sheet with id=172, first strand: chain 'g' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU g 244 " --> pdb=" O LEU g 78 " (cutoff:3.500A) Processing sheet with id=173, first strand: chain 'h' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA h 48 " --> pdb=" O LEU h 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS h 71 " --> pdb=" O LEU h 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU h 54 " --> pdb=" O LYS h 71 " (cutoff:3.500A) Processing sheet with id=174, first strand: chain 'h' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG h 137 " --> pdb=" O LEU h 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA h 255 " --> pdb=" O SER h 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA h 208 " --> pdb=" O LEU h 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS h 198 " --> pdb=" O TYR h 168 " (cutoff:3.500A) Processing sheet with id=175, first strand: chain 'h' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP h 217 " --> pdb=" O VAL h 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR h 245 " --> pdb=" O GLY h 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG h 239 " --> pdb=" O GLU h 231 " (cutoff:3.500A) Processing sheet with id=176, first strand: chain 'h' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU h 244 " --> pdb=" O LEU h 78 " (cutoff:3.500A) Processing sheet with id=177, first strand: chain 'i' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA i 48 " --> pdb=" O LEU i 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS i 71 " --> pdb=" O LEU i 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU i 54 " --> pdb=" O LYS i 71 " (cutoff:3.500A) Processing sheet with id=178, first strand: chain 'i' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG i 137 " --> pdb=" O LEU i 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA i 255 " --> pdb=" O SER i 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA i 208 " --> pdb=" O LEU i 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS i 198 " --> pdb=" O TYR i 168 " (cutoff:3.500A) Processing sheet with id=179, first strand: chain 'i' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP i 217 " --> pdb=" O VAL i 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR i 245 " --> pdb=" O GLY i 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG i 239 " --> pdb=" O GLU i 231 " (cutoff:3.500A) Processing sheet with id=180, first strand: chain 'i' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU i 244 " --> pdb=" O LEU i 78 " (cutoff:3.500A) Processing sheet with id=181, first strand: chain 'j' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA j 48 " --> pdb=" O LEU j 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS j 71 " --> pdb=" O LEU j 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU j 54 " --> pdb=" O LYS j 71 " (cutoff:3.500A) Processing sheet with id=182, first strand: chain 'j' and resid 137 through 140 removed outlier: 6.005A pdb=" N ARG j 137 " --> pdb=" O LEU j 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA j 255 " --> pdb=" O SER j 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA j 208 " --> pdb=" O LEU j 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS j 198 " --> pdb=" O TYR j 168 " (cutoff:3.500A) Processing sheet with id=183, first strand: chain 'j' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP j 217 " --> pdb=" O VAL j 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR j 245 " --> pdb=" O GLY j 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG j 239 " --> pdb=" O GLU j 231 " (cutoff:3.500A) Processing sheet with id=184, first strand: chain 'j' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU j 244 " --> pdb=" O LEU j 78 " (cutoff:3.500A) Processing sheet with id=185, first strand: chain 'k' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA k 48 " --> pdb=" O LEU k 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS k 71 " --> pdb=" O LEU k 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU k 54 " --> pdb=" O LYS k 71 " (cutoff:3.500A) Processing sheet with id=186, first strand: chain 'k' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG k 137 " --> pdb=" O LEU k 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA k 255 " --> pdb=" O SER k 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA k 208 " --> pdb=" O LEU k 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS k 198 " --> pdb=" O TYR k 168 " (cutoff:3.500A) Processing sheet with id=187, first strand: chain 'k' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP k 217 " --> pdb=" O VAL k 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR k 245 " --> pdb=" O GLY k 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG k 239 " --> pdb=" O GLU k 231 " (cutoff:3.500A) Processing sheet with id=188, first strand: chain 'k' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU k 244 " --> pdb=" O LEU k 78 " (cutoff:3.500A) Processing sheet with id=189, first strand: chain 'l' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA l 48 " --> pdb=" O LEU l 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS l 71 " --> pdb=" O LEU l 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU l 54 " --> pdb=" O LYS l 71 " (cutoff:3.500A) Processing sheet with id=190, first strand: chain 'l' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG l 137 " --> pdb=" O LEU l 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA l 255 " --> pdb=" O SER l 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA l 208 " --> pdb=" O LEU l 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS l 198 " --> pdb=" O TYR l 168 " (cutoff:3.500A) Processing sheet with id=191, first strand: chain 'l' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP l 217 " --> pdb=" O VAL l 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR l 245 " --> pdb=" O GLY l 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG l 239 " --> pdb=" O GLU l 231 " (cutoff:3.500A) Processing sheet with id=192, first strand: chain 'l' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU l 244 " --> pdb=" O LEU l 78 " (cutoff:3.500A) Processing sheet with id=193, first strand: chain 'm' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA m 48 " --> pdb=" O LEU m 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS m 71 " --> pdb=" O LEU m 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU m 54 " --> pdb=" O LYS m 71 " (cutoff:3.500A) Processing sheet with id=194, first strand: chain 'm' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG m 137 " --> pdb=" O LEU m 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA m 255 " --> pdb=" O SER m 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA m 208 " --> pdb=" O LEU m 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS m 198 " --> pdb=" O TYR m 168 " (cutoff:3.500A) Processing sheet with id=195, first strand: chain 'm' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP m 217 " --> pdb=" O VAL m 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR m 245 " --> pdb=" O GLY m 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG m 239 " --> pdb=" O GLU m 231 " (cutoff:3.500A) Processing sheet with id=196, first strand: chain 'm' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU m 244 " --> pdb=" O LEU m 78 " (cutoff:3.500A) Processing sheet with id=197, first strand: chain 'n' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA n 48 " --> pdb=" O LEU n 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS n 71 " --> pdb=" O LEU n 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU n 54 " --> pdb=" O LYS n 71 " (cutoff:3.500A) Processing sheet with id=198, first strand: chain 'n' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG n 137 " --> pdb=" O LEU n 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA n 255 " --> pdb=" O SER n 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA n 208 " --> pdb=" O LEU n 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS n 198 " --> pdb=" O TYR n 168 " (cutoff:3.500A) Processing sheet with id=199, first strand: chain 'n' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP n 217 " --> pdb=" O VAL n 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR n 245 " --> pdb=" O GLY n 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG n 239 " --> pdb=" O GLU n 231 " (cutoff:3.500A) Processing sheet with id=200, first strand: chain 'n' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU n 244 " --> pdb=" O LEU n 78 " (cutoff:3.500A) Processing sheet with id=201, first strand: chain 'o' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA o 48 " --> pdb=" O LEU o 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS o 71 " --> pdb=" O LEU o 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU o 54 " --> pdb=" O LYS o 71 " (cutoff:3.500A) Processing sheet with id=202, first strand: chain 'o' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG o 137 " --> pdb=" O LEU o 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA o 255 " --> pdb=" O SER o 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA o 208 " --> pdb=" O LEU o 259 " (cutoff:3.500A) removed outlier: 3.632A pdb=" N LYS o 198 " --> pdb=" O TYR o 168 " (cutoff:3.500A) Processing sheet with id=203, first strand: chain 'o' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP o 217 " --> pdb=" O VAL o 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR o 245 " --> pdb=" O GLY o 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG o 239 " --> pdb=" O GLU o 231 " (cutoff:3.500A) Processing sheet with id=204, first strand: chain 'o' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU o 244 " --> pdb=" O LEU o 78 " (cutoff:3.500A) Processing sheet with id=205, first strand: chain 'p' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA p 48 " --> pdb=" O LEU p 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS p 71 " --> pdb=" O LEU p 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU p 54 " --> pdb=" O LYS p 71 " (cutoff:3.500A) Processing sheet with id=206, first strand: chain 'p' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG p 137 " --> pdb=" O LEU p 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA p 255 " --> pdb=" O SER p 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA p 208 " --> pdb=" O LEU p 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS p 198 " --> pdb=" O TYR p 168 " (cutoff:3.500A) Processing sheet with id=207, first strand: chain 'p' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP p 217 " --> pdb=" O VAL p 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR p 245 " --> pdb=" O GLY p 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG p 239 " --> pdb=" O GLU p 231 " (cutoff:3.500A) Processing sheet with id=208, first strand: chain 'p' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU p 244 " --> pdb=" O LEU p 78 " (cutoff:3.500A) Processing sheet with id=209, first strand: chain 'q' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA q 48 " --> pdb=" O LEU q 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS q 71 " --> pdb=" O LEU q 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU q 54 " --> pdb=" O LYS q 71 " (cutoff:3.500A) Processing sheet with id=210, first strand: chain 'q' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG q 137 " --> pdb=" O LEU q 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA q 255 " --> pdb=" O SER q 212 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ALA q 208 " --> pdb=" O LEU q 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS q 198 " --> pdb=" O TYR q 168 " (cutoff:3.500A) Processing sheet with id=211, first strand: chain 'q' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP q 217 " --> pdb=" O VAL q 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR q 245 " --> pdb=" O GLY q 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG q 239 " --> pdb=" O GLU q 231 " (cutoff:3.500A) Processing sheet with id=212, first strand: chain 'q' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU q 244 " --> pdb=" O LEU q 78 " (cutoff:3.500A) Processing sheet with id=213, first strand: chain 'r' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA r 48 " --> pdb=" O LEU r 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS r 71 " --> pdb=" O LEU r 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU r 54 " --> pdb=" O LYS r 71 " (cutoff:3.500A) Processing sheet with id=214, first strand: chain 'r' and resid 137 through 140 removed outlier: 6.003A pdb=" N ARG r 137 " --> pdb=" O LEU r 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA r 255 " --> pdb=" O SER r 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA r 208 " --> pdb=" O LEU r 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS r 198 " --> pdb=" O TYR r 