Starting phenix.real_space_refine on Sun Mar 17 13:12:34 2024 by dcliebschner =============================================================================== Processing files: ------------------------------------------------------------------------------- Found model, /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.pdb Found real_map, /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.map Processing PHIL parameters: ------------------------------------------------------------------------------- Adding command-line PHIL: ------------------------- refinement.macro_cycles=10 scattering_table=electron resolution=2.8 write_initial_geo_file=False Final processed PHIL parameters: ------------------------------------------------------------------------------- data_manager { real_map_files = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.map" default_real_map = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.map" model { file = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.pdb" } default_model = "/net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7mud_24005/03_2024/7mud_24005.pdb" } resolution = 2.8 write_initial_geo_file = False refinement { macro_cycles = 10 } qi { qm_restraints { package { program = *test } } } 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 Origin is already at (0, 0, 0), no shifts will be applied ------------------------------------------------------------------------------- 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= 0.000 sd= 0.004 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 520 5.16 5 C 85397 2.51 5 N 23764 2.21 5 O 25077 1.98 5 sf(0) = scattering factor at diffraction angle 0. Process input model Symmetric amino acids flipped Residue "AC GLU 81": "OE1" <-> "OE2" Residue "AC ASP 91": "OD1" <-> "OD2" Residue "AC ASP 121": "OD1" <-> "OD2" Residue "AC ASP 129": "OD1" <-> "OD2" Residue "AC TYR 150": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AC TYR 155": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AC ASP 236": "OD1" <-> "OD2" Residue "AD TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AD GLU 92": "OE1" <-> "OE2" Residue "AD GLU 126": "OE1" <-> "OE2" Residue "AD ASP 134": "OD1" <-> "OD2" Residue "AH ASP 301": "OD1" <-> "OD2" Residue "AH TYR 312": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AH GLU 338": "OE1" <-> "OE2" Residue "AK ASP 46": "OD1" <-> "OD2" Residue "AK ASP 50": "OD1" <-> "OD2" Residue "AK ASP 86": "OD1" <-> "OD2" Residue "AK GLU 181": "OE1" <-> "OE2" Residue "AL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AL GLU 118": "OE1" <-> "OE2" Residue "AL ASP 121": "OD1" <-> "OD2" Residue "AL GLU 142": "OE1" <-> "OE2" Residue "AL GLU 206": "OE1" <-> "OE2" Residue "AM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "AM GLU 141": "OE1" <-> "OE2" Residue "AM GLU 262": "OE1" <-> "OE2" Residue "AM ASP 308": "OD1" <-> "OD2" Residue "AN ASP 105": "OD1" <-> "OD2" Residue "AN TYR 107": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Ad TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Ad ASP 86": "OD1" <-> "OD2" Residue "Ad GLU 93": "OE1" <-> "OE2" Residue "Ad GLU 130": "OE1" <-> "OE2" Residue "Ad ASP 134": "OD1" <-> "OD2" Residue "Ad ASP 136": "OD1" <-> "OD2" Residue "Ad GLU 155": "OE1" <-> "OE2" Residue "Af TYR 210": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Af GLU 234": "OE1" <-> "OE2" Residue "BC GLU 81": "OE1" <-> "OE2" Residue "BC GLU 102": "OE1" <-> "OE2" Residue "BC ASP 189": "OD1" <-> "OD2" Residue "BD GLU 43": "OE1" <-> "OE2" Residue "BD GLU 130": "OE1" <-> "OE2" Residue "BD GLU 155": "OE1" <-> "OE2" Residue "BH GLU 359": "OE1" <-> "OE2" Residue "BK ASP 46": "OD1" <-> "OD2" Residue "BK ASP 86": "OD1" <-> "OD2" Residue "BK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "BL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "BL ASP 108": "OD1" <-> "OD2" Residue "BM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "BM TYR 282": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "BM ASP 308": "OD1" <-> "OD2" Residue "Bd ASP 36": "OD1" <-> "OD2" Residue "Bd ASP 50": "OD1" <-> "OD2" Residue "Bd GLU 59": "OE1" <-> "OE2" Residue "Bd ASP 86": "OD1" <-> "OD2" Residue "Bd GLU 92": "OE1" <-> "OE2" Residue "Bd ASP 134": "OD1" <-> "OD2" Residue "Bd ASP 136": "OD1" <-> "OD2" Residue "Bf TYR 241": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CC ASP 189": "OD1" <-> "OD2" Residue "CC ASP 230": "OD1" <-> "OD2" Residue "CC GLU 261": "OE1" <-> "OE2" Residue "CD GLU 54": "OE1" <-> "OE2" Residue "CD GLU 59": "OE1" <-> "OE2" Residue "CD TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CD GLU 92": "OE1" <-> "OE2" Residue "CD ASP 125": "OD1" <-> "OD2" Residue "CD ASP 136": "OD1" <-> "OD2" Residue "CH GLU 285": "OE1" <-> "OE2" Residue "CK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CK GLU 181": "OE1" <-> "OE2" Residue "CL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CL GLU 118": "OE1" <-> "OE2" Residue "CM TYR 101": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "CM TYR 197": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Cd ASP 36": "OD1" <-> "OD2" Residue "Cd ASP 68": "OD1" <-> "OD2" Residue "Cd TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Cd ASP 86": "OD1" <-> "OD2" Residue "Cd GLU 92": "OE1" <-> "OE2" Residue "Cd GLU 130": "OE1" <-> "OE2" Residue "Cd GLU 155": "OE1" <-> "OE2" Residue "Cf TYR 241": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DC ASP 121": "OD1" <-> "OD2" Residue "DC GLU 239": "OE1" <-> "OE2" Residue "DC GLU 254": "OE1" <-> "OE2" Residue "DD TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DD GLU 130": "OE1" <-> "OE2" Residue "DD ASP 136": "OD1" <-> "OD2" Residue "DD GLU 155": "OE1" <-> "OE2" Residue "DH ASP 301": "OD1" <-> "OD2" Residue "DH TYR 312": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DK ASP 46": "OD1" <-> "OD2" Residue "DK ASP 59": "OD1" <-> "OD2" Residue "DK ASP 86": "OD1" <-> "OD2" Residue "DK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DK GLU 142": "OE1" <-> "OE2" Residue "DK ASP 150": "OD1" <-> "OD2" Residue "DK GLU 181": "OE1" <-> "OE2" Residue "DL GLU 118": "OE1" <-> "OE2" Residue "DL ASP 130": "OD1" <-> "OD2" Residue "DL GLU 142": "OE1" <-> "OE2" Residue "DL GLU 187": "OE1" <-> "OE2" Residue "DL GLU 206": "OE1" <-> "OE2" Residue "DM TYR 101": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "DM GLU 141": "OE1" <-> "OE2" Residue "DM TYR 281": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Dd TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Dd ASP 86": "OD1" <-> "OD2" Residue "Dd GLU 92": "OE1" <-> "OE2" Residue "Dd GLU 93": "OE1" <-> "OE2" Residue "Dd ASP 125": "OD1" <-> "OD2" Residue "Dd GLU 130": "OE1" <-> "OE2" Residue "Dd ASP 134": "OD1" <-> "OD2" Residue "Dd ASP 136": "OD1" <-> "OD2" Residue "Df TYR 241": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "EC GLU 81": "OE1" <-> "OE2" Residue "EC ASP 91": "OD1" <-> "OD2" Residue "EC ASP 121": "OD1" <-> "OD2" Residue "EC TYR 155": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "EC TYR 225": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "ED GLU 54": "OE1" <-> "OE2" Residue "ED ASP 86": "OD1" <-> "OD2" Residue "ED GLU 126": "OE1" <-> "OE2" Residue "ED GLU 130": "OE1" <-> "OE2" Residue "ED ASP 134": "OD1" <-> "OD2" Residue "EK ASP 46": "OD1" <-> "OD2" Residue "EK ASP 86": "OD1" <-> "OD2" Residue "EK GLU 142": "OE1" <-> "OE2" Residue "EL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "EL ASP 108": "OD1" <-> "OD2" Residue "EL ASP 170": "OD1" <-> "OD2" Residue "EL GLU 206": "OE1" <-> "OE2" Residue "EL ASP 216": "OD1" <-> "OD2" Residue "EM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Ed ASP 68": "OD1" <-> "OD2" Residue "Ed GLU 130": "OE1" <-> "OE2" Residue "Ed ASP 134": "OD1" <-> "OD2" Residue "Ed ASP 136": "OD1" <-> "OD2" Residue "Ed GLU 155": "OE1" <-> "OE2" Residue "Ef TYR 210": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Ef TYR 211": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FC GLU 81": "OE1" <-> "OE2" Residue "FC ASP 91": "OD1" <-> "OD2" Residue "FC GLU 102": "OE1" <-> "OE2" Residue "FC ASP 121": "OD1" <-> "OD2" Residue "FC TYR 150": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FC GLU 196": "OE1" <-> "OE2" Residue "FC GLU 204": "OE1" <-> "OE2" Residue "FC ASP 205": "OD1" <-> "OD2" Residue "FC ASP 236": "OD1" <-> "OD2" Residue "FC GLU 254": "OE1" <-> "OE2" Residue "FD ASP 50": "OD1" <-> "OD2" Residue "FD TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FD ASP 86": "OD1" <-> "OD2" Residue "FD GLU 92": "OE1" <-> "OE2" Residue "FD GLU 130": "OE1" <-> "OE2" Residue "FD GLU 155": "OE1" <-> "OE2" Residue "FH ASP 301": "OD1" <-> "OD2" Residue "FH GLU 338": "OE1" <-> "OE2" Residue "FK ASP 46": "OD1" <-> "OD2" Residue "FK ASP 50": "OD1" <-> "OD2" Residue "FK ASP 59": "OD1" <-> "OD2" Residue "FK GLU 142": "OE1" <-> "OE2" Residue "FL TYR 47": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FL ASP 108": "OD1" <-> "OD2" Residue "FL GLU 118": "OE1" <-> "OE2" Residue "FL GLU 142": "OE1" <-> "OE2" Residue "FL GLU 187": "OE1" <-> "OE2" Residue "FL PHE 234": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FM PHE 188": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FM TYR 197": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "FN ASP 105": "OD1" <-> "OD2" Residue "Fd GLU 59": "OE1" <-> "OE2" Residue "Fd ASP 68": "OD1" <-> "OD2" Residue "Fd ASP 86": "OD1" <-> "OD2" Residue "Fd ASP 134": "OD1" <-> "OD2" Residue "Fd ASP 136": "OD1" <-> "OD2" Residue "Fd GLU 155": "OE1" <-> "OE2" Residue "Ff TYR 210": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "GC ASP 95": "OD1" <-> "OD2" Residue "GC GLU 102": "OE1" <-> "OE2" Residue "GC ASP 121": "OD1" <-> "OD2" Residue "GC TYR 155": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "GC ASP 189": "OD1" <-> "OD2" Residue "GC GLU 261": "OE1" <-> "OE2" Residue "GD GLU 59": "OE1" <-> "OE2" Residue "GD GLU 130": "OE1" <-> "OE2" Residue "GD ASP 134": "OD1" <-> "OD2" Residue "GH GLU 285": "OE1" <-> "OE2" Residue "GH GLU 338": "OE1" <-> "OE2" Residue "GK ASP 50": "OD1" <-> "OD2" Residue "GK ASP 59": "OD1" <-> "OD2" Residue "GK GLU 142": "OE1" <-> "OE2" Residue "GL ASP 108": "OD1" <-> "OD2" Residue "GL ASP 121": "OD1" <-> "OD2" Residue "GL ASP 130": "OD1" <-> "OD2" Residue "GL GLU 142": "OE1" <-> "OE2" Residue "GL GLU 187": "OE1" <-> "OE2" Residue "GM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "GM ASP 180": "OD1" <-> "OD2" Residue "GM PHE 188": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "GM ASP 313": "OD1" <-> "OD2" Residue "Gd ASP 68": "OD1" <-> "OD2" Residue "Gd TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Gd ASP 86": "OD1" <-> "OD2" Residue "Gd GLU 93": "OE1" <-> "OE2" Residue "Gd GLU 130": "OE1" <-> "OE2" Residue "Gd ASP 136": "OD1" <-> "OD2" Residue "Gd GLU 155": "OE1" <-> "OE2" Residue "Gf TYR 211": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Gf TYR 241": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "HC ASP 91": "OD1" <-> "OD2" Residue "HC ASP 189": "OD1" <-> "OD2" Residue "HC ASP 230": "OD1" <-> "OD2" Residue "HD GLU 59": "OE1" <-> "OE2" Residue "HD ASP 136": "OD1" <-> "OD2" Residue "HD GLU 155": "OE1" <-> "OE2" Residue "HH GLU 338": "OE1" <-> "OE2" Residue "HK ASP 46": "OD1" <-> "OD2" Residue "HK ASP 86": "OD1" <-> "OD2" Residue "HK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "HK GLU 142": "OE1" <-> "OE2" Residue "HK GLU 181": "OE1" <-> "OE2" Residue "HL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "HL ASP 113": "OD1" <-> "OD2" Residue "HL ASP 121": "OD1" <-> "OD2" Residue "HL GLU 142": "OE1" <-> "OE2" Residue "HM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "HM ASP 195": "OD1" <-> "OD2" Residue "HM TYR 282": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "HN GLU 110": "OE1" <-> "OE2" Residue "Hd ASP 50": "OD1" <-> "OD2" Residue "Hd GLU 59": "OE1" <-> "OE2" Residue "Hd ASP 68": "OD1" <-> "OD2" Residue "Hd ASP 86": "OD1" <-> "OD2" Residue "Hd ASP 125": "OD1" <-> "OD2" Residue "Hd GLU 130": "OE1" <-> "OE2" Residue "Hd ASP 136": "OD1" <-> "OD2" Residue "Hd GLU 155": "OE1" <-> "OE2" Residue "IC GLU 81": "OE1" <-> "OE2" Residue "IC ASP 121": "OD1" <-> "OD2" Residue "IC ASP 189": "OD1" <-> "OD2" Residue "IC GLU 196": "OE1" <-> "OE2" Residue "IC TYR 225": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "IC ASP 236": "OD1" <-> "OD2" Residue "ID GLU 54": "OE1" <-> "OE2" Residue "ID ASP 86": "OD1" <-> "OD2" Residue "IH GLU 285": "OE1" <-> "OE2" Residue "IK ASP 46": "OD1" <-> "OD2" Residue "IK ASP 59": "OD1" <-> "OD2" Residue "IK ASP 86": "OD1" <-> "OD2" Residue "IK GLU 142": "OE1" <-> "OE2" Residue "IL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "IL ASP 108": "OD1" <-> "OD2" Residue "IL TYR 116": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "IL ASP 170": "OD1" <-> "OD2" Residue "IL GLU 187": "OE1" <-> "OE2" Residue "IM ASP 135": "OD1" <-> "OD2" Residue "IM GLU 262": "OE1" <-> "OE2" Residue "IM ASP 313": "OD1" <-> "OD2" Residue "IN ASP 105": "OD1" <-> "OD2" Residue "IN TYR 107": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Id GLU 43": "OE1" <-> "OE2" Residue "Id ASP 50": "OD1" <-> "OD2" Residue "Id ASP 68": "OD1" <-> "OD2" Residue "Id TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Id ASP 86": "OD1" <-> "OD2" Residue "Id GLU 92": "OE1" <-> "OE2" Residue "Id GLU 93": "OE1" <-> "OE2" Residue "Id GLU 126": "OE1" <-> "OE2" Residue "Id GLU 130": "OE1" <-> "OE2" Residue "Id ASP 134": "OD1" <-> "OD2" Residue "JC TYR 225": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "JD ASP 125": "OD1" <-> "OD2" Residue "JD ASP 134": "OD1" <-> "OD2" Residue "JK ASP 50": "OD1" <-> "OD2" Residue "JK ASP 86": "OD1" <-> "OD2" Residue "JK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "JK GLU 142": "OE1" <-> "OE2" Residue "JL ASP 108": "OD1" <-> "OD2" Residue "JL ASP 130": "OD1" <-> "OD2" Residue "JL GLU 142": "OE1" <-> "OE2" Residue "JL GLU 187": "OE1" <-> "OE2" Residue "JM TYR 197": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "JM ASP 313": "OD1" <-> "OD2" Residue "Jd ASP 68": "OD1" <-> "OD2" Residue "Jd ASP 125": "OD1" <-> "OD2" Residue "Jd ASP 134": "OD1" <-> "OD2" Residue "Jd GLU 155": "OE1" <-> "OE2" Residue "KC ASP 121": "OD1" <-> "OD2" Residue "KC ASP 189": "OD1" <-> "OD2" Residue "KD ASP 50": "OD1" <-> "OD2" Residue "KD GLU 92": "OE1" <-> "OE2" Residue "KD ASP 134": "OD1" <-> "OD2" Residue "KH GLU 285": "OE1" <-> "OE2" Residue "KH TYR 312": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "KK ASP 46": "OD1" <-> "OD2" Residue "KK ASP 86": "OD1" <-> "OD2" Residue "KK TYR 119": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "KL TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "KL GLU 118": "OE1" <-> "OE2" Residue "KL GLU 187": "OE1" <-> "OE2" Residue "KL GLU 206": "OE1" <-> "OE2" Residue "KM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "KM ASP 180": "OD1" <-> "OD2" Residue "KM TYR 197": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "KM GLU 262": "OE1" <-> "OE2" Residue "KM ASP 313": "OD1" <-> "OD2" Residue "Kd ASP 68": "OD1" <-> "OD2" Residue "Kd TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Kd ASP 86": "OD1" <-> "OD2" Residue "Kd GLU 92": "OE1" <-> "OE2" Residue "Kd GLU 155": "OE1" <-> "OE2" Residue "Kf TYR 210": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Kf TYR 211": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LC ASP 121": "OD1" <-> "OD2" Residue "LC ASP 154": "OD1" <-> "OD2" Residue "LC TYR 155": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LC ASP 230": "OD1" <-> "OD2" Residue "LC GLU 254": "OE1" <-> "OE2" Residue "LD ASP 50": "OD1" <-> "OD2" Residue "LD GLU 54": "OE1" <-> "OE2" Residue "LD TYR 77": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LD GLU 92": "OE1" <-> "OE2" Residue "LD ASP 136": "OD1" <-> "OD2" Residue "LK ASP 86": "OD1" <-> "OD2" Residue "LK GLU 142": "OE1" <-> "OE2" Residue "LL ASP 108": "OD1" <-> "OD2" Residue "LL TYR 116": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LL ASP 130": "OD1" <-> "OD2" Residue "LL GLU 187": "OE1" <-> "OE2" Residue "LL GLU 206": "OE1" <-> "OE2" Residue "LM TYR 101": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LM GLU 141": "OE1" <-> "OE2" Residue "LM GLU 262": "OE1" <-> "OE2" Residue "LN ASP 105": "OD1" <-> "OD2" Residue "LN TYR 107": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "LN GLU 110": "OE1" <-> "OE2" Residue "Ld GLU 43": "OE1" <-> "OE2" Residue "Ld GLU 59": "OE1" <-> "OE2" Residue "Ld ASP 68": "OD1" <-> "OD2" Residue "Ld GLU 130": "OE1" <-> "OE2" Residue "Ld ASP 134": "OD1" <-> "OD2" Residue "Ld ASP 136": "OD1" <-> "OD2" Residue "Lf TYR 210": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Lf TYR 241": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "MC ASP 91": "OD1" <-> "OD2" Residue "MC GLU 196": "OE1" <-> "OE2" Residue "MC TYR 225": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "MC GLU 239": "OE1" <-> "OE2" Residue "MD GLU 43": "OE1" <-> "OE2" Residue "MD ASP 50": "OD1" <-> "OD2" Residue "MD GLU 59": "OE1" <-> "OE2" Residue "MD ASP 86": "OD1" <-> "OD2" Residue "MD GLU 126": "OE1" <-> "OE2" Residue "MD GLU 130": "OE1" <-> "OE2" Residue "MD ASP 134": "OD1" <-> "OD2" Residue "MD GLU 155": "OE1" <-> "OE2" Residue "MH GLU 285": "OE1" <-> "OE2" Residue "MK ASP 46": "OD1" <-> "OD2" Residue "MK ASP 59": "OD1" <-> "OD2" Residue "MK GLU 142": "OE1" <-> "OE2" Residue "ML TYR 98": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "ML ASP 108": "OD1" <-> "OD2" Residue "ML GLU 187": "OE1" <-> "OE2" Residue "ML ASP 216": "OD1" <-> "OD2" Residue "MM TYR 137": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "MM ASP 180": "OD1" <-> "OD2" Residue "MM PHE 188": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "MN TYR 107": "CD1" <-> "CD2" "CE1" <-> "CE2" Residue "Md GLU 43": "OE1" <-> "OE2" Residue "Md GLU 59": "OE1" <-> "OE2" Residue "Md ASP 68": "OD1" <-> "OD2" Residue "Md ASP 86": "OD1" <-> "OD2" Residue "Md GLU 92": "OE1" <-> "OE2" Residue "Md GLU 93": "OE1" <-> "OE2" Residue "Md GLU 126": "OE1" <-> "OE2" Residue "Md GLU 130": "OE1" <-> "OE2" Residue "Md ASP 134": "OD1" <-> "OD2" Residue "Mf TYR 211": "CD1" <-> "CD2" "CE1" <-> "CE2" Time to flip residues: 0.30s Monomer Library directory: "/net/cci-filer2/raid1/xp/phenix/phenix-dev-5265/modules/chem_data/mon_lib" Total number of atoms: 134758 Number of models: 1 Model: "" Number of chains: 130 Chain: "AC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "AD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "AH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "AK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "AL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "AM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "AN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "AU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Ad" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Af" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "BC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "BD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "BH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "BK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "BL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "BM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "BN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "BU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Bd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Bf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "CC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "CD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "CH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "CK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "CL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "CM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "CN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "CU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Cd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Cf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "DC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "DD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "DH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "DK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "DL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "DM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "DN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "DU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Dd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Df" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "EC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "ED" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "EH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "EK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "EL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "EM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "EN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "EU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Ed" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Ef" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "FC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "FD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "FH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "FK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "FL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "FM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "FN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "FU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Fd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Ff" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "GC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "GD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "GH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "GK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "GL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "GM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "GN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "GU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Gd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Gf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "HC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "HD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "HH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "HK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "HL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "HM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "HN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "HU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Hd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Hf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "IC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "ID" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "IH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "IK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "IL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "IM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "IN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "IU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Id" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "If" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "JC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "JD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "JH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "JK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "JL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "JM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "JN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "JU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Jd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Jf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "KC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "KD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "KH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "KK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "KL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "KM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "KN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "KU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Kd" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Kf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "LC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "LD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "LH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "LK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "LL" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "LM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "LN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "LU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Ld" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Lf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Chain: "MC" Number of atoms: 1634 Number of conformers: 1 Conformer: "" Number of residues, atoms: 206, 1634 Classifications: {'peptide': 206} Link IDs: {'PTRANS': 9, 'TRANS': 196} Chain breaks: 2 Chain: "MD" Number of atoms: 1078 Number of conformers: 1 Conformer: "" Number of residues, atoms: 139, 1078 Classifications: {'peptide': 139} Link IDs: {'PTRANS': 10, 'TRANS': 128} Chain: "MH" Number of atoms: 690 Number of conformers: 1 Conformer: "" Number of residues, atoms: 91, 690 Classifications: {'peptide': 91} Link IDs: {'PTRANS': 7, 'TRANS': 83} Chain: "MK" Number of atoms: 1161 Number of conformers: 1 Conformer: "" Number of residues, atoms: 149, 1161 Classifications: {'peptide': 149} Link IDs: {'PTRANS': 5, 'TRANS': 143} Chain: "ML" Number of atoms: 1375 Number of conformers: 1 Conformer: "" Number of residues, atoms: 171, 1375 Classifications: {'peptide': 171} Link IDs: {'PTRANS': 7, 'TRANS': 163} Chain breaks: 1 Chain: "MM" Number of atoms: 2320 Number of conformers: 1 Conformer: "" Number of residues, atoms: 292, 2320 Classifications: {'peptide': 292} Link IDs: {'PTRANS': 5, 'TRANS': 286} Chain: "MN" Number of atoms: 565 Number of conformers: 1 Conformer: "" Number of residues, atoms: 76, 565 Classifications: {'peptide': 76} Link IDs: {'PTRANS': 1, 'TRANS': 74} Chain: "MU" Number of atoms: 45 Number of conformers: 1 Conformer: "" Number of residues, atoms: 9, 45 Classifications: {'peptide': 9} Incomplete info: {'truncation_to_alanine': 9} Link IDs: {'TRANS': 8} Unresolved non-hydrogen bonds: 18 Unresolved non-hydrogen angles: 27 Unresolved non-hydrogen dihedrals: 9 Planarities with less than four sites: {'UNK:plan-1': 9} Unresolved non-hydrogen planarities: 9 Chain: "Md" Number of atoms: 1049 Number of conformers: 1 Conformer: "" Number of residues, atoms: 136, 1049 Classifications: {'peptide': 136} Link IDs: {'PTRANS': 10, 'TRANS': 125} Chain: "Mf" Number of atoms: 449 Number of conformers: 1 Conformer: "" Number of residues, atoms: 59, 449 Classifications: {'peptide': 59} Link IDs: {'PTRANS': 2, 'TRANS': 56} Time building chain proxies: 48.05, per 1000 atoms: 0.36 Number of scatterers: 134758 At special positions: 0 Unit cell: (442.2, 441.1, 114.4, 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 520 16.00 O 25077 8.00 N 23764 7.00 C 85397 6.00 sf(0) = scattering factor at diffraction angle 0. Number of disulfides: simple=65, symmetry=0 Simple disulfide: pdb=" SG CYSAN 41 " - pdb=" SG CYSAN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSAN 42 " - pdb=" SG