168 " (cutoff:3.500A) Processing sheet with id=215, first strand: chain 'r' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP r 217 " --> pdb=" O VAL r 251 " (cutoff:3.500A) removed outlier: 6.686A pdb=" N THR r 245 " --> pdb=" O GLY r 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG r 239 " --> pdb=" O GLU r 231 " (cutoff:3.500A) Processing sheet with id=216, first strand: chain 'r' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU r 244 " --> pdb=" O LEU r 78 " (cutoff:3.500A) Processing sheet with id=217, first strand: chain 's' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA s 48 " --> pdb=" O LEU s 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS s 71 " --> pdb=" O LEU s 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU s 54 " --> pdb=" O LYS s 71 " (cutoff:3.500A) Processing sheet with id=218, first strand: chain 's' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG s 137 " --> pdb=" O LEU s 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA s 255 " --> pdb=" O SER s 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA s 208 " --> pdb=" O LEU s 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS s 198 " --> pdb=" O TYR s 168 " (cutoff:3.500A) Processing sheet with id=219, first strand: chain 's' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP s 217 " --> pdb=" O VAL s 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR s 245 " --> pdb=" O GLY s 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG s 239 " --> pdb=" O GLU s 231 " (cutoff:3.500A) Processing sheet with id=220, first strand: chain 's' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU s 244 " --> pdb=" O LEU s 78 " (cutoff:3.500A) Processing sheet with id=221, first strand: chain 't' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA t 48 " --> pdb=" O LEU t 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS t 71 " --> pdb=" O LEU t 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU t 54 " --> pdb=" O LYS t 71 " (cutoff:3.500A) Processing sheet with id=222, first strand: chain 't' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG t 137 " --> pdb=" O LEU t 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA t 255 " --> pdb=" O SER t 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA t 208 " --> pdb=" O LEU t 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS t 198 " --> pdb=" O TYR t 168 " (cutoff:3.500A) Processing sheet with id=223, first strand: chain 't' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP t 217 " --> pdb=" O VAL t 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR t 245 " --> pdb=" O GLY t 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG t 239 " --> pdb=" O GLU t 231 " (cutoff:3.500A) Processing sheet with id=224, first strand: chain 't' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU t 244 " --> pdb=" O LEU t 78 " (cutoff:3.500A) Processing sheet with id=225, first strand: chain 'u' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA u 48 " --> pdb=" O LEU u 75 " (cutoff:3.500A) removed outlier: 6.967A pdb=" N LYS u 71 " --> pdb=" O LEU u 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU u 54 " --> pdb=" O LYS u 71 " (cutoff:3.500A) Processing sheet with id=226, first strand: chain 'u' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG u 137 " --> pdb=" O LEU u 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA u 255 " --> pdb=" O SER u 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA u 208 " --> pdb=" O LEU u 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS u 198 " --> pdb=" O TYR u 168 " (cutoff:3.500A) Processing sheet with id=227, first strand: chain 'u' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP u 217 " --> pdb=" O VAL u 251 " (cutoff:3.500A) removed outlier: 6.688A pdb=" N THR u 245 " --> pdb=" O GLY u 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG u 239 " --> pdb=" O GLU u 231 " (cutoff:3.500A) Processing sheet with id=228, first strand: chain 'u' and resid 75 through 84 removed outlier: 3.542A pdb=" N GLU u 244 " --> pdb=" O LEU u 78 " (cutoff:3.500A) Processing sheet with id=229, first strand: chain 'v' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA v 48 " --> pdb=" O LEU v 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS v 71 " --> pdb=" O LEU v 52 " (cutoff:3.500A) removed outlier: 4.786A pdb=" N GLU v 54 " --> pdb=" O LYS v 71 " (cutoff:3.500A) Processing sheet with id=230, first strand: chain 'v' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG v 137 " --> pdb=" O LEU v 256 " (cutoff:3.500A) removed outlier: 6.903A pdb=" N ALA v 255 " --> pdb=" O SER v 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA v 208 " --> pdb=" O LEU v 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS v 198 " --> pdb=" O TYR v 168 " (cutoff:3.500A) Processing sheet with id=231, first strand: chain 'v' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP v 217 " --> pdb=" O VAL v 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR v 245 " --> pdb=" O GLY v 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG v 239 " --> pdb=" O GLU v 231 " (cutoff:3.500A) Processing sheet with id=232, first strand: chain 'v' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU v 244 " --> pdb=" O LEU v 78 " (cutoff:3.500A) Processing sheet with id=233, first strand: chain 'w' and resid 48 through 52 removed outlier: 7.422A pdb=" N ALA w 48 " --> pdb=" O LEU w 75 " (cutoff:3.500A) removed outlier: 6.969A pdb=" N LYS w 71 " --> pdb=" O LEU w 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU w 54 " --> pdb=" O LYS w 71 " (cutoff:3.500A) Processing sheet with id=234, first strand: chain 'w' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG w 137 " --> pdb=" O LEU w 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA w 255 " --> pdb=" O SER w 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA w 208 " --> pdb=" O LEU w 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS w 198 " --> pdb=" O TYR w 168 " (cutoff:3.500A) Processing sheet with id=235, first strand: chain 'w' and resid 217 through 223 removed outlier: 7.502A pdb=" N ASP w 217 " --> pdb=" O VAL w 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR w 245 " --> pdb=" O GLY w 223 " (cutoff:3.500A) removed outlier: 6.937A pdb=" N ARG w 239 " --> pdb=" O GLU w 231 " (cutoff:3.500A) Processing sheet with id=236, first strand: chain 'w' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU w 244 " --> pdb=" O LEU w 78 " (cutoff:3.500A) Processing sheet with id=237, first strand: chain 'x' and resid 48 through 52 removed outlier: 7.423A pdb=" N ALA x 48 " --> pdb=" O LEU x 75 " (cutoff:3.500A) removed outlier: 6.968A pdb=" N LYS x 71 " --> pdb=" O LEU x 52 " (cutoff:3.500A) removed outlier: 4.785A pdb=" N GLU x 54 " --> pdb=" O LYS x 71 " (cutoff:3.500A) Processing sheet with id=238, first strand: chain 'x' and resid 137 through 140 removed outlier: 6.004A pdb=" N ARG x 137 " --> pdb=" O LEU x 256 " (cutoff:3.500A) removed outlier: 6.904A pdb=" N ALA x 255 " --> pdb=" O SER x 212 " (cutoff:3.500A) removed outlier: 3.696A pdb=" N ALA x 208 " --> pdb=" O LEU x 259 " (cutoff:3.500A) removed outlier: 3.633A pdb=" N LYS x 198 " --> pdb=" O TYR x 168 " (cutoff:3.500A) Processing sheet with id=239, first strand: chain 'x' and resid 217 through 223 removed outlier: 7.501A pdb=" N ASP x 217 " --> pdb=" O VAL x 251 " (cutoff:3.500A) removed outlier: 6.687A pdb=" N THR x 245 " --> pdb=" O GLY x 223 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N ARG x 239 " --> pdb=" O GLU x 231 " (cutoff:3.500A) Processing sheet with id=240, first strand: chain 'x' and resid 75 through 84 removed outlier: 3.543A pdb=" N GLU x 244 " --> pdb=" O LEU x 78 " (cutoff:3.500A) 6120 hydrogen bonds defined for protein. 18180 hydrogen bond angles defined for protein. Restraints generated for nucleic acids: 0 hydrogen bonds 0 hydrogen bond angles 0 basepair planarities 0 basepair parallelities 0 stacking parallelities Total time for adding SS restraints: 57.56 Time building geometry restraints manager: 42.18 seconds NOTE: a complete listing of the restraints can be obtained by requesting output of .geo file. Histogram of bond lengths: 1.21 - 1.33: 29718 1.33 - 1.45: 26625 1.45 - 1.57: 74697 1.57 - 1.69: 0 1.69 - 1.81: 300 Bond restraints: 131340 Sorted by residual: bond pdb=" N GLY K 197 " pdb=" CA GLY K 197 " ideal model delta sigma weight residual 1.443 1.479 -0.036 8.60e-03 1.35e+04 1.76e+01 bond pdb=" N GLY v 197 " pdb=" CA GLY v 197 " ideal model delta sigma weight residual 1.443 1.479 -0.036 8.60e-03 1.35e+04 1.76e+01 bond pdb=" N GLY a 197 " pdb=" CA GLY a 197 " ideal model delta sigma weight residual 1.443 1.479 -0.036 8.60e-03 1.35e+04 1.75e+01 bond pdb=" N GLY D 197 " pdb=" CA GLY D 197 " ideal model delta sigma weight residual 1.443 1.479 -0.036 8.60e-03 1.35e+04 1.74e+01 bond pdb=" N GLY j 197 " pdb=" CA GLY j 197 " ideal model delta sigma weight residual 1.443 1.479 -0.036 8.60e-03 1.35e+04 1.74e+01 ... (remaining 131335 not shown) Histogram of bond angle deviations from ideal: 100.37 - 107.14: 2697 107.14 - 113.90: 74084 113.90 - 120.66: 56416 120.66 - 127.42: 43203 127.42 - 134.19: 1020 Bond angle restraints: 177420 Sorted by residual: angle pdb=" CA GLY X 197 " pdb=" C GLY X 197 " pdb=" N LYS X 198 " ideal model delta sigma weight residual 114.30 119.04 -4.74 1.20e+00 6.94e-01 1.56e+01 angle pdb=" CA GLY O 197 " pdb=" C GLY O 197 " pdb=" N LYS O 198 " ideal model delta sigma weight residual 114.30 119.03 -4.73 1.20e+00 6.94e-01 1.56e+01 angle pdb=" CA GLY 0 197 " pdb=" C GLY 0 197 " pdb=" N LYS 0 198 " ideal model delta sigma weight residual 114.30 119.03 -4.73 1.20e+00 6.94e-01 1.55e+01 angle pdb=" CA GLY d 197 " pdb=" C GLY d 197 " pdb=" N LYS d 198 " ideal model delta sigma weight residual 114.30 119.03 -4.73 1.20e+00 6.94e-01 1.55e+01 angle pdb=" CA GLY e 197 " pdb=" C GLY e 197 " pdb=" N LYS e 198 " ideal model delta sigma weight residual 114.30 119.03 -4.73 1.20e+00 6.94e-01 1.55e+01 ... (remaining 177415 not shown) Histogram of dihedral angle deviations from ideal: 0.00 - 17.03: 70713 17.03 - 34.07: 5971 34.07 - 51.10: 1316 51.10 - 68.13: 300 68.13 - 85.16: 300 Dihedral angle restraints: 78600 sinusoidal: 33540 harmonic: 45060 Sorted by residual: dihedral pdb=" CA GLU I 234 " pdb=" C GLU I 234 " pdb=" N LYS I 235 " pdb=" CA LYS I 235 " ideal model delta harmonic sigma weight residual 180.00 160.75 19.25 0 5.00e+00 4.00e-02 1.48e+01 dihedral pdb=" CA GLU o 234 " pdb=" C GLU o 234 " pdb=" N LYS o 235 " pdb=" CA LYS o 235 " ideal model delta harmonic sigma weight residual 180.00 160.75 19.25 0 5.00e+00 4.00e-02 1.48e+01 dihedral pdb=" CA GLU 2 234 " pdb=" C GLU 2 234 " pdb=" N LYS 2 235 " pdb=" CA LYS 2 235 " ideal model delta harmonic sigma weight residual 180.00 160.76 19.24 0 5.00e+00 4.00e-02 1.48e+01 ... (remaining 78597 not shown) Histogram of chiral volume deviations from ideal: 0.000 - 0.059: 15756 0.059 - 0.118: 3214 0.118 - 0.178: 410 0.178 - 0.237: 60 0.237 - 0.296: 180 Chirality restraints: 19620 Sorted by residual: chirality pdb=" C4' RBF R 301 " pdb=" C3' RBF R 301 " pdb=" C5' RBF R 301 " pdb=" O4' RBF R 301 " both_signs ideal model delta sigma weight residual False -2.27 -2.57 0.30 2.00e-01 2.50e+01 2.19e+00 chirality pdb=" C4' RBF g 301 " pdb=" C3' RBF g 301 " pdb=" C5' RBF g 301 " pdb=" O4' RBF g 301 " both_signs ideal model delta sigma weight residual False -2.27 -2.57 0.30 2.00e-01 2.50e+01 2.19e+00 chirality pdb=" C4' RBF i 301 " pdb=" C3' RBF i 301 " pdb=" C5' RBF i 301 " pdb=" O4' RBF i 301 " both_signs ideal model delta sigma weight residual False -2.27 -2.57 0.30 2.00e-01 2.50e+01 2.19e+00 ... (remaining 19617 not shown) Planarity restraints: 22620 Sorted by residual: delta sigma weight rms_deltas residual plane pdb=" C THR x 144 " 0.034 5.00e-02 4.00e+02 5.08e-02 4.12e+00 pdb=" N PRO x 145 " -0.088 5.00e-02 4.00e+02 pdb=" CA PRO x 145 " 0.026 5.00e-02 4.00e+02 pdb=" CD PRO x 145 " 0.028 5.00e-02 4.00e+02 delta sigma weight rms_deltas residual plane pdb=" C THR Q 144 " 0.033 5.00e-02 4.00e+02 5.06e-02 4.10e+00 pdb=" N PRO Q 145 " -0.088 5.00e-02 4.00e+02 pdb=" CA PRO Q 145 " 0.026 5.00e-02 4.00e+02 pdb=" CD PRO Q 145 " 0.028 5.00e-02 4.00e+02 delta sigma weight rms_deltas residual plane pdb=" C THR B 144 " 0.033 5.00e-02 4.00e+02 5.06e-02 4.10e+00 pdb=" N PRO B 145 " -0.088 5.00e-02 4.00e+02 pdb=" CA PRO B 145 " 0.026 5.00e-02 4.00e+02 pdb=" CD PRO B 145 " 0.028 5.00e-02 4.00e+02 ... (remaining 22617 not shown) Histogram of nonbonded interaction distances: 2.21 - 2.75: 17584 2.75 - 3.29: 108486 3.29 - 3.83: 189585 3.83 - 4.36: 238591 4.36 - 4.90: 436262 Nonbonded interactions: 990508 Sorted by model distance: nonbonded pdb=" O TRP e 45 " pdb=" NH2 ARG j 70 " model