CYSAN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSAN 51 " - pdb=" SG CYSAN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSAN 84 " - pdb=" SG CYSAN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSAN 85 " - pdb=" SG CYSAN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSBN 41 " - pdb=" SG CYSBN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSBN 42 " - pdb=" SG CYSBN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSBN 51 " - pdb=" SG CYSBN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSBN 84 " - pdb=" SG CYSBN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSBN 85 " - pdb=" SG CYSBN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSCN 41 " - pdb=" SG CYSCN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSCN 42 " - pdb=" SG CYSCN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSCN 51 " - pdb=" SG CYSCN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSCN 84 " - pdb=" SG CYSCN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSCN 85 " - pdb=" SG CYSCN 103 " distance=2.04 Simple disulfide: pdb=" SG CYSDN 41 " - pdb=" SG CYSDN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSDN 42 " - pdb=" SG CYSDN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSDN 51 " - pdb=" SG CYSDN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSDN 84 " - pdb=" SG CYSDN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSDN 85 " - pdb=" SG CYSDN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSEN 41 " - pdb=" SG CYSEN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSEN 42 " - pdb=" SG CYSEN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSEN 51 " - pdb=" SG CYSEN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSEN 84 " - pdb=" SG CYSEN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSEN 85 " - pdb=" SG CYSEN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSFN 41 " - pdb=" SG CYSFN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSFN 42 " - pdb=" SG CYSFN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSFN 51 " - pdb=" SG CYSFN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSFN 84 " - pdb=" SG CYSFN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSFN 85 " - pdb=" SG CYSFN 103 " distance=2.04 Simple disulfide: pdb=" SG CYSGN 41 " - pdb=" SG CYSGN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSGN 42 " - pdb=" SG CYSGN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSGN 51 " - pdb=" SG CYSGN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSGN 84 " - pdb=" SG CYSGN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSGN 85 " - pdb=" SG CYSGN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSHN 41 " - pdb=" SG CYSHN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSHN 42 " - pdb=" SG CYSHN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSHN 51 " - pdb=" SG CYSHN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSHN 84 " - pdb=" SG CYSHN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSHN 85 " - pdb=" SG CYSHN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSIN 41 " - pdb=" SG CYSIN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSIN 42 " - pdb=" SG CYSIN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSIN 51 " - pdb=" SG CYSIN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSIN 84 " - pdb=" SG CYSIN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSIN 85 " - pdb=" SG CYSIN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSJN 41 " - pdb=" SG CYSJN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSJN 42 " - pdb=" SG CYSJN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSJN 51 " - pdb=" SG CYSJN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSJN 84 " - pdb=" SG CYSJN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSJN 85 " - pdb=" SG CYSJN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSKN 41 " - pdb=" SG CYSKN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSKN 42 " - pdb=" SG CYSKN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSKN 51 " - pdb=" SG CYSKN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSKN 84 " - pdb=" SG CYSKN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSKN 85 " - pdb=" SG CYSKN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSLN 41 " - pdb=" SG CYSLN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSLN 42 " - pdb=" SG CYSLN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSLN 51 " - pdb=" SG CYSLN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSLN 84 " - pdb=" SG CYSLN 112 " distance=2.04 Simple disulfide: pdb=" SG CYSLN 85 " - pdb=" SG CYSLN 103 " distance=2.03 Simple disulfide: pdb=" SG CYSMN 41 " - pdb=" SG CYSMN 68 " distance=2.03 Simple disulfide: pdb=" SG CYSMN 42 " - pdb=" SG CYSMN 60 " distance=2.03 Simple disulfide: pdb=" SG CYSMN 51 " - pdb=" SG CYSMN 70 " distance=2.03 Simple disulfide: pdb=" SG CYSMN 84 " - pdb=" SG CYSMN 112 " distance=2.03 Simple disulfide: pdb=" SG CYSMN 85 " - pdb=" SG CYSMN 103 " distance=2.04 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: 31.83 Conformation dependent library (CDL) restraints added in 16.2 seconds 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. Adding C-beta torsion restraints... Number of C-beta restraints generated: 32188 Finding SS restraints... Secondary structure from input PDB file: 377 helices and 263 sheets defined 27.9% alpha, 63.9% beta 0 base pairs and 0 stacking pairs defined. Time for finding SS restraints: 14.49 Creating SS restraints... Processing helix chain 'AC' and resid 30 through 35 Processing helix chain 'AC' and resid 61 through 86 removed outlier: 3.758A pdb=" N SERAC 65 " --> pdb=" O GLUAC 61 " (cutoff:3.500A) removed outlier: 3.995A pdb=" N ALAAC 73 " --> pdb=" O GLNAC 69 " (cutoff:3.500A) removed outlier: 3.717A pdb=" N GLNAC 86 " --> pdb=" O GLNAC 82 " (cutoff:3.500A) Processing helix chain 'AC' and resid 86 through 94 Processing helix chain 'AC' and resid 96 through 100 removed outlier: 3.661A pdb=" N VALAC 100 " --> pdb=" O ASNAC 97 " (cutoff:3.500A) Processing helix chain 'AC' and resid 147 through 152 removed outlier: 3.605A pdb=" N TRPAC 152 " --> pdb=" O ARGAC 148 " (cutoff:3.500A) Processing helix chain 'AC' and resid 175 through 218 removed outlier: 3.855A pdb=" N TYRAC 179 " --> pdb=" O ILEAC 175 " (cutoff:3.500A) removed outlier: 3.603A pdb=" N ILEAC 188 " --> pdb=" O TRPAC 184 " (cutoff:3.500A) removed outlier: 3.653A pdb=" N ALAAC 217 " --> pdb=" O ARGAC 213 " (cutoff:3.500A) Processing helix chain 'AC' and resid 258 through 262 removed outlier: 3.572A pdb=" N TRPAC 262 " --> pdb=" O SERAC 259 " (cutoff:3.500A) Processing helix chain 'AD' and resid 35 through 63 removed outlier: 3.790A pdb=" N SERAD 47 " --> pdb=" O GLUAD 43 " (cutoff:3.500A) Processing helix chain 'AD' and resid 90 through 102 removed outlier: 4.229A pdb=" N LEUAD 94 " --> pdb=" O PROAD 90 " (cutoff:3.500A) Processing helix chain 'AD' and resid 128 through 140 removed outlier: 3.535A pdb=" N GLYAD 140 " --> pdb=" O ASPAD 136 " (cutoff:3.500A) Processing helix chain 'AH' and resid 278 through 286 removed outlier: 4.331A pdb=" N HISAH 282 " --> pdb=" O ASPAH 278 " (cutoff:3.500A) Processing helix chain 'AK' and resid 49 through 64 Processing helix chain 'AK' and resid 81 through 83 No H-bonds generated for 'chain 'AK' and resid 81 through 83' Processing helix chain 'AK' and resid 92 through 94 No H-bonds generated for 'chain 'AK' and resid 92 through 94' Processing helix chain 'AK' and resid 95 through 107 Processing helix chain 'AK' and resid 125 through 147 removed outlier: 3.880A pdb=" N GLUAK 129 " --> pdb=" O SERAK 125 " (cutoff:3.500A) Processing helix chain 'AL' and resid 46 through 51 removed outlier: 3.595A pdb=" N ASNAL 49 " --> pdb=" O PROAL 46 " (cutoff:3.500A) Processing helix chain 'AL' and resid 54 through 63 removed outlier: 4.035A pdb=" N LYSAL 58 " --> pdb=" O ARGAL 54 " (cutoff:3.500A) removed outlier: 3.652A pdb=" N ARGAL 59 " --> pdb=" O ARGAL 55 " (cutoff:3.500A) Processing helix chain 'AL' and resid 89 through 100 Processing helix chain 'AL' and resid 101 through 112 Processing helix chain 'AL' and resid 129 through 133 Processing helix chain 'AL' and resid 141 through 143 No H-bonds generated for 'chain 'AL' and resid 141 through 143' Processing helix chain 'AL' and resid 144 through 156 removed outlier: 3.756A pdb=" N LEUAL 148 " --> pdb=" O CYSAL 144 " (cutoff:3.500A) Processing helix chain 'AL' and resid 174 through 195 Processing helix chain 'AL' and resid 199 through 201 No H-bonds generated for 'chain 'AL' and resid 199 through 201' Processing helix chain 'AL' and resid 219 through 225 Processing helix chain 'Ad' and resid 37 through 60 Processing helix chain 'Ad' and resid 76 through 80 removed outlier: 3.697A pdb=" N GLNAd 80 " --> pdb=" O TYRAd 77 " (cutoff:3.500A) Processing helix chain 'Ad' and resid 91 through 102 Processing helix chain 'Ad' and resid 128 through 140 removed outlier: 3.630A pdb=" N GLYAd 140 " --> pdb=" O ASPAd 136 " (cutoff:3.500A) Processing helix chain 'BC' and resid 30 through 35 Processing helix chain 'BC' and resid 61 through 86 removed outlier: 3.912A pdb=" N SERBC 65 " --> pdb=" O GLUBC 61 " (cutoff:3.500A) removed outlier: 3.975A pdb=" N GLNBC 69 " --> pdb=" O SERBC 65 " (cutoff:3.500A) removed outlier: 4.228A pdb=" N ALABC 70 " --> pdb=" O VALBC 66 " (cutoff:3.500A) removed outlier: 3.741A pdb=" N GLNBC 86 " --> pdb=" O GLNBC 82 " (cutoff:3.500A) Processing helix chain 'BC' and resid 86 through 94 Processing helix chain 'BC' and resid 96 through 100 removed outlier: 3.554A pdb=" N LEUBC 99 " --> pdb=" O PHEBC 96 " (cutoff:3.500A) removed outlier: 3.666A pdb=" N VALBC 100 " --> pdb=" O ASNBC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'BC' and resid 96 through 100' Processing helix chain 'BC' and resid 147 through 152 removed outlier: 3.618A pdb=" N TRPBC 152 " --> pdb=" O ARGBC 148 " (cutoff:3.500A) Processing helix chain 'BC' and resid 175 through 218 removed outlier: 3.928A pdb=" N TYRBC 179 " --> pdb=" O ILEBC 175 " (cutoff:3.500A) removed outlier: 3.703A pdb=" N ARGBC 213 " --> pdb=" O METBC 209 " (cutoff:3.500A) Processing helix chain 'BC' and resid 258 through 262 removed outlier: 3.521A pdb=" N GLUBC 261 " --> pdb=" O ASNBC 258 " (cutoff:3.500A) removed outlier: 3.585A pdb=" N TRPBC 262 " --> pdb=" O SERBC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'BC' and resid 258 through 262' Processing helix chain 'BD' and resid 35 through 63 removed outlier: 3.873A pdb=" N SERBD 47 " --> pdb=" O GLUBD 43 " (cutoff:3.500A) Processing helix chain 'BD' and resid 90 through 102 removed outlier: 4.201A pdb=" N LEUBD 94 " --> pdb=" O PROBD 90 " (cutoff:3.500A) Processing helix chain 'BD' and resid 128 through 140 removed outlier: 3.547A pdb=" N GLYBD 140 " --> pdb=" O ASPBD 136 " (cutoff:3.500A) Processing helix chain 'BH' and resid 278 through 286 removed outlier: 4.231A pdb=" N HISBH 282 " --> pdb=" O ASPBH 278 " (cutoff:3.500A) Processing helix chain 'BK' and resid 49 through 64 Processing helix chain 'BK' and resid 81 through 83 No H-bonds generated for 'chain 'BK' and resid 81 through 83' Processing helix chain 'BK' and resid 92 through 94 No H-bonds generated for 'chain 'BK' and resid 92 through 94' Processing helix chain 'BK' and resid 95 through 107 Processing helix chain 'BK' and resid 125 through 147 removed outlier: 3.760A pdb=" N GLUBK 129 " --> pdb=" O SERBK 125 " (cutoff:3.500A) Processing helix chain 'BL' and resid 46 through 51 removed outlier: 3.592A pdb=" N ASNBL 49 " --> pdb=" O PROBL 46 " (cutoff:3.500A) Processing helix chain 'BL' and resid 54 through 63 removed outlier: 4.151A pdb=" N LYSBL 58 " --> pdb=" O ARGBL 54 " (cutoff:3.500A) removed outlier: 3.780A pdb=" N ARGBL 59 " --> pdb=" O ARGBL 55 " (cutoff:3.500A) Processing helix chain 'BL' and resid 89 through 100 Processing helix chain 'BL' and resid 101 through 112 Processing helix chain 'BL' and resid 129 through 133 Processing helix chain 'BL' and resid 141 through 143 No H-bonds generated for 'chain 'BL' and resid 141 through 143' Processing helix chain 'BL' and resid 144 through 156 removed outlier: 3.742A pdb=" N LEUBL 148 " --> pdb=" O CYSBL 144 " (cutoff:3.500A) Processing helix chain 'BL' and resid 174 through 195 Processing helix chain 'BL' and resid 199 through 201 No H-bonds generated for 'chain 'BL' and resid 199 through 201' Processing helix chain 'BL' and resid 219 through 225 Processing helix chain 'Bd' and resid 37 through 60 Processing helix chain 'Bd' and resid 76 through 80 removed outlier: 3.721A pdb=" N GLNBd 80 " --> pdb=" O TYRBd 77 " (cutoff:3.500A) Processing helix chain 'Bd' and resid 91 through 102 Processing helix chain 'Bd' and resid 128 through 140 removed outlier: 3.598A pdb=" N GLYBd 140 " --> pdb=" O ASPBd 136 " (cutoff:3.500A) Processing helix chain 'CC' and resid 30 through 35 Processing helix chain 'CC' and resid 61 through 86 removed outlier: 3.860A pdb=" N SERCC 65 " --> pdb=" O GLUCC 61 " (cutoff:3.500A) removed outlier: 3.994A pdb=" N GLNCC 69 " --> pdb=" O SERCC 65 " (cutoff:3.500A) removed outlier: 4.309A pdb=" N ALACC 70 " --> pdb=" O VALCC 66 " (cutoff:3.500A) Processing helix chain 'CC' and resid 86 through 94 Processing helix chain 'CC' and resid 96 through 100 removed outlier: 3.565A pdb=" N LEUCC 99 " --> pdb=" O PHECC 96 " (cutoff:3.500A) removed outlier: 3.677A pdb=" N VALCC 100 " --> pdb=" O ASNCC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'CC' and resid 96 through 100' Processing helix chain 'CC' and resid 147 through 152 removed outlier: 3.564A pdb=" N TRPCC 152 " --> pdb=" O ARGCC 148 " (cutoff:3.500A) Processing helix chain 'CC' and resid 175 through 218 removed outlier: 3.796A pdb=" N TYRCC 179 " --> pdb=" O ILECC 175 " (cutoff:3.500A) removed outlier: 3.790A pdb=" N ARGCC 182 " --> pdb=" O ILECC 178 " (cutoff:3.500A) removed outlier: 3.546A pdb=" N TYRCC 212 " --> pdb=" O GLYCC 208 " (cutoff:3.500A) removed outlier: 3.834A pdb=" N ARGCC 213 " --> pdb=" O METCC 209 " (cutoff:3.500A) Processing helix chain 'CC' and resid 258 through 262 removed outlier: 3.512A pdb=" N TRPCC 262 " --> pdb=" O SERCC 259 " (cutoff:3.500A) Processing helix chain 'CD' and resid 35 through 63 removed outlier: 3.856A pdb=" N SERCD 47 " --> pdb=" O GLUCD 43 " (cutoff:3.500A) Processing helix chain 'CD' and resid 90 through 102 removed outlier: 4.194A pdb=" N LEUCD 94 " --> pdb=" O PROCD 90 " (cutoff:3.500A) Processing helix chain 'CD' and resid 128 through 140 Processing helix chain 'CH' and resid 278 through 286 removed outlier: 4.344A pdb=" N HISCH 282 " --> pdb=" O ASPCH 278 " (cutoff:3.500A) Processing helix chain 'CK' and resid 49 through 64 Processing helix chain 'CK' and resid 81 through 83 No H-bonds generated for 'chain 'CK' and resid 81 through 83' Processing helix chain 'CK' and resid 94 through 107 removed outlier: 4.431A pdb=" N LEUCK 98 " --> pdb=" O ALACK 94 " (cutoff:3.500A) Processing helix chain 'CK' and resid 125 through 147 removed outlier: 3.792A pdb=" N GLUCK 129 " --> pdb=" O SERCK 125 " (cutoff:3.500A) Processing helix chain 'CL' and resid 46 through 51 removed outlier: 3.594A pdb=" N ASNCL 49 " --> pdb=" O PROCL 46 " (cutoff:3.500A) Processing helix chain 'CL' and resid 54 through 63 removed outlier: 4.058A pdb=" N LYSCL 58 " --> pdb=" O ARGCL 54 " (cutoff:3.500A) removed outlier: 3.759A pdb=" N ARGCL 59 " --> pdb=" O ARGCL 55 " (cutoff:3.500A) Processing helix chain 'CL' and resid 89 through 100 Processing helix chain 'CL' and resid 101 through 112 Processing helix chain 'CL' and resid 129 through 133 Processing helix chain 'CL' and resid 141 through 143 No H-bonds generated for 'chain 'CL' and resid 141 through 143' Processing helix chain 'CL' and resid 144 through 156 removed outlier: 3.710A pdb=" N LEUCL 148 " --> pdb=" O CYSCL 144 " (cutoff:3.500A) Processing helix chain 'CL' and resid 174 through 195 Processing helix chain 'CL' and resid 199 through 201 No H-bonds generated for 'chain 'CL' and resid 199 through 201' Processing helix chain 'CL' and resid 219 through 225 Processing helix chain 'Cd' and resid 35 through 60 removed outlier: 3.941A pdb=" N LYSCd 40 " --> pdb=" O ASPCd 36 " (cutoff:3.500A) Processing helix chain 'Cd' and resid 76 through 80 removed outlier: 3.741A pdb=" N GLNCd 80 " --> pdb=" O TYRCd 77 " (cutoff:3.500A) Processing helix chain 'Cd' and resid 91 through 102 Processing helix chain 'Cd' and resid 128 through 140 removed outlier: 3.617A pdb=" N GLYCd 140 " --> pdb=" O ASPCd 136 " (cutoff:3.500A) Processing helix chain 'DC' and resid 30 through 35 Processing helix chain 'DC' and resid 61 through 86 removed outlier: 3.877A pdb=" N SERDC 65 " --> pdb=" O GLUDC 61 " (cutoff:3.500A) removed outlier: 3.958A pdb=" N GLNDC 69 " --> pdb=" O SERDC 65 " (cutoff:3.500A) removed outlier: 4.221A pdb=" N ALADC 70 " --> pdb=" O VALDC 66 " (cutoff:3.500A) removed outlier: 3.692A pdb=" N GLNDC 86 " --> pdb=" O GLNDC 82 " (cutoff:3.500A) Processing helix chain 'DC' and resid 86 through 94 Processing helix chain 'DC' and resid 96 through 100 removed outlier: 3.722A pdb=" N VALDC 100 " --> pdb=" O ASNDC 97 " (cutoff:3.500A) Processing helix chain 'DC' and resid 147 through 152 removed outlier: 3.637A pdb=" N TRPDC 152 " --> pdb=" O ARGDC 148 " (cutoff:3.500A) Processing helix chain 'DC' and resid 175 through 218 removed outlier: 3.867A pdb=" N TYRDC 179 " --> pdb=" O ILEDC 175 " (cutoff:3.500A) removed outlier: 3.558A pdb=" N TYRDC 212 " --> pdb=" O GLYDC 208 " (cutoff:3.500A) removed outlier: 3.785A pdb=" N ARGDC 213 " --> pdb=" O METDC 209 " (cutoff:3.500A) Processing helix chain 'DC' and resid 258 through 262 removed outlier: 3.933A pdb=" N GLUDC 261 " --> pdb=" O ASNDC 258 " (cutoff:3.500A) removed outlier: 3.551A pdb=" N TRPDC 262 " --> pdb=" O SERDC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'DC' and resid 258 through 262' Processing helix chain 'DD' and resid 35 through 63 removed outlier: 3.825A pdb=" N SERDD 47 " --> pdb=" O GLUDD 43 " (cutoff:3.500A) Processing helix chain 'DD' and resid 90 through 102 removed outlier: 4.183A pdb=" N LEUDD 94 " --> pdb=" O PRODD 90 " (cutoff:3.500A) Processing helix chain 'DD' and resid 128 through 140 removed outlier: 3.530A pdb=" N GLYDD 140 " --> pdb=" O ASPDD 136 " (cutoff:3.500A) Processing helix chain 'DH' and resid 278 through 286 removed outlier: 4.378A pdb=" N HISDH 282 " --> pdb=" O ASPDH 278 " (cutoff:3.500A) Processing helix chain 'DK' and resid 49 through 64 Processing helix chain 'DK' and resid 81 through 83 No H-bonds generated for 'chain 'DK' and resid 81 through 83' Processing helix chain 'DK' and resid 92 through 94 No H-bonds generated for 'chain 'DK' and resid 92 through 94' Processing helix chain 'DK' and resid 95 through 107 Processing helix chain 'DK' and resid 125 through 147 removed outlier: 3.763A pdb=" N GLUDK 129 " --> pdb=" O SERDK 125 " (cutoff:3.500A) Processing helix chain 'DL' and resid 46 through 51 removed outlier: 3.592A pdb=" N ASNDL 49 " --> pdb=" O PRODL 46 " (cutoff:3.500A) Processing helix chain 'DL' and resid 54 through 63 removed outlier: 4.087A pdb=" N LYSDL 58 " --> pdb=" O ARGDL 54 " (cutoff:3.500A) removed outlier: 3.791A pdb=" N ARGDL 59 " --> pdb=" O ARGDL 55 " (cutoff:3.500A) Processing helix chain 'DL' and resid 89 through 100 Processing helix chain 'DL' and resid 101 through 112 Processing helix chain 'DL' and resid 129 through 133 Processing helix chain 'DL' and resid 141 through 143 No H-bonds generated for 'chain 'DL' and resid 141 through 143' Processing helix chain 'DL' and resid 144 through 156 removed outlier: 3.727A pdb=" N LEUDL 148 " --> pdb=" O CYSDL 144 " (cutoff:3.500A) Processing helix chain 'DL' and resid 174 through 195 Processing helix chain 'DL' and resid 199 through 201 No H-bonds generated for 'chain 'DL' and resid 199 through 201' Processing helix chain 'DL' and resid 219 through 226 Processing helix chain 'Dd' and resid 37 through 60 Processing helix chain 'Dd' and resid 76 through 80 removed outlier: 3.680A pdb=" N GLNDd 80 " --> pdb=" O TYRDd 77 " (cutoff:3.500A) Processing helix chain 'Dd' and resid 91 through 102 Processing helix chain 'Dd' and resid 128 through 140 removed outlier: 3.609A pdb=" N GLYDd 140 " --> pdb=" O ASPDd 136 " (cutoff:3.500A) Processing helix chain 'EC' and resid 30 through 35 Processing helix chain 'EC' and resid 61 through 86 removed outlier: 3.877A pdb=" N SEREC 65 " --> pdb=" O GLUEC 61 " (cutoff:3.500A) removed outlier: 3.889A pdb=" N GLNEC 69 " --> pdb=" O SEREC 65 " (cutoff:3.500A) removed outlier: 4.190A pdb=" N ALAEC 70 " --> pdb=" O VALEC 66 " (cutoff:3.500A) removed outlier: 3.679A pdb=" N GLNEC 86 " --> pdb=" O GLNEC 82 " (cutoff:3.500A) Processing helix chain 'EC' and resid 86 through 94 Processing helix chain 'EC' and resid 96 through 100 removed outlier: 3.731A pdb=" N VALEC 100 " --> pdb=" O ASNEC 97 " (cutoff:3.500A) Processing helix chain 'EC' and resid 147 through 152 removed outlier: 3.665A pdb=" N TRPEC 152 " --> pdb=" O ARGEC 148 " (cutoff:3.500A) Processing helix chain 'EC' and resid 175 through 218 removed outlier: 3.882A pdb=" N TYREC 179 " --> pdb=" O ILEEC 175 " (cutoff:3.500A) removed outlier: 3.571A pdb=" N ILEEC 188 " --> pdb=" O TRPEC 184 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N TYREC 212 " --> pdb=" O GLYEC 208 " (cutoff:3.500A) removed outlier: 3.751A pdb=" N ARGEC 213 " --> pdb=" O METEC 209 " (cutoff:3.500A) Processing helix chain 'EC' and resid 258 through 262 removed outlier: 4.124A pdb=" N GLUEC 261 " --> pdb=" O ASNEC 258 " (cutoff:3.500A) removed outlier: 3.571A pdb=" N TRPEC 262 " --> pdb=" O SEREC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'EC' and resid 258 through 262' Processing helix chain 'ED' and resid 35 through 63 removed outlier: 3.834A pdb=" N SERED 47 " --> pdb=" O GLUED 43 " (cutoff:3.500A) Processing helix chain 'ED' and resid 90 through 102 removed outlier: 4.167A pdb=" N LEUED 94 " --> pdb=" O PROED 90 " (cutoff:3.500A) Processing helix chain 'ED' and resid 128 through 140 Processing helix chain 'EH' and resid 278 through 286 removed outlier: 4.357A pdb=" N HISEH 282 " --> pdb=" O ASPEH 278 " (cutoff:3.500A) Processing helix chain 'EK' and resid 49 through 64 Processing helix chain 'EK' and resid 81 through 83 No H-bonds generated for 'chain 'EK' and resid 81 through 83' Processing helix chain 'EK' and resid 94 through 107 removed outlier: 4.451A pdb=" N LEUEK 98 " --> pdb=" O ALAEK 94 " (cutoff:3.500A) Processing helix chain 'EK' and resid 125 through 147 removed outlier: 3.832A pdb=" N GLUEK 129 " --> pdb=" O SEREK 125 " (cutoff:3.500A) Processing helix chain 'EL' and resid 46 through 51 removed outlier: 3.620A pdb=" N ASNEL 49 " --> pdb=" O PROEL 46 " (cutoff:3.500A) Processing helix chain 'EL' and resid 54 through 63 removed outlier: 4.116A pdb=" N LYSEL 58 " --> pdb=" O ARGEL 54 " (cutoff:3.500A) removed outlier: 3.829A pdb=" N ARGEL 59 " --> pdb=" O ARGEL 55 " (cutoff:3.500A) Processing helix chain 'EL' and resid 89 through 100 Processing helix chain 'EL' and resid 101 through 112 Processing helix chain 'EL' and resid 129 through 133 Processing helix chain 'EL' and resid 141 through 143 No H-bonds generated for 'chain 'EL' and resid 141 through 143' Processing helix chain 'EL' and resid 144 through 156 removed outlier: 3.705A pdb=" N LEUEL 148 " --> pdb=" O CYSEL 144 " (cutoff:3.500A) Processing helix chain 'EL' and resid 174 through 195 Processing helix chain 'EL' and resid 199 through 201 No H-bonds generated for 'chain 'EL' and resid 199 through 201' Processing helix chain 'EL' and resid 219 through 225 Processing helix chain 'Ed' and resid 37 through 60 Processing helix chain 'Ed' and resid 76 through 80 removed outlier: 3.830A pdb=" N GLNEd 80 " --> pdb=" O TYREd 77 " (cutoff:3.500A) Processing helix chain 'Ed' and resid 91 through 102 Processing helix chain 'Ed' and resid 128 through 140 removed outlier: 3.545A pdb=" N GLYEd 140 " --> pdb=" O ASPEd 136 " (cutoff:3.500A) Processing helix chain 'FC' and resid 30 through 35 Processing helix chain 'FC' and resid 61 through 86 removed outlier: 3.992A pdb=" N ALAFC 68 " --> pdb=" O LEUFC 64 " (cutoff:3.500A) removed outlier: 4.163A pdb=" N GLNFC 69 " --> pdb=" O SERFC 65 " (cutoff:3.500A) removed outlier: 4.035A pdb=" N ALAFC 70 " --> pdb=" O VALFC 66 " (cutoff:3.500A) removed outlier: 3.692A pdb=" N GLNFC 86 " --> pdb=" O GLNFC 82 " (cutoff:3.500A) Processing helix chain 'FC' and resid 86 through 94 Processing helix chain 'FC' and resid 96 through 100 removed outlier: 3.692A pdb=" N VALFC 100 " --> pdb=" O ASNFC 97 " (cutoff:3.500A) Processing helix chain 'FC' and resid 147 through 152 removed outlier: 3.611A pdb=" N TRPFC 152 " --> pdb=" O ARGFC 148 " (cutoff:3.500A) Processing helix chain 'FC' and resid 175 through 218 removed outlier: 3.893A pdb=" N TYRFC 179 " --> pdb=" O ILEFC 175 " (cutoff:3.500A) removed outlier: 3.755A pdb=" N ASPFC 205 " --> pdb=" O ARGFC 201 " (cutoff:3.500A) removed outlier: 3.617A pdb=" N ARGFC 213 " --> pdb=" O METFC 209 " (cutoff:3.500A) Processing helix chain 'FC' and resid 258 through 262 removed outlier: 3.533A pdb=" N TRPFC 262 " --> pdb=" O SERFC 259 " (cutoff:3.500A) Processing helix chain 'FD' and resid 35 through 63 removed outlier: 3.894A pdb=" N SERFD 47 " --> pdb=" O GLUFD 43 " (cutoff:3.500A) Processing helix chain 'FD' and resid 90 through 102 removed outlier: 4.212A pdb=" N LEUFD 94 " --> pdb=" O PROFD 90 " (cutoff:3.500A) Processing helix chain 'FD' and resid 128 through 140 removed outlier: 3.557A pdb=" N GLYFD 140 " --> pdb=" O ASPFD 136 " (cutoff:3.500A) Processing helix chain 'FH' and resid 278 through 286 removed outlier: 4.264A pdb=" N HISFH 282 " --> pdb=" O ASPFH 278 " (cutoff:3.500A) Processing helix chain 'FK' and resid 49 through 64 Processing helix chain 'FK' and resid 81 through 83 No H-bonds generated for 'chain 'FK' and resid 81 through 83' Processing helix chain 'FK' and resid 92 through 94 No H-bonds generated for 'chain 'FK' and resid 92 through 94' Processing helix chain 'FK' and resid 95 through 107 Processing helix chain 'FK' and resid 125 through 147 Processing helix chain 'FL' and resid 46 through 51 removed outlier: 3.632A pdb=" N ASNFL 49 " --> pdb=" O PROFL 46 " (cutoff:3.500A) Processing helix chain 'FL' and resid 54 through 63 removed outlier: 4.221A pdb=" N LYSFL 58 " --> pdb=" O ARGFL 54 " (cutoff:3.500A) removed outlier: 3.789A pdb=" N ARGFL 59 " --> pdb=" O ARGFL 55 " (cutoff:3.500A) Processing helix chain 'FL' and resid 89 through 100 Processing helix chain 'FL' and resid 101 through 112 Processing helix chain 'FL' and resid 129 through 133 Processing helix chain 'FL' and resid 141 through 143 No H-bonds generated for 'chain 'FL' and resid 141 through 143' Processing helix chain 'FL' and resid 144 through 156 removed outlier: 3.692A pdb=" N LEUFL 148 " --> pdb=" O CYSFL 144 " (cutoff:3.500A) Processing helix chain 'FL' and resid 174 through 195 Processing helix chain 'FL' and resid 199 through 201 No H-bonds generated for 'chain 'FL' and resid 199 through 201' Processing helix chain 'FL' and resid 219 through 225 Processing helix chain 'Fd' and resid 35 through 60 removed outlier: 3.955A pdb=" N LYSFd 40 " --> pdb=" O ASPFd 36 " (cutoff:3.500A) Processing helix chain 'Fd' and resid 91 through 102 Processing helix chain 'Fd' and resid 128 through 140 removed outlier: 3.697A pdb=" N GLYFd 140 " --> pdb=" O ASPFd 136 " (cutoff:3.500A) Processing helix chain 'GC' and resid 30 through 35 Processing helix chain 'GC' and resid 61 through 86 removed outlier: 4.105A pdb=" N ALAGC 68 " --> pdb=" O LEUGC 64 " (cutoff:3.500A) removed outlier: 4.226A pdb=" N GLNGC 69 " --> pdb=" O SERGC 