vdw 2.214 2.520 nonbonded pdb=" NH2 ARG U 70 " pdb=" O TRP Z 45 " model vdw 2.214 2.520 nonbonded pdb=" NH2 ARG I 70 " pdb=" O TRP s 45 " model vdw 2.214 2.520 nonbonded pdb=" NH2 ARG 8 70 " pdb=" O TRP m 45 " model vdw 2.214 2.520 nonbonded pdb=" O TRP T 45 " pdb=" NH2 ARG c 70 " model vdw 2.214 2.520 ... (remaining 990503 not shown) NOTE: a complete listing of the restraints can be obtained by requesting output of .geo file. Find NCS groups from input model Found NCS groups: ncs_group { reference = chain '0' selection = chain '1' selection = chain '2' selection = chain '3' selection = chain '4' selection = chain '5' selection = chain '6' selection = chain '7' selection = chain '8' selection = chain '9' selection = chain 'A' selection = chain 'B' selection = chain 'C' selection = chain 'D' selection = chain 'E' selection = chain 'F' selection = chain 'G' selection = chain 'H' selection = chain 'I' selection = chain 'J' selection = chain 'K' selection = chain 'L' selection = chain 'M' selection = chain 'N' selection = chain 'O' selection = chain 'P' selection = chain 'Q' selection = chain 'R' selection = chain 'S' selection = chain 'T' selection = chain 'U' selection = chain 'V' selection = chain 'W' selection = chain 'X' selection = chain 'Y' selection = chain 'Z' selection = chain 'a' selection = chain 'b' selection = chain 'c' selection = chain 'd' selection = chain 'e' selection = chain 'f' selection = chain 'g' selection = chain 'h' selection = chain 'i' selection = chain 'j' selection = chain 'k' selection = chain 'l' selection = chain 'm' selection = chain 'n' selection = chain 'o' selection = chain 'p' selection = chain 'q' selection = chain 'r' selection = chain 's' selection = chain 't' selection = chain 'u' selection = chain 'v' selection = chain 'w' selection = chain 'x' } Set up NCS constraints No NCS constraints will be used in refinement. Set refine NCS operators Adjust number of macro_cycles Number of macro_cycles: 10 Reset NCS operators Extract rigid body selections Check and reset occupancies Occupancies: min=1.00 max=1.00 mean=1.00 Load rotamer database and sin/cos tables Set ADP refinement strategy ADPs will be refined as individual isotropic Make a string to write initial .geo file Internal consistency checks Time: Set random seed: 0.000 Set model cs if undefined: 0.000 Decide on map wrapping: 0.000 Normalize map: mean=0, sd=1: 2.040 Set stop_for_unknowns flag: 0.000 Assert model is a single copy model: 0.000 Assert all atoms have isotropic ADPs: 0.010 Construct map_model_manager: 0.120 Extract box with map and model: 20.350 Check model and map are aligned: 1.380 Set scattering table: 0.820 Process input model: 248.800 Find NCS groups from input model: 6.430 Set up NCS constraints: 1.470 Set refine NCS operators: 0.000 Adjust number of macro_cycles: 0.000 Reset NCS operators: 0.000 Extract rigid body selections: 0.000 Check and reset occupancies: 0.020 Load rotamer database and sin/cos tables:11.080 Set ADP refinement strategy: 0.000 Make a string to write initial .geo file:0.000 Internal consistency checks: 0.000 Total: 292.520 ------------------------------------------------------------------------------- Set refinement monitor ********************** ------------------------------------------------------------------------------- Setup refinement engine *********************** ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8502 moved from start: 0.0000 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.008 0.064 131340 Z= 0.519 Angle : 0.788 7.397 177420 Z= 0.422 Chirality : 0.057 0.296 19620 Planarity : 0.005 0.051 22620 Dihedral : 14.457 85.165 49440 Min Nonbonded Distance : 2.214 Molprobity Statistics. All-atom Clashscore : 2.81 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.47 % Favored : 96.53 % Rotamer Outliers : 3.45 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.22 (0.06), residues: 15540 helix: 2.80 (0.07), residues: 4920 sheet: -0.34 (0.08), residues: 3780 loop : -1.63 (0.06), residues: 6840 *********************** REFINEMENT MACRO_CYCLE 1 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1831 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 480 poor density : 1351 time to evaluate : 11.708 Fit side-chains outliers start: 480 outliers final: 96 residues processed: 1771 average time/residue: 2.2665 time to fit residues: 5454.0895 Evaluate side-chains 1113 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 96 poor density : 1017 time to evaluate : 11.729 Switching outliers to nearest non-outliers outliers start: 96 outliers final: 84 residues processed: 12 average time/residue: 0.9692 time to fit residues: 37.2315 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=5.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 1317 optimal weight: 0.8980 chunk 1182 optimal weight: 0.8980 chunk 656 optimal weight: 0.3980 chunk 403 optimal weight: 5.9990 chunk 797 optimal weight: 0.9990 chunk 631 optimal weight: 3.9990 chunk 1222 optimal weight: 4.9990 chunk 473 optimal weight: 3.9990 chunk 743 optimal weight: 1.9990 chunk 910 optimal weight: 4.9990 chunk 1416 optimal weight: 0.4980 overall best weight: 0.7382 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: B 252 ASN C 17 GLN C 252 ASN H 252 ASN I 252 ASN N 252 ASN O 252 ASN P 17 GLN P 252 ASN T 252 ASN W 252 ASN X 17 GLN X 252 ASN 0 252 ASN 1 17 GLN 1 252 ASN 4 17 GLN 4 252 ASN 8 252 ASN c 252 ASN d 17 GLN d 252 ASN e 252 ASN i 252 ASN m 252 ASN n 17 GLN n 252 ASN q 252 ASN r 17 GLN r 252 ASN u 252 ASN v 17 GLN v 252 ASN Total number of N/Q/H flips: 33 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8362 moved from start: 0.1624 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.002 0.020 131340 Z= 0.119 Angle : 0.479 5.590 177420 Z= 0.248 Chirality : 0.041 0.130 19620 Planarity : 0.004 0.048 22620 Dihedral : 4.093 20.583 17040 Min Nonbonded Distance : 2.235 Molprobity Statistics. All-atom Clashscore : 2.08 Ramachandran Plot: Outliers : 0.00 % Allowed : 2.70 % Favored : 97.30 % Rotamer Outliers : 2.29 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.57 (0.07), residues: 15540 helix: 3.02 (0.07), residues: 5040 sheet: -0.22 (0.08), residues: 4080 loop : -1.44 (0.06), residues: 6420 *********************** REFINEMENT MACRO_CYCLE 2 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1222 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 319 poor density : 903 time to evaluate : 11.830 Fit side-chains outliers start: 319 outliers final: 166 residues processed: 1174 average time/residue: 2.0058 time to fit residues: 3367.0396 Evaluate side-chains 954 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 166 poor density : 788 time to evaluate : 11.703 Switching outliers to nearest non-outliers outliers start: 166 outliers final: 142 residues processed: 24 average time/residue: 1.6392 time to fit residues: 76.1824 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=4.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 787 optimal weight: 10.0000 chunk 439 optimal weight: 4.9990 chunk 1179 optimal weight: 6.9990 chunk 964 optimal weight: 6.9990 chunk 390 optimal weight: 5.9990 chunk 1419 optimal weight: 7.9990 chunk 1533 optimal weight: 6.9990 chunk 1263 optimal weight: 6.9990 chunk 1407 optimal weight: 8.9990 chunk 483 optimal weight: 5.9990 chunk 1138 optimal weight: 5.9990 overall best weight: 5.9990 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: B 252 ASN D 252 ASN H 252 ASN I 17 GLN J 252 ASN K 252 ASN N 252 ASN O 17 GLN Q 252 ASN T 252 ASN W 252 ASN Y 252 ASN 0 252 ASN 2 252 ASN 5 252 ASN 8 252 ASN 9 252 ASN c 252 ASN e 17 GLN f 252 ASN i 252 ASN j 252 ASN m 252 ASN q 252 ASN s 252 ASN u 252 ASN w 252 ASN Total number of N/Q/H flips: 27 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8498 moved from start: 0.1233 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.008 0.039 131340 Z= 0.487 Angle : 0.709 11.154 177420 Z= 0.353 Chirality : 0.049 0.152 19620 Planarity : 0.005 0.054 22620 Dihedral : 4.671 20.047 17040 Min Nonbonded Distance : 2.194 Molprobity Statistics. All-atom Clashscore : 2.66 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.92 % Favored : 96.08 % Rotamer Outliers : 3.48 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.26 (0.06), residues: 15540 helix: 2.72 (0.07), residues: 5040 sheet: -0.30 (0.08), residues: 3780 loop : -1.60 (0.06), residues: 6720 *********************** REFINEMENT MACRO_CYCLE 3 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1397 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 484 poor density : 913 time to evaluate : 11.929 Fit side-chains outliers start: 484 outliers final: 136 residues processed: 1294 average time/residue: 2.2884 time to fit residues: 4033.7714 Evaluate side-chains 1045 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 136 poor density : 909 time to evaluate : 11.709 Switching outliers to nearest non-outliers outliers start: 136 outliers final: 127 residues processed: 9 average time/residue: 1.1638 time to fit residues: 34.2154 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=4.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 1402 optimal weight: 3.9990 chunk 1067 optimal weight: 4.9990 chunk 736 optimal weight: 2.9990 chunk 157 optimal weight: 0.8980 chunk 677 optimal weight: 0.9980 chunk 952 optimal weight: 8.9990 chunk 1424 optimal weight: 1.9990 chunk 1507 optimal weight: 1.9990 chunk 744 optimal weight: 8.9990 chunk 1349 optimal weight: 0.8980 chunk 406 optimal weight: 0.9980 overall best weight: 1.1582 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: C 17 GLN I 17 GLN O 17 GLN P 17 GLN X 17 GLN 1 17 GLN 4 17 GLN d 17 GLN e 17 GLN n 17 GLN r 17 GLN v 17 GLN Total number of N/Q/H flips: 12 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8388 moved from start: 0.1780 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.002 0.018 131340 Z= 0.130 Angle : 0.476 5.118 177420 Z= 0.247 Chirality : 0.041 0.135 19620 Planarity : 0.004 0.050 22620 Dihedral : 4.075 20.844 17040 Min Nonbonded Distance : 2.208 Molprobity Statistics. All-atom Clashscore : 2.50 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.09 % Favored : 96.91 % Rotamer Outliers : 2.14 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.57 (0.07), residues: 15540 helix: 3.03 (0.07), residues: 5040 sheet: -0.22 (0.08), residues: 4080 loop : -1.45 (0.06), residues: 6420 *********************** REFINEMENT MACRO_CYCLE 4 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1080 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 298 poor density : 782 time to evaluate : 11.931 Fit side-chains outliers start: 298 outliers final: 174 residues processed: 1020 average time/residue: 2.2657 time to fit residues: 3190.5606 Evaluate side-chains 920 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 174 poor density : 746 time to evaluate : 11.674 Switching outliers to nearest non-outliers outliers start: 174 outliers final: 147 residues processed: 27 average time/residue: 1.6886 time to fit residues: 84.8491 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=3.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 1255 optimal weight: 3.9990 chunk 855 optimal weight: 7.9990 chunk 21 optimal weight: 10.0000 chunk 1122 optimal weight: 0.2980 chunk 622 optimal weight: 0.9980 chunk 1286 optimal weight: 2.9990 chunk 1042 optimal weight: 0.7980 chunk 1 optimal weight: 3.9990 chunk 769 optimal weight: 6.9990 chunk 1353 optimal weight: 6.9990 chunk 380 optimal weight: 7.9990 overall best weight: 1.8184 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: B 252 ASN H 252 ASN T 252 ASN W 252 ASN 0 252 ASN c 252 ASN q 252 ASN Total number of N/Q/H flips: 7 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8408 moved from start: 0.1728 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.003 0.023 131340 Z= 0.170 Angle : 0.491 5.569 177420 Z= 0.251 Chirality : 0.041 0.139 19620 Planarity : 0.004 0.049 22620 Dihedral : 4.027 20.737 17040 Min Nonbonded Distance : 2.201 Molprobity Statistics. All-atom Clashscore : 2.90 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.17 % Favored : 96.83 % Rotamer Outliers : 2.09 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.69 (0.07), residues: 15540 helix: 3.15 (0.07), residues: 5040 sheet: -0.16 (0.08), residues: 4080 loop : -1.40 (0.06), residues: 6420 *********************** REFINEMENT MACRO_CYCLE 5 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1039 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 291 poor density : 748 time to evaluate : 11.818 Fit side-chains outliers start: 291 outliers final: 175 residues processed: 983 average time/residue: 2.1322 time to fit residues: 2917.0804 Evaluate side-chains 893 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 175 poor density : 718 time to evaluate : 11.726 Switching outliers to nearest non-outliers outliers start: 175 outliers final: 160 residues processed: 15 average time/residue: 1.2489 time to fit residues: 47.4419 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=3.