65 " (cutoff:3.500A) removed outlier: 4.121A pdb=" N ALAGC 70 " --> pdb=" O VALGC 66 " (cutoff:3.500A) removed outlier: 3.680A pdb=" N GLNGC 86 " --> pdb=" O GLNGC 82 " (cutoff:3.500A) Processing helix chain 'GC' and resid 86 through 94 Processing helix chain 'GC' and resid 96 through 100 removed outlier: 3.626A pdb=" N VALGC 100 " --> pdb=" O ASNGC 97 " (cutoff:3.500A) Processing helix chain 'GC' and resid 147 through 152 removed outlier: 3.605A pdb=" N TRPGC 152 " --> pdb=" O ARGGC 148 " (cutoff:3.500A) Processing helix chain 'GC' and resid 175 through 218 removed outlier: 3.891A pdb=" N TYRGC 179 " --> pdb=" O ILEGC 175 " (cutoff:3.500A) removed outlier: 3.673A pdb=" N ARGGC 213 " --> pdb=" O METGC 209 " (cutoff:3.500A) Processing helix chain 'GC' and resid 258 through 262 removed outlier: 3.527A pdb=" N TRPGC 262 " --> pdb=" O SERGC 259 " (cutoff:3.500A) Processing helix chain 'GD' and resid 35 through 63 removed outlier: 3.893A pdb=" N SERGD 47 " --> pdb=" O GLUGD 43 " (cutoff:3.500A) Processing helix chain 'GD' and resid 90 through 102 removed outlier: 4.179A pdb=" N LEUGD 94 " --> pdb=" O PROGD 90 " (cutoff:3.500A) Processing helix chain 'GD' and resid 128 through 140 removed outlier: 3.614A pdb=" N GLYGD 140 " --> pdb=" O ASPGD 136 " (cutoff:3.500A) Processing helix chain 'GH' and resid 278 through 286 removed outlier: 4.373A pdb=" N HISGH 282 " --> pdb=" O ASPGH 278 " (cutoff:3.500A) Processing helix chain 'GK' and resid 49 through 64 Processing helix chain 'GK' and resid 81 through 83 No H-bonds generated for 'chain 'GK' and resid 81 through 83' Processing helix chain 'GK' and resid 95 through 107 Processing helix chain 'GK' and resid 125 through 147 removed outlier: 3.813A pdb=" N GLUGK 129 " --> pdb=" O SERGK 125 " (cutoff:3.500A) Processing helix chain 'GL' and resid 46 through 51 removed outlier: 3.607A pdb=" N ASNGL 49 " --> pdb=" O PROGL 46 " (cutoff:3.500A) Processing helix chain 'GL' and resid 54 through 63 removed outlier: 4.170A pdb=" N LYSGL 58 " --> pdb=" O ARGGL 54 " (cutoff:3.500A) removed outlier: 3.745A pdb=" N ARGGL 59 " --> pdb=" O ARGGL 55 " (cutoff:3.500A) Processing helix chain 'GL' and resid 89 through 100 Processing helix chain 'GL' and resid 101 through 112 Processing helix chain 'GL' and resid 129 through 133 Processing helix chain 'GL' and resid 141 through 143 No H-bonds generated for 'chain 'GL' and resid 141 through 143' Processing helix chain 'GL' and resid 144 through 156 removed outlier: 3.625A pdb=" N LEUGL 148 " --> pdb=" O CYSGL 144 " (cutoff:3.500A) Processing helix chain 'GL' and resid 174 through 195 Processing helix chain 'GL' and resid 199 through 201 No H-bonds generated for 'chain 'GL' and resid 199 through 201' Processing helix chain 'GL' and resid 219 through 225 Processing helix chain 'Gd' and resid 37 through 60 Processing helix chain 'Gd' and resid 64 through 68 removed outlier: 3.525A pdb=" N LYSGd 67 " --> pdb=" O PROGd 64 " (cutoff:3.500A) removed outlier: 3.878A pdb=" N ASPGd 68 " --> pdb=" O PROGd 65 " (cutoff:3.500A) No H-bonds generated for 'chain 'Gd' and resid 64 through 68' Processing helix chain 'Gd' and resid 91 through 102 Processing helix chain 'Gd' and resid 128 through 140 removed outlier: 3.534A pdb=" N GLYGd 140 " --> pdb=" O ASPGd 136 " (cutoff:3.500A) Processing helix chain 'HC' and resid 30 through 35 Processing helix chain 'HC' and resid 61 through 86 removed outlier: 3.871A pdb=" N SERHC 65 " --> pdb=" O GLUHC 61 " (cutoff:3.500A) removed outlier: 3.738A pdb=" N GLNHC 69 " --> pdb=" O SERHC 65 " (cutoff:3.500A) removed outlier: 4.113A pdb=" N ALAHC 70 " --> pdb=" O VALHC 66 " (cutoff:3.500A) removed outlier: 3.646A pdb=" N ALAHC 73 " --> pdb=" O GLNHC 69 " (cutoff:3.500A) removed outlier: 3.622A pdb=" N GLNHC 86 " --> pdb=" O GLNHC 82 " (cutoff:3.500A) Processing helix chain 'HC' and resid 86 through 94 removed outlier: 3.521A pdb=" N LEUHC 90 " --> pdb=" O GLNHC 86 " (cutoff:3.500A) removed outlier: 3.505A pdb=" N ALAHC 92 " --> pdb=" O ARGHC 88 " (cutoff:3.500A) Processing helix chain 'HC' and resid 96 through 100 removed outlier: 3.600A pdb=" N LEUHC 99 " --> pdb=" O PHEHC 96 " (cutoff:3.500A) removed outlier: 3.735A pdb=" N VALHC 100 " --> pdb=" O ASNHC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'HC' and resid 96 through 100' Processing helix chain 'HC' and resid 147 through 152 removed outlier: 3.603A pdb=" N TRPHC 152 " --> pdb=" O ARGHC 148 " (cutoff:3.500A) Processing helix chain 'HC' and resid 175 through 218 removed outlier: 3.842A pdb=" N TYRHC 179 " --> pdb=" O ILEHC 175 " (cutoff:3.500A) removed outlier: 3.714A pdb=" N ASPHC 205 " --> pdb=" O ARGHC 201 " (cutoff:3.500A) removed outlier: 3.683A pdb=" N ARGHC 213 " --> pdb=" O METHC 209 " (cutoff:3.500A) Processing helix chain 'HC' and resid 258 through 262 removed outlier: 3.875A pdb=" N GLUHC 261 " --> pdb=" O ASNHC 258 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N TRPHC 262 " --> pdb=" O SERHC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'HC' and resid 258 through 262' Processing helix chain 'HD' and resid 35 through 63 removed outlier: 3.819A pdb=" N SERHD 47 " --> pdb=" O GLUHD 43 " (cutoff:3.500A) Processing helix chain 'HD' and resid 90 through 102 removed outlier: 4.192A pdb=" N LEUHD 94 " --> pdb=" O PROHD 90 " (cutoff:3.500A) Processing helix chain 'HD' and resid 128 through 140 Processing helix chain 'HH' and resid 278 through 286 removed outlier: 4.382A pdb=" N HISHH 282 " --> pdb=" O ASPHH 278 " (cutoff:3.500A) Processing helix chain 'HK' and resid 49 through 64 Processing helix chain 'HK' and resid 81 through 83 No H-bonds generated for 'chain 'HK' and resid 81 through 83' Processing helix chain 'HK' and resid 94 through 107 removed outlier: 4.459A pdb=" N LEUHK 98 " --> pdb=" O ALAHK 94 " (cutoff:3.500A) Processing helix chain 'HK' and resid 125 through 147 removed outlier: 3.776A pdb=" N GLUHK 129 " --> pdb=" O SERHK 125 " (cutoff:3.500A) Processing helix chain 'HL' and resid 46 through 51 removed outlier: 3.611A pdb=" N ASNHL 49 " --> pdb=" O PROHL 46 " (cutoff:3.500A) Processing helix chain 'HL' and resid 54 through 63 removed outlier: 4.055A pdb=" N LYSHL 58 " --> pdb=" O ARGHL 54 " (cutoff:3.500A) removed outlier: 3.695A pdb=" N ARGHL 59 " --> pdb=" O ARGHL 55 " (cutoff:3.500A) Processing helix chain 'HL' and resid 89 through 100 Processing helix chain 'HL' and resid 101 through 112 Processing helix chain 'HL' and resid 129 through 133 Processing helix chain 'HL' and resid 141 through 143 No H-bonds generated for 'chain 'HL' and resid 141 through 143' Processing helix chain 'HL' and resid 144 through 156 removed outlier: 3.735A pdb=" N LEUHL 148 " --> pdb=" O CYSHL 144 " (cutoff:3.500A) Processing helix chain 'HL' and resid 174 through 195 Processing helix chain 'HL' and resid 199 through 201 No H-bonds generated for 'chain 'HL' and resid 199 through 201' Processing helix chain 'HL' and resid 219 through 225 Processing helix chain 'Hd' and resid 37 through 60 Processing helix chain 'Hd' and resid 91 through 102 Processing helix chain 'Hd' and resid 128 through 140 removed outlier: 3.616A pdb=" N GLYHd 140 " --> pdb=" O ASPHd 136 " (cutoff:3.500A) Processing helix chain 'IC' and resid 30 through 35 Processing helix chain 'IC' and resid 61 through 86 removed outlier: 4.106A pdb=" N ALAIC 68 " --> pdb=" O LEUIC 64 " (cutoff:3.500A) removed outlier: 4.235A pdb=" N GLNIC 69 " --> pdb=" O SERIC 65 " (cutoff:3.500A) removed outlier: 4.120A pdb=" N ALAIC 70 " --> pdb=" O VALIC 66 " (cutoff:3.500A) removed outlier: 3.670A pdb=" N GLNIC 86 " --> pdb=" O GLNIC 82 " (cutoff:3.500A) Processing helix chain 'IC' and resid 86 through 94 Processing helix chain 'IC' and resid 96 through 100 removed outlier: 3.730A pdb=" N VALIC 100 " --> pdb=" O ASNIC 97 " (cutoff:3.500A) Processing helix chain 'IC' and resid 147 through 152 removed outlier: 3.589A pdb=" N TRPIC 152 " --> pdb=" O ARGIC 148 " (cutoff:3.500A) Processing helix chain 'IC' and resid 175 through 218 removed outlier: 3.849A pdb=" N TYRIC 179 " --> pdb=" O ILEIC 175 " (cutoff:3.500A) removed outlier: 3.979A pdb=" N METIC 209 " --> pdb=" O ASPIC 205 " (cutoff:3.500A) removed outlier: 3.516A pdb=" N ALAIC 217 " --> pdb=" O ARGIC 213 " (cutoff:3.500A) Processing helix chain 'IC' and resid 258 through 262 removed outlier: 3.785A pdb=" N GLUIC 261 " --> pdb=" O ASNIC 258 " (cutoff:3.500A) removed outlier: 3.557A pdb=" N TRPIC 262 " --> pdb=" O SERIC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'IC' and resid 258 through 262' Processing helix chain 'ID' and resid 35 through 63 removed outlier: 3.897A pdb=" N SERID 47 " --> pdb=" O GLUID 43 " (cutoff:3.500A) Processing helix chain 'ID' and resid 90 through 102 removed outlier: 4.187A pdb=" N LEUID 94 " --> pdb=" O PROID 90 " (cutoff:3.500A) Processing helix chain 'ID' and resid 128 through 140 removed outlier: 3.563A pdb=" N GLYID 140 " --> pdb=" O ASPID 136 " (cutoff:3.500A) Processing helix chain 'IH' and resid 278 through 286 removed outlier: 4.370A pdb=" N HISIH 282 " --> pdb=" O ASPIH 278 " (cutoff:3.500A) Processing helix chain 'IK' and resid 49 through 64 Processing helix chain 'IK' and resid 81 through 83 No H-bonds generated for 'chain 'IK' and resid 81 through 83' Processing helix chain 'IK' and resid 94 through 107 removed outlier: 4.451A pdb=" N LEUIK 98 " --> pdb=" O ALAIK 94 " (cutoff:3.500A) Processing helix chain 'IK' and resid 125 through 147 Processing helix chain 'IL' and resid 46 through 51 removed outlier: 3.591A pdb=" N ASNIL 49 " --> pdb=" O PROIL 46 " (cutoff:3.500A) Processing helix chain 'IL' and resid 54 through 63 removed outlier: 4.188A pdb=" N LYSIL 58 " --> pdb=" O ARGIL 54 " (cutoff:3.500A) removed outlier: 3.646A pdb=" N ARGIL 59 " --> pdb=" O ARGIL 55 " (cutoff:3.500A) Processing helix chain 'IL' and resid 89 through 100 Processing helix chain 'IL' and resid 101 through 112 Processing helix chain 'IL' and resid 129 through 133 Processing helix chain 'IL' and resid 141 through 143 No H-bonds generated for 'chain 'IL' and resid 141 through 143' Processing helix chain 'IL' and resid 144 through 156 removed outlier: 3.733A pdb=" N LEUIL 148 " --> pdb=" O CYSIL 144 " (cutoff:3.500A) Processing helix chain 'IL' and resid 174 through 195 Processing helix chain 'IL' and resid 199 through 201 No H-bonds generated for 'chain 'IL' and resid 199 through 201' Processing helix chain 'IL' and resid 219 through 225 Processing helix chain 'Id' and resid 37 through 60 Processing helix chain 'Id' and resid 76 through 80 removed outlier: 3.525A pdb=" N LEUId 79 " --> pdb=" O ALAId 76 " (cutoff:3.500A) removed outlier: 3.711A pdb=" N GLNId 80 " --> pdb=" O TYRId 77 " (cutoff:3.500A) No H-bonds generated for 'chain 'Id' and resid 76 through 80' Processing helix chain 'Id' and resid 91 through 102 Processing helix chain 'Id' and resid 128 through 140 removed outlier: 3.724A pdb=" N GLYId 140 " --> pdb=" O ASPId 136 " (cutoff:3.500A) Processing helix chain 'JC' and resid 30 through 35 Processing helix chain 'JC' and resid 61 through 86 removed outlier: 3.926A pdb=" N SERJC 65 " --> pdb=" O GLUJC 61 " (cutoff:3.500A) removed outlier: 3.886A pdb=" N GLNJC 69 " --> pdb=" O SERJC 65 " (cutoff:3.500A) removed outlier: 4.103A pdb=" N ALAJC 70 " --> pdb=" O VALJC 66 " (cutoff:3.500A) removed outlier: 3.630A pdb=" N GLNJC 86 " --> pdb=" O GLNJC 82 " (cutoff:3.500A) Processing helix chain 'JC' and resid 86 through 94 Processing helix chain 'JC' and resid 96 through 100 removed outlier: 3.503A pdb=" N LEUJC 99 " --> pdb=" O PHEJC 96 " (cutoff:3.500A) removed outlier: 3.667A pdb=" N VALJC 100 " --> pdb=" O ASNJC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'JC' and resid 96 through 100' Processing helix chain 'JC' and resid 147 through 152 removed outlier: 3.653A pdb=" N TRPJC 152 " --> pdb=" O ARGJC 148 " (cutoff:3.500A) Processing helix chain 'JC' and resid 175 through 218 removed outlier: 3.750A pdb=" N TYRJC 179 " --> pdb=" O ILEJC 175 " (cutoff:3.500A) removed outlier: 4.036A pdb=" N ARGJC 182 " --> pdb=" O ILEJC 178 " (cutoff:3.500A) removed outlier: 3.720A pdb=" N ARGJC 213 " --> pdb=" O METJC 209 " (cutoff:3.500A) Processing helix chain 'JC' and resid 258 through 262 removed outlier: 3.517A pdb=" N TRPJC 262 " --> pdb=" O SERJC 259 " (cutoff:3.500A) Processing helix chain 'JD' and resid 35 through 63 removed outlier: 3.817A pdb=" N SERJD 47 " --> pdb=" O GLUJD 43 " (cutoff:3.500A) Processing helix chain 'JD' and resid 90 through 102 removed outlier: 4.161A pdb=" N LEUJD 94 " --> pdb=" O PROJD 90 " (cutoff:3.500A) Processing helix chain 'JD' and resid 128 through 140 removed outlier: 3.643A pdb=" N GLYJD 140 " --> pdb=" O ASPJD 136 " (cutoff:3.500A) Processing helix chain 'JH' and resid 278 through 286 removed outlier: 4.322A pdb=" N HISJH 282 " --> pdb=" O ASPJH 278 " (cutoff:3.500A) Processing helix chain 'JK' and resid 49 through 64 Processing helix chain 'JK' and resid 81 through 83 No H-bonds generated for 'chain 'JK' and resid 81 through 83' Processing helix chain 'JK' and resid 94 through 107 removed outlier: 4.435A pdb=" N LEUJK 98 " --> pdb=" O ALAJK 94 " (cutoff:3.500A) Processing helix chain 'JK' and resid 125 through 147 removed outlier: 3.874A pdb=" N GLUJK 129 " --> pdb=" O SERJK 125 " (cutoff:3.500A) Processing helix chain 'JL' and resid 46 through 51 removed outlier: 3.592A pdb=" N ASNJL 49 " --> pdb=" O PROJL 46 " (cutoff:3.500A) Processing helix chain 'JL' and resid 54 through 63 removed outlier: 4.032A pdb=" N LYSJL 58 " --> pdb=" O ARGJL 54 " (cutoff:3.500A) removed outlier: 3.641A pdb=" N ARGJL 59 " --> pdb=" O ARGJL 55 " (cutoff:3.500A) Processing helix chain 'JL' and resid 89 through 100 Processing helix chain 'JL' and resid 101 through 112 Processing helix chain 'JL' and resid 129 through 133 Processing helix chain 'JL' and resid 141 through 143 No H-bonds generated for 'chain 'JL' and resid 141 through 143' Processing helix chain 'JL' and resid 144 through 156 removed outlier: 3.747A pdb=" N LEUJL 148 " --> pdb=" O CYSJL 144 " (cutoff:3.500A) Processing helix chain 'JL' and resid 174 through 195 Processing helix chain 'JL' and resid 199 through 201 No H-bonds generated for 'chain 'JL' and resid 199 through 201' Processing helix chain 'JL' and resid 219 through 225 Processing helix chain 'Jd' and resid 35 through 60 removed outlier: 4.040A pdb=" N LYSJd 40 " --> pdb=" O ASPJd 36 " (cutoff:3.500A) Processing helix chain 'Jd' and resid 76 through 80 removed outlier: 3.737A pdb=" N GLNJd 80 " --> pdb=" O TYRJd 77 " (cutoff:3.500A) Processing helix chain 'Jd' and resid 91 through 102 Processing helix chain 'Jd' and resid 128 through 140 removed outlier: 3.590A pdb=" N GLYJd 140 " --> pdb=" O ASPJd 136 " (cutoff:3.500A) Processing helix chain 'KC' and resid 30 through 35 Processing helix chain 'KC' and resid 61 through 86 removed outlier: 3.687A pdb=" N SERKC 65 " --> pdb=" O GLUKC 61 " (cutoff:3.500A) removed outlier: 3.757A pdb=" N ALAKC 73 " --> pdb=" O GLNKC 69 " (cutoff:3.500A) removed outlier: 3.510A pdb=" N GLNKC 86 " --> pdb=" O GLNKC 82 " (cutoff:3.500A) Processing helix chain 'KC' and resid 86 through 94 removed outlier: 3.589A pdb=" N LEUKC 90 " --> pdb=" O GLNKC 86 " (cutoff:3.500A) removed outlier: 3.624A pdb=" N ALAKC 92 " --> pdb=" O ARGKC 88 " (cutoff:3.500A) Processing helix chain 'KC' and resid 96 through 100 removed outlier: 3.501A pdb=" N LEUKC 99 " --> pdb=" O PHEKC 96 " (cutoff:3.500A) removed outlier: 3.737A pdb=" N VALKC 100 " --> pdb=" O ASNKC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'KC' and resid 96 through 100' Processing helix chain 'KC' and resid 147 through 152 removed outlier: 3.578A pdb=" N TRPKC 152 " --> pdb=" O ARGKC 148 " (cutoff:3.500A) Processing helix chain 'KC' and resid 175 through 218 removed outlier: 3.932A pdb=" N TYRKC 179 " --> pdb=" O ILEKC 175 " (cutoff:3.500A) removed outlier: 3.937A pdb=" N METKC 209 " --> pdb=" O ASPKC 205 " (cutoff:3.500A) removed outlier: 3.515A pdb=" N ARGKC 213 " --> pdb=" O METKC 209 " (cutoff:3.500A) Processing helix chain 'KC' and resid 258 through 262 removed outlier: 3.705A pdb=" N GLUKC 261 " --> pdb=" O ASNKC 258 " (cutoff:3.500A) Processing helix chain 'KD' and resid 35 through 63 removed outlier: 3.934A pdb=" N SERKD 47 " --> pdb=" O GLUKD 43 " (cutoff:3.500A) Processing helix chain 'KD' and resid 90 through 102 removed outlier: 4.230A pdb=" N LEUKD 94 " --> pdb=" O PROKD 90 " (cutoff:3.500A) Processing helix chain 'KD' and resid 128 through 140 Processing helix chain 'KH' and resid 278 through 286 removed outlier: 4.183A pdb=" N HISKH 282 " --> pdb=" O ASPKH 278 " (cutoff:3.500A) Processing helix chain 'KK' and resid 49 through 64 Processing helix chain 'KK' and resid 81 through 83 No H-bonds generated for 'chain 'KK' and resid 81 through 83' Processing helix chain 'KK' and resid 95 through 107 Processing helix chain 'KK' and resid 125 through 147 removed outlier: 3.926A pdb=" N GLUKK 129 " --> pdb=" O SERKK 125 " (cutoff:3.500A) Processing helix chain 'KL' and resid 46 through 51 removed outlier: 3.648A pdb=" N ASNKL 49 " --> pdb=" O PROKL 46 " (cutoff:3.500A) Processing helix chain 'KL' and resid 54 through 63 removed outlier: 4.034A pdb=" N LYSKL 58 " --> pdb=" O ARGKL 54 " (cutoff:3.500A) removed outlier: 3.692A pdb=" N ARGKL 59 " --> pdb=" O ARGKL 55 " (cutoff:3.500A) Processing helix chain 'KL' and resid 89 through 100 Processing helix chain 'KL' and resid 101 through 112 Processing helix chain 'KL' and resid 129 through 133 Processing helix chain 'KL' and resid 141 through 143 No H-bonds generated for 'chain 'KL' and resid 141 through 143' Processing helix chain 'KL' and resid 144 through 156 removed outlier: 3.661A pdb=" N LEUKL 148 " --> pdb=" O CYSKL 144 " (cutoff:3.500A) Processing helix chain 'KL' and resid 174 through 195 Processing helix chain 'KL' and resid 199 through 201 No H-bonds generated for 'chain 'KL' and resid 199 through 201' Processing helix chain 'KL' and resid 219 through 225 Processing helix chain 'Kd' and resid 35 through 60 removed outlier: 3.986A pdb=" N LYSKd 40 " --> pdb=" O ASPKd 36 " (cutoff:3.500A) Processing helix chain 'Kd' and resid 91 through 102 Processing helix chain 'Kd' and resid 128 through 140 removed outlier: 3.583A pdb=" N GLYKd 140 " --> pdb=" O ASPKd 136 " (cutoff:3.500A) Processing helix chain 'LC' and resid 30 through 35 Processing helix chain 'LC' and resid 61 through 86 removed outlier: 3.885A pdb=" N SERLC 65 " --> pdb=" O GLULC 61 " (cutoff:3.500A) removed outlier: 3.948A pdb=" N GLNLC 69 " --> pdb=" O SERLC 65 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N ALALC 70 " --> pdb=" O VALLC 66 " (cutoff:3.500A) removed outlier: 3.704A pdb=" N GLNLC 86 " --> pdb=" O GLNLC 82 " (cutoff:3.500A) Processing helix chain 'LC' and resid 86 through 94 Processing helix chain 'LC' and resid 96 through 100 removed outlier: 3.711A pdb=" N VALLC 100 " --> pdb=" O ASNLC 97 " (cutoff:3.500A) Processing helix chain 'LC' and resid 147 through 152 removed outlier: 3.642A pdb=" N TRPLC 152 " --> pdb=" O ARGLC 148 " (cutoff:3.500A) Processing helix chain 'LC' and resid 175 through 218 removed outlier: 3.871A pdb=" N TYRLC 179 " --> pdb=" O ILELC 175 " (cutoff:3.500A) removed outlier: 3.840A pdb=" N METLC 209 " --> pdb=" O ASPLC 205 " (cutoff:3.500A) removed outlier: 3.526A pdb=" N ARGLC 213 " --> pdb=" O METLC 209 " (cutoff:3.500A) Processing helix chain 'LC' and resid 258 through 262 removed outlier: 3.785A pdb=" N GLULC 261 " --> pdb=" O ASNLC 258 " (cutoff:3.500A) removed outlier: 3.533A pdb=" N TRPLC 262 " --> pdb=" O SERLC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'LC' and resid 258 through 262' Processing helix chain 'LD' and resid 35 through 63 removed outlier: 3.876A pdb=" N SERLD 47 " --> pdb=" O GLULD 43 " (cutoff:3.500A) Processing helix chain 'LD' and resid 90 through 102 removed outlier: 4.184A pdb=" N LEULD 94 " --> pdb=" O PROLD 90 " (cutoff:3.500A) Processing helix chain 'LD' and resid 128 through 140 removed outlier: 3.603A pdb=" N GLYLD 140 " --> pdb=" O ASPLD 136 " (cutoff:3.500A) Processing helix chain 'LH' and resid 278 through 286 removed outlier: 4.326A pdb=" N HISLH 282 " --> pdb=" O ASPLH 278 " (cutoff:3.500A) Processing helix chain 'LK' and resid 49 through 64 Processing helix chain 'LK' and resid 81 through 83 No H-bonds generated for 'chain 'LK' and resid 81 through 83' Processing helix chain 'LK' and resid 94 through 107 removed outlier: 4.443A pdb=" N LEULK 98 " --> pdb=" O ALALK 94 " (cutoff:3.500A) Processing helix chain 'LK' and resid 125 through 147 Processing helix chain 'LL' and resid 46 through 51 removed outlier: 3.571A pdb=" N ASNLL 49 " --> pdb=" O PROLL 46 " (cutoff:3.500A) Processing helix chain 'LL' and resid 54 through 63 removed outlier: 4.105A pdb=" N LYSLL 58 " --> pdb=" O ARGLL 54 " (cutoff:3.500A) removed outlier: 3.765A pdb=" N ARGLL 59 " --> pdb=" O ARGLL 55 " (cutoff:3.500A) Processing helix chain 'LL' and resid 89 through 100 Processing helix chain 'LL' and resid 101 through 112 Processing helix chain 'LL' and resid 129 through 133 Processing helix chain 'LL' and resid 141 through 143 No H-bonds generated for 'chain 'LL' and resid 141 through 143' Processing helix chain 'LL' and resid 144 through 156 removed outlier: 3.715A pdb=" N LEULL 148 " --> pdb=" O CYSLL 144 " (cutoff:3.500A) Processing helix chain 'LL' and resid 174 through 195 Processing helix chain 'LL' and resid 199 through 201 No H-bonds generated for 'chain 'LL' and resid 199 through 201' Processing helix chain 'LL' and resid 219 through 225 Processing helix chain 'Ld' and resid 35 through 60 removed outlier: 3.945A pdb=" N LYSLd 40 " --> pdb=" O ASPLd 36 " (cutoff:3.500A) Processing helix chain 'Ld' and resid 91 through 102 Processing helix chain 'Ld' and resid 128 through 140 removed outlier: 3.556A pdb=" N GLYLd 140 " --> pdb=" O ASPLd 136 " (cutoff:3.500A) Processing helix chain 'MC' and resid 30 through 35 Processing helix chain 'MC' and resid 61 through 86 removed outlier: 3.885A pdb=" N SERMC 65 " --> pdb=" O GLUMC 61 " (cutoff:3.500A) removed outlier: 3.725A pdb=" N GLNMC 69 " --> pdb=" O SERMC 65 " (cutoff:3.500A) removed outlier: 3.996A pdb=" N ALAMC 70 " --> pdb=" O VALMC 66 " (cutoff:3.500A) removed outlier: 3.534A pdb=" N ALAMC 73 " --> pdb=" O GLNMC 69 " (cutoff:3.500A) removed outlier: 3.676A pdb=" N GLNMC 86 " --> pdb=" O GLNMC 82 " (cutoff:3.500A) Processing helix chain 'MC' and resid 86 through 94 Processing helix chain 'MC' and resid 96 through 100 removed outlier: 3.504A pdb=" N LEUMC 99 " --> pdb=" O PHEMC 96 " (cutoff:3.500A) removed outlier: 3.724A pdb=" N VALMC 100 " --> pdb=" O ASNMC 97 " (cutoff:3.500A) No H-bonds generated for 'chain 'MC' and resid 96 through 100' Processing helix chain 'MC' and resid 147 through 152 removed outlier: 3.653A pdb=" N TRPMC 152 " --> pdb=" O ARGMC 148 " (cutoff:3.500A) Processing helix chain 'MC' and resid 175 through 218 removed outlier: 3.908A pdb=" N TYRMC 179 " --> pdb=" O ILEMC 175 " (cutoff:3.500A) removed outlier: 3.561A pdb=" N ILEMC 188 " --> pdb=" O TRPMC 184 " (cutoff:3.500A) removed outlier: 3.708A pdb=" N ARGMC 213 " --> pdb=" O METMC 209 " (cutoff:3.500A) Processing helix chain 'MC' and resid 258 through 262 removed outlier: 3.572A pdb=" N GLUMC 261 " --> pdb=" O ASNMC 258 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N TRPMC 262 " --> pdb=" O SERMC 259 " (cutoff:3.500A) No H-bonds generated for 'chain 'MC' and resid 258 through 262' Processing helix chain 'MD' and resid 35 through 63 removed outlier: 3.775A pdb=" N SERMD 47 " --> pdb=" O GLUMD 43 " (cutoff:3.500A) Processing helix chain 'MD' and resid 90 through 102 removed outlier: 4.259A pdb=" N LEUMD 94 " --> pdb=" O PROMD 90 " (cutoff:3.500A) Processing helix chain 'MD' and resid 128 through 140 removed outlier: 3.641A pdb=" N GLYMD 140 " --> pdb=" O ASPMD 136 " (cutoff:3.500A) Processing helix chain 'MH' and resid 278 through 286 removed outlier: 4.335A pdb=" N HISMH 282 " --> pdb=" O ASPMH 278 " (cutoff:3.500A) Processing helix chain 'MK' and resid 49 through 64 Processing helix chain 'MK' and resid 81 through 83 No H-bonds generated for 'chain 'MK' and resid 81 through 83' Processing helix chain 'MK' and resid 95 through 107 Processing helix chain 'MK' and resid 125 through 147 removed outlier: 3.787A pdb=" N GLUMK 129 " --> pdb=" O SERMK 125 " (cutoff:3.500A) Processing helix chain 'ML' and resid 46 through 51 removed outlier: 3.610A pdb=" N ASNML 49 " --> pdb=" O PROML 46 " (cutoff:3.500A) Processing helix chain 'ML' and resid 54 through 63 removed outlier: 4.127A pdb=" N LYSML 58 " --> pdb=" O ARGML 54 " (cutoff:3.500A) removed outlier: 3.763A pdb=" N ARGML 59 " --> pdb=" O ARGML 55 " (cutoff:3.500A) Processing helix chain 'ML' and resid 89 through 100 Processing helix chain 'ML' and resid 101 through 112 Processing helix chain 'ML' and resid 129 through 133 Processing helix chain 'ML' and resid 141 through 143 No H-bonds generated for 'chain 'ML' and resid 141 through 143' Processing helix chain 'ML' and resid 144 through 156 removed outlier: 3.732A pdb=" N LEUML 148 " --> pdb=" O CYSML 144 " (cutoff:3.500A) Processing helix chain 'ML' and resid 174 through 195 Processing helix chain 'ML' and resid 199 through 201 No H-bonds generated for 'chain 'ML' and resid 199 through 201' Processing helix chain 'ML' and resid 219 through 225 Processing helix chain 'Md' and resid 37 through 60 Processing helix chain 'Md' and resid 77 through 80 removed outlier: 3.571A pdb=" N GLNMd 80 " --> pdb=" O TYRMd 77 " (cutoff:3.500A) No H-bonds generated for 'chain 'Md' and resid 77 through 80' Processing helix chain 'Md' and resid 91 through 102 Processing helix chain 'Md' and resid 128 through 140 removed outlier: 3.549A pdb=" N GLYMd 140 " --> pdb=" O ASPMd 136 " (cutoff:3.500A) Processing sheet with id=AA1, first strand: chain 'AC' and resid 105 through 106 removed outlier: 3.922A pdb=" N HISAC 139 " --> pdb=" O LEUAC 106 " (cutoff:3.500A) Processing sheet with id=AA2, first strand: chain 'AH' and resid 318 through 319 removed outlier: 3.580A pdb=" N THRAH 318 " --> pdb=" O SERAH 348 " (cutoff:3.500A) removed outlier: 4.796A pdb=" N ALAAH 304 " --> pdb=" O LEUAH 295 " (cutoff:3.500A) removed outlier: 5.469A pdb=" N VALAH 297 " --> pdb=" O ALAAH 302 " (cutoff:3.500A) removed outlier: 6.232A pdb=" N ALAAH 302 " --> pdb=" O VALAH 297 " (cutoff:3.500A) removed outlier: 4.400A pdb=" N THRAH 329 " --> pdb=" O ASNAC 115 " (cutoff:3.500A) removed outlier: 4.891A pdb=" N ASNAC 115 " --> pdb=" O THRAH 329 " (cutoff:3.500A) removed outlier: 6.601A pdb=" N VALAC 109 " --> pdb=" O ALAAC 135 " (cutoff:3.500A) removed outlier: 6.899A pdb=" N ASPAC 129 " --> pdb=" O ASNAC 115 " (cutoff:3.500A) removed outlier: 6.844A pdb=" N LEUAC 117 " --> pdb=" O ILEAC 127 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N ILEAC 127 " --> pdb=" O LEUAC 117 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N LEUAC 119 " --> pdb=" O ILEAC 125 " (cutoff:3.500A) removed outlier: 7.295A pdb=" N ILEAC 125 " --> pdb=" O LEUAC 119 " (cutoff:3.500A) removed outlier: 3.719A pdb=" N ASPMC 244 " --> pdb=" O LEUMC 231 " (cutoff:3.500A) removed outlier: 6.804A pdb=" N TYRMC 225 " --> pdb=" O THRMC 250 " (cutoff:3.500A) Processing sheet with id=AA3, first strand: chain 'AH' and resid 318 through 319 removed outlier: 3.580A pdb=" N THRAH 318 " --> pdb=" O SERAH 348 " (cutoff:3.500A) removed outlier: 4.796A pdb=" N ALAAH 304 " --> pdb=" O LEUAH 295 " (cutoff:3.500A) removed outlier: 5.469A pdb=" N VALAH 297 " --> pdb=" O ALAAH 302 " (cutoff:3.500A) removed outlier: 6.232A