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 507 optimal weight: 10.0000 chunk 1357 optimal weight: 5.9990 chunk 298 optimal weight: 6.9990 chunk 885 optimal weight: 6.9990 chunk 372 optimal weight: 7.9990 chunk 1509 optimal weight: 0.0470 chunk 1252 optimal weight: 3.9990 chunk 698 optimal weight: 7.9990 chunk 125 optimal weight: 6.9990 chunk 499 optimal weight: 10.0000 chunk 792 optimal weight: 6.9990 overall best weight: 4.8086 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: D 252 ASN J 252 ASN Q 252 ASN Y 252 ASN j 252 ASN s 252 ASN u 252 ASN Total number of N/Q/H flips: 7 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8481 moved from start: 0.1448 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.006 0.030 131340 Z= 0.391 Angle : 0.640 8.639 177420 Z= 0.321 Chirality : 0.046 0.148 19620 Planarity : 0.005 0.053 22620 Dihedral : 4.494 20.568 17040 Min Nonbonded Distance : 2.189 Molprobity Statistics. All-atom Clashscore : 2.59 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.75 % Favored : 96.25 % Rotamer Outliers : 3.14 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.34 (0.06), residues: 15540 helix: 2.85 (0.07), residues: 5040 sheet: -0.24 (0.08), residues: 3780 loop : -1.62 (0.06), residues: 6720 *********************** REFINEMENT MACRO_CYCLE 6 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1306 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 437 poor density : 869 time to evaluate : 11.976 Fit side-chains outliers start: 437 outliers final: 178 residues processed: 1182 average time/residue: 2.2057 time to fit residues: 3616.2422 Evaluate side-chains 1021 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 178 poor density : 843 time to evaluate : 11.828 Switching outliers to nearest non-outliers outliers start: 178 outliers final: 154 residues processed: 24 average time/residue: 1.5979 time to fit residues: 74.5460 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=2.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 1455 optimal weight: 2.9990 chunk 170 optimal weight: 2.9990 chunk 859 optimal weight: 0.9980 chunk 1102 optimal weight: 3.9990 chunk 854 optimal weight: 0.9980 chunk 1270 optimal weight: 0.9990 chunk 842 optimal weight: 5.9990 chunk 1503 optimal weight: 2.9990 chunk 940 optimal weight: 1.9990 chunk 916 optimal weight: 2.9990 chunk 694 optimal weight: 5.9990 overall best weight: 1.5986 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... No N/Q/H corrections needed this macrocycle ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8404 moved from start: 0.1819 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.002 0.032 131340 Z= 0.158 Angle : 0.486 6.973 177420 Z= 0.251 Chirality : 0.041 0.135 19620 Planarity : 0.004 0.050 22620 Dihedral : 4.064 20.944 17040 Min Nonbonded Distance : 2.194 Molprobity Statistics. All-atom Clashscore : 2.83 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.17 % Favored : 96.83 % Rotamer Outliers : 2.37 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.63 (0.07), residues: 15540 helix: 3.09 (0.07), residues: 5040 sheet: -0.17 (0.08), residues: 4080 loop : -1.44 (0.06), residues: 6420 *********************** REFINEMENT MACRO_CYCLE 7 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1080 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 330 poor density : 750 time to evaluate : 12.022 Fit side-chains outliers start: 330 outliers final: 182 residues processed: 1031 average time/residue: 2.2640 time to fit residues: 3222.2226 Evaluate side-chains 902 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 182 poor density : 720 time to evaluate : 11.730 Switching outliers to nearest non-outliers outliers start: 182 outliers final: 162 residues processed: 32 average time/residue: 1.3434 time to fit residues: 86.2073 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=2.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 930 optimal weight: 0.7980 chunk 600 optimal weight: 7.9990 chunk 898 optimal weight: 6.9990 chunk 452 optimal weight: 7.9990 chunk 295 optimal weight: 0.8980 chunk 291 optimal weight: 0.0370 chunk 955 optimal weight: 8.9990 chunk 1024 optimal weight: 3.9990 chunk 743 optimal weight: 7.9990 chunk 140 optimal weight: 8.9990 chunk 1181 optimal weight: 6.9990 overall best weight: 2.5462 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: N 252 ASN 8 252 ASN i 252 ASN m 252 ASN Total number of N/Q/H flips: 4 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8434 moved from start: 0.1703 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.003 0.025 131340 Z= 0.219 Angle : 0.527 6.332 177420 Z= 0.268 Chirality : 0.042 0.142 19620 Planarity : 0.004 0.050 22620 Dihedral : 4.142 20.889 17040 Min Nonbonded Distance : 2.192 Molprobity Statistics. All-atom Clashscore : 2.92 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.20 % Favored : 96.80 % Rotamer Outliers : 2.51 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.62 (0.07), residues: 15540 helix: 3.10 (0.07), residues: 5040 sheet: -0.20 (0.08), residues: 4080 loop : -1.44 (0.06), residues: 6420 *********************** REFINEMENT MACRO_CYCLE 8 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1101 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 349 poor density : 752 time to evaluate : 11.857 Fit side-chains outliers start: 349 outliers final: 205 residues processed: 1011 average time/residue: 2.1779 time to fit residues: 3055.1145 Evaluate side-chains 951 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 205 poor density : 746 time to evaluate : 11.684 Switching outliers to nearest non-outliers outliers start: 205 outliers final: 174 residues processed: 43 average time/residue: 1.4181 time to fit residues: 112.8331 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=1.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 1367 optimal weight: 0.8980 chunk 1440 optimal weight: 2.9990 chunk 1314 optimal weight: 8.9990 chunk 1401 optimal weight: 4.9990 chunk 843 optimal weight: 3.9990 chunk 610 optimal weight: 6.9990 chunk 1100 optimal weight: 6.9990 chunk 429 optimal weight: 6.9990 chunk 1266 optimal weight: 4.9990 chunk 1325 optimal weight: 4.9990 chunk 1396 optimal weight: 5.9990 overall best weight: 3.5788 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... No N/Q/H corrections needed this macrocycle ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8460 moved from start: 0.1611 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.005 0.031 131340 Z= 0.297 Angle : 0.589 8.121 177420 Z= 0.297 Chirality : 0.044 0.145 19620 Planarity : 0.004 0.051 22620 Dihedral : 4.339 20.799 17040 Min Nonbonded Distance : 2.177 Molprobity Statistics. All-atom Clashscore : 2.90 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.19 % Favored : 96.81 % Rotamer Outliers : 2.16 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.41 (0.06), residues: 15540 helix: 2.97 (0.07), residues: 5040 sheet: -0.25 (0.08), residues: 3780 loop : -1.61 (0.06), residues: 6720 *********************** REFINEMENT MACRO_CYCLE 9 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 1103 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 300 poor density : 803 time to evaluate : 12.075 Fit side-chains outliers start: 300 outliers final: 191 residues processed: 1040 average time/residue: 2.1697 time to fit residues: 3127.4741 Evaluate side-chains 1000 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 191 poor density : 809 time to evaluate : 11.801 Switching outliers to nearest non-outliers outliers start: 191 outliers final: 171 residues processed: 26 average time/residue: 1.3863 time to fit residues: 73.5666 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=1.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 920 optimal weight: 6.9990 chunk 1481 optimal weight: 3.9990 chunk 904 optimal weight: 8.9990 chunk 702 optimal weight: 5.9990 chunk 1029 optimal weight: 5.9990 chunk 1554 optimal weight: 2.9990 chunk 1430 optimal weight: 5.9990 chunk 1237 optimal weight: 2.9990 chunk 128 optimal weight: 4.9990 chunk 955 optimal weight: 0.6980 chunk 758 optimal weight: 5.9990 overall best weight: 3.1388 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... No N/Q/H corrections needed this macrocycle ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8450 moved from start: 0.1661 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.004 0.029 131340 Z= 0.264 Angle : 0.562 7.188 177420 Z= 0.285 Chirality : 0.043 0.142 19620 Planarity : 0.004 0.051 22620 Dihedral : 4.278 20.939 17040 Min Nonbonded Distance : 2.170 Molprobity Statistics. All-atom Clashscore : 2.87 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.19 % Favored : 96.81 % Rotamer Outliers : 1.44 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.43 (0.06), residues: 15540 helix: 2.98 (0.07), residues: 5040 sheet: -0.23 (0.08), residues: 3780 loop : -1.62 (0.06), residues: 6720 ********************** REFINEMENT MACRO_CYCLE 10 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 31080 Ramachandran restraints generated. 15540 Oldfield, 0 Emsley, 15540 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 966 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 201 poor density : 765 time to evaluate : 11.899 Fit side-chains outliers start: 201 outliers final: 170 residues processed: 950 average time/residue: 2.2673 time to fit residues: 2990.5221 Evaluate side-chains 945 residues out of total 13920 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 170 poor density : 775 time to evaluate : 11.811 Switching outliers to nearest non-outliers outliers start: 170 outliers final: 168 residues processed: 2 average time/residue: 2.2748 time to fit residues: 22.6288 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Rotamers are restrained with sigma=1.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1560 random chunks: chunk 983 optimal weight: 0.8980 chunk 1318 optimal weight: 7.9990 chunk 379 optimal weight: 3.9990 chunk 1141 optimal weight: 0.9990 chunk 182 optimal weight: 10.0000 chunk 343 optimal weight: 0.8980 chunk 1239 optimal weight: 9.9990 chunk 518 optimal weight: 2.9990 chunk 1272 optimal weight: 2.9990 chunk 156 optimal weight: 4.9990 chunk 228 optimal weight: 5.9990 overall best weight: 1.7586 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... No N/Q/H corrections needed this macrocycle ------------------------------------------------------------------------------- ADP refinement ************** |-group b-factor refinement (macro cycle = 0; iterations = 0)-----------------| | r_work = 0.3469 r_free = 0.3469 target = 0.124078 restraints weight = None | |-----------------------------------------------------------------------------| |-group b-factor refinement (macro cycle = 1; iterations = 42)----------------| | r_work = 0.3222 r_free = 0.3222 target = 0.105568 restraints weight = 158331.222| |-----------------------------------------------------------------------------| r_work (start): 0.3176 rms_B_bonded: 1.94 r_work: 0.3028 rms_B_bonded: 2.51 restraints_weight: 0.5000 r_work: 0.2883 rms_B_bonded: 4.21 restraints_weight: 0.2500 r_work (final): 0.2883 ------------------------------------------------------------------------------- Occupancy refinement ******************** ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8710 moved from start: 0.1880 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd. rmsZ for bonds and angles. Bond : 0.003 0.030 131340 Z= 0.166 Angle : 0.487 5.272 177420 Z= 0.251 Chirality : 0.041 0.136 19620 Planarity : 0.004 0.050 22620 Dihedral : 4.022 20.952 17040 Min Nonbonded Distance : 2.171 Molprobity Statistics. All-atom Clashscore : 3.00 Ramachandran Plot: Outliers : 0.00 % Allowed : 3.11 % Favored : 96.89 % Rotamer Outliers : 1.80 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.00 % Rama-Z (Ramachandran plot Z-score): Interpretation: bad |Rama-Z| > 3; suspicious 2 < |Rama-Z| < 3; good |Rama-Z| < 2. Scores for whole/helix/sheet/loop are scaled independently; therefore, the values are not related in a simple manner. whole: 0.66 (0.07), residues: 15540 helix: 3.14 (0.07), residues: 5040 sheet: -0.18 (0.08), residues: 4080 loop : -1.43 (0.06), residues: 6420 =============================================================================== Job complete usr+sys time: 46060.95 seconds wall clock time: 794 minutes 21.87 seconds (47661.87 seconds total)