pdb=" N ALAAH 302 " --> pdb=" O VALAH 297 " (cutoff:3.500A) removed outlier: 4.400A pdb=" N THRAH 329 " --> pdb=" O ASNAC 115 " (cutoff:3.500A) removed outlier: 4.891A pdb=" N ASNAC 115 " --> pdb=" O THRAH 329 " (cutoff:3.500A) removed outlier: 6.601A pdb=" N VALAC 109 " --> pdb=" O ALAAC 135 " (cutoff:3.500A) removed outlier: 6.899A pdb=" N ASPAC 129 " --> pdb=" O ASNAC 115 " (cutoff:3.500A) removed outlier: 6.844A pdb=" N LEUAC 117 " --> pdb=" O ILEAC 127 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N ILEAC 127 " --> pdb=" O LEUAC 117 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N LEUAC 119 " --> pdb=" O ILEAC 125 " (cutoff:3.500A) removed outlier: 7.295A pdb=" N ILEAC 125 " --> pdb=" O LEUAC 119 " (cutoff:3.500A) removed outlier: 3.501A pdb=" N GLUMC 239 " --> pdb=" O ASPMC 236 " (cutoff:3.500A) Processing sheet with id=AA4, first strand: chain 'AC' and resid 225 through 230 removed outlier: 6.669A pdb=" N TYRAC 225 " --> pdb=" O THRAC 250 " (cutoff:3.500A) Processing sheet with id=AA5, first strand: chain 'AC' and resid 225 through 230 removed outlier: 6.669A pdb=" N TYRAC 225 " --> pdb=" O THRAC 250 " (cutoff:3.500A) removed outlier: 7.345A pdb=" N ILEBC 125 " --> pdb=" O LEUBC 119 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N LEUBC 119 " --> pdb=" O ILEBC 125 " (cutoff:3.500A) removed outlier: 6.851A pdb=" N ILEBC 127 " --> pdb=" O LEUBC 117 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUBC 117 " --> pdb=" O ILEBC 127 " (cutoff:3.500A) removed outlier: 6.923A pdb=" N ASPBC 129 " --> pdb=" O ASNBC 115 " (cutoff:3.500A) removed outlier: 6.647A pdb=" N VALBC 109 " --> pdb=" O ALABC 135 " (cutoff:3.500A) removed outlier: 4.847A pdb=" N ASNBC 115 " --> pdb=" O THRBH 329 " (cutoff:3.500A) removed outlier: 4.328A pdb=" N THRBH 329 " --> pdb=" O ASNBC 115 " (cutoff:3.500A) removed outlier: 6.181A pdb=" N ALABH 302 " --> pdb=" O VALBH 297 " (cutoff:3.500A) removed outlier: 5.369A pdb=" N VALBH 297 " --> pdb=" O ALABH 302 " (cutoff:3.500A) removed outlier: 4.686A pdb=" N ALABH 304 " --> pdb=" O LEUBH 295 " (cutoff:3.500A) removed outlier: 3.803A pdb=" N THRBH 318 " --> pdb=" O SERBH 348 " (cutoff:3.500A) Processing sheet with id=AA6, first strand: chain 'AC' and resid 266 through 267 removed outlier: 3.586A pdb=" N ALAAC 267 " --> pdb=" O SERMd 84 " (cutoff:3.500A) removed outlier: 6.302A pdb=" N ALAMd 83 " --> pdb=" O ASPMd 125 " (cutoff:3.500A) removed outlier: 3.747A pdb=" N ASPMd 125 " --> pdb=" O ALAMd 83 " (cutoff:3.500A) Processing sheet with id=AA7, first strand: chain 'AD' and resid 121 through 122 Processing sheet with id=AA8, first strand: chain 'AD' and resid 121 through 122 removed outlier: 6.475A pdb=" N ILEAK 114 " --> pdb=" O PHEAK 155 " (cutoff:3.500A) removed outlier: 8.146A pdb=" N GLNAK 157 " --> pdb=" O ILEAK 114 " (cutoff:3.500A) removed outlier: 6.222A pdb=" N VALAK 116 " --> pdb=" O GLNAK 157 " (cutoff:3.500A) removed outlier: 7.560A pdb=" N LEUAK 159 " --> pdb=" O VALAK 116 " (cutoff:3.500A) removed outlier: 7.866A pdb=" N SERAK 118 " --> pdb=" O LEUAK 159 " (cutoff:3.500A) removed outlier: 6.047A pdb=" N ALAAK 113 " --> pdb=" O ARGAK 185 " (cutoff:3.500A) removed outlier: 4.620A pdb=" N ARGAK 185 " --> pdb=" O ALAAK 113 " (cutoff:3.500A) Processing sheet with id=AA9, first strand: chain 'AD' and resid 105 through 109 removed outlier: 6.238A pdb=" N ARGAD 105 " --> pdb=" O VALAD 154 " (cutoff:3.500A) removed outlier: 7.786A pdb=" N LEUAD 156 " --> pdb=" O ARGAD 105 " (cutoff:3.500A) removed outlier: 6.423A pdb=" N ARGAD 107 " --> pdb=" O LEUAD 156 " (cutoff:3.500A) removed outlier: 8.032A pdb=" N TYRAD 158 " --> pdb=" O ARGAD 107 " (cutoff:3.500A) removed outlier: 7.165A pdb=" N LEUAD 109 " --> pdb=" O TYRAD 158 " (cutoff:3.500A) Processing sheet with id=AB1, first strand: chain 'AL' and resid 115 through 119 removed outlier: 3.521A pdb=" N THRAL 122 " --> pdb=" O TYRAL 119 " (cutoff:3.500A) Processing sheet with id=AB2, first strand: chain 'AM' and resid 287 through 292 removed outlier: 10.195A pdb=" N ARGAM 247 " --> pdb=" O VALAM 266 " (cutoff:3.500A) removed outlier: 9.917A pdb=" N HISAM 268 " --> pdb=" O ARGAM 247 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N GLNAM 249 " --> pdb=" O HISAM 268 " (cutoff:3.500A) removed outlier: 7.756A pdb=" N SERAM 270 " --> pdb=" O GLNAM 249 " (cutoff:3.500A) removed outlier: 6.138A pdb=" N SERAM 251 " --> pdb=" O SERAM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUAM 272 " --> pdb=" O SERAM 251 " (cutoff:3.500A) removed outlier: 6.487A pdb=" N VALAM 253 " --> pdb=" O LEUAM 272 " (cutoff:3.500A) removed outlier: 6.876A pdb=" N ILEAM 227 " --> pdb=" O LEUAM 246 " (cutoff:3.500A) removed outlier: 7.293A pdb=" N ALAAM 248 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 7.131A pdb=" N ASNAM 229 " --> pdb=" O ALAAM 248 " (cutoff:3.500A) removed outlier: 6.194A pdb=" N ILEAM 207 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 8.400A pdb=" N ASNAM 229 " --> pdb=" O ILEAM 207 " (cutoff:3.500A) removed outlier: 7.042A pdb=" N LYSAM 208 " --> pdb=" O GLYAM 187 " (cutoff:3.500A) removed outlier: 6.026A pdb=" N VALAM 189 " --> pdb=" O LYSAM 208 " (cutoff:3.500A) removed outlier: 4.394A pdb=" N VALAM 162 " --> pdb=" O LYSAM 182 " (cutoff:3.500A) removed outlier: 7.521A pdb=" N LEUAM 184 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 4.338A pdb=" N GLNAM 164 " --> pdb=" O LEUAM 184 " (cutoff:3.500A) removed outlier: 7.437A pdb=" N SERAM 186 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 5.211A pdb=" N ASNAM 166 " --> pdb=" O SERAM 186 " (cutoff:3.500A) removed outlier: 8.809A pdb=" N PHEAM 188 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 5.738A pdb=" N VALAM 168 " --> pdb=" O PHEAM 188 " (cutoff:3.500A) removed outlier: 7.118A pdb=" N ASNAM 190 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 7.835A pdb=" N SERAM 170 " --> pdb=" O ASNAM 190 " (cutoff:3.500A) removed outlier: 9.187A pdb=" N ARGAM 192 " --> pdb=" O SERAM 170 " (cutoff:3.500A) removed outlier: 10.813A pdb=" N ASNAM 172 " --> pdb=" O ARGAM 192 " (cutoff:3.500A) removed outlier: 11.936A pdb=" N LEUAM 194 " --> pdb=" O ASNAM 172 " (cutoff:3.500A) removed outlier: 10.265A pdb=" N GLNAM 174 " --> pdb=" O LEUAM 194 " (cutoff:3.500A) removed outlier: 10.938A pdb=" N METAM 196 " --> pdb=" O GLNAM 174 " (cutoff:3.500A) removed outlier: 9.680A pdb=" N VALAM 176 " --> pdb=" O METAM 196 " (cutoff:3.500A) removed outlier: 5.611A pdb=" N GLYAM 142 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 7.129A pdb=" N GLNAM 164 " --> pdb=" O GLYAM 142 " (cutoff:3.500A) removed outlier: 6.580A pdb=" N THRAM 144 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ASNAM 166 " --> pdb=" O THRAM 144 " (cutoff:3.500A) removed outlier: 6.713A pdb=" N LEUAM 146 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 7.573A pdb=" N VALAM 168 " --> pdb=" O LEUAM 146 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N GLYAM 148 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 9.809A pdb=" N SERAM 170 " --> pdb=" O GLYAM 148 " (cutoff:3.500A) removed outlier: 3.572A pdb=" N ASNAM 128 " --> pdb=" O ALAAM 147 " (cutoff:3.500A) removed outlier: 6.464A pdb=" N ASNAM 149 " --> pdb=" O ASNAM 128 " (cutoff:3.500A) removed outlier: 5.167A pdb=" N ARGAM 130 " --> pdb=" O ASNAM 149 " (cutoff:3.500A) removed outlier: 6.335A pdb=" N VALAM 58 " --> pdb=" O THRAM 125 " (cutoff:3.500A) removed outlier: 8.505A pdb=" N ASNAM 127 " --> pdb=" O VALAM 58 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N LEUAM 60 " --> pdb=" O ASNAM 127 " (cutoff:3.500A) removed outlier: 7.769A pdb=" N LEUAM 129 " --> pdb=" O LEUAM 60 " (cutoff:3.500A) removed outlier: 9.058A pdb=" N THRAM 62 " --> pdb=" O LEUAM 129 " (cutoff:3.500A) removed outlier: 6.536A pdb=" N ASNAM 57 " --> pdb=" O VALAM 106 " (cutoff:3.500A) removed outlier: 7.826A pdb=" N ILEAM 108 " --> pdb=" O ASNAM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNAM 59 " --> pdb=" O ILEAM 108 " (cutoff:3.500A) removed outlier: 8.292A pdb=" N THRAM 110 " --> pdb=" O ASNAM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISAM 61 " --> pdb=" O THRAM 110 " (cutoff:3.500A) removed outlier: 3.546A pdb=" N VALAM 69 " --> pdb=" O ARGAM 42 " (cutoff:3.500A) Processing sheet with id=AB3, first strand: chain 'AM' and resid 41 through 43 removed outlier: 3.546A pdb=" N VALAM 69 " --> pdb=" O ARGAM 42 " (cutoff:3.500A) removed outlier: 6.536A pdb=" N ASNAM 57 " --> pdb=" O VALAM 106 " (cutoff:3.500A) removed outlier: 7.826A pdb=" N ILEAM 108 " --> pdb=" O ASNAM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNAM 59 " --> pdb=" O ILEAM 108 " (cutoff:3.500A) removed outlier: 8.292A pdb=" N THRAM 110 " --> pdb=" O ASNAM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISAM 61 " --> pdb=" O THRAM 110 " (cutoff:3.500A) removed outlier: 6.335A pdb=" N VALAM 58 " --> pdb=" O THRAM 125 " (cutoff:3.500A) removed outlier: 8.505A pdb=" N ASNAM 127 " --> pdb=" O VALAM 58 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N LEUAM 60 " --> pdb=" O ASNAM 127 " (cutoff:3.500A) removed outlier: 7.769A pdb=" N LEUAM 129 " --> pdb=" O LEUAM 60 " (cutoff:3.500A) removed outlier: 9.058A pdb=" N THRAM 62 " --> pdb=" O LEUAM 129 " (cutoff:3.500A) removed outlier: 3.572A pdb=" N ASNAM 128 " --> pdb=" O ALAAM 147 " (cutoff:3.500A) removed outlier: 6.464A pdb=" N ASNAM 149 " --> pdb=" O ASNAM 128 " (cutoff:3.500A) removed outlier: 5.167A pdb=" N ARGAM 130 " --> pdb=" O ASNAM 149 " (cutoff:3.500A) removed outlier: 5.611A pdb=" N GLYAM 142 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 7.129A pdb=" N GLNAM 164 " --> pdb=" O GLYAM 142 " (cutoff:3.500A) removed outlier: 6.580A pdb=" N THRAM 144 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ASNAM 166 " --> pdb=" O THRAM 144 " (cutoff:3.500A) removed outlier: 6.713A pdb=" N LEUAM 146 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 7.573A pdb=" N VALAM 168 " --> pdb=" O LEUAM 146 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N GLYAM 148 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 9.809A pdb=" N SERAM 170 " --> pdb=" O GLYAM 148 " (cutoff:3.500A) removed outlier: 4.394A pdb=" N VALAM 162 " --> pdb=" O LYSAM 182 " (cutoff:3.500A) removed outlier: 7.521A pdb=" N LEUAM 184 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 4.338A pdb=" N GLNAM 164 " --> pdb=" O LEUAM 184 " (cutoff:3.500A) removed outlier: 7.437A pdb=" N SERAM 186 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 5.211A pdb=" N ASNAM 166 " --> pdb=" O SERAM 186 " (cutoff:3.500A) removed outlier: 8.809A pdb=" N PHEAM 188 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 5.738A pdb=" N VALAM 168 " --> pdb=" O PHEAM 188 " (cutoff:3.500A) removed outlier: 7.118A pdb=" N ASNAM 190 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 7.835A pdb=" N SERAM 170 " --> pdb=" O ASNAM 190 " (cutoff:3.500A) removed outlier: 9.187A pdb=" N ARGAM 192 " --> pdb=" O SERAM 170 " (cutoff:3.500A) removed outlier: 10.813A pdb=" N ASNAM 172 " --> pdb=" O ARGAM 192 " (cutoff:3.500A) removed outlier: 11.936A pdb=" N LEUAM 194 " --> pdb=" O ASNAM 172 " (cutoff:3.500A) removed outlier: 10.265A pdb=" N GLNAM 174 " --> pdb=" O LEUAM 194 " (cutoff:3.500A) removed outlier: 10.938A pdb=" N METAM 196 " --> pdb=" O GLNAM 174 " (cutoff:3.500A) removed outlier: 9.680A pdb=" N VALAM 176 " --> pdb=" O METAM 196 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N THRAM 211 " --> pdb=" O ASNAM 190 " (cutoff:3.500A) removed outlier: 4.757A pdb=" N ARGAM 192 " --> pdb=" O THRAM 211 " (cutoff:3.500A) removed outlier: 3.532A pdb=" N THRAM 213 " --> pdb=" O ARGAM 192 " (cutoff:3.500A) removed outlier: 6.876A pdb=" N ILEAM 227 " --> pdb=" O LEUAM 246 " (cutoff:3.500A) removed outlier: 7.293A pdb=" N ALAAM 248 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 7.131A pdb=" N ASNAM 229 " --> pdb=" O ALAAM 248 " (cutoff:3.500A) removed outlier: 10.195A pdb=" N ARGAM 247 " --> pdb=" O VALAM 266 " (cutoff:3.500A) removed outlier: 9.917A pdb=" N HISAM 268 " --> pdb=" O ARGAM 247 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N GLNAM 249 " --> pdb=" O HISAM 268 " (cutoff:3.500A) removed outlier: 7.756A pdb=" N SERAM 270 " --> pdb=" O GLNAM 249 " (cutoff:3.500A) removed outlier: 6.138A pdb=" N SERAM 251 " --> pdb=" O SERAM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUAM 272 " --> pdb=" O SERAM 251 " (cutoff:3.500A) removed outlier: 6.487A pdb=" N VALAM 253 " --> pdb=" O LEUAM 272 " (cutoff:3.500A) Processing sheet with id=AB4, first strand: chain 'AM' and resid 297 through 299 removed outlier: 3.672A pdb=" N TYRAM 281 " --> pdb=" O LEUAM 299 " (cutoff:3.500A) removed outlier: 6.743A pdb=" N ILEAM 222 " --> pdb=" O LYSAM 242 " (cutoff:3.500A) removed outlier: 4.394A pdb=" N VALAM 162 " --> pdb=" O LYSAM 182 " (cutoff:3.500A) removed outlier: 7.521A pdb=" N LEUAM 184 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 4.338A pdb=" N GLNAM 164 " --> pdb=" O LEUAM 184 " (cutoff:3.500A) removed outlier: 7.437A pdb=" N SERAM 186 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 5.211A pdb=" N ASNAM 166 " --> pdb=" O SERAM 186 " (cutoff:3.500A) removed outlier: 8.809A pdb=" N PHEAM 188 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 5.738A pdb=" N VALAM 168 " --> pdb=" O PHEAM 188 " (cutoff:3.500A) removed outlier: 7.118A pdb=" N ASNAM 190 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 7.835A pdb=" N SERAM 170 " --> pdb=" O ASNAM 190 " (cutoff:3.500A) removed outlier: 9.187A pdb=" N ARGAM 192 " --> pdb=" O SERAM 170 " (cutoff:3.500A) removed outlier: 10.813A pdb=" N ASNAM 172 " --> pdb=" O ARGAM 192 " (cutoff:3.500A) removed outlier: 11.936A pdb=" N LEUAM 194 " --> pdb=" O ASNAM 172 " (cutoff:3.500A) removed outlier: 10.265A pdb=" N GLNAM 174 " --> pdb=" O LEUAM 194 " (cutoff:3.500A) removed outlier: 10.938A pdb=" N METAM 196 " --> pdb=" O GLNAM 174 " (cutoff:3.500A) removed outlier: 9.680A pdb=" N VALAM 176 " --> pdb=" O METAM 196 " (cutoff:3.500A) removed outlier: 5.611A pdb=" N GLYAM 142 " --> pdb=" O VALAM 162 " (cutoff:3.500A) removed outlier: 7.129A pdb=" N GLNAM 164 " --> pdb=" O GLYAM 142 " (cutoff:3.500A) removed outlier: 6.580A pdb=" N THRAM 144 " --> pdb=" O GLNAM 164 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ASNAM 166 " --> pdb=" O THRAM 144 " (cutoff:3.500A) removed outlier: 6.713A pdb=" N LEUAM 146 " --> pdb=" O ASNAM 166 " (cutoff:3.500A) removed outlier: 7.573A pdb=" N VALAM 168 " --> pdb=" O LEUAM 146 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N GLYAM 148 " --> pdb=" O VALAM 168 " (cutoff:3.500A) removed outlier: 9.809A pdb=" N SERAM 170 " --> pdb=" O GLYAM 148 " (cutoff:3.500A) removed outlier: 3.572A pdb=" N ASNAM 128 " --> pdb=" O ALAAM 147 " (cutoff:3.500A) removed outlier: 6.464A pdb=" N ASNAM 149 " --> pdb=" O ASNAM 128 " (cutoff:3.500A) removed outlier: 5.167A pdb=" N ARGAM 130 " --> pdb=" O ASNAM 149 " (cutoff:3.500A) removed outlier: 6.335A pdb=" N VALAM 58 " --> pdb=" O THRAM 125 " (cutoff:3.500A) removed outlier: 8.505A pdb=" N ASNAM 127 " --> pdb=" O VALAM 58 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N LEUAM 60 " --> pdb=" O ASNAM 127 " (cutoff:3.500A) removed outlier: 7.769A pdb=" N LEUAM 129 " --> pdb=" O LEUAM 60 " (cutoff:3.500A) removed outlier: 9.058A pdb=" N THRAM 62 " --> pdb=" O LEUAM 129 " (cutoff:3.500A) removed outlier: 6.536A pdb=" N ASNAM 57 " --> pdb=" O VALAM 106 " (cutoff:3.500A) removed outlier: 7.826A pdb=" N ILEAM 108 " --> pdb=" O ASNAM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNAM 59 " --> pdb=" O ILEAM 108 " (cutoff:3.500A) removed outlier: 8.292A pdb=" N THRAM 110 " --> pdb=" O ASNAM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISAM 61 " --> pdb=" O THRAM 110 " (cutoff:3.500A) removed outlier: 3.546A pdb=" N VALAM 69 " --> pdb=" O ARGAM 42 " (cutoff:3.500A) Processing sheet with id=AB5, first strand: chain 'AM' and resid 287 through 292 removed outlier: 10.195A pdb=" N ARGAM 247 " --> pdb=" O VALAM 266 " (cutoff:3.500A) removed outlier: 9.917A pdb=" N HISAM 268 " --> pdb=" O ARGAM 247 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N GLNAM 249 " --> pdb=" O HISAM 268 " (cutoff:3.500A) removed outlier: 7.756A pdb=" N SERAM 270 " --> pdb=" O GLNAM 249 " (cutoff:3.500A) removed outlier: 6.138A pdb=" N SERAM 251 " --> pdb=" O SERAM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUAM 272 " --> pdb=" O SERAM 251 " (cutoff:3.500A) removed outlier: 6.487A pdb=" N VALAM 253 " --> pdb=" O LEUAM 272 " (cutoff:3.500A) removed outlier: 6.876A pdb=" N ILEAM 227 " --> pdb=" O LEUAM 246 " (cutoff:3.500A) removed outlier: 7.293A pdb=" N ALAAM 248 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 7.131A pdb=" N ASNAM 229 " --> pdb=" O ALAAM 248 " (cutoff:3.500A) removed outlier: 6.194A pdb=" N ILEAM 207 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 8.400A pdb=" N ASNAM 229 " --> pdb=" O ILEAM 207 " (cutoff:3.500A) removed outlier: 7.042A pdb=" N LYSAM 208 " --> pdb=" O GLYAM 187 " (cutoff:3.500A) removed outlier: 6.026A pdb=" N VALAM 189 " --> pdb=" O LYSAM 208 " (cutoff:3.500A) removed outlier: 6.743A pdb=" N ILEAM 222 " --> pdb=" O LYSAM 242 " (cutoff:3.500A) removed outlier: 3.672A pdb=" N TYRAM 281 " --> pdb=" O LEUAM 299 " (cutoff:3.500A) Processing sheet with id=AB6, first strand: chain 'AM' and resid 297 through 299 removed outlier: 3.672A pdb=" N TYRAM 281 " --> pdb=" O LEUAM 299 " (cutoff:3.500A) removed outlier: 6.743A pdb=" N ILEAM 222 " --> pdb=" O LYSAM 242 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N THRAM 211 " --> pdb=" O ASNAM 190 " (cutoff:3.500A) removed outlier: 4.757A pdb=" N ARGAM 192 " --> pdb=" O THRAM 211 " (cutoff:3.500A) removed outlier: 3.532A pdb=" N THRAM 213 " --> pdb=" O ARGAM 192 " (cutoff:3.500A) removed outlier: 6.876A pdb=" N ILEAM 227 " --> pdb=" O LEUAM 246 " (cutoff:3.500A) removed outlier: 7.293A pdb=" N ALAAM 248 " --> pdb=" O ILEAM 227 " (cutoff:3.500A) removed outlier: 7.131A pdb=" N ASNAM 229 " --> pdb=" O ALAAM 248 " (cutoff:3.500A) removed outlier: 10.195A pdb=" N ARGAM 247 " --> pdb=" O VALAM 266 " (cutoff:3.500A) removed outlier: 9.917A pdb=" N HISAM 268 " --> pdb=" O ARGAM 247 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N GLNAM 249 " --> pdb=" O HISAM 268 " (cutoff:3.500A) removed outlier: 7.756A pdb=" N SERAM 270 " --> pdb=" O GLNAM 249 " (cutoff:3.500A) removed outlier: 6.138A pdb=" N SERAM 251 " --> pdb=" O SERAM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUAM 272 " --> pdb=" O SERAM 251 " (cutoff:3.500A) removed outlier: 6.487A pdb=" N VALAM 253 " --> pdb=" O LEUAM 272 " (cutoff:3.500A) Processing sheet with id=AB7, first strand: chain 'AM' and resid 81 through 84 removed outlier: 3.570A pdb=" N ARGAM 82 " --> pdb=" O SERAM 93 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N SERAM 93 " --> pdb=" O ARGAM 82 " (cutoff:3.500A) removed outlier: 3.552A pdb=" N ILEAM 84 " --> pdb=" O TYRAM 91 " (cutoff:3.500A) removed outlier: 4.236A pdb=" N LEUAM 94 " --> pdb=" O GLNAM 53 " (cutoff:3.500A) removed outlier: 3.806A pdb=" N LEUAM 136 " --> pdb=" O LYSAM 154 " (cutoff:3.500A) Processing sheet with id=AB8, first strand: chain 'AN' and resid 48 through 52 removed outlier: 6.693A pdb=" N VALAN 59 " --> pdb=" O ASNAN 49 " (cutoff:3.500A) removed outlier: 4.870A pdb=" N CYSAN 51 " --> pdb=" O ARGAN 57 " (cutoff:3.500A) removed outlier: 6.483A pdb=" N ARGAN 57 " --> pdb=" O CYSAN 51 " (cutoff:3.500A) removed outlier: 4.955A pdb=" N LEUAN 58 " --> pdb=" O SERAN 66 " (cutoff:3.500A) Processing sheet with id=AB9, first strand: chain 'AN' and resid 101 through 102 removed outlier: 4.589A pdb=" N VALAN 101 " --> pdb=" O SERAN 109 " (cutoff:3.500A) Processing sheet with id=AC1, first strand: chain 'Ad' and resid 118 through 127 removed outlier: 3.628A pdb=" N ASPAd 125 " --> pdb=" O ALAAd 83 " (cutoff:3.500A) removed outlier: 6.096A pdb=" N ALAAd 83 " --> pdb=" O ASPAd 125 " (cutoff:3.500A) removed outlier: 3.572A pdb=" N ALABC 267 " --> pdb=" O SERAd 84 " (cutoff:3.500A) Processing sheet with id=AC2, first strand: chain 'Ad' and resid 105 through 109 Processing sheet with id=AC3, first strand: chain 'Af' and resid 210 through 216 removed outlier: 6.945A pdb=" N TRPAf 221 " --> pdb=" O GLNAf 213 " (cutoff:3.500A) removed outlier: 5.545A pdb=" N VALAf 215 " --> pdb=" O ARGAf 219 " (cutoff:3.500A) removed outlier: 7.500A pdb=" N ARGAf 219 " --> pdb=" O VALAf 215 " (cutoff:3.500A) Processing sheet with id=AC4, first strand: chain 'Af' and resid 237 through 238 removed outlier: 3.578A pdb=" N ILEAf 238 " --> pdb=" O GLYAf 242 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N GLYAf 242 " --> pdb=" O ILEAf 238 " (cutoff:3.500A) removed outlier: 7.137A pdb=" N LEUAf 255 " --> pdb=" O LYSAf 245 " (cutoff:3.500A) Processing sheet with id=AC5, first strand: chain 'BC' and resid 105 through 106 removed outlier: 3.922A pdb=" N HISBC 139 " --> pdb=" O LEUBC 106 " (cutoff:3.500A) Processing sheet with id=AC6, first strand: chain 'BC' and resid 225 through 231 removed outlier: 6.905A pdb=" N TYRBC 225 " --> pdb=" O THRBC 250 " (cutoff:3.500A) removed outlier: 3.640A pdb=" N ASPBC 244 " --> pdb=" O LEUBC 231 " (cutoff:3.500A) Processing sheet with id=AC7, first strand: chain 'BC' and resid 225 through 231 removed outlier: 6.905A pdb=" N TYRBC 225 " --> pdb=" O THRBC 250 " (cutoff:3.500A) removed outlier: 3.640A pdb=" N ASPBC 244 " --> pdb=" O LEUBC 231 " (cutoff:3.500A) removed outlier: 7.297A pdb=" N ILECC 125 " --> pdb=" O LEUCC 119 " (cutoff:3.500A) removed outlier: 7.071A pdb=" N LEUCC 119 " --> pdb=" O ILECC 125 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N ILECC 127 " --> pdb=" O LEUCC 117 " (cutoff:3.500A) removed outlier: 6.806A pdb=" N LEUCC 117 " --> pdb=" O ILECC 127 " (cutoff:3.500A) removed outlier: 6.939A pdb=" N ASPCC 129 " --> pdb=" O ASNCC 115 " (cutoff:3.500A) removed outlier: 6.620A pdb=" N VALCC 109 " --> pdb=" O ALACC 135 " (cutoff:3.500A) removed outlier: 4.918A pdb=" N ASNCC 115 " --> pdb=" O THRCH 329 " (cutoff:3.500A) removed outlier: 4.372A pdb=" N THRCH 329 " --> pdb=" O ASNCC 115 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N ALACH 302 " --> pdb=" O VALCH 297 " (cutoff:3.500A) removed outlier: 5.320A pdb=" N VALCH 297 " --> pdb=" O ALACH 302 " (cutoff:3.500A) removed outlier: 4.699A pdb=" N ALACH 304 " --> pdb=" O LEUCH 295 " (cutoff:3.500A) removed outlier: 3.855A pdb=" N THRCH 318 " --> pdb=" O SERCH 348 " (cutoff:3.500A) Processing sheet with id=AC8, first strand: chain 'BD' and resid 121 through 122 Processing sheet with id=AC9, first strand: chain 'BD' and resid 121 through 122 removed outlier: 6.420A pdb=" N ILEBK 114 " --> pdb=" O PHEBK 155 " (cutoff:3.500A) removed outlier: 8.064A pdb=" N GLNBK 157 " --> pdb=" O ILEBK 114 " (cutoff:3.500A) removed outlier: 6.210A pdb=" N VALBK 116 " --> pdb=" O GLNBK 157 " (cutoff:3.500A) removed outlier: 7.525A pdb=" N LEUBK 159 " --> pdb=" O VALBK 116 " (cutoff:3.500A) removed outlier: 7.882A pdb=" N SERBK 118 " --> pdb=" O LEUBK 159 " (cutoff:3.500A) removed outlier: 5.946A pdb=" N ALABK 113 " --> pdb=" O ARGBK 185 " (cutoff:3.500A) removed outlier: 4.594A pdb=" N ARGBK 185 " --> pdb=" O ALABK 113 " (cutoff:3.500A) Processing sheet with id=AD1, first strand: chain 'BD' and resid 105 through 109 removed outlier: 6.218A pdb=" N ARGBD 105 " --> pdb=" O VALBD 154 " (cutoff:3.500A) removed outlier: 7.742A pdb=" N LEUBD 156 " --> pdb=" O ARGBD 105 " (cutoff:3.500A) removed outlier: 6.429A pdb=" N ARGBD 107 " --> pdb=" O LEUBD 156 " (cutoff:3.500A) removed outlier: 8.069A pdb=" N TYRBD 158 " --> pdb=" O ARGBD 107 " (cutoff:3.500A) removed outlier: 7.112A pdb=" N LEUBD 109 " --> pdb=" O TYRBD 158 " (cutoff:3.500A) Processing sheet with id=AD2, first strand: chain 'BL' and resid 115 through 119 removed outlier: 3.614A pdb=" N THRBL 122 " --> pdb=" O TYRBL 119 " (cutoff:3.500A) Processing sheet with id=AD3, first strand: chain 'BM' and resid 41 through 43 removed outlier: 3.554A pdb=" N VALBM 69 " --> pdb=" O ARGBM 42 " (cutoff:3.500A) removed outlier: 6.582A pdb=" N ASNBM 57 " --> pdb=" O VALBM 106 " (cutoff:3.500A) removed outlier: 7.862A pdb=" N ILEBM 108 " --> pdb=" O ASNBM 57 " (cutoff:3.500A) removed outlier: 6.613A pdb=" N ASNBM 59 " --> pdb=" O ILEBM 108 " (cutoff:3.500A) removed outlier: 8.237A pdb=" N THRBM 110 " --> pdb=" O ASNBM 59 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N HISBM 61 " --> pdb=" O THRBM 110 " (cutoff:3.500A) removed outlier: 6.351A pdb=" N VALBM 58 " --> pdb=" O THRBM 125 " (cutoff:3.500A) removed outlier: 8.537A pdb=" N ASNBM 127 " --> pdb=" O VALBM 58 " (cutoff:3.500A) removed outlier: 7.033A pdb=" N LEUBM 60 " --> pdb=" O ASNBM 127 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N LEUBM 129 " --> pdb=" O LEUBM 60 " (cutoff:3.500A) removed outlier: 9.084A pdb=" N THRBM 62 " --> pdb=" O LEUBM 129 " (cutoff:3.500A) removed outlier: 3.516A pdb=" N ASNBM 128 " --> pdb=" O ALABM 147 " (cutoff:3.500A) removed outlier: 6.402A pdb=" N ASNBM 149 " --> pdb=" O ASNBM 128 " (cutoff:3.500A) removed outlier: 5.151A pdb=" N ARGBM 130 " --> pdb=" O ASNBM 149 " (cutoff:3.500A) removed outlier: 5.449A pdb=" N GLYBM 142 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNBM 164 " --> pdb=" O GLYBM 142 " (cutoff:3.500A) removed outlier: 6.648A pdb=" N THRBM 144 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N ASNBM 166 " --> pdb=" O THRBM 144 " (cutoff:3.500A) removed outlier: 6.795A pdb=" N LEUBM 146 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 7.742A pdb=" N VALBM 168 " --> pdb=" O LEUBM 146 " (cutoff:3.500A) removed outlier: 9.893A pdb=" N GLYBM 148 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N SERBM 170 " --> pdb=" O GLYBM 148 " (cutoff:3.500A) removed outlier: 4.406A pdb=" N VALBM 162 " --> pdb=" O LYSBM 182 " (cutoff:3.500A) removed outlier: 7.402A pdb=" N LEUBM 184 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 4.227A pdb=" N GLNBM 164 " --> pdb=" O LEUBM 184 " (cutoff:3.500A) removed outlier: 7.351A pdb=" N SERBM 186 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 5.161A pdb=" N ASNBM 166 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.827A pdb=" N PHEBM 188 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 5.717A pdb=" N VALBM 168 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.127A pdb=" N ASNBM 190 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 7.776A pdb=" N SERBM 170 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 9.075A pdb=" N ARGBM 192 " --> pdb=" O SERBM 170 " (cutoff:3.500A) removed outlier: 10.715A pdb=" N ASNBM 172 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 11.912A pdb=" N LEUBM 194 " --> pdb=" O ASNBM 172 " (cutoff:3.500A) removed outlier: 10.256A pdb=" N GLNBM 174 " --> pdb=" O LEUBM 194 " (cutoff:3.500A) removed outlier: 10.948A pdb=" N METBM 196 " --> pdb=" O GLNBM 174 " (cutoff:3.500A) removed outlier: 9.676A pdb=" N VALBM 176 " --> pdb=" O METBM 196 " (cutoff:3.500A) removed outlier: 3.536A pdb=" N SERBM 203 " --> pdb=" O VALBM 183 " (cutoff:3.500A) removed outlier: 6.680A pdb=" N ILEBM 222 " --> pdb=" O LYSBM 242 " (cutoff:3.500A) removed outlier: 7.061A pdb=" N LYSBM 244 " --> pdb=" O ILEBM 222 " (cutoff:3.500A) removed outlier: 4.033A pdb=" N SERBM 264 " --> pdb=" O GLYBM 243 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N TYRBM 245 " --> pdb=" O SERBM 264 " (cutoff:3.500A) removed outlier: 10.810A pdb=" N VALBM 266 " --> pdb=" O TYRBM 245 " (cutoff:3.500A) removed outlier: 10.224A pdb=" N ARGBM 247 " --> pdb=" O VALBM 266 " (cutoff:3.500A) removed outlier: 9.958A pdb=" N HISBM 268 " --> pdb=" O ARGBM 247 " (cutoff:3.500A) removed outlier: 6.135A pdb=" N GLNBM 249 " --> pdb=" O HISBM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERBM 270 " --> pdb=" O GLNBM 249 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N SERBM 251 " --> pdb=" O SERBM 270 " (cutoff:3.500A) removed outlier: 8.009A pdb=" N LEUBM 272 " --> pdb=" O SERBM 251 " (cutoff:3.500A) removed outlier: 6.508A pdb=" N VALBM 253 " --> pdb=" O LEUBM 272 " (cutoff:3.500A) Processing sheet with id=AD4, first strand: chain 'BM' and resid 287 through 292 removed outlier: 4.033A pdb=" N SERBM 264 " --> pdb=" O GLYBM 243 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N TYRBM 245 " --> pdb=" O SERBM 264 " (cutoff:3.500A) removed outlier: 10.810A pdb=" N VALBM 266 " --> pdb=" O TYRBM 245 " (cutoff:3.500A) removed outlier: 10.224A pdb=" N ARGBM 247 " --> pdb=" O VALBM 266 " (cutoff:3.500A) removed outlier: 9.958A pdb=" N HISBM 268 " --> pdb=" O ARGBM 247 " (cutoff:3.500A) removed outlier: 6.135A pdb=" N GLNBM 249 " --> pdb=" O HISBM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERBM 270 " --> pdb=" O GLNBM 249 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N SERBM 251 " --> pdb=" O SERBM 270 " (cutoff:3.500A) removed outlier: 8.009A pdb=" N LEUBM 272 " --> pdb=" O SERBM 251 " (cutoff:3.500A) removed outlier: 6.508A pdb=" N VALBM 253 " --> pdb=" O LEUBM 272 " (cutoff:3.500A) removed outlier: 6.871A pdb=" N ILEBM 227 " --> pdb=" O LEUBM 246 " (cutoff:3.500A) removed outlier: 7.288A pdb=" N ALABM 248 " --> pdb=" O ILEBM 227 " (cutoff:3.500A) removed outlier: 7.067A pdb=" N ASNBM 229 " --> pdb=" O ALABM 248 " (cutoff:3.500A) removed outlier: 6.978A pdb=" N LYSBM 208 " --> pdb=" O GLYBM 226 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALBM 228 " --> pdb=" O LYSBM 208 " (cutoff:3.500A) removed outlier: 6.814A pdb=" N ASPBM 210 " --> pdb=" O VALBM 228 " (cutoff:3.500A) removed outlier: 8.873A pdb=" N ILEBM 207 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.156A pdb=" N PHEBM 188 " --> pdb=" O ILEBM 207 " (cutoff:3.500A) removed outlier: 8.779A pdb=" N SERBM 209 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.961A pdb=" N ASNBM 190 " --> pdb=" O SERBM 209 " (cutoff:3.500A) removed outlier: 7.932A pdb=" N THRBM 211 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 4.813A pdb=" N ARGBM 192 " --> pdb=" O THRBM 211 " (cutoff:3.500A) removed outlier: 3.527A pdb=" N THRBM 213 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 4.406A pdb=" N VALBM 162 " --> pdb=" O LYSBM 182 " (cutoff:3.500A) removed outlier: 7.402A pdb=" N LEUBM 184 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 4.227A pdb=" N GLNBM 164 " --> pdb=" O LEUBM 184 " (cutoff:3.500A) removed outlier: 7.351A pdb=" N SERBM 186 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 5.161A pdb=" N ASNBM 166 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.827A pdb=" N PHEBM 188 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 5.717A pdb=" N VALBM 168 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.127A pdb=" N ASNBM 190 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 7.776A pdb=" N SERBM 170 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 9.075A pdb=" N ARGBM 192 " --> pdb=" O SERBM 170 " (cutoff:3.500A) removed outlier: 10.715A pdb=" N ASNBM 172 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 11.912A pdb=" N LEUBM 194 " --> pdb=" O ASNBM 172 " (cutoff:3.500A) removed outlier: 10.256A pdb=" N GLNBM 174 " --> pdb=" O LEUBM 194 " (cutoff:3.500A) removed outlier: 10.948A pdb=" N METBM 196 " --> pdb=" O GLNBM 174 " (cutoff:3.500A) removed outlier: 9.676A pdb=" N VALBM 176 " --> pdb=" O METBM 196 " (cutoff:3.500A) removed outlier: 5.449A pdb=" N GLYBM 142 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNBM 164 " --> pdb=" O GLYBM 142 " (cutoff:3.500A) removed outlier: 6.648A pdb=" N THRBM 144 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N ASNBM 166 " --> pdb=" O THRBM 144 " (cutoff:3.500A) removed outlier: 6.795A pdb=" N LEUBM 146 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 7.742A pdb=" N VALBM 168 " --> pdb=" O LEUBM 146 " (cutoff:3.500A) removed outlier: 9.893A pdb=" N GLYBM 148 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N SERBM 170 " --> pdb=" O GLYBM 148 " (cutoff:3.500A) removed outlier: 3.516A pdb=" N ASNBM 128 " --> pdb=" O ALABM 147 " (cutoff:3.500A) removed outlier: 6.402A pdb=" N ASNBM 149 " --> pdb=" O ASNBM 128 " (cutoff:3.500A) removed outlier: 5.151A pdb=" N ARGBM 130 " --> pdb=" O ASNBM 149 " (cutoff:3.500A) removed outlier: 6.351A pdb=" N VALBM 58 " --> pdb=" O THRBM 125 " (cutoff:3.500A) removed outlier: 8.537A pdb=" N ASNBM 127 " --> pdb=" O VALBM 58 " (cutoff:3.500A) removed outlier: 7.033A pdb=" N LEUBM 60 " --> pdb=" O ASNBM 127 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N LEUBM 129 " --> pdb=" O LEUBM 60 " (cutoff:3.500A) removed outlier: 9.084A pdb=" N THRBM 62 " --> pdb=" O LEUBM 129 " (cutoff:3.500A) removed outlier: 6.582A pdb=" N ASNBM 57 " --> pdb=" O VALBM 106 " (cutoff:3.500A) removed outlier: 7.862A pdb=" N ILEBM 108 " --> pdb=" O ASNBM 57 " (cutoff:3.500A) removed outlier: 6.613A pdb=" N ASNBM 59 " --> pdb=" O ILEBM 108 " (cutoff:3.500A) removed outlier: 8.237A pdb=" N THRBM 110 " --> pdb=" O ASNBM 59 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N HISBM 61 " --> pdb=" O THRBM 110 " (cutoff:3.500A) removed outlier: 3.554A pdb=" N VALBM 69 " --> pdb=" O ARGBM 42 " (cutoff:3.500A) Processing sheet with id=AD5, first strand: chain 'BM' and resid 41 through 43 removed outlier: 3.554A pdb=" N VALBM 69 " --> pdb=" O ARGBM 42 " (cutoff:3.500A) removed outlier: 6.582A pdb=" N ASNBM 57 " --> pdb=" O VALBM 106 " (cutoff:3.500A) removed outlier: 7.862A pdb=" N ILEBM 108 " --> pdb=" O ASNBM 57 " (cutoff:3.500A) removed outlier: 6.613A pdb=" N ASNBM 59 " --> pdb=" O ILEBM 108 " (cutoff:3.500A) removed outlier: 8.237A pdb=" N THRBM 110 " --> pdb=" O ASNBM 59 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N HISBM 61 " --> pdb=" O THRBM 110 " (cutoff:3.500A) removed outlier: 6.351A pdb=" N VALBM 58 " --> pdb=" O THRBM 125 " (cutoff:3.500A) removed outlier: 8.537A pdb=" N ASNBM 127 " --> pdb=" O VALBM 58 " (cutoff:3.500A) removed outlier: 7.033A pdb=" N LEUBM 60 " --> pdb=" O ASNBM 127 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N LEUBM 129 " --> pdb=" O LEUBM 60 " (cutoff:3.500A) removed outlier: 9.084A pdb=" N THRBM 62 " --> pdb=" O LEUBM 129 " (cutoff:3.500A) removed outlier: 3.516A pdb=" N ASNBM 128 " --> pdb=" O ALABM 147 " (cutoff:3.500A) removed outlier: 6.402A pdb=" N ASNBM 149 " --> pdb=" O ASNBM 128 " (cutoff:3.500A) removed outlier: 5.151A pdb=" N ARGBM 130 " --> pdb=" O ASNBM 149 " (cutoff:3.500A) removed outlier: 5.449A pdb=" N GLYBM 142 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNBM 164 " --> pdb=" O GLYBM 142 " (cutoff:3.500A) removed outlier: 6.648A pdb=" N THRBM 144 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N ASNBM 166 " --> pdb=" O THRBM 144 " (cutoff:3.500A) removed outlier: 6.795A pdb=" N LEUBM 146 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 7.742A pdb=" N VALBM 168 " --> pdb=" O LEUBM 146 " (cutoff:3.500A) removed outlier: 9.893A pdb=" N GLYBM 148 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N SERBM 170 " --> pdb=" O GLYBM 148 " (cutoff:3.500A) removed outlier: 4.406A pdb=" N VALBM 162 " --> pdb=" O LYSBM 182 " (cutoff:3.500A) removed outlier: 7.402A pdb=" N LEUBM 184 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 4.227A pdb=" N GLNBM 164 " --> pdb=" O LEUBM 184 " (cutoff:3.500A) removed outlier: 7.351A pdb=" N SERBM 186 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 5.161A pdb=" N ASNBM 166 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.827A pdb=" N PHEBM 188 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 5.717A pdb=" N VALBM 168 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.127A pdb=" N ASNBM 190 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 7.776A pdb=" N SERBM 170 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 9.075A pdb=" N ARGBM 192 " --> pdb=" O SERBM 170 " (cutoff:3.500A) removed outlier: 10.715A pdb=" N ASNBM 172 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 11.912A pdb=" N LEUBM 194 " --> pdb=" O ASNBM 172 " (cutoff:3.500A) removed outlier: 10.256A pdb=" N GLNBM 174 " --> pdb=" O LEUBM 194 " (cutoff:3.500A) removed outlier: 10.948A pdb=" N METBM 196 " --> pdb=" O GLNBM 174 " (cutoff:3.500A) removed outlier: 9.676A pdb=" N VALBM 176 " --> pdb=" O METBM 196 " (cutoff:3.500A) removed outlier: 3.536A pdb=" N SERBM 203 " --> pdb=" O VALBM 183 " (cutoff:3.500A) removed outlier: 6.680A pdb=" N ILEBM 222 " --> pdb=" O LYSBM 242 " (cutoff:3.500A) removed outlier: 7.061A pdb=" N LYSBM 244 " --> pdb=" O ILEBM 222 " (cutoff:3.500A) removed outlier: 4.033A pdb=" N SERBM 264 " --> pdb=" O GLYBM 243 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N TYRBM 245 " --> pdb=" O SERBM 264 " (cutoff:3.500A) removed outlier: 10.810A pdb=" N VALBM 266 " --> pdb=" O TYRBM 245 " (cutoff:3.500A) removed outlier: 10.224A pdb=" N ARGBM 247 " --> pdb=" O VALBM 266 " (cutoff:3.500A) removed outlier: 9.958A pdb=" N HISBM 268 " --> pdb=" O ARGBM 247 " (cutoff:3.500A) removed outlier: 6.135A pdb=" N GLNBM 249 " --> pdb=" O HISBM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERBM 270 " --> pdb=" O GLNBM 249 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N SERBM 251 " --> pdb=" O SERBM 270 " (cutoff:3.500A) removed outlier: 8.009A pdb=" N LEUBM 272 " --> pdb=" O SERBM 251 " (cutoff:3.500A) removed outlier: 6.508A pdb=" N VALBM 253 " --> pdb=" O LEUBM 272 " (cutoff:3.500A) removed outlier: 6.530A pdb=" N ALABM 261 " --> pdb=" O TYRBM 280 " (cutoff:3.500A) Processing sheet with id=AD6, first strand: chain 'BM' and resid 297 through 299 removed outlier: 6.530A pdb=" N ALABM 261 " --> pdb=" O TYRBM 280 " (cutoff:3.500A) removed outlier: 4.033A pdb=" N SERBM 264 " --> pdb=" O GLYBM 243 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N TYRBM 245 " --> pdb=" O SERBM 264 " (cutoff:3.500A) removed outlier: 10.810A pdb=" N VALBM 266 " --> pdb=" O TYRBM 245 " (cutoff:3.500A) removed outlier: 10.224A pdb=" N ARGBM 247 " --> pdb=" O VALBM 266 " (cutoff:3.500A) removed outlier: 9.958A pdb=" N HISBM 268 " --> pdb=" O ARGBM 247 " (cutoff:3.500A) removed outlier: 6.135A pdb=" N GLNBM 249 " --> pdb=" O HISBM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERBM 270 " --> pdb=" O GLNBM 249 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N SERBM 251 " --> pdb=" O SERBM 270 " (cutoff:3.500A) removed outlier: 8.009A pdb=" N LEUBM 272 " --> pdb=" O SERBM 251 " (cutoff:3.500A) removed outlier: 6.508A pdb=" N VALBM 253 " --> pdb=" O LEUBM 272 " (cutoff:3.500A) removed outlier: 6.871A pdb=" N ILEBM 227 " --> pdb=" O LEUBM 246 " (cutoff:3.500A) removed outlier: 7.288A pdb=" N ALABM 248 " --> pdb=" O ILEBM 227 " (cutoff:3.500A) removed outlier: 7.067A pdb=" N ASNBM 229 " --> pdb=" O ALABM 248 " (cutoff:3.500A) removed outlier: 6.978A pdb=" N LYSBM 208 " --> pdb=" O GLYBM 226 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALBM 228 " --> pdb=" O LYSBM 208 " (cutoff:3.500A) removed outlier: 6.814A pdb=" N ASPBM 210 " --> pdb=" O VALBM 228 " (cutoff:3.500A) removed outlier: 8.873A pdb=" N ILEBM 207 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.156A pdb=" N PHEBM 188 " --> pdb=" O ILEBM 207 " (cutoff:3.500A) removed outlier: 8.779A pdb=" N SERBM 209 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.961A pdb=" N ASNBM 190 " --> pdb=" O SERBM 209 " (cutoff:3.500A) removed outlier: 7.932A pdb=" N THRBM 211 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 4.813A pdb=" N ARGBM 192 " --> pdb=" O THRBM 211 " (cutoff:3.500A) removed outlier: 3.527A pdb=" N THRBM 213 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 4.406A pdb=" N VALBM 162 " --> pdb=" O LYSBM 182 " (cutoff:3.500A) removed outlier: 7.402A pdb=" N LEUBM 184 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 4.227A pdb=" N GLNBM 164 " --> pdb=" O LEUBM 184 " (cutoff:3.500A) removed outlier: 7.351A pdb=" N SERBM 186 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 5.161A pdb=" N ASNBM 166 " --> pdb=" O SERBM 186 " (cutoff:3.500A) removed outlier: 8.827A pdb=" N PHEBM 188 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 5.717A pdb=" N VALBM 168 " --> pdb=" O PHEBM 188 " (cutoff:3.500A) removed outlier: 7.127A pdb=" N ASNBM 190 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 7.776A pdb=" N SERBM 170 " --> pdb=" O ASNBM 190 " (cutoff:3.500A) removed outlier: 9.075A pdb=" N ARGBM 192 " --> pdb=" O SERBM 170 " (cutoff:3.500A) removed outlier: 10.715A pdb=" N ASNBM 172 " --> pdb=" O ARGBM 192 " (cutoff:3.500A) removed outlier: 11.912A pdb=" N LEUBM 194 " --> pdb=" O ASNBM 172 " (cutoff:3.500A) removed outlier: 10.256A pdb=" N GLNBM 174 " --> pdb=" O LEUBM 194 " (cutoff:3.500A) removed outlier: 10.948A pdb=" N METBM 196 " --> pdb=" O GLNBM 174 " (cutoff:3.500A) removed outlier: 9.676A pdb=" N VALBM 176 " --> pdb=" O METBM 196 " (cutoff:3.500A) removed outlier: 5.449A pdb=" N GLYBM 142 " --> pdb=" O VALBM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNBM 164 " --> pdb=" O GLYBM 142 " (cutoff:3.500A) removed outlier: 6.648A pdb=" N THRBM 144 " --> pdb=" O GLNBM 164 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N ASNBM 166 " --> pdb=" O THRBM 144 " (cutoff:3.500A) removed outlier: 6.795A pdb=" N LEUBM 146 " --> pdb=" O ASNBM 166 " (cutoff:3.500A) removed outlier: 7.742A pdb=" N VALBM 168 " --> pdb=" O LEUBM 146 " (cutoff:3.500A) removed outlier: 9.893A pdb=" N GLYBM 148 " --> pdb=" O VALBM 168 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N SERBM 170 " --> pdb=" O GLYBM 148 " (cutoff:3.500A) removed outlier: 3.516A pdb=" N ASNBM 128 " --> pdb=" O ALABM 147 " (cutoff:3.500A) removed outlier: 6.402A pdb=" N ASNBM 149 " --> pdb=" O ASNBM 128 " (cutoff:3.500A) removed outlier: 5.151A pdb=" N ARGBM 130 " --> pdb=" O ASNBM 149 " (cutoff:3.500A) removed outlier: 6.351A pdb=" N VALBM 58 " --> pdb=" O THRBM 125 " (cutoff:3.500A) removed outlier: 8.537A pdb=" N ASNBM 127 " --> pdb=" O VALBM 58 " (cutoff:3.500A) removed outlier: 7.033A pdb=" N LEUBM 60 " --> pdb=" O ASNBM 127 " (cutoff:3.500A) removed outlier: 7.931A pdb=" N LEUBM 129 " --> pdb=" O LEUBM 60 " (cutoff:3.500A) removed outlier: 9.084A pdb=" N THRBM 62 " --> pdb=" O LEUBM 129 " (cutoff:3.500A) removed outlier: 6.582A pdb=" N ASNBM 57 " --> pdb=" O VALBM 106 " (cutoff:3.500A) removed outlier: 7.862A pdb=" N ILEBM 108 " --> pdb=" O ASNBM 57 " (cutoff:3.500A) removed outlier: 6.613A pdb=" N ASNBM 59 " --> pdb=" O ILEBM 108 " (cutoff:3.500A) removed outlier: 8.237A pdb=" N THRBM 110 " --> pdb=" O ASNBM 59 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N HISBM 61 " --> pdb=" O THRBM 110 " (cutoff:3.500A) removed outlier: 3.554A pdb=" N VALBM 69 " --> pdb=" O ARGBM 42 " (cutoff:3.500A) Processing sheet with id=AD7, first strand: chain 'BM' and resid 287 through 292 removed outlier: 6.530A pdb=" N ALABM 261 " --> pdb=" O TYRBM 280 " (cutoff:3.500A) Processing sheet with id=AD8, first strand: chain 'BM' and resid 81 through 86 removed outlier: 6.340A pdb=" N GLNBM 49 " --> pdb=" O LEUBM 90 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N VALBM 92 " --> pdb=" O GLNBM 49 " (cutoff:3.500A) removed outlier: 6.182A pdb=" N VALBM 51 " --> pdb=" O VALBM 92 " (cutoff:3.500A) removed outlier: 7.830A pdb=" N LEUBM 94 " --> pdb=" O VALBM 51 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N GLNBM 53 " --> pdb=" O LEUBM 94 " (cutoff:3.500A) Processing sheet with id=AD9, first strand: chain 'BN' and resid 48 through 52 removed outlier: 6.695A pdb=" N VALBN 59 " --> pdb=" O ASNBN 49 " (cutoff:3.500A) removed outlier: 4.858A pdb=" N CYSBN 51 " --> pdb=" O ARGBN 57 " (cutoff:3.500A) removed outlier: 6.471A pdb=" N ARGBN 57 " --> pdb=" O CYSBN 51 " (cutoff:3.500A) removed outlier: 4.977A pdb=" N LEUBN 58 " --> pdb=" O SERBN 66 " (cutoff:3.500A) Processing sheet with id=AE1, first strand: chain 'Bd' and resid 118 through 127 removed outlier: 3.631A pdb=" N ASPBd 125 " --> pdb=" O ALABd 83 " (cutoff:3.500A) removed outlier: 6.071A pdb=" N ALABd 83 " --> pdb=" O ASPBd 125 " (cutoff:3.500A) removed outlier: 3.608A pdb=" N ALACC 267 " --> pdb=" O SERBd 84 " (cutoff:3.500A) Processing sheet with id=AE2, first strand: chain 'Bd' and resid 105 through 109 Processing sheet with id=AE3, first strand: chain 'Bf' and resid 210 through 215 removed outlier: 7.167A pdb=" N TRPBf 221 " --> pdb=" O GLNBf 213 " (cutoff:3.500A) Processing sheet with id=AE4, first strand: chain 'Bf' and resid 237 through 238 removed outlier: 3.837A pdb=" N LYSBf 245 " --> pdb=" O LEUBf 255 " (cutoff:3.500A) removed outlier: 7.377A pdb=" N LEUBf 255 " --> pdb=" O LYSBf 245 " (cutoff:3.500A) removed outlier: 5.393A pdb=" N ILEBf 247 " --> pdb=" O ARGBf 253 " (cutoff:3.500A) removed outlier: 7.670A pdb=" N ARGBf 253 " --> pdb=" O ILEBf 247 " (cutoff:3.500A) Processing sheet with id=AE5, first strand: chain 'CC' and resid 105 through 106 removed outlier: 3.940A pdb=" N HISCC 139 " --> pdb=" O LEUCC 106 " (cutoff:3.500A) Processing sheet with id=AE6, first strand: chain 'CC' and resid 225 through 231 removed outlier: 7.129A pdb=" N TYRCC 225 " --> pdb=" O THRCC 250 " (cutoff:3.500A) removed outlier: 3.623A pdb=" N ASPCC 244 " --> pdb=" O LEUCC 231 " (cutoff:3.500A) Processing sheet with id=AE7, first strand: chain 'CC' and resid 225 through 231 removed outlier: 7.129A pdb=" N TYRCC 225 " --> pdb=" O THRCC 250 " (cutoff:3.500A) removed outlier: 3.623A pdb=" N ASPCC 244 " --> pdb=" O LEUCC 231 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N ILEDC 125 " --> pdb=" O LEUDC 119 " (cutoff:3.500A) removed outlier: 7.079A pdb=" N LEUDC 119 " --> pdb=" O ILEDC 125 " (cutoff:3.500A) removed outlier: 6.721A pdb=" N ILEDC 127 " --> pdb=" O LEUDC 117 " (cutoff:3.500A) removed outlier: 6.713A pdb=" N LEUDC 117 " --> pdb=" O ILEDC 127 " (cutoff:3.500A) removed outlier: 6.913A pdb=" N ASPDC 129 " --> pdb=" O ASNDC 115 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N VALDC 109 " --> pdb=" O ALADC 135 " (cutoff:3.500A) removed outlier: 4.753A pdb=" N THRDC 116 " --> pdb=" O SERDH 327 " (cutoff:3.500A) removed outlier: 7.183A pdb=" N SERDH 327 " --> pdb=" O THRDC 116 " (cutoff:3.500A) removed outlier: 6.111A pdb=" N ALADH 302 " --> pdb=" O VALDH 297 " (cutoff:3.500A) removed outlier: 5.377A pdb=" N VALDH 297 " --> pdb=" O ALADH 302 " (cutoff:3.500A) removed outlier: 4.766A pdb=" N ALADH 304 " --> pdb=" O LEUDH 295 " (cutoff:3.500A) removed outlier: 3.520A pdb=" N THRDH 318 " --> pdb=" O SERDH 348 " (cutoff:3.500A) Processing sheet with id=AE8, first strand: chain 'CD' and resid 121 through 122 Processing sheet with id=AE9, first strand: chain 'CD' and resid 121 through 122 removed outlier: 6.476A pdb=" N ILECK 114 " --> pdb=" O PHECK 155 " (cutoff:3.500A) removed outlier: 8.087A pdb=" N GLNCK 157 " --> pdb=" O ILECK 114 " (cutoff:3.500A) removed outlier: 6.208A pdb=" N VALCK 116 " --> pdb=" O GLNCK 157 " (cutoff:3.500A) removed outlier: 7.572A pdb=" N LEUCK 159 " --> pdb=" O VALCK 116 " (cutoff:3.500A) removed outlier: 7.883A pdb=" N SERCK 118 " --> pdb=" O LEUCK 159 " (cutoff:3.500A) removed outlier: 5.986A pdb=" N ALACK 113 " --> pdb=" O ARGCK 185 " (cutoff:3.500A) removed outlier: 4.596A pdb=" N ARGCK 185 " --> pdb=" O ALACK 113 " (cutoff:3.500A) Processing sheet with id=AF1, first strand: chain 'CD' and resid 105 through 109 removed outlier: 6.206A pdb=" N ARGCD 105 " --> pdb=" O VALCD 154 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N LEUCD 156 " --> pdb=" O ARGCD 105 " (cutoff:3.500A) removed outlier: 6.454A pdb=" N ARGCD 107 " --> pdb=" O LEUCD 156 " (cutoff:3.500A) removed outlier: 8.075A pdb=" N TYRCD 158 " --> pdb=" O ARGCD 107 " (cutoff:3.500A) removed outlier: 7.161A pdb=" N LEUCD 109 " --> pdb=" O TYRCD 158 " (cutoff:3.500A) Processing sheet with id=AF2, first strand: chain 'CL' and resid 115 through 119 removed outlier: 3.564A pdb=" N THRCL 122 " --> pdb=" O TYRCL 119 " (cutoff:3.500A) Processing sheet with id=AF3, first strand: chain 'CM' and resid 41 through 43 removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 3.615A pdb=" N SERCM 203 " --> pdb=" O VALCM 183 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILECM 222 " --> pdb=" O LYSCM 242 " (cutoff:3.500A) removed outlier: 7.025A pdb=" N LYSCM 244 " --> pdb=" O ILECM 222 " (cutoff:3.500A) removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) Processing sheet with id=AF4, first strand: chain 'CM' and resid 287 through 292 removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) removed outlier: 6.913A pdb=" N ILECM 227 " --> pdb=" O LEUCM 246 " (cutoff:3.500A) removed outlier: 7.266A pdb=" N ALACM 248 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 7.047A pdb=" N ASNCM 229 " --> pdb=" O ALACM 248 " (cutoff:3.500A) removed outlier: 6.178A pdb=" N ILECM 207 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 8.223A pdb=" N ASNCM 229 " --> pdb=" O ILECM 207 " (cutoff:3.500A) removed outlier: 6.994A pdb=" N LYSCM 208 " --> pdb=" O GLYCM 187 " (cutoff:3.500A) removed outlier: 5.953A pdb=" N VALCM 189 " --> pdb=" O LYSCM 208 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) Processing sheet with id=AF5, first strand: chain 'CM' and resid 41 through 43 removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 7.875A pdb=" N THRCM 211 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N ARGCM 192 " --> pdb=" O THRCM 211 " (cutoff:3.500A) removed outlier: 6.913A pdb=" N ILECM 227 " --> pdb=" O LEUCM 246 " (cutoff:3.500A) removed outlier: 7.266A pdb=" N ALACM 248 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 7.047A pdb=" N ASNCM 229 " --> pdb=" O ALACM 248 " (cutoff:3.500A) removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) Processing sheet with id=AF6, first strand: chain 'CM' and resid 297 through 299 removed outlier: 3.559A pdb=" N TYRCM 281 " --> pdb=" O LEUCM 299 " (cutoff:3.500A) removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILECM 222 " --> pdb=" O LYSCM 242 " (cutoff:3.500A) removed outlier: 7.025A pdb=" N LYSCM 244 " --> pdb=" O ILECM 222 " (cutoff:3.500A) removed outlier: 3.615A pdb=" N SERCM 203 " --> pdb=" O VALCM 183 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) Processing sheet with id=AF7, first strand: chain 'CM' and resid 41 through 43 removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 6.994A pdb=" N LYSCM 208 " --> pdb=" O GLYCM 187 " (cutoff:3.500A) removed outlier: 5.953A pdb=" N VALCM 189 " --> pdb=" O LYSCM 208 " (cutoff:3.500A) removed outlier: 6.178A pdb=" N ILECM 207 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 8.223A pdb=" N ASNCM 229 " --> pdb=" O ILECM 207 " (cutoff:3.500A) removed outlier: 6.913A pdb=" N ILECM 227 " --> pdb=" O LEUCM 246 " (cutoff:3.500A) removed outlier: 7.266A pdb=" N ALACM 248 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 7.047A pdb=" N ASNCM 229 " --> pdb=" O ALACM 248 " (cutoff:3.500A) removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) removed outlier: 3.559A pdb=" N TYRCM 281 " --> pdb=" O LEUCM 299 " (cutoff:3.500A) Processing sheet with id=AF8, first strand: chain 'CM' and resid 297 through 299 removed outlier: 3.559A pdb=" N TYRCM 281 " --> pdb=" O LEUCM 299 " (cutoff:3.500A) removed outlier: 4.034A pdb=" N SERCM 264 " --> pdb=" O GLYCM 243 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N TYRCM 245 " --> pdb=" O SERCM 264 " (cutoff:3.500A) removed outlier: 10.787A pdb=" N VALCM 266 " --> pdb=" O TYRCM 245 " (cutoff:3.500A) removed outlier: 10.236A pdb=" N ARGCM 247 " --> pdb=" O VALCM 266 " (cutoff:3.500A) removed outlier: 9.899A pdb=" N HISCM 268 " --> pdb=" O ARGCM 247 " (cutoff:3.500A) removed outlier: 6.145A pdb=" N GLNCM 249 " --> pdb=" O HISCM 268 " (cutoff:3.500A) removed outlier: 7.806A pdb=" N SERCM 270 " --> pdb=" O GLNCM 249 " (cutoff:3.500A) removed outlier: 6.143A pdb=" N SERCM 251 " --> pdb=" O SERCM 270 " (cutoff:3.500A) removed outlier: 7.989A pdb=" N LEUCM 272 " --> pdb=" O SERCM 251 " (cutoff:3.500A) removed outlier: 6.430A pdb=" N VALCM 253 " --> pdb=" O LEUCM 272 " (cutoff:3.500A) removed outlier: 6.913A pdb=" N ILECM 227 " --> pdb=" O LEUCM 246 " (cutoff:3.500A) removed outlier: 7.266A pdb=" N ALACM 248 " --> pdb=" O ILECM 227 " (cutoff:3.500A) removed outlier: 7.047A pdb=" N ASNCM 229 " --> pdb=" O ALACM 248 " (cutoff:3.500A) removed outlier: 7.875A pdb=" N THRCM 211 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 4.484A pdb=" N ARGCM 192 " --> pdb=" O THRCM 211 " (cutoff:3.500A) removed outlier: 4.351A pdb=" N VALCM 162 " --> pdb=" O LYSCM 182 " (cutoff:3.500A) removed outlier: 7.363A pdb=" N LEUCM 184 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 4.212A pdb=" N GLNCM 164 " --> pdb=" O LEUCM 184 " (cutoff:3.500A) removed outlier: 7.373A pdb=" N SERCM 186 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 5.064A pdb=" N ASNCM 166 " --> pdb=" O SERCM 186 " (cutoff:3.500A) removed outlier: 8.802A pdb=" N PHECM 188 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 5.703A pdb=" N VALCM 168 " --> pdb=" O PHECM 188 " (cutoff:3.500A) removed outlier: 7.132A pdb=" N ASNCM 190 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERCM 170 " --> pdb=" O ASNCM 190 " (cutoff:3.500A) removed outlier: 9.307A pdb=" N ARGCM 192 " --> pdb=" O SERCM 170 " (cutoff:3.500A) removed outlier: 11.094A pdb=" N ASNCM 172 " --> pdb=" O ARGCM 192 " (cutoff:3.500A) removed outlier: 11.993A pdb=" N LEUCM 194 " --> pdb=" O ASNCM 172 " (cutoff:3.500A) removed outlier: 10.304A pdb=" N GLNCM 174 " --> pdb=" O LEUCM 194 " (cutoff:3.500A) removed outlier: 10.871A pdb=" N METCM 196 " --> pdb=" O GLNCM 174 " (cutoff:3.500A) removed outlier: 9.640A pdb=" N VALCM 176 " --> pdb=" O METCM 196 " (cutoff:3.500A) removed outlier: 5.624A pdb=" N GLYCM 142 " --> pdb=" O VALCM 162 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N GLNCM 164 " --> pdb=" O GLYCM 142 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N THRCM 144 " --> pdb=" O GLNCM 164 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N ASNCM 166 " --> pdb=" O THRCM 144 " (cutoff:3.500A) removed outlier: 6.958A pdb=" N LEUCM 146 " --> pdb=" O ASNCM 166 " (cutoff:3.500A) removed outlier: 7.802A pdb=" N VALCM 168 " --> pdb=" O LEUCM 146 " (cutoff:3.500A) removed outlier: 9.930A pdb=" N GLYCM 148 " --> pdb=" O VALCM 168 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N SERCM 170 " --> pdb=" O GLYCM 148 " (cutoff:3.500A) removed outlier: 6.431A pdb=" N ASNCM 149 " --> pdb=" O ASNCM 128 " (cutoff:3.500A) removed outlier: 5.185A pdb=" N ARGCM 130 " --> pdb=" O ASNCM 149 " (cutoff:3.500A) removed outlier: 6.313A pdb=" N VALCM 58 " --> pdb=" O THRCM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNCM 127 " --> pdb=" O VALCM 58 " (cutoff:3.500A) removed outlier: 6.959A pdb=" N LEUCM 60 " --> pdb=" O ASNCM 127 " (cutoff:3.500A) removed outlier: 7.743A pdb=" N LEUCM 129 " --> pdb=" O LEUCM 60 " (cutoff:3.500A) removed outlier: 9.008A pdb=" N THRCM 62 " --> pdb=" O LEUCM 129 " (cutoff:3.500A) removed outlier: 6.581A pdb=" N ASNCM 57 " --> pdb=" O VALCM 106 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ILECM 108 " --> pdb=" O ASNCM 57 " (cutoff:3.500A) removed outlier: 6.595A pdb=" N ASNCM 59 " --> pdb=" O ILECM 108 " (cutoff:3.500A) removed outlier: 8.226A pdb=" N THRCM 110 " --> pdb=" O ASNCM 59 " (cutoff:3.500A) removed outlier: 6.869A pdb=" N HISCM 61 " --> pdb=" O THRCM 110 " (cutoff:3.500A) Processing sheet with id=AF9, first strand: chain 'CM' and resid 287 through 292 removed outlier: 3.559A pdb=" N TYRCM 281 " --> pdb=" O LEUCM 299 " (cutoff:3.500A) Processing sheet with id=AG1, first strand: chain 'CM' and resid 81 through 84 removed outlier: 3.667A pdb=" N SERCM 93 " --> pdb=" O ARGCM 82 " (cutoff:3.500A) removed outlier: 3.655A pdb=" N ILECM 84 " --> pdb=" O TYRCM 91 " (cutoff:3.500A) removed outlier: 4.273A pdb=" N LEUCM 94 " --> pdb=" O GLNCM 53 " (cutoff:3.500A) removed outlier: 3.852A pdb=" N LEUCM 136 " --> pdb=" O LYSCM 154 " (cutoff:3.500A) Processing sheet with id=AG2, first strand: chain 'CN' and resid 48 through 52 removed outlier: 4.885A pdb=" N LEUCN 58 " --> pdb=" O SERCN 66 " (cutoff:3.500A) Processing sheet with id=AG3, first strand: chain 'CN' and resid 101 through 102 removed outlier: 4.557A pdb=" N VALCN 101 " --> pdb=" O SERCN 109 " (cutoff:3.500A) Processing sheet with id=AG4, first strand: chain 'Cd' and resid 118 through 127 removed outlier: 3.637A pdb=" N ASPCd 125 " --> pdb=" O ALACd 83 " (cutoff:3.500A) removed outlier: 6.132A pdb=" N ALACd 83 " --> pdb=" O ASPCd 125 " (cutoff:3.500A) removed outlier: 3.551A pdb=" N ALADC 267 " --> pdb=" O SERCd 84 " (cutoff:3.500A) Processing sheet with id=AG5, first strand: chain 'Cd' and resid 105 through 109 Processing sheet with id=AG6, first strand: chain 'Cf' and resid 210 through 215 removed outlier: 6.873A pdb=" N TRPCf 221 " --> pdb=" O GLNCf 213 " (cutoff:3.500A) Processing sheet with id=AG7, first strand: chain 'Cf' and resid 237 through 238 removed outlier: 3.546A pdb=" N GLYCf 242 " --> pdb=" O ILECf 238 " (cutoff:3.500A) removed outlier: 4.254A pdb=" N LEUCf 246 " --> pdb=" O LEUCf 255 " (cutoff:3.500A) Processing sheet with id=AG8, first strand: chain 'DC' and resid 105 through 106 removed outlier: 3.964A pdb=" N HISDC 139 " --> pdb=" O LEUDC 106 " (cutoff:3.500A) Processing sheet with id=AG9, first strand: chain 'DC' and resid 225 through 230 removed outlier: 6.704A pdb=" N TYRDC 225 " --> pdb=" O THRDC 250 " (cutoff:3.500A) removed outlier: 3.537A pdb=" N GLUDC 239 " --> pdb=" O ASPDC 236 " (cutoff:3.500A) Processing sheet with id=AH1, first strand: chain 'DC' and resid 225 through 230 removed outlier: 6.704A pdb=" N TYRDC 225 " --> pdb=" O THRDC 250 " (cutoff:3.500A) removed outlier: 7.335A pdb=" N ILEEC 125 " --> pdb=" O LEUEC 119 " (cutoff:3.500A) removed outlier: 7.090A pdb=" N LEUEC 119 " --> pdb=" O ILEEC 125 " (cutoff:3.500A) removed outlier: 6.842A pdb=" N ILEEC 127 " --> pdb=" O LEUEC 117 " (cutoff:3.500A) removed outlier: 6.788A pdb=" N LEUEC 117 " --> pdb=" O ILEEC 127 " (cutoff:3.500A) removed outlier: 6.914A pdb=" N ASPEC 129 " --> pdb=" O ASNEC 115 " (cutoff:3.500A) removed outlier: 6.651A pdb=" N VALEC 109 " --> pdb=" O ALAEC 135 " (cutoff:3.500A) removed outlier: 4.850A pdb=" N ASNEC 115 " --> pdb=" O THREH 329 " (cutoff:3.500A) removed outlier: 4.355A pdb=" N THREH 329 " --> pdb=" O ASNEC 115 " (cutoff:3.500A) removed outlier: 6.220A pdb=" N ALAEH 302 " --> pdb=" O VALEH 297 " (cutoff:3.500A) removed outlier: 5.328A pdb=" N VALEH 297 " --> pdb=" O ALAEH 302 " (cutoff:3.500A) removed outlier: 4.705A pdb=" N ALAEH 304 " --> pdb=" O LEUEH 295 " (cutoff:3.500A) removed outlier: 3.907A pdb=" N THREH 318 " --> pdb=" O SEREH 348 " (cutoff:3.500A) Processing sheet with id=AH2, first strand: chain 'DD' and resid 121 through 122 Processing sheet with id=AH3, first strand: chain 'DD' and resid 121 through 122 removed outlier: 6.510A pdb=" N ILEDK 114 " --> pdb=" O PHEDK 155 " (cutoff:3.500A) removed outlier: 8.139A pdb=" N GLNDK 157 " --> pdb=" O ILEDK 114 " (cutoff:3.500A) removed outlier: 6.212A pdb=" N VALDK 116 " --> pdb=" O GLNDK 157 " (cutoff:3.500A) removed outlier: 7.523A pdb=" N LEUDK 159 " --> pdb=" O VALDK 116 " (cutoff:3.500A) removed outlier: 7.839A pdb=" N SERDK 118 " --> pdb=" O LEUDK 159 " (cutoff:3.500A) removed outlier: 5.946A pdb=" N ALADK 113 " --> pdb=" O ARGDK 185 " (cutoff:3.500A) removed outlier: 4.558A pdb=" N ARGDK 185 " --> pdb=" O ALADK 113 " (cutoff:3.500A) Processing sheet with id=AH4, first strand: chain 'DD' and resid 105 through 109 removed outlier: 6.214A pdb=" N ARGDD 105 " --> pdb=" O VALDD 154 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUDD 156 " --> pdb=" O ARGDD 105 " (cutoff:3.500A) removed outlier: 6.465A pdb=" N ARGDD 107 " --> pdb=" O LEUDD 156 " (cutoff:3.500A) removed outlier: 8.038A pdb=" N TYRDD 158 " --> pdb=" O ARGDD 107 " (cutoff:3.500A) removed outlier: 7.108A pdb=" N LEUDD 109 " --> pdb=" O TYRDD 158 " (cutoff:3.500A) Processing sheet with id=AH5, first strand: chain 'DL' and resid 115 through 119 Processing sheet with id=AH6, first strand: chain 'DM' and resid 41 through 43 removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 3.615A pdb=" N SERDM 203 " --> pdb=" O VALDM 183 " (cutoff:3.500A) removed outlier: 6.532A pdb=" N ILEDM 222 " --> pdb=" O LYSDM 242 " (cutoff:3.500A) removed outlier: 6.827A pdb=" N LYSDM 244 " --> pdb=" O ILEDM 222 " (cutoff:3.500A) removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) Processing sheet with id=AH7, first strand: chain 'DM' and resid 287 through 292 removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) removed outlier: 6.864A pdb=" N ILEDM 227 " --> pdb=" O LEUDM 246 " (cutoff:3.500A) removed outlier: 7.281A pdb=" N ALADM 248 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.097A pdb=" N ASNDM 229 " --> pdb=" O ALADM 248 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N ILEDM 207 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.975A pdb=" N ASNDM 229 " --> pdb=" O ILEDM 207 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LYSDM 208 " --> pdb=" O GLYDM 187 " (cutoff:3.500A) removed outlier: 5.951A pdb=" N VALDM 189 " --> pdb=" O LYSDM 208 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) Processing sheet with id=AH8, first strand: chain 'DM' and resid 41 through 43 removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 13.694A pdb=" N THRDM 211 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 9.350A pdb=" N ASNDM 190 " --> pdb=" O THRDM 211 " (cutoff:3.500A) removed outlier: 9.600A pdb=" N THRDM 213 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 6.829A pdb=" N ARGDM 192 " --> pdb=" O THRDM 213 " (cutoff:3.500A) removed outlier: 8.279A pdb=" N ARGDM 215 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 6.479A pdb=" N LEUDM 194 " --> pdb=" O ARGDM 215 " (cutoff:3.500A) removed outlier: 6.864A pdb=" N ILEDM 227 " --> pdb=" O LEUDM 246 " (cutoff:3.500A) removed outlier: 7.281A pdb=" N ALADM 248 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.097A pdb=" N ASNDM 229 " --> pdb=" O ALADM 248 " (cutoff:3.500A) removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) Processing sheet with id=AH9, first strand: chain 'DM' and resid 297 through 299 removed outlier: 3.520A pdb=" N TYRDM 281 " --> pdb=" O LEUDM 299 " (cutoff:3.500A) removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) removed outlier: 6.532A pdb=" N ILEDM 222 " --> pdb=" O LYSDM 242 " (cutoff:3.500A) removed outlier: 6.827A pdb=" N LYSDM 244 " --> pdb=" O ILEDM 222 " (cutoff:3.500A) removed outlier: 3.615A pdb=" N SERDM 203 " --> pdb=" O VALDM 183 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) Processing sheet with id=AI1, first strand: chain 'DM' and resid 41 through 43 removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LYSDM 208 " --> pdb=" O GLYDM 187 " (cutoff:3.500A) removed outlier: 5.951A pdb=" N VALDM 189 " --> pdb=" O LYSDM 208 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N ILEDM 207 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.975A pdb=" N ASNDM 229 " --> pdb=" O ILEDM 207 " (cutoff:3.500A) removed outlier: 6.864A pdb=" N ILEDM 227 " --> pdb=" O LEUDM 246 " (cutoff:3.500A) removed outlier: 7.281A pdb=" N ALADM 248 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.097A pdb=" N ASNDM 229 " --> pdb=" O ALADM 248 " (cutoff:3.500A) removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) removed outlier: 3.520A pdb=" N TYRDM 281 " --> pdb=" O LEUDM 299 " (cutoff:3.500A) Processing sheet with id=AI2, first strand: chain 'DM' and resid 297 through 299 removed outlier: 3.520A pdb=" N TYRDM 281 " --> pdb=" O LEUDM 299 " (cutoff:3.500A) removed outlier: 4.068A pdb=" N SERDM 264 " --> pdb=" O GLYDM 243 " (cutoff:3.500A) removed outlier: 6.746A pdb=" N TYRDM 245 " --> pdb=" O SERDM 264 " (cutoff:3.500A) removed outlier: 10.668A pdb=" N VALDM 266 " --> pdb=" O TYRDM 245 " (cutoff:3.500A) removed outlier: 10.212A pdb=" N ARGDM 247 " --> pdb=" O VALDM 266 " (cutoff:3.500A) removed outlier: 9.981A pdb=" N HISDM 268 " --> pdb=" O ARGDM 247 " (cutoff:3.500A) removed outlier: 6.156A pdb=" N GLNDM 249 " --> pdb=" O HISDM 268 " (cutoff:3.500A) removed outlier: 7.801A pdb=" N SERDM 270 " --> pdb=" O GLNDM 249 " (cutoff:3.500A) removed outlier: 6.121A pdb=" N SERDM 251 " --> pdb=" O SERDM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUDM 272 " --> pdb=" O SERDM 251 " (cutoff:3.500A) removed outlier: 6.469A pdb=" N VALDM 253 " --> pdb=" O LEUDM 272 " (cutoff:3.500A) removed outlier: 6.864A pdb=" N ILEDM 227 " --> pdb=" O LEUDM 246 " (cutoff:3.500A) removed outlier: 7.281A pdb=" N ALADM 248 " --> pdb=" O ILEDM 227 " (cutoff:3.500A) removed outlier: 7.097A pdb=" N ASNDM 229 " --> pdb=" O ALADM 248 " (cutoff:3.500A) removed outlier: 13.694A pdb=" N THRDM 211 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 9.350A pdb=" N ASNDM 190 " --> pdb=" O THRDM 211 " (cutoff:3.500A) removed outlier: 9.600A pdb=" N THRDM 213 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 6.829A pdb=" N ARGDM 192 " --> pdb=" O THRDM 213 " (cutoff:3.500A) removed outlier: 8.279A pdb=" N ARGDM 215 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 6.479A pdb=" N LEUDM 194 " --> pdb=" O ARGDM 215 " (cutoff:3.500A) removed outlier: 4.358A pdb=" N VALDM 162 " --> pdb=" O LYSDM 182 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEUDM 184 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 4.189A pdb=" N GLNDM 164 " --> pdb=" O LEUDM 184 " (cutoff:3.500A) removed outlier: 7.360A pdb=" N SERDM 186 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 5.163A pdb=" N ASNDM 166 " --> pdb=" O SERDM 186 " (cutoff:3.500A) removed outlier: 8.875A pdb=" N PHEDM 188 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 5.760A pdb=" N VALDM 168 " --> pdb=" O PHEDM 188 " (cutoff:3.500A) removed outlier: 7.224A pdb=" N ASNDM 190 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 8.037A pdb=" N SERDM 170 " --> pdb=" O ASNDM 190 " (cutoff:3.500A) removed outlier: 9.259A pdb=" N ARGDM 192 " --> pdb=" O SERDM 170 " (cutoff:3.500A) removed outlier: 11.044A pdb=" N ASNDM 172 " --> pdb=" O ARGDM 192 " (cutoff:3.500A) removed outlier: 11.997A pdb=" N LEUDM 194 " --> pdb=" O ASNDM 172 " (cutoff:3.500A) removed outlier: 10.313A pdb=" N GLNDM 174 " --> pdb=" O LEUDM 194 " (cutoff:3.500A) removed outlier: 11.000A pdb=" N METDM 196 " --> pdb=" O GLNDM 174 " (cutoff:3.500A) removed outlier: 9.768A pdb=" N VALDM 176 " --> pdb=" O METDM 196 " (cutoff:3.500A) removed outlier: 5.476A pdb=" N GLYDM 142 " --> pdb=" O VALDM 162 " (cutoff:3.500A) removed outlier: 7.036A pdb=" N GLNDM 164 " --> pdb=" O GLYDM 142 " (cutoff:3.500A) removed outlier: 6.642A pdb=" N THRDM 144 " --> pdb=" O GLNDM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNDM 166 " --> pdb=" O THRDM 144 " (cutoff:3.500A) removed outlier: 6.786A pdb=" N LEUDM 146 " --> pdb=" O ASNDM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALDM 168 " --> pdb=" O LEUDM 146 " (cutoff:3.500A) removed outlier: 9.885A pdb=" N GLYDM 148 " --> pdb=" O VALDM 168 " (cutoff:3.500A) removed outlier: 9.888A pdb=" N SERDM 170 " --> pdb=" O GLYDM 148 " (cutoff:3.500A) removed outlier: 3.540A pdb=" N ASNDM 128 " --> pdb=" O ALADM 147 " (cutoff:3.500A) removed outlier: 6.384A pdb=" N ASNDM 149 " --> pdb=" O ASNDM 128 " (cutoff:3.500A) removed outlier: 5.141A pdb=" N ARGDM 130 " --> pdb=" O ASNDM 149 " (cutoff:3.500A) removed outlier: 6.334A pdb=" N VALDM 58 " --> pdb=" O THRDM 125 " (cutoff:3.500A) removed outlier: 8.496A pdb=" N ASNDM 127 " --> pdb=" O VALDM 58 " (cutoff:3.500A) removed outlier: 7.010A pdb=" N LEUDM 60 " --> pdb=" O ASNDM 127 " (cutoff:3.500A) removed outlier: 7.810A pdb=" N LEUDM 129 " --> pdb=" O LEUDM 60 " (cutoff:3.500A) removed outlier: 9.054A pdb=" N THRDM 62 " --> pdb=" O LEUDM 129 " (cutoff:3.500A) removed outlier: 6.579A pdb=" N ASNDM 57 " --> pdb=" O VALDM 106 " (cutoff:3.500A) removed outlier: 7.874A pdb=" N ILEDM 108 " --> pdb=" O ASNDM 57 " (cutoff:3.500A) removed outlier: 6.623A pdb=" N ASNDM 59 " --> pdb=" O ILEDM 108 " (cutoff:3.500A) removed outlier: 8.287A pdb=" N THRDM 110 " --> pdb=" O ASNDM 59 " (cutoff:3.500A) removed outlier: 6.900A pdb=" N HISDM 61 " --> pdb=" O THRDM 110 " (cutoff:3.500A) removed outlier: 3.529A pdb=" N VALDM 69 " --> pdb=" O ARGDM 42 " (cutoff:3.500A) Processing sheet with id=AI3, first strand: chain 'DM' and resid 287 through 292 removed outlier: 3.520A pdb=" N TYRDM 281 " --> pdb=" O LEUDM 299 " (cutoff:3.500A) Processing sheet with id=AI4, first strand: chain 'DM' and resid 81 through 86 removed outlier: 3.646A pdb=" N ARGDM 82 " --> pdb=" O SERDM 93 " (cutoff:3.500A) removed outlier: 3.813A pdb=" N SERDM 93 " --> pdb=" O ARGDM 82 " (cutoff:3.500A) removed outlier: 3.573A pdb=" N ILEDM 84 " --> pdb=" O TYRDM 91 " (cutoff:3.500A) removed outlier: 6.382A pdb=" N GLNDM 49 " --> pdb=" O LEUDM 90 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N VALDM 92 " --> pdb=" O GLNDM 49 " (cutoff:3.500A) removed outlier: 6.127A pdb=" N VALDM 51 " --> pdb=" O VALDM 92 " (cutoff:3.500A) removed outlier: 7.807A pdb=" N LEUDM 94 " --> pdb=" O VALDM 51 " (cutoff:3.500A) removed outlier: 8.283A pdb=" N GLNDM 53 " --> pdb=" O LEUDM 94 " (cutoff:3.500A) removed outlier: 3.930A pdb=" N LEUDM 136 " --> pdb=" O LYSDM 154 " (cutoff:3.500A) Processing sheet with id=AI5, first strand: chain 'DN' and resid 48 through 52 removed outlier: 6.717A pdb=" N VALDN 59 " --> pdb=" O ASNDN 49 " (cutoff:3.500A) removed outlier: 4.871A pdb=" N CYSDN 51 " --> pdb=" O ARGDN 57 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N ARGDN 57 " --> pdb=" O CYSDN 51 " (cutoff:3.500A) removed outlier: 5.100A pdb=" N LEUDN 58 " --> pdb=" O SERDN 66 " (cutoff:3.500A) Processing sheet with id=AI6, first strand: chain 'DN' and resid 101 through 102 removed outlier: 4.566A pdb=" N VALDN 101 " --> pdb=" O SERDN 109 " (cutoff:3.500A) Processing sheet with id=AI7, first strand: chain 'Dd' and resid 118 through 127 removed outlier: 3.554A pdb=" N ASPDd 125 " --> pdb=" O ALADd 83 " (cutoff:3.500A) removed outlier: 5.935A pdb=" N ALADd 83 " --> pdb=" O ASPDd 125 " (cutoff:3.500A) removed outlier: 3.544A pdb=" N ALAEC 267 " --> pdb=" O SERDd 84 " (cutoff:3.500A) Processing sheet with id=AI8, first strand: chain 'Dd' and resid 105 through 109 Processing sheet with id=AI9, first strand: chain 'Df' and resid 211 through 216 removed outlier: 7.099A pdb=" N TRPDf 221 " --> pdb=" O GLNDf 213 " (cutoff:3.500A) removed outlier: 5.481A pdb=" N VALDf 215 " --> pdb=" O ARGDf 219 " (cutoff:3.500A) removed outlier: 7.493A pdb=" N ARGDf 219 " --> pdb=" O VALDf 215 " (cutoff:3.500A) Processing sheet with id=AJ1, first strand: chain 'Df' and resid 237 through 238 removed outlier: 4.004A pdb=" N LEUDf 246 " --> pdb=" O LEUDf 255 " (cutoff:3.500A) removed outlier: 3.570A pdb=" N ILEDf 254 " --> pdb=" O ILEDf 262 " (cutoff:3.500A) Processing sheet with id=AJ2, first strand: chain 'EC' and resid 105 through 106 removed outlier: 3.931A pdb=" N HISEC 139 " --> pdb=" O LEUEC 106 " (cutoff:3.500A) Processing sheet with id=AJ3, first strand: chain 'EC' and resid 225 through 230 removed outlier: 6.676A pdb=" N TYREC 225 " --> pdb=" O THREC 250 " (cutoff:3.500A) Processing sheet with id=AJ4, first strand: chain 'EC' and resid 225 through 230 removed outlier: 6.676A pdb=" N TYREC 225 " --> pdb=" O THREC 250 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N ILEFC 125 " --> pdb=" O LEUFC 119 " (cutoff:3.500A) removed outlier: 7.077A pdb=" N LEUFC 119 " --> pdb=" O ILEFC 125 " (cutoff:3.500A) removed outlier: 6.832A pdb=" N ILEFC 127 " --> pdb=" O LEUFC 117 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N LEUFC 117 " --> pdb=" O ILEFC 127 " (cutoff:3.500A) removed outlier: 6.918A pdb=" N ASPFC 129 " --> pdb=" O ASNFC 115 " (cutoff:3.500A) removed outlier: 6.610A pdb=" N VALFC 109 " --> pdb=" O ALAFC 135 " (cutoff:3.500A) removed outlier: 4.802A pdb=" N ASNFC 115 " --> pdb=" O THRFH 329 " (cutoff:3.500A) removed outlier: 4.309A pdb=" N THRFH 329 " --> pdb=" O ASNFC 115 " (cutoff:3.500A) Processing sheet with id=AJ5, first strand: chain 'ED' and resid 121 through 122 Processing sheet with id=AJ6, first strand: chain 'ED' and resid 121 through 122 removed outlier: 6.441A pdb=" N ILEEK 114 " --> pdb=" O PHEEK 155 " (cutoff:3.500A) removed outlier: 8.048A pdb=" N GLNEK 157 " --> pdb=" O ILEEK 114 " (cutoff:3.500A) removed outlier: 6.185A pdb=" N VALEK 116 " --> pdb=" O GLNEK 157 " (cutoff:3.500A) removed outlier: 5.976A pdb=" N ALAEK 113 " --> pdb=" O ARGEK 185 " (cutoff:3.500A) removed outlier: 4.613A pdb=" N ARGEK 185 " --> pdb=" O ALAEK 113 " (cutoff:3.500A) Processing sheet with id=AJ7, first strand: chain 'ED' and resid 105 through 109 removed outlier: 6.194A pdb=" N ARGED 105 " --> pdb=" O VALED 154 " (cutoff:3.500A) removed outlier: 7.747A pdb=" N LEUED 156 " --> pdb=" O ARGED 105 " (cutoff:3.500A) removed outlier: 6.443A pdb=" N ARGED 107 " --> pdb=" O LEUED 156 " (cutoff:3.500A) removed outlier: 8.047A pdb=" N TYRED 158 " --> pdb=" O ARGED 107 " (cutoff:3.500A) removed outlier: 7.153A pdb=" N LEUED 109 " --> pdb=" O TYRED 158 " (cutoff:3.500A) Processing sheet with id=AJ8, first strand: chain 'EL' and resid 115 through 119 Processing sheet with id=AJ9, first strand: chain 'EM' and resid 41 through 43 removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 6.865A pdb=" N ILEEM 222 " --> pdb=" O LYSEM 242 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N LYSEM 244 " --> pdb=" O ILEEM 222 " (cutoff:3.500A) removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) Processing sheet with id=AK1, first strand: chain 'EM' and resid 287 through 292 removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) removed outlier: 6.866A pdb=" N ILEEM 227 " --> pdb=" O LEUEM 246 " (cutoff:3.500A) removed outlier: 7.222A pdb=" N ALAEM 248 " --> pdb=" O ILEEM 227 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N ASNEM 229 " --> pdb=" O ALAEM 248 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ASNEM 229 " --> pdb=" O SEREM 209 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N LYSEM 208 " --> pdb=" O GLYEM 187 " (cutoff:3.500A) removed outlier: 5.752A pdb=" N VALEM 189 " --> pdb=" O LYSEM 208 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) Processing sheet with id=AK2, first strand: chain 'EM' and resid 41 through 43 removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 6.866A pdb=" N ILEEM 227 " --> pdb=" O LEUEM 246 " (cutoff:3.500A) removed outlier: 7.222A pdb=" N ALAEM 248 " --> pdb=" O ILEEM 227 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N ASNEM 229 " --> pdb=" O ALAEM 248 " (cutoff:3.500A) removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) Processing sheet with id=AK3, first strand: chain 'EM' and resid 297 through 299 removed outlier: 6.432A pdb=" N ALAEM 261 " --> pdb=" O TYREM 280 " (cutoff:3.500A) removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) removed outlier: 6.865A pdb=" N ILEEM 222 " --> pdb=" O LYSEM 242 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N LYSEM 244 " --> pdb=" O ILEEM 222 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) Processing sheet with id=AK4, first strand: chain 'EM' and resid 41 through 43 removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 6.938A pdb=" N LYSEM 208 " --> pdb=" O GLYEM 187 " (cutoff:3.500A) removed outlier: 5.752A pdb=" N VALEM 189 " --> pdb=" O LYSEM 208 " (cutoff:3.500A) removed outlier: 3.772A pdb=" N ASNEM 229 " --> pdb=" O SEREM 209 " (cutoff:3.500A) removed outlier: 6.866A pdb=" N ILEEM 227 " --> pdb=" O LEUEM 246 " (cutoff:3.500A) removed outlier: 7.222A pdb=" N ALAEM 248 " --> pdb=" O ILEEM 227 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N ASNEM 229 " --> pdb=" O ALAEM 248 " (cutoff:3.500A) removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) removed outlier: 6.432A pdb=" N ALAEM 261 " --> pdb=" O TYREM 280 " (cutoff:3.500A) Processing sheet with id=AK5, first strand: chain 'EM' and resid 297 through 299 removed outlier: 6.432A pdb=" N ALAEM 261 " --> pdb=" O TYREM 280 " (cutoff:3.500A) removed outlier: 4.075A pdb=" N SEREM 264 " --> pdb=" O GLYEM 243 " (cutoff:3.500A) removed outlier: 6.744A pdb=" N TYREM 245 " --> pdb=" O SEREM 264 " (cutoff:3.500A) removed outlier: 10.683A pdb=" N VALEM 266 " --> pdb=" O TYREM 245 " (cutoff:3.500A) removed outlier: 10.328A pdb=" N ARGEM 247 " --> pdb=" O VALEM 266 " (cutoff:3.500A) removed outlier: 9.984A pdb=" N HISEM 268 " --> pdb=" O ARGEM 247 " (cutoff:3.500A) removed outlier: 6.160A pdb=" N GLNEM 249 " --> pdb=" O HISEM 268 " (cutoff:3.500A) removed outlier: 7.788A pdb=" N SEREM 270 " --> pdb=" O GLNEM 249 " (cutoff:3.500A) removed outlier: 6.123A pdb=" N SEREM 251 " --> pdb=" O SEREM 270 " (cutoff:3.500A) removed outlier: 7.981A pdb=" N LEUEM 272 " --> pdb=" O SEREM 251 " (cutoff:3.500A) removed outlier: 6.499A pdb=" N VALEM 253 " --> pdb=" O LEUEM 272 " (cutoff:3.500A) removed outlier: 6.866A pdb=" N ILEEM 227 " --> pdb=" O LEUEM 246 " (cutoff:3.500A) removed outlier: 7.222A pdb=" N ALAEM 248 " --> pdb=" O ILEEM 227 " (cutoff:3.500A) removed outlier: 7.100A pdb=" N ASNEM 229 " --> pdb=" O ALAEM 248 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N VALEM 162 " --> pdb=" O LYSEM 182 " (cutoff:3.500A) removed outlier: 7.350A pdb=" N LEUEM 184 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 4.219A pdb=" N GLNEM 164 " --> pdb=" O LEUEM 184 " (cutoff:3.500A) removed outlier: 7.380A pdb=" N SEREM 186 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 5.088A pdb=" N ASNEM 166 " --> pdb=" O SEREM 186 " (cutoff:3.500A) removed outlier: 8.820A pdb=" N PHEEM 188 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 5.701A pdb=" N VALEM 168 " --> pdb=" O PHEEM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNEM 190 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 7.918A pdb=" N SEREM 170 " --> pdb=" O ASNEM 190 " (cutoff:3.500A) removed outlier: 9.344A pdb=" N ARGEM 192 " --> pdb=" O SEREM 170 " (cutoff:3.500A) removed outlier: 11.130A pdb=" N ASNEM 172 " --> pdb=" O ARGEM 192 " (cutoff:3.500A) removed outlier: 12.011A pdb=" N LEUEM 194 " --> pdb=" O ASNEM 172 " (cutoff:3.500A) removed outlier: 10.335A pdb=" N GLNEM 174 " --> pdb=" O LEUEM 194 " (cutoff:3.500A) removed outlier: 10.854A pdb=" N METEM 196 " --> pdb=" O GLNEM 174 " (cutoff:3.500A) removed outlier: 9.604A pdb=" N VALEM 176 " --> pdb=" O METEM 196 " (cutoff:3.500A) removed outlier: 5.724A pdb=" N GLYEM 142 " --> pdb=" O VALEM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNEM 164 " --> pdb=" O GLYEM 142 " (cutoff:3.500A) removed outlier: 6.723A pdb=" N THREM 144 " --> pdb=" O GLNEM 164 " (cutoff:3.500A) removed outlier: 7.929A pdb=" N ASNEM 166 " --> pdb=" O THREM 144 " (cutoff:3.500A) removed outlier: 6.816A pdb=" N LEUEM 146 " --> pdb=" O ASNEM 166 " (cutoff:3.500A) removed outlier: 7.615A pdb=" N VALEM 168 " --> pdb=" O LEUEM 146 " (cutoff:3.500A) removed outlier: 9.849A pdb=" N GLYEM 148 " --> pdb=" O VALEM 168 " (cutoff:3.500A) removed outlier: 9.852A pdb=" N SEREM 170 " --> pdb=" O GLYEM 148 " (cutoff:3.500A) removed outlier: 3.564A pdb=" N ASNEM 128 " --> pdb=" O ALAEM 147 " (cutoff:3.500A) removed outlier: 6.418A pdb=" N ASNEM 149 " --> pdb=" O ASNEM 128 " (cutoff:3.500A) removed outlier: 5.132A pdb=" N ARGEM 130 " --> pdb=" O ASNEM 149 " (cutoff:3.500A) removed outlier: 6.348A pdb=" N VALEM 58 " --> pdb=" O THREM 125 " (cutoff:3.500A) removed outlier: 8.506A pdb=" N ASNEM 127 " --> pdb=" O VALEM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEUEM 60 " --> pdb=" O ASNEM 127 " (cutoff:3.500A) removed outlier: 7.894A pdb=" N LEUEM 129 " --> pdb=" O LEUEM 60 " (cutoff:3.500A) removed outlier: 9.143A pdb=" N THREM 62 " --> pdb=" O LEUEM 129 " (cutoff:3.500A) removed outlier: 6.555A pdb=" N ASNEM 57 " --> pdb=" O VALEM 106 " (cutoff:3.500A) removed outlier: 7.863A pdb=" N ILEEM 108 " --> pdb=" O ASNEM 57 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N ASNEM 59 " --> pdb=" O ILEEM 108 " (cutoff:3.500A) removed outlier: 8.176A pdb=" N THREM 110 " --> pdb=" O ASNEM 59 " (cutoff:3.500A) removed outlier: 6.846A pdb=" N HISEM 61 " --> pdb=" O THREM 110 " (cutoff:3.500A) Processing sheet with id=AK6, first strand: chain 'EM' and resid 287 through 292 removed outlier: 6.432A pdb=" N ALAEM 261 " --> pdb=" O TYREM 280 " (cutoff:3.500A) Processing sheet with id=AK7, first strand: chain 'EM' and resid 81 through 86 removed outlier: 3.769A pdb=" N SEREM 93 " --> pdb=" O ARGEM 82 " (cutoff:3.500A) removed outlier: 3.675A pdb=" N ILEEM 84 " --> pdb=" O TYREM 91 " (cutoff:3.500A) removed outlier: 4.315A pdb=" N LEUEM 94 " --> pdb=" O GLNEM 53 " (cutoff:3.500A) removed outlier: 3.893A pdb=" N LEUEM 136 " --> pdb=" O LYSEM 154 " (cutoff:3.500A) Processing sheet with id=AK8, first strand: chain 'EN' and resid 48 through 52 removed outlier: 5.012A pdb=" N LEUEN 58 " --> pdb=" O SEREN 66 " (cutoff:3.500A) Processing sheet with id=AK9, first strand: chain 'EN' and resid 101 through 102 removed outlier: 4.567A pdb=" N VALEN 101 " --> pdb=" O SEREN 109 " (cutoff:3.500A) Processing sheet with id=AL1, first strand: chain 'Ed' and resid 118 through 127 removed outlier: 3.765A pdb=" N ASPEd 125 " --> pdb=" O ALAEd 83 " (cutoff:3.500A) removed outlier: 6.224A pdb=" N ALAEd 83 " --> pdb=" O ASPEd 125 " (cutoff:3.500A) removed outlier: 3.558A pdb=" N ALAFC 267 " --> pdb=" O SEREd 84 " (cutoff:3.500A) Processing sheet with id=AL2, first strand: chain 'Ed' and resid 105 through 109 Processing sheet with id=AL3, first strand: chain 'Ef' and resid 210 through 215 removed outlier: 6.889A pdb=" N TRPEf 221 " --> pdb=" O GLNEf 213 " (cutoff:3.500A) Processing sheet with id=AL4, first strand: chain 'Ef' and resid 237 through 238 removed outlier: 3.836A pdb=" N ILEEf 238 " --> pdb=" O GLYEf 242 " (cutoff:3.500A) removed outlier: 3.737A pdb=" N GLYEf 242 " --> pdb=" O ILEEf 238 " (cutoff:3.500A) removed outlier: 3.710A pdb=" N LYSEf 245 " --> pdb=" O LEUEf 255 " (cutoff:3.500A) removed outlier: 7.079A pdb=" N LEUEf 255 " --> pdb=" O LYSEf 245 " (cutoff:3.500A) removed outlier: 5.315A pdb=" N ILEEf 247 " --> pdb=" O ARGEf 253 " (cutoff:3.500A) removed outlier: 7.635A pdb=" N ARGEf 253 " --> pdb=" O ILEEf 247 " (cutoff:3.500A) Processing sheet with id=AL5, first strand: chain 'FC' and resid 105 through 106 removed outlier: 3.910A pdb=" N HISFC 139 " --> pdb=" O LEUFC 106 " (cutoff:3.500A) Processing sheet with id=AL6, first strand: chain 'FC' and resid 225 through 230 removed outlier: 6.684A pdb=" N TYRFC 225 " --> pdb=" O THRFC 250 " (cutoff:3.500A) removed outlier: 3.511A pdb=" N GLUFC 239 " --> pdb=" O ASPFC 236 " (cutoff:3.500A) Processing sheet with id=AL7, first strand: chain 'FC' and resid 225 through 230 removed outlier: 6.684A pdb=" N TYRFC 225 " --> pdb=" O THRFC 250 " (cutoff:3.500A) removed outlier: 7.348A pdb=" N ILEGC 125 " --> pdb=" O LEUGC 119 " (cutoff:3.500A) removed outlier: 7.079A pdb=" N LEUGC 119 " --> pdb=" O ILEGC 125 " (cutoff:3.500A) removed outlier: 6.828A pdb=" N ILEGC 127 " --> pdb=" O LEUGC 117 " (cutoff:3.500A) removed outlier: 6.776A pdb=" N LEUGC 117 " --> pdb=" O ILEGC 127 " (cutoff:3.500A) removed outlier: 6.898A pdb=" N ASPGC 129 " --> pdb=" O ASNGC 115 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N VALGC 109 " --> pdb=" O ALAGC 135 " (cutoff:3.500A) removed outlier: 4.800A pdb=" N ASNGC 115 " --> pdb=" O THRGH 329 " (cutoff:3.500A) removed outlier: 4.350A pdb=" N THRGH 329 " --> pdb=" O ASNGC 115 " (cutoff:3.500A) removed outlier: 6.126A pdb=" N ALAGH 302 " --> pdb=" O VALGH 297 " (cutoff:3.500A) removed outlier: 5.340A pdb=" N VALGH 297 " --> pdb=" O ALAGH 302 " (cutoff:3.500A) removed outlier: 4.679A pdb=" N ALAGH 304 " --> pdb=" O LEUGH 295 " (cutoff:3.500A) removed outlier: 3.610A pdb=" N THRGH 318 " --> pdb=" O SERGH 348 " (cutoff:3.500A) Processing sheet with id=AL8, first strand: chain 'FD' and resid 121 through 122 Processing sheet with id=AL9, first strand: chain 'FD' and resid 121 through 122 removed outlier: 6.466A pdb=" N ILEFK 114 " --> pdb=" O PHEFK 155 " (cutoff:3.500A) removed outlier: 8.119A pdb=" N GLNFK 157 " --> pdb=" O ILEFK 114 " (cutoff:3.500A) removed outlier: 6.163A pdb=" N VALFK 116 " --> pdb=" O GLNFK 157 " (cutoff:3.500A) removed outlier: 6.000A pdb=" N ALAFK 113 " --> pdb=" O ARGFK 185 " (cutoff:3.500A) removed outlier: 4.584A pdb=" N ARGFK 185 " --> pdb=" O ALAFK 113 " (cutoff:3.500A) Processing sheet with id=AM1, first strand: chain 'FD' and resid 105 through 109 removed outlier: 6.206A pdb=" N ARGFD 105 " --> pdb=" O VALFD 154 " (cutoff:3.500A) removed outlier: 7.738A pdb=" N LEUFD 156 " --> pdb=" O ARGFD 105 " (cutoff:3.500A) removed outlier: 6.437A pdb=" N ARGFD 107 " --> pdb=" O LEUFD 156 " (cutoff:3.500A) removed outlier: 8.054A pdb=" N TYRFD 158 " --> pdb=" O ARGFD 107 " (cutoff:3.500A) removed outlier: 7.158A pdb=" N LEUFD 109 " --> pdb=" O TYRFD 158 " (cutoff:3.500A) Processing sheet with id=AM2, first strand: chain 'FH' and resid 296 through 298 removed outlier: 3.613A pdb=" N THRFH 318 " --> pdb=" O SERFH 348 " (cutoff:3.500A) Processing sheet with id=AM3, first strand: chain 'FL' and resid 115 through 119 removed outlier: 3.546A pdb=" N THRFL 122 " --> pdb=" O TYRFL 119 " (cutoff:3.500A) Processing sheet with id=AM4, first strand: chain 'FM' and resid 41 through 43 removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 6.674A pdb=" N ILEFM 222 " --> pdb=" O LYSFM 242 " (cutoff:3.500A) removed outlier: 7.099A pdb=" N LYSFM 244 " --> pdb=" O ILEFM 222 " (cutoff:3.500A) removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) Processing sheet with id=AM5, first strand: chain 'FM' and resid 287 through 292 removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) removed outlier: 6.807A pdb=" N ILEFM 227 " --> pdb=" O LEUFM 246 " (cutoff:3.500A) removed outlier: 7.191A pdb=" N ALAFM 248 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 7.043A pdb=" N ASNFM 229 " --> pdb=" O ALAFM 248 " (cutoff:3.500A) removed outlier: 6.187A pdb=" N ILEFM 207 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 8.040A pdb=" N ASNFM 229 " --> pdb=" O ILEFM 207 " (cutoff:3.500A) removed outlier: 6.996A pdb=" N LYSFM 208 " --> pdb=" O GLYFM 187 " (cutoff:3.500A) removed outlier: 5.985A pdb=" N VALFM 189 " --> pdb=" O LYSFM 208 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) Processing sheet with id=AM6, first strand: chain 'FM' and resid 41 through 43 removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 6.807A pdb=" N ILEFM 227 " --> pdb=" O LEUFM 246 " (cutoff:3.500A) removed outlier: 7.191A pdb=" N ALAFM 248 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 7.043A pdb=" N ASNFM 229 " --> pdb=" O ALAFM 248 " (cutoff:3.500A) removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) Processing sheet with id=AM7, first strand: chain 'FM' and resid 297 through 299 removed outlier: 6.406A pdb=" N ALAFM 261 " --> pdb=" O TYRFM 280 " (cutoff:3.500A) removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) removed outlier: 6.674A pdb=" N ILEFM 222 " --> pdb=" O LYSFM 242 " (cutoff:3.500A) removed outlier: 7.099A pdb=" N LYSFM 244 " --> pdb=" O ILEFM 222 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) Processing sheet with id=AM8, first strand: chain 'FM' and resid 41 through 43 removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 6.996A pdb=" N LYSFM 208 " --> pdb=" O GLYFM 187 " (cutoff:3.500A) removed outlier: 5.985A pdb=" N VALFM 189 " --> pdb=" O LYSFM 208 " (cutoff:3.500A) removed outlier: 6.187A pdb=" N ILEFM 207 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 8.040A pdb=" N ASNFM 229 " --> pdb=" O ILEFM 207 " (cutoff:3.500A) removed outlier: 6.807A pdb=" N ILEFM 227 " --> pdb=" O LEUFM 246 " (cutoff:3.500A) removed outlier: 7.191A pdb=" N ALAFM 248 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 7.043A pdb=" N ASNFM 229 " --> pdb=" O ALAFM 248 " (cutoff:3.500A) removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) removed outlier: 6.406A pdb=" N ALAFM 261 " --> pdb=" O TYRFM 280 " (cutoff:3.500A) Processing sheet with id=AM9, first strand: chain 'FM' and resid 297 through 299 removed outlier: 6.406A pdb=" N ALAFM 261 " --> pdb=" O TYRFM 280 " (cutoff:3.500A) removed outlier: 4.047A pdb=" N SERFM 264 " --> pdb=" O GLYFM 243 " (cutoff:3.500A) removed outlier: 6.749A pdb=" N TYRFM 245 " --> pdb=" O SERFM 264 " (cutoff:3.500A) removed outlier: 10.850A pdb=" N VALFM 266 " --> pdb=" O TYRFM 245 " (cutoff:3.500A) removed outlier: 10.189A pdb=" N ARGFM 247 " --> pdb=" O VALFM 266 " (cutoff:3.500A) removed outlier: 9.943A pdb=" N HISFM 268 " --> pdb=" O ARGFM 247 " (cutoff:3.500A) removed outlier: 6.153A pdb=" N GLNFM 249 " --> pdb=" O HISFM 268 " (cutoff:3.500A) removed outlier: 7.757A pdb=" N SERFM 270 " --> pdb=" O GLNFM 249 " (cutoff:3.500A) removed outlier: 6.129A pdb=" N SERFM 251 " --> pdb=" O SERFM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUFM 272 " --> pdb=" O SERFM 251 " (cutoff:3.500A) removed outlier: 6.522A pdb=" N VALFM 253 " --> pdb=" O LEUFM 272 " (cutoff:3.500A) removed outlier: 6.807A pdb=" N ILEFM 227 " --> pdb=" O LEUFM 246 " (cutoff:3.500A) removed outlier: 7.191A pdb=" N ALAFM 248 " --> pdb=" O ILEFM 227 " (cutoff:3.500A) removed outlier: 7.043A pdb=" N ASNFM 229 " --> pdb=" O ALAFM 248 " (cutoff:3.500A) removed outlier: 4.343A pdb=" N VALFM 162 " --> pdb=" O LYSFM 182 " (cutoff:3.500A) removed outlier: 7.422A pdb=" N LEUFM 184 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 4.344A pdb=" N GLNFM 164 " --> pdb=" O LEUFM 184 " (cutoff:3.500A) removed outlier: 7.393A pdb=" N SERFM 186 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 5.267A pdb=" N ASNFM 166 " --> pdb=" O SERFM 186 " (cutoff:3.500A) removed outlier: 8.836A pdb=" N PHEFM 188 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 5.751A pdb=" N VALFM 168 " --> pdb=" O PHEFM 188 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N ASNFM 190 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 7.910A pdb=" N SERFM 170 " --> pdb=" O ASNFM 190 " (cutoff:3.500A) removed outlier: 9.209A pdb=" N ARGFM 192 " --> pdb=" O SERFM 170 " (cutoff:3.500A) removed outlier: 11.041A pdb=" N ASNFM 172 " --> pdb=" O ARGFM 192 " (cutoff:3.500A) removed outlier: 12.001A pdb=" N LEUFM 194 " --> pdb=" O ASNFM 172 " (cutoff:3.500A) removed outlier: 10.349A pdb=" N GLNFM 174 " --> pdb=" O LEUFM 194 " (cutoff:3.500A) removed outlier: 10.935A pdb=" N METFM 196 " --> pdb=" O GLNFM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALFM 176 " --> pdb=" O METFM 196 " (cutoff:3.500A) removed outlier: 5.475A pdb=" N GLYFM 142 " --> pdb=" O VALFM 162 " (cutoff:3.500A) removed outlier: 6.983A pdb=" N GLNFM 164 " --> pdb=" O GLYFM 142 " (cutoff:3.500A) removed outlier: 6.669A pdb=" N THRFM 144 " --> pdb=" O GLNFM 164 " (cutoff:3.500A) removed outlier: 7.937A pdb=" N ASNFM 166 " --> pdb=" O THRFM 144 " (cutoff:3.500A) removed outlier: 6.892A pdb=" N LEUFM 146 " --> pdb=" O ASNFM 166 " (cutoff:3.500A) removed outlier: 7.678A pdb=" N VALFM 168 " --> pdb=" O LEUFM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYFM 148 " --> pdb=" O VALFM 168 " (cutoff:3.500A) removed outlier: 9.949A pdb=" N SERFM 170 " --> pdb=" O GLYFM 148 " (cutoff:3.500A) removed outlier: 3.513A pdb=" N ASNFM 128 " --> pdb=" O ALAFM 147 " (cutoff:3.500A) removed outlier: 6.481A pdb=" N ASNFM 149 " --> pdb=" O ASNFM 128 " (cutoff:3.500A) removed outlier: 5.204A pdb=" N ARGFM 130 " --> pdb=" O ASNFM 149 " (cutoff:3.500A) removed outlier: 4.370A pdb=" N ASNFM 127 " --> pdb=" O LEUFM 60 " (cutoff:3.500A) removed outlier: 5.157A pdb=" N THRFM 62 " --> pdb=" O ASNFM 127 " (cutoff:3.500A) removed outlier: 7.589A pdb=" N LEUFM 129 " --> pdb=" O THRFM 62 " (cutoff:3.500A) removed outlier: 6.516A pdb=" N ASNFM 57 " --> pdb=" O VALFM 106 " (cutoff:3.500A) removed outlier: 7.855A pdb=" N ILEFM 108 " --> pdb=" O ASNFM 57 " (cutoff:3.500A) removed outlier: 6.654A pdb=" N ASNFM 59 " --> pdb=" O ILEFM 108 " (cutoff:3.500A) removed outlier: 8.282A pdb=" N THRFM 110 " --> pdb=" O ASNFM 59 " (cutoff:3.500A) removed outlier: 6.836A pdb=" N HISFM 61 " --> pdb=" O THRFM 110 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N VALFM 69 " --> pdb=" O ARGFM 42 " (cutoff:3.500A) Processing sheet with id=AN1, first strand: chain 'FM' and resid 287 through 292 removed outlier: 6.406A pdb=" N ALAFM 261 " --> pdb=" O TYRFM 280 " (cutoff:3.500A) Processing sheet with id=AN2, first strand: chain 'FM' and resid 81 through 84 removed outlier: 3.636A pdb=" N ARGFM 82 " --> pdb=" O SERFM 93 " (cutoff:3.500A) removed outlier: 3.959A pdb=" N SERFM 93 " --> pdb=" O ARGFM 82 " (cutoff:3.500A) removed outlier: 4.172A pdb=" N ILEFM 84 " --> pdb=" O TYRFM 91 " (cutoff:3.500A) removed outlier: 4.390A pdb=" N LEUFM 94 " --> pdb=" O GLNFM 53 " (cutoff:3.500A) Processing sheet with id=AN3, first strand: chain 'FN' and resid 48 through 52 removed outlier: 6.724A pdb=" N VALFN 59 " --> pdb=" O ASNFN 49 " (cutoff:3.500A) removed outlier: 4.881A pdb=" N CYSFN 51 " --> pdb=" O ARGFN 57 " (cutoff:3.500A) removed outlier: 6.483A pdb=" N ARGFN 57 " --> pdb=" O CYSFN 51 " (cutoff:3.500A) removed outlier: 4.925A pdb=" N LEUFN 58 " --> pdb=" O SERFN 66 " (cutoff:3.500A) Processing sheet with id=AN4, first strand: chain 'FN' and resid 101 through 102 removed outlier: 4.501A pdb=" N VALFN 101 " --> pdb=" O SERFN 109 " (cutoff:3.500A) Processing sheet with id=AN5, first strand: chain 'Fd' and resid 118 through 127 removed outlier: 3.578A pdb=" N ASPFd 125 " --> pdb=" O ALAFd 83 " (cutoff:3.500A) removed outlier: 6.069A pdb=" N ALAFd 83 " --> pdb=" O ASPFd 125 " (cutoff:3.500A) removed outlier: 3.593A pdb=" N ALAGC 267 " --> pdb=" O SERFd 84 " (cutoff:3.500A) Processing sheet with id=AN6, first strand: chain 'Fd' and resid 105 through 109 Processing sheet with id=AN7, first strand: chain 'Ff' and resid 210 through 216 removed outlier: 7.136A pdb=" N TRPFf 221 " --> pdb=" O GLNFf 213 " (cutoff:3.500A) removed outlier: 5.456A pdb=" N VALFf 215 " --> pdb=" O ARGFf 219 " (cutoff:3.500A) removed outlier: 7.505A pdb=" N ARGFf 219 " --> pdb=" O VALFf 215 " (cutoff:3.500A) Processing sheet with id=AN8, first strand: chain 'Ff' and resid 237 through 238 removed outlier: 3.514A pdb=" N ILEFf 238 " --> pdb=" O GLYFf 242 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N GLYFf 242 " --> pdb=" O ILEFf 238 " (cutoff:3.500A) removed outlier: 3.539A pdb=" N LYSFf 245 " --> pdb=" O LEUFf 255 " (cutoff:3.500A) removed outlier: 6.985A pdb=" N LEUFf 255 " --> pdb=" O LYSFf 245 " (cutoff:3.500A) removed outlier: 5.252A pdb=" N ILEFf 247 " --> pdb=" O ARGFf 253 " (cutoff:3.500A) removed outlier: 7.586A pdb=" N ARGFf 253 " --> pdb=" O ILEFf 247 " (cutoff:3.500A) Processing sheet with id=AN9, first strand: chain 'GC' and resid 105 through 106 removed outlier: 3.962A pdb=" N HISGC 139 " --> pdb=" O LEUGC 106 " (cutoff:3.500A) Processing sheet with id=AO1, first strand: chain 'GC' and resid 225 through 231 removed outlier: 6.692A pdb=" N TYRGC 225 " --> pdb=" O THRGC 250 " (cutoff:3.500A) removed outlier: 3.529A pdb=" N ASPGC 244 " --> pdb=" O LEUGC 231 " (cutoff:3.500A) removed outlier: 3.510A pdb=" N GLUGC 239 " --> pdb=" O ASPGC 236 " (cutoff:3.500A) Processing sheet with id=AO2, first strand: chain 'GC' and resid 225 through 231 removed outlier: 6.692A pdb=" N TYRGC 225 " --> pdb=" O THRGC 250 " (cutoff:3.500A) removed outlier: 3.529A pdb=" N ASPGC 244 " --> pdb=" O LEUGC 231 " (cutoff:3.500A) removed outlier: 7.349A pdb=" N ILEHC 125 " --> pdb=" O LEUHC 119 " (cutoff:3.500A) removed outlier: 7.085A pdb=" N LEUHC 119 " --> pdb=" O ILEHC 125 " (cutoff:3.500A) removed outlier: 6.838A pdb=" N ILEHC 127 " --> pdb=" O LEUHC 117 " (cutoff:3.500A) removed outlier: 6.787A pdb=" N LEUHC 117 " --> pdb=" O ILEHC 127 " (cutoff:3.500A) removed outlier: 6.936A pdb=" N ASPHC 129 " --> pdb=" O ASNHC 115 " (cutoff:3.500A) removed outlier: 6.652A pdb=" N VALHC 109 " --> pdb=" O ALAHC 135 " (cutoff:3.500A) removed outlier: 4.417A pdb=" N THRHC 116 " --> pdb=" O SERHH 327 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N SERHH 327 " --> pdb=" O THRHC 116 " (cutoff:3.500A) removed outlier: 6.141A pdb=" N ALAHH 302 " --> pdb=" O VALHH 297 " (cutoff:3.500A) removed outlier: 5.389A pdb=" N VALHH 297 " --> pdb=" O ALAHH 302 " (cutoff:3.500A) removed outlier: 4.649A pdb=" N ALAHH 304 " --> pdb=" O LEUHH 295 " (cutoff:3.500A) removed outlier: 3.805A pdb=" N THRHH 318 " --> pdb=" O SERHH 348 " (cutoff:3.500A) Processing sheet with id=AO3, first strand: chain 'GD' and resid 121 through 122 Processing sheet with id=AO4, first strand: chain 'GD' and resid 121 through 122 removed outlier: 6.494A pdb=" N ILEGK 114 " --> pdb=" O PHEGK 155 " (cutoff:3.500A) removed outlier: 8.112A pdb=" N GLNGK 157 " --> pdb=" O ILEGK 114 " (cutoff:3.500A) removed outlier: 6.220A pdb=" N VALGK 116 " --> pdb=" O GLNGK 157 " (cutoff:3.500A) removed outlier: 7.576A pdb=" N LEUGK 159 " --> pdb=" O VALGK 116 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N SERGK 118 " --> pdb=" O LEUGK 159 " (cutoff:3.500A) removed outlier: 5.979A pdb=" N ALAGK 113 " --> pdb=" O ARGGK 185 " (cutoff:3.500A) removed outlier: 4.569A pdb=" N ARGGK 185 " --> pdb=" O ALAGK 113 " (cutoff:3.500A) Processing sheet with id=AO5, first strand: chain 'GD' and resid 105 through 109 removed outlier: 5.970A pdb=" N ARGGD 105 " --> pdb=" O VALGD 154 " (cutoff:3.500A) removed outlier: 7.533A pdb=" N LEUGD 156 " --> pdb=" O ARGGD 105 " (cutoff:3.500A) removed outlier: 6.406A pdb=" N ARGGD 107 " --> pdb=" O LEUGD 156 " (cutoff:3.500A) removed outlier: 8.040A pdb=" N TYRGD 158 " --> pdb=" O ARGGD 107 " (cutoff:3.500A) removed outlier: 7.190A pdb=" N LEUGD 109 " --> pdb=" O TYRGD 158 " (cutoff:3.500A) Processing sheet with id=AO6, first strand: chain 'GL' and resid 115 through 119 removed outlier: 3.637A pdb=" N THRGL 122 " --> pdb=" O TYRGL 119 " (cutoff:3.500A) Processing sheet with id=AO7, first strand: chain 'GM' and resid 41 through 43 removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 6.608A pdb=" N ILEGM 222 " --> pdb=" O LYSGM 242 " (cutoff:3.500A) removed outlier: 6.979A pdb=" N LYSGM 244 " --> pdb=" O ILEGM 222 " (cutoff:3.500A) removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) Processing sheet with id=AO8, first strand: chain 'GM' and resid 287 through 292 removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N ILEGM 227 " --> pdb=" O LEUGM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAGM 248 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 7.070A pdb=" N ASNGM 229 " --> pdb=" O ALAGM 248 " (cutoff:3.500A) removed outlier: 6.113A pdb=" N ILEGM 207 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 8.015A pdb=" N ASNGM 229 " --> pdb=" O ILEGM 207 " (cutoff:3.500A) removed outlier: 6.899A pdb=" N LYSGM 208 " --> pdb=" O GLYGM 187 " (cutoff:3.500A) removed outlier: 5.814A pdb=" N VALGM 189 " --> pdb=" O LYSGM 208 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) Processing sheet with id=AO9, first strand: chain 'GM' and resid 41 through 43 removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N ILEGM 227 " --> pdb=" O LEUGM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAGM 248 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 7.070A pdb=" N ASNGM 229 " --> pdb=" O ALAGM 248 " (cutoff:3.500A) removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) Processing sheet with id=AP1, first strand: chain 'GM' and resid 297 through 299 removed outlier: 3.504A pdb=" N TYRGM 281 " --> pdb=" O LEUGM 299 " (cutoff:3.500A) removed outlier: 6.399A pdb=" N ALAGM 261 " --> pdb=" O TYRGM 280 " (cutoff:3.500A) removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) removed outlier: 6.608A pdb=" N ILEGM 222 " --> pdb=" O LYSGM 242 " (cutoff:3.500A) removed outlier: 6.979A pdb=" N LYSGM 244 " --> pdb=" O ILEGM 222 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) Processing sheet with id=AP2, first strand: chain 'GM' and resid 41 through 43 removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 6.899A pdb=" N LYSGM 208 " --> pdb=" O GLYGM 187 " (cutoff:3.500A) removed outlier: 5.814A pdb=" N VALGM 189 " --> pdb=" O LYSGM 208 " (cutoff:3.500A) removed outlier: 6.113A pdb=" N ILEGM 207 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 8.015A pdb=" N ASNGM 229 " --> pdb=" O ILEGM 207 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N ILEGM 227 " --> pdb=" O LEUGM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAGM 248 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 7.070A pdb=" N ASNGM 229 " --> pdb=" O ALAGM 248 " (cutoff:3.500A) removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) removed outlier: 6.399A pdb=" N ALAGM 261 " --> pdb=" O TYRGM 280 " (cutoff:3.500A) removed outlier: 3.504A pdb=" N TYRGM 281 " --> pdb=" O LEUGM 299 " (cutoff:3.500A) Processing sheet with id=AP3, first strand: chain 'GM' and resid 297 through 299 removed outlier: 3.504A pdb=" N TYRGM 281 " --> pdb=" O LEUGM 299 " (cutoff:3.500A) removed outlier: 6.399A pdb=" N ALAGM 261 " --> pdb=" O TYRGM 280 " (cutoff:3.500A) removed outlier: 4.169A pdb=" N SERGM 264 " --> pdb=" O GLYGM 243 " (cutoff:3.500A) removed outlier: 6.775A pdb=" N TYRGM 245 " --> pdb=" O SERGM 264 " (cutoff:3.500A) removed outlier: 10.725A pdb=" N VALGM 266 " --> pdb=" O TYRGM 245 " (cutoff:3.500A) removed outlier: 10.257A pdb=" N ARGGM 247 " --> pdb=" O VALGM 266 " (cutoff:3.500A) removed outlier: 9.966A pdb=" N HISGM 268 " --> pdb=" O ARGGM 247 " (cutoff:3.500A) removed outlier: 6.157A pdb=" N GLNGM 249 " --> pdb=" O HISGM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERGM 270 " --> pdb=" O GLNGM 249 " (cutoff:3.500A) removed outlier: 6.164A pdb=" N SERGM 251 " --> pdb=" O SERGM 270 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N LEUGM 272 " --> pdb=" O SERGM 251 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N VALGM 253 " --> pdb=" O LEUGM 272 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N ILEGM 227 " --> pdb=" O LEUGM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAGM 248 " --> pdb=" O ILEGM 227 " (cutoff:3.500A) removed outlier: 7.070A pdb=" N ASNGM 229 " --> pdb=" O ALAGM 248 " (cutoff:3.500A) removed outlier: 4.423A pdb=" N VALGM 162 " --> pdb=" O LYSGM 182 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUGM 184 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 4.277A pdb=" N GLNGM 164 " --> pdb=" O LEUGM 184 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N SERGM 186 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 5.164A pdb=" N ASNGM 166 " --> pdb=" O SERGM 186 " (cutoff:3.500A) removed outlier: 8.895A pdb=" N PHEGM 188 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 5.765A pdb=" N VALGM 168 " --> pdb=" O PHEGM 188 " (cutoff:3.500A) removed outlier: 7.204A pdb=" N ASNGM 190 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 7.811A pdb=" N SERGM 170 " --> pdb=" O ASNGM 190 " (cutoff:3.500A) removed outlier: 9.136A pdb=" N ARGGM 192 " --> pdb=" O SERGM 170 " (cutoff:3.500A) removed outlier: 10.739A pdb=" N ASNGM 172 " --> pdb=" O ARGGM 192 " (cutoff:3.500A) removed outlier: 11.924A pdb=" N LEUGM 194 " --> pdb=" O ASNGM 172 " (cutoff:3.500A) removed outlier: 10.277A pdb=" N GLNGM 174 " --> pdb=" O LEUGM 194 " (cutoff:3.500A) removed outlier: 10.931A pdb=" N METGM 196 " --> pdb=" O GLNGM 174 " (cutoff:3.500A) removed outlier: 9.694A pdb=" N VALGM 176 " --> pdb=" O METGM 196 " (cutoff:3.500A) removed outlier: 5.539A pdb=" N GLYGM 142 " --> pdb=" O VALGM 162 " (cutoff:3.500A) removed outlier: 7.046A pdb=" N GLNGM 164 " --> pdb=" O GLYGM 142 " (cutoff:3.500A) removed outlier: 6.570A pdb=" N THRGM 144 " --> pdb=" O GLNGM 164 " (cutoff:3.500A) removed outlier: 7.873A pdb=" N ASNGM 166 " --> pdb=" O THRGM 144 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N LEUGM 146 " --> pdb=" O ASNGM 166 " (cutoff:3.500A) removed outlier: 7.716A pdb=" N VALGM 168 " --> pdb=" O LEUGM 146 " (cutoff:3.500A) removed outlier: 9.901A pdb=" N GLYGM 148 " --> pdb=" O VALGM 168 " (cutoff:3.500A) removed outlier: 9.947A pdb=" N SERGM 170 " --> pdb=" O GLYGM 148 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNGM 128 " --> pdb=" O ALAGM 147 " (cutoff:3.500A) removed outlier: 6.446A pdb=" N ASNGM 149 " --> pdb=" O ASNGM 128 " (cutoff:3.500A) removed outlier: 5.148A pdb=" N ARGGM 130 " --> pdb=" O ASNGM 149 " (cutoff:3.500A) removed outlier: 6.339A pdb=" N VALGM 58 " --> pdb=" O THRGM 125 " (cutoff:3.500A) removed outlier: 8.508A pdb=" N ASNGM 127 " --> pdb=" O VALGM 58 " (cutoff:3.500A) removed outlier: 7.007A pdb=" N LEUGM 60 " --> pdb=" O ASNGM 127 " (cutoff:3.500A) removed outlier: 7.637A pdb=" N LEUGM 129 " --> pdb=" O LEUGM 60 " (cutoff:3.500A) removed outlier: 9.045A pdb=" N THRGM 62 " --> pdb=" O LEUGM 129 " (cutoff:3.500A) removed outlier: 6.490A pdb=" N ASNGM 57 " --> pdb=" O VALGM 106 " (cutoff:3.500A) removed outlier: 7.854A pdb=" N ILEGM 108 " --> pdb=" O ASNGM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNGM 59 " --> pdb=" O ILEGM 108 " (cutoff:3.500A) removed outlier: 8.265A pdb=" N THRGM 110 " --> pdb=" O ASNGM 59 " (cutoff:3.500A) removed outlier: 6.907A pdb=" N HISGM 61 " --> pdb=" O THRGM 110 " (cutoff:3.500A) removed outlier: 3.826A pdb=" N VALGM 69 " --> pdb=" O ARGGM 42 " (cutoff:3.500A) removed outlier: 3.751A pdb=" N ARGGM 42 " --> pdb=" O VALGM 69 " (cutoff:3.500A) Processing sheet with id=AP4, first strand: chain 'GM' and resid 287 through 292 removed outlier: 6.399A pdb=" N ALAGM 261 " --> pdb=" O TYRGM 280 " (cutoff:3.500A) removed outlier: 3.504A pdb=" N TYRGM 281 " --> pdb=" O LEUGM 299 " (cutoff:3.500A) Processing sheet with id=AP5, first strand: chain 'GM' and resid 81 through 84 removed outlier: 3.574A pdb=" N ARGGM 82 " --> pdb=" O SERGM 93 " (cutoff:3.500A) removed outlier: 3.775A pdb=" N SERGM 93 " --> pdb=" O ARGGM 82 " (cutoff:3.500A) removed outlier: 3.565A pdb=" N ILEGM 84 " --> pdb=" O TYRGM 91 " (cutoff:3.500A) removed outlier: 4.334A pdb=" N LEUGM 94 " --> pdb=" O GLNGM 53 " (cutoff:3.500A) removed outlier: 3.798A pdb=" N LEUGM 136 " --> pdb=" O LYSGM 154 " (cutoff:3.500A) Processing sheet with id=AP6, first strand: chain 'GN' and resid 48 through 52 removed outlier: 6.700A pdb=" N VALGN 59 " --> pdb=" O ASNGN 49 " (cutoff:3.500A) removed outlier: 4.877A pdb=" N CYSGN 51 " --> pdb=" O ARGGN 57 " (cutoff:3.500A) removed outlier: 6.513A pdb=" N ARGGN 57 " --> pdb=" O CYSGN 51 " (cutoff:3.500A) removed outlier: 5.095A pdb=" N LEUGN 58 " --> pdb=" O SERGN 66 " (cutoff:3.500A) Processing sheet with id=AP7, first strand: chain 'GN' and resid 101 through 102 removed outlier: 4.593A pdb=" N VALGN 101 " --> pdb=" O SERGN 109 " (cutoff:3.500A) Processing sheet with id=AP8, first strand: chain 'Gd' and resid 118 through 127 removed outlier: 3.735A pdb=" N ASPGd 125 " --> pdb=" O ALAGd 83 " (cutoff:3.500A) removed outlier: 6.287A pdb=" N ALAGd 83 " --> pdb=" O ASPGd 125 " (cutoff:3.500A) removed outlier: 3.631A pdb=" N ALAHC 267 " --> pdb=" O SERGd 84 " (cutoff:3.500A) Processing sheet with id=AP9, first strand: chain 'Gd' and resid 105 through 109 Processing sheet with id=AQ1, first strand: chain 'Gf' and resid 211 through 215 removed outlier: 7.269A pdb=" N TRPGf 221 " --> pdb=" O GLNGf 213 " (cutoff:3.500A) Processing sheet with id=AQ2, first strand: chain 'Gf' and resid 237 through 238 removed outlier: 3.587A pdb=" N GLYGf 242 " --> pdb=" O ILEGf 238 " (cutoff:3.500A) removed outlier: 3.577A pdb=" N LYSGf 245 " --> pdb=" O LEUGf 255 " (cutoff:3.500A) removed outlier: 7.364A pdb=" N LEUGf 255 " --> pdb=" O LYSGf 245 " (cutoff:3.500A) removed outlier: 5.381A pdb=" N ILEGf 247 " --> pdb=" O ARGGf 253 " (cutoff:3.500A) removed outlier: 7.665A pdb=" N ARGGf 253 " --> pdb=" O ILEGf 247 " (cutoff:3.500A) Processing sheet with id=AQ3, first strand: chain 'HC' and resid 105 through 106 removed outlier: 3.924A pdb=" N HISHC 139 " --> pdb=" O LEUHC 106 " (cutoff:3.500A) Processing sheet with id=AQ4, first strand: chain 'HC' and resid 225 through 231 removed outlier: 6.652A pdb=" N TYRHC 225 " --> pdb=" O THRHC 250 " (cutoff:3.500A) removed outlier: 3.644A pdb=" N ASPHC 244 " --> pdb=" O LEUHC 231 " (cutoff:3.500A) removed outlier: 3.522A pdb=" N GLUHC 239 " --> pdb=" O ASPHC 236 " (cutoff:3.500A) Processing sheet with id=AQ5, first strand: chain 'HC' and resid 225 through 231 removed outlier: 6.652A pdb=" N TYRHC 225 " --> pdb=" O THRHC 250 " (cutoff:3.500A) removed outlier: 3.644A pdb=" N ASPHC 244 " --> pdb=" O LEUHC 231 " (cutoff:3.500A) removed outlier: 7.358A pdb=" N ILEIC 125 " --> pdb=" O LEUIC 119 " (cutoff:3.500A) removed outlier: 7.111A pdb=" N LEUIC 119 " --> pdb=" O ILEIC 125 " (cutoff:3.500A) removed outlier: 6.859A pdb=" N ILEIC 127 " --> pdb=" O LEUIC 117 " (cutoff:3.500A) removed outlier: 6.795A pdb=" N LEUIC 117 " --> pdb=" O ILEIC 127 " (cutoff:3.500A) removed outlier: 6.948A pdb=" N ASPIC 129 " --> pdb=" O ASNIC 115 " (cutoff:3.500A) removed outlier: 6.627A pdb=" N VALIC 109 " --> pdb=" O ALAIC 135 " (cutoff:3.500A) removed outlier: 4.839A pdb=" N ASNIC 115 " --> pdb=" O THRIH 329 " (cutoff:3.500A) removed outlier: 4.362A pdb=" N THRIH 329 " --> pdb=" O ASNIC 115 " (cutoff:3.500A) Processing sheet with id=AQ6, first strand: chain 'HD' and resid 121 through 122 Processing sheet with id=AQ7, first strand: chain 'HD' and resid 121 through 122 removed outlier: 6.468A pdb=" N ILEHK 114 " --> pdb=" O PHEHK 155 " (cutoff:3.500A) removed outlier: 8.042A pdb=" N GLNHK 157 " --> pdb=" O ILEHK 114 " (cutoff:3.500A) removed outlier: 6.198A pdb=" N VALHK 116 " --> pdb=" O GLNHK 157 " (cutoff:3.500A) removed outlier: 7.576A pdb=" N LEUHK 159 " --> pdb=" O VALHK 116 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N SERHK 118 " --> pdb=" O LEUHK 159 " (cutoff:3.500A) removed outlier: 5.894A pdb=" N ALAHK 113 " --> pdb=" O ARGHK 185 " (cutoff:3.500A) removed outlier: 4.582A pdb=" N ARGHK 185 " --> pdb=" O ALAHK 113 " (cutoff:3.500A) Processing sheet with id=AQ8, first strand: chain 'HD' and resid 105 through 109 removed outlier: 6.221A pdb=" N ARGHD 105 " --> pdb=" O VALHD 154 " (cutoff:3.500A) removed outlier: 7.728A pdb=" N LEUHD 156 " --> pdb=" O ARGHD 105 " (cutoff:3.500A) removed outlier: 6.448A pdb=" N ARGHD 107 " --> pdb=" O LEUHD 156 " (cutoff:3.500A) removed outlier: 8.027A pdb=" N TYRHD 158 " --> pdb=" O ARGHD 107 " (cutoff:3.500A) removed outlier: 7.156A pdb=" N LEUHD 109 " --> pdb=" O TYRHD 158 " (cutoff:3.500A) Processing sheet with id=AQ9, first strand: chain 'HL' and resid 115 through 119 removed outlier: 3.561A pdb=" N THRHL 122 " --> pdb=" O TYRHL 119 " (cutoff:3.500A) Processing sheet with id=AR1, first strand: chain 'HM' and resid 41 through 43 removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 6.590A pdb=" N ILEHM 222 " --> pdb=" O LYSHM 242 " (cutoff:3.500A) removed outlier: 7.040A pdb=" N LYSHM 244 " --> pdb=" O ILEHM 222 " (cutoff:3.500A) removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) Processing sheet with id=AR2, first strand: chain 'HM' and resid 287 through 292 removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N ILEHM 227 " --> pdb=" O LEUHM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAHM 248 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 7.112A pdb=" N ASNHM 229 " --> pdb=" O ALAHM 248 " (cutoff:3.500A) removed outlier: 6.081A pdb=" N ILEHM 207 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 8.056A pdb=" N ASNHM 229 " --> pdb=" O ILEHM 207 " (cutoff:3.500A) removed outlier: 7.030A pdb=" N LYSHM 208 " --> pdb=" O GLYHM 187 " (cutoff:3.500A) removed outlier: 6.041A pdb=" N VALHM 189 " --> pdb=" O LYSHM 208 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) Processing sheet with id=AR3, first strand: chain 'HM' and resid 41 through 43 removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 13.753A pdb=" N THRHM 211 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 9.424A pdb=" N ASNHM 190 " --> pdb=" O THRHM 211 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N THRHM 213 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 7.078A pdb=" N ARGHM 192 " --> pdb=" O THRHM 213 " (cutoff:3.500A) removed outlier: 8.783A pdb=" N ARGHM 215 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N LEUHM 194 " --> pdb=" O ARGHM 215 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N ILEHM 227 " --> pdb=" O LEUHM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAHM 248 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 7.112A pdb=" N ASNHM 229 " --> pdb=" O ALAHM 248 " (cutoff:3.500A) removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) Processing sheet with id=AR4, first strand: chain 'HM' and resid 297 through 299 removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) removed outlier: 6.590A pdb=" N ILEHM 222 " --> pdb=" O LYSHM 242 " (cutoff:3.500A) removed outlier: 7.040A pdb=" N LYSHM 244 " --> pdb=" O ILEHM 222 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) Processing sheet with id=AR5, first strand: chain 'HM' and resid 41 through 43 removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 7.030A pdb=" N LYSHM 208 " --> pdb=" O GLYHM 187 " (cutoff:3.500A) removed outlier: 6.041A pdb=" N VALHM 189 " --> pdb=" O LYSHM 208 " (cutoff:3.500A) removed outlier: 6.081A pdb=" N ILEHM 207 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 8.056A pdb=" N ASNHM 229 " --> pdb=" O ILEHM 207 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N ILEHM 227 " --> pdb=" O LEUHM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAHM 248 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 7.112A pdb=" N ASNHM 229 " --> pdb=" O ALAHM 248 " (cutoff:3.500A) removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) Processing sheet with id=AR6, first strand: chain 'HM' and resid 297 through 299 removed outlier: 4.177A pdb=" N SERHM 264 " --> pdb=" O GLYHM 243 " (cutoff:3.500A) removed outlier: 6.768A pdb=" N TYRHM 245 " --> pdb=" O SERHM 264 " (cutoff:3.500A) removed outlier: 10.753A pdb=" N VALHM 266 " --> pdb=" O TYRHM 245 " (cutoff:3.500A) removed outlier: 10.249A pdb=" N ARGHM 247 " --> pdb=" O VALHM 266 " (cutoff:3.500A) removed outlier: 9.936A pdb=" N HISHM 268 " --> pdb=" O ARGHM 247 " (cutoff:3.500A) removed outlier: 6.125A pdb=" N GLNHM 249 " --> pdb=" O HISHM 268 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N SERHM 270 " --> pdb=" O GLNHM 249 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N SERHM 251 " --> pdb=" O SERHM 270 " (cutoff:3.500A) removed outlier: 7.990A pdb=" N LEUHM 272 " --> pdb=" O SERHM 251 " (cutoff:3.500A) removed outlier: 6.484A pdb=" N VALHM 253 " --> pdb=" O LEUHM 272 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N ILEHM 227 " --> pdb=" O LEUHM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAHM 248 " --> pdb=" O ILEHM 227 " (cutoff:3.500A) removed outlier: 7.112A pdb=" N ASNHM 229 " --> pdb=" O ALAHM 248 " (cutoff:3.500A) removed outlier: 13.753A pdb=" N THRHM 211 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 9.424A pdb=" N ASNHM 190 " --> pdb=" O THRHM 211 " (cutoff:3.500A) removed outlier: 9.907A pdb=" N THRHM 213 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 7.078A pdb=" N ARGHM 192 " --> pdb=" O THRHM 213 " (cutoff:3.500A) removed outlier: 8.783A pdb=" N ARGHM 215 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 6.587A pdb=" N LEUHM 194 " --> pdb=" O ARGHM 215 " (cutoff:3.500A) removed outlier: 4.405A pdb=" N VALHM 162 " --> pdb=" O LYSHM 182 " (cutoff:3.500A) removed outlier: 7.477A pdb=" N LEUHM 184 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 4.238A pdb=" N GLNHM 164 " --> pdb=" O LEUHM 184 " (cutoff:3.500A) removed outlier: 7.401A pdb=" N SERHM 186 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 5.059A pdb=" N ASNHM 166 " --> pdb=" O SERHM 186 " (cutoff:3.500A) removed outlier: 8.859A pdb=" N PHEHM 188 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 5.704A pdb=" N VALHM 168 " --> pdb=" O PHEHM 188 " (cutoff:3.500A) removed outlier: 7.205A pdb=" N ASNHM 190 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 7.828A pdb=" N SERHM 170 " --> pdb=" O ASNHM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGHM 192 " --> pdb=" O SERHM 170 " (cutoff:3.500A) removed outlier: 10.808A pdb=" N ASNHM 172 " --> pdb=" O ARGHM 192 " (cutoff:3.500A) removed outlier: 11.952A pdb=" N LEUHM 194 " --> pdb=" O ASNHM 172 " (cutoff:3.500A) removed outlier: 10.339A pdb=" N GLNHM 174 " --> pdb=" O LEUHM 194 " (cutoff:3.500A) removed outlier: 10.929A pdb=" N METHM 196 " --> pdb=" O GLNHM 174 " (cutoff:3.500A) removed outlier: 9.648A pdb=" N VALHM 176 " --> pdb=" O METHM 196 " (cutoff:3.500A) removed outlier: 5.732A pdb=" N GLYHM 142 " --> pdb=" O VALHM 162 " (cutoff:3.500A) removed outlier: 7.216A pdb=" N GLNHM 164 " --> pdb=" O GLYHM 142 " (cutoff:3.500A) removed outlier: 6.667A pdb=" N THRHM 144 " --> pdb=" O GLNHM 164 " (cutoff:3.500A) removed outlier: 7.964A pdb=" N ASNHM 166 " --> pdb=" O THRHM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUHM 146 " --> pdb=" O ASNHM 166 " (cutoff:3.500A) removed outlier: 7.663A pdb=" N VALHM 168 " --> pdb=" O LEUHM 146 " (cutoff:3.500A) removed outlier: 9.894A pdb=" N GLYHM 148 " --> pdb=" O VALHM 168 " (cutoff:3.500A) removed outlier: 9.932A pdb=" N SERHM 170 " --> pdb=" O GLYHM 148 " (cutoff:3.500A) removed outlier: 6.310A pdb=" N ASNHM 149 " --> pdb=" O ASNHM 128 " (cutoff:3.500A) removed outlier: 4.496A pdb=" N ARGHM 130 " --> pdb=" O ASNHM 149 " (cutoff:3.500A) removed outlier: 6.353A pdb=" N VALHM 58 " --> pdb=" O THRHM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNHM 127 " --> pdb=" O VALHM 58 " (cutoff:3.500A) removed outlier: 7.021A pdb=" N LEUHM 60 " --> pdb=" O ASNHM 127 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N LEUHM 129 " --> pdb=" O LEUHM 60 " (cutoff:3.500A) removed outlier: 9.196A pdb=" N THRHM 62 " --> pdb=" O LEUHM 129 " (cutoff:3.500A) removed outlier: 6.546A pdb=" N ASNHM 57 " --> pdb=" O VALHM 106 " (cutoff:3.500A) removed outlier: 7.846A pdb=" N ILEHM 108 " --> pdb=" O ASNHM 57 " (cutoff:3.500A) removed outlier: 6.619A pdb=" N ASNHM 59 " --> pdb=" O ILEHM 108 " (cutoff:3.500A) removed outlier: 8.285A pdb=" N THRHM 110 " --> pdb=" O ASNHM 59 " (cutoff:3.500A) removed outlier: 6.872A pdb=" N HISHM 61 " --> pdb=" O THRHM 110 " (cutoff:3.500A) removed outlier: 3.507A pdb=" N VALHM 69 " --> pdb=" O ARGHM 42 " (cutoff:3.500A) Processing sheet with id=AR7, first strand: chain 'HM' and resid 287 through 292 Processing sheet with id=AR8, first strand: chain 'HM' and resid 81 through 84 removed outlier: 3.668A pdb=" N SERHM 93 " --> pdb=" O ARGHM 82 " (cutoff:3.500A) removed outlier: 4.323A pdb=" N LEUHM 94 " --> pdb=" O GLNHM 53 " (cutoff:3.500A) removed outlier: 3.872A pdb=" N LEUHM 136 " --> pdb=" O LYSHM 154 " (cutoff:3.500A) Processing sheet with id=AR9, first strand: chain 'HN' and resid 48 through 52 removed outlier: 6.682A pdb=" N VALHN 59 " --> pdb=" O ASNHN 49 " (cutoff:3.500A) removed outlier: 4.887A pdb=" N CYSHN 51 " --> pdb=" O ARGHN 57 " (cutoff:3.500A) removed outlier: 6.524A pdb=" N ARGHN 57 " --> pdb=" O CYSHN 51 " (cutoff:3.500A) removed outlier: 4.994A pdb=" N LEUHN 58 " --> pdb=" O SERHN 66 " (cutoff:3.500A) Processing sheet with id=AS1, first strand: chain 'HN' and resid 101 through 102 removed outlier: 4.519A pdb=" N VALHN 101 " --> pdb=" O SERHN 109 " (cutoff:3.500A) Processing sheet with id=AS2, first strand: chain 'Hd' and resid 118 through 127 removed outlier: 3.626A pdb=" N ASPHd 125 " --> pdb=" O ALAHd 83 " (cutoff:3.500A) removed outlier: 6.127A pdb=" N ALAHd 83 " --> pdb=" O ASPHd 125 " (cutoff:3.500A) removed outlier: 3.567A pdb=" N ALAIC 267 " --> pdb=" O SERHd 84 " (cutoff:3.500A) Processing sheet with id=AS3, first strand: chain 'Hd' and resid 105 through 109 Processing sheet with id=AS4, first strand: chain 'Hf' and resid 210 through 215 removed outlier: 7.002A pdb=" N TRPHf 221 " --> pdb=" O GLNHf 213 " (cutoff:3.500A) Processing sheet with id=AS5, first strand: chain 'Hf' and resid 237 through 238 removed outlier: 3.595A pdb=" N LYSHf 245 " --> pdb=" O LEUHf 255 " (cutoff:3.500A) removed outlier: 7.241A pdb=" N LEUHf 255 " --> pdb=" O LYSHf 245 " (cutoff:3.500A) removed outlier: 5.386A pdb=" N ILEHf 247 " --> pdb=" O ARGHf 253 " (cutoff:3.500A) removed outlier: 7.671A pdb=" N ARGHf 253 " --> pdb=" O ILEHf 247 " (cutoff:3.500A) Processing sheet with id=AS6, first strand: chain 'IC' and resid 105 through 106 removed outlier: 3.953A pdb=" N HISIC 139 " --> pdb=" O LEUIC 106 " (cutoff:3.500A) Processing sheet with id=AS7, first strand: chain 'IC' and resid 225 through 231 removed outlier: 6.667A pdb=" N TYRIC 225 " --> pdb=" O THRIC 250 " (cutoff:3.500A) removed outlier: 3.523A pdb=" N GLUIC 239 " --> pdb=" O ASPIC 236 " (cutoff:3.500A) Processing sheet with id=AS8, first strand: chain 'IC' and resid 225 through 231 removed outlier: 6.667A pdb=" N TYRIC 225 " --> pdb=" O THRIC 250 " (cutoff:3.500A) removed outlier: 7.412A pdb=" N ILEJC 125 " --> pdb=" O LEUJC 119 " (cutoff:3.500A) removed outlier: 7.122A pdb=" N LEUJC 119 " --> pdb=" O ILEJC 125 " (cutoff:3.500A) removed outlier: 6.864A pdb=" N ILEJC 127 " --> pdb=" O LEUJC 117 " (cutoff:3.500A) removed outlier: 6.828A pdb=" N LEUJC 117 " --> pdb=" O ILEJC 127 " (cutoff:3.500A) removed outlier: 6.898A pdb=" N ASPJC 129 " --> pdb=" O ASNJC 115 " (cutoff:3.500A) removed outlier: 6.603A pdb=" N VALJC 109 " --> pdb=" O ALAJC 135 " (cutoff:3.500A) removed outlier: 4.859A pdb=" N ASNJC 115 " --> pdb=" O THRJH 329 " (cutoff:3.500A) removed outlier: 4.472A pdb=" N THRJH 329 " --> pdb=" O ASNJC 115 " (cutoff:3.500A) removed outlier: 6.140A pdb=" N ALAJH 302 " --> pdb=" O VALJH 297 " (cutoff:3.500A) removed outlier: 5.358A pdb=" N VALJH 297 " --> pdb=" O ALAJH 302 " (cutoff:3.500A) removed outlier: 4.657A pdb=" N ALAJH 304 " --> pdb=" O LEUJH 295 " (cutoff:3.500A) removed outlier: 3.595A pdb=" N THRJH 318 " --> pdb=" O SERJH 348 " (cutoff:3.500A) Processing sheet with id=AS9, first strand: chain 'ID' and resid 121 through 122 Processing sheet with id=AT1, first strand: chain 'ID' and resid 121 through 122 removed outlier: 6.459A pdb=" N ILEIK 114 " --> pdb=" O PHEIK 155 " (cutoff:3.500A) removed outlier: 8.046A pdb=" N GLNIK 157 " --> pdb=" O ILEIK 114 " (cutoff:3.500A) removed outlier: 6.199A pdb=" N VALIK 116 " --> pdb=" O GLNIK 157 " (cutoff:3.500A) removed outlier: 7.566A pdb=" N LEUIK 159 " --> pdb=" O VALIK 116 " (cutoff:3.500A) removed outlier: 7.909A pdb=" N SERIK 118 " --> pdb=" O LEUIK 159 " (cutoff:3.500A) removed outlier: 5.976A pdb=" N ALAIK 113 " --> pdb=" O ARGIK 185 " (cutoff:3.500A) removed outlier: 4.629A pdb=" N ARGIK 185 " --> pdb=" O ALAIK 113 " (cutoff:3.500A) Processing sheet with id=AT2, first strand: chain 'ID' and resid 105 through 109 removed outlier: 6.214A pdb=" N ARGID 105 " --> pdb=" O VALID 154 " (cutoff:3.500A) removed outlier: 7.768A pdb=" N LEUID 156 " --> pdb=" O ARGID 105 " (cutoff:3.500A) removed outlier: 6.496A pdb=" N ARGID 107 " --> pdb=" O LEUID 156 " (cutoff:3.500A) removed outlier: 8.089A pdb=" N TYRID 158 " --> pdb=" O ARGID 107 " (cutoff:3.500A) removed outlier: 7.200A pdb=" N LEUID 109 " --> pdb=" O TYRID 158 " (cutoff:3.500A) Processing sheet with id=AT3, first strand: chain 'IH' and resid 296 through 298 removed outlier: 3.866A pdb=" N THRIH 318 " --> pdb=" O SERIH 348 " (cutoff:3.500A) Processing sheet with id=AT4, first strand: chain 'IL' and resid 115 through 119 removed outlier: 3.532A pdb=" N THRIL 122 " --> pdb=" O TYRIL 119 " (cutoff:3.500A) Processing sheet with id=AT5, first strand: chain 'IM' and resid 41 through 43 removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 3.534A pdb=" N SERIM 203 " --> pdb=" O VALIM 183 " (cutoff:3.500A) removed outlier: 6.674A pdb=" N ILEIM 222 " --> pdb=" O LYSIM 242 " (cutoff:3.500A) removed outlier: 6.984A pdb=" N LYSIM 244 " --> pdb=" O ILEIM 222 " (cutoff:3.500A) removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) Processing sheet with id=AT6, first strand: chain 'IM' and resid 287 through 292 removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) removed outlier: 6.777A pdb=" N ILEIM 227 " --> pdb=" O LEUIM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAIM 248 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.136A pdb=" N ASNIM 229 " --> pdb=" O ALAIM 248 " (cutoff:3.500A) removed outlier: 6.012A pdb=" N ILEIM 207 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.955A pdb=" N ASNIM 229 " --> pdb=" O ILEIM 207 " (cutoff:3.500A) removed outlier: 7.037A pdb=" N LYSIM 208 " --> pdb=" O GLYIM 187 " (cutoff:3.500A) removed outlier: 6.074A pdb=" N VALIM 189 " --> pdb=" O LYSIM 208 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) Processing sheet with id=AT7, first strand: chain 'IM' and resid 41 through 43 removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 3.503A pdb=" N THRIM 213 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 6.777A pdb=" N ILEIM 227 " --> pdb=" O LEUIM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAIM 248 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.136A pdb=" N ASNIM 229 " --> pdb=" O ALAIM 248 " (cutoff:3.500A) removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) Processing sheet with id=AT8, first strand: chain 'IM' and resid 297 through 299 removed outlier: 3.530A pdb=" N TYRIM 281 " --> pdb=" O LEUIM 299 " (cutoff:3.500A) removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) removed outlier: 6.674A pdb=" N ILEIM 222 " --> pdb=" O LYSIM 242 " (cutoff:3.500A) removed outlier: 6.984A pdb=" N LYSIM 244 " --> pdb=" O ILEIM 222 " (cutoff:3.500A) removed outlier: 3.534A pdb=" N SERIM 203 " --> pdb=" O VALIM 183 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) Processing sheet with id=AT9, first strand: chain 'IM' and resid 41 through 43 removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 7.037A pdb=" N LYSIM 208 " --> pdb=" O GLYIM 187 " (cutoff:3.500A) removed outlier: 6.074A pdb=" N VALIM 189 " --> pdb=" O LYSIM 208 " (cutoff:3.500A) removed outlier: 6.012A pdb=" N ILEIM 207 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.955A pdb=" N ASNIM 229 " --> pdb=" O ILEIM 207 " (cutoff:3.500A) removed outlier: 6.777A pdb=" N ILEIM 227 " --> pdb=" O LEUIM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAIM 248 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.136A pdb=" N ASNIM 229 " --> pdb=" O ALAIM 248 " (cutoff:3.500A) removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) removed outlier: 3.530A pdb=" N TYRIM 281 " --> pdb=" O LEUIM 299 " (cutoff:3.500A) Processing sheet with id=AU1, first strand: chain 'IM' and resid 297 through 299 removed outlier: 3.530A pdb=" N TYRIM 281 " --> pdb=" O LEUIM 299 " (cutoff:3.500A) removed outlier: 4.066A pdb=" N SERIM 264 " --> pdb=" O GLYIM 243 " (cutoff:3.500A) removed outlier: 6.751A pdb=" N TYRIM 245 " --> pdb=" O SERIM 264 " (cutoff:3.500A) removed outlier: 10.743A pdb=" N VALIM 266 " --> pdb=" O TYRIM 245 " (cutoff:3.500A) removed outlier: 10.190A pdb=" N ARGIM 247 " --> pdb=" O VALIM 266 " (cutoff:3.500A) removed outlier: 9.946A pdb=" N HISIM 268 " --> pdb=" O ARGIM 247 " (cutoff:3.500A) removed outlier: 6.059A pdb=" N GLNIM 249 " --> pdb=" O HISIM 268 " (cutoff:3.500A) removed outlier: 7.662A pdb=" N SERIM 270 " --> pdb=" O GLNIM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERIM 251 " --> pdb=" O SERIM 270 " (cutoff:3.500A) removed outlier: 8.004A pdb=" N LEUIM 272 " --> pdb=" O SERIM 251 " (cutoff:3.500A) removed outlier: 6.485A pdb=" N VALIM 253 " --> pdb=" O LEUIM 272 " (cutoff:3.500A) removed outlier: 6.777A pdb=" N ILEIM 227 " --> pdb=" O LEUIM 246 " (cutoff:3.500A) removed outlier: 7.242A pdb=" N ALAIM 248 " --> pdb=" O ILEIM 227 " (cutoff:3.500A) removed outlier: 7.136A pdb=" N ASNIM 229 " --> pdb=" O ALAIM 248 " (cutoff:3.500A) removed outlier: 3.503A pdb=" N THRIM 213 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 4.375A pdb=" N VALIM 162 " --> pdb=" O LYSIM 182 " (cutoff:3.500A) removed outlier: 7.378A pdb=" N LEUIM 184 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 4.209A pdb=" N GLNIM 164 " --> pdb=" O LEUIM 184 " (cutoff:3.500A) removed outlier: 7.374A pdb=" N SERIM 186 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 5.083A pdb=" N ASNIM 166 " --> pdb=" O SERIM 186 " (cutoff:3.500A) removed outlier: 8.822A pdb=" N PHEIM 188 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 5.766A pdb=" N VALIM 168 " --> pdb=" O PHEIM 188 " (cutoff:3.500A) removed outlier: 7.139A pdb=" N ASNIM 190 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 7.787A pdb=" N SERIM 170 " --> pdb=" O ASNIM 190 " (cutoff:3.500A) removed outlier: 9.146A pdb=" N ARGIM 192 " --> pdb=" O SERIM 170 " (cutoff:3.500A) removed outlier: 10.781A pdb=" N ASNIM 172 " --> pdb=" O ARGIM 192 " (cutoff:3.500A) removed outlier: 11.948A pdb=" N LEUIM 194 " --> pdb=" O ASNIM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNIM 174 " --> pdb=" O LEUIM 194 " (cutoff:3.500A) removed outlier: 11.019A pdb=" N METIM 196 " --> pdb=" O GLNIM 174 " (cutoff:3.500A) removed outlier: 9.747A pdb=" N VALIM 176 " --> pdb=" O METIM 196 " (cutoff:3.500A) removed outlier: 5.637A pdb=" N GLYIM 142 " --> pdb=" O VALIM 162 " (cutoff:3.500A) removed outlier: 7.196A pdb=" N GLNIM 164 " --> pdb=" O GLYIM 142 " (cutoff:3.500A) removed outlier: 6.718A pdb=" N THRIM 144 " --> pdb=" O GLNIM 164 " (cutoff:3.500A) removed outlier: 7.897A pdb=" N ASNIM 166 " --> pdb=" O THRIM 144 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUIM 146 " --> pdb=" O ASNIM 166 " (cutoff:3.500A) removed outlier: 7.583A pdb=" N VALIM 168 " --> pdb=" O LEUIM 146 " (cutoff:3.500A) removed outlier: 9.924A pdb=" N GLYIM 148 " --> pdb=" O VALIM 168 " (cutoff:3.500A) removed outlier: 9.941A pdb=" N SERIM 170 " --> pdb=" O GLYIM 148 " (cutoff:3.500A) removed outlier: 3.542A pdb=" N ASNIM 128 " --> pdb=" O ALAIM 147 " (cutoff:3.500A) removed outlier: 6.327A pdb=" N ASNIM 149 " --> pdb=" O ASNIM 128 " (cutoff:3.500A) removed outlier: 4.626A pdb=" N ARGIM 130 " --> pdb=" O ASNIM 149 " (cutoff:3.500A) removed outlier: 6.329A pdb=" N VALIM 58 " --> pdb=" O THRIM 125 " (cutoff:3.500A) removed outlier: 8.535A pdb=" N ASNIM 127 " --> pdb=" O VALIM 58 " (cutoff:3.500A) removed outlier: 6.998A pdb=" N LEUIM 60 " --> pdb=" O ASNIM 127 " (cutoff:3.500A) removed outlier: 7.720A pdb=" N LEUIM 129 " --> pdb=" O LEUIM 60 " (cutoff:3.500A) removed outlier: 9.097A pdb=" N THRIM 62 " --> pdb=" O LEUIM 129 " (cutoff:3.500A) removed outlier: 6.571A pdb=" N ASNIM 57 " --> pdb=" O VALIM 106 " (cutoff:3.500A) removed outlier: 7.881A pdb=" N ILEIM 108 " --> pdb=" O ASNIM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNIM 59 " --> pdb=" O ILEIM 108 " (cutoff:3.500A) removed outlier: 8.264A pdb=" N THRIM 110 " --> pdb=" O ASNIM 59 " (cutoff:3.500A) removed outlier: 6.886A pdb=" N HISIM 61 " --> pdb=" O THRIM 110 " (cutoff:3.500A) Processing sheet with id=AU2, first strand: chain 'IM' and resid 287 through 292 removed outlier: 3.530A pdb=" N TYRIM 281 " --> pdb=" O LEUIM 299 " (cutoff:3.500A) Processing sheet with id=AU3, first strand: chain 'IM' and resid 81 through 84 removed outlier: 3.697A pdb=" N SERIM 93 " --> pdb=" O ARGIM 82 " (cutoff:3.500A) removed outlier: 3.512A pdb=" N ILEIM 84 " --> pdb=" O TYRIM 91 " (cutoff:3.500A) removed outlier: 6.194A pdb=" N VALIM 51 " --> pdb=" O VALIM 92 " (cutoff:3.500A) removed outlier: 7.792A pdb=" N LEUIM 94 " --> pdb=" O VALIM 51 " (cutoff:3.500A) removed outlier: 8.344A pdb=" N GLNIM 53 " --> pdb=" O LEUIM 94 " (cutoff:3.500A) removed outlier: 3.721A pdb=" N LEUIM 136 " --> pdb=" O LYSIM 154 " (cutoff:3.500A) Processing sheet with id=AU4, first strand: chain 'IN' and resid 48 through 52 removed outlier: 6.701A pdb=" N VALIN 59 " --> pdb=" O ASNIN 49 " (cutoff:3.500A) removed outlier: 4.877A pdb=" N CYSIN 51 " --> pdb=" O ARGIN 57 " (cutoff:3.500A) removed outlier: 6.445A pdb=" N ARGIN 57 " --> pdb=" O CYSIN 51 " (cutoff:3.500A) removed outlier: 5.071A pdb=" N LEUIN 58 " --> pdb=" O SERIN 66 " (cutoff:3.500A) Processing sheet with id=AU5, first strand: chain 'IN' and resid 101 through 102 removed outlier: 4.585A pdb=" N VALIN 101 " --> pdb=" O SERIN 109 " (cutoff:3.500A) Processing sheet with id=AU6, first strand: chain 'Id' and resid 82 through 90 removed outlier: 6.329A pdb=" N ALAId 83 " --> pdb=" O ASPId 125 " (cutoff:3.500A) removed outlier: 3.674A pdb=" N ASPId 125 " --> pdb=" O ALAId 83 " (cutoff:3.500A) Processing sheet with id=AU7, first strand: chain 'Id' and resid 105 through 109 Processing sheet with id=AU8, first strand: chain 'If' and resid 210 through 215 removed outlier: 6.917A pdb=" N TRPIf 221 " --> pdb=" O GLNIf 213 " (cutoff:3.500A) removed outlier: 5.344A pdb=" N VALIf 215 " --> pdb=" O ARGIf 219 " (cutoff:3.500A) removed outlier: 7.269A pdb=" N ARGIf 219 " --> pdb=" O VALIf 215 " (cutoff:3.500A) Processing sheet with id=AU9, first strand: chain 'If' and resid 237 through 238 removed outlier: 4.292A pdb=" N LEUIf 246 " --> pdb=" O LEUIf 255 " (cutoff:3.500A) removed outlier: 4.221A pdb=" N ARGIf 253 " --> pdb=" O ASPIf 248 " (cutoff:3.500A) Processing sheet with id=AV1, first strand: chain 'JC' and resid 105 through 106 removed outlier: 3.887A pdb=" N HISJC 139 " --> pdb=" O LEUJC 106 " (cutoff:3.500A) Processing sheet with id=AV2, first strand: chain 'JC' and resid 225 through 231 removed outlier: 6.910A pdb=" N TYRJC 225 " --> pdb=" O THRJC 250 " (cutoff:3.500A) removed outlier: 3.675A pdb=" N ASPJC 244 " --> pdb=" O LEUJC 231 " (cutoff:3.500A) Processing sheet with id=AV3, first strand: chain 'JC' and resid 225 through 231 removed outlier: 6.910A pdb=" N TYRJC 225 " --> pdb=" O THRJC 250 " (cutoff:3.500A) removed outlier: 3.675A pdb=" N ASPJC 244 " --> pdb=" O LEUJC 231 " (cutoff:3.500A) removed outlier: 7.386A pdb=" N ILEKC 125 " --> pdb=" O LEUKC 119 " (cutoff:3.500A) removed outlier: 7.050A pdb=" N LEUKC 119 " --> pdb=" O ILEKC 125 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N ILEKC 127 " --> pdb=" O LEUKC 117 " (cutoff:3.500A) removed outlier: 6.745A pdb=" N LEUKC 117 " --> pdb=" O ILEKC 127 " (cutoff:3.500A) removed outlier: 6.962A pdb=" N ASPKC 129 " --> pdb=" O ASNKC 115 " (cutoff:3.500A) removed outlier: 6.638A pdb=" N VALKC 109 " --> pdb=" O ALAKC 135 " (cutoff:3.500A) removed outlier: 4.766A pdb=" N THRKC 116 " --> pdb=" O SERKH 327 " (cutoff:3.500A) removed outlier: 7.182A pdb=" N SERKH 327 " --> pdb=" O THRKC 116 " (cutoff:3.500A) removed outlier: 6.203A pdb=" N ALAKH 302 " --> pdb=" O VALKH 297 " (cutoff:3.500A) removed outlier: 5.384A pdb=" N VALKH 297 " --> pdb=" O ALAKH 302 " (cutoff:3.500A) removed outlier: 4.698A pdb=" N ALAKH 304 " --> pdb=" O LEUKH 295 " (cutoff:3.500A) removed outlier: 3.533A pdb=" N THRKH 318 " --> pdb=" O SERKH 348 " (cutoff:3.500A) Processing sheet with id=AV4, first strand: chain 'JD' and resid 121 through 122 Processing sheet with id=AV5, first strand: chain 'JD' and resid 121 through 122 removed outlier: 6.523A pdb=" N ILEJK 114 " --> pdb=" O PHEJK 155 " (cutoff:3.500A) removed outlier: 8.081A pdb=" N GLNJK 157 " --> pdb=" O ILEJK 114 " (cutoff:3.500A) removed outlier: 6.190A pdb=" N VALJK 116 " --> pdb=" O GLNJK 157 " (cutoff:3.500A) removed outlier: 5.872A pdb=" N ALAJK 113 " --> pdb=" O ARGJK 185 " (cutoff:3.500A) removed outlier: 4.505A pdb=" N ARGJK 185 " --> pdb=" O ALAJK 113 " (cutoff:3.500A) Processing sheet with id=AV6, first strand: chain 'JD' and resid 105 through 109 removed outlier: 6.203A pdb=" N ARGJD 105 " --> pdb=" O VALJD 154 " (cutoff:3.500A) removed outlier: 7.756A pdb=" N LEUJD 156 " --> pdb=" O ARGJD 105 " (cutoff:3.500A) removed outlier: 6.462A pdb=" N ARGJD 107 " --> pdb=" O LEUJD 156 " (cutoff:3.500A) removed outlier: 8.060A pdb=" N TYRJD 158 " --> pdb=" O ARGJD 107 " (cutoff:3.500A) removed outlier: 7.164A pdb=" N LEUJD 109 " --> pdb=" O TYRJD 158 " (cutoff:3.500A) Processing sheet with id=AV7, first strand: chain 'JL' and resid 115 through 119 removed outlier: 3.570A pdb=" N THRJL 122 " --> pdb=" O TYRJL 119 " (cutoff:3.500A) Processing sheet with id=AV8, first strand: chain 'JM' and resid 41 through 43 removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N ILEJM 222 " --> pdb=" O LYSJM 242 " (cutoff:3.500A) removed outlier: 7.064A pdb=" N LYSJM 244 " --> pdb=" O ILEJM 222 " (cutoff:3.500A) removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) Processing sheet with id=AV9, first strand: chain 'JM' and resid 287 through 292 removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) removed outlier: 6.809A pdb=" N ILEJM 227 " --> pdb=" O LEUJM 246 " (cutoff:3.500A) removed outlier: 7.193A pdb=" N ALAJM 248 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N ASNJM 229 " --> pdb=" O ALAJM 248 " (cutoff:3.500A) removed outlier: 6.372A pdb=" N ILEJM 207 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 8.414A pdb=" N ASNJM 229 " --> pdb=" O ILEJM 207 " (cutoff:3.500A) removed outlier: 7.001A pdb=" N LYSJM 208 " --> pdb=" O GLYJM 187 " (cutoff:3.500A) removed outlier: 5.841A pdb=" N VALJM 189 " --> pdb=" O LYSJM 208 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) Processing sheet with id=AW1, first strand: chain 'JM' and resid 41 through 43 removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 6.809A pdb=" N ILEJM 227 " --> pdb=" O LEUJM 246 " (cutoff:3.500A) removed outlier: 7.193A pdb=" N ALAJM 248 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N ASNJM 229 " --> pdb=" O ALAJM 248 " (cutoff:3.500A) removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) Processing sheet with id=AW2, first strand: chain 'JM' and resid 297 through 299 removed outlier: 6.395A pdb=" N ALAJM 261 " --> pdb=" O TYRJM 280 " (cutoff:3.500A) removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N ILEJM 222 " --> pdb=" O LYSJM 242 " (cutoff:3.500A) removed outlier: 7.064A pdb=" N LYSJM 244 " --> pdb=" O ILEJM 222 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) Processing sheet with id=AW3, first strand: chain 'JM' and resid 41 through 43 removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 7.001A pdb=" N LYSJM 208 " --> pdb=" O GLYJM 187 " (cutoff:3.500A) removed outlier: 5.841A pdb=" N VALJM 189 " --> pdb=" O LYSJM 208 " (cutoff:3.500A) removed outlier: 6.372A pdb=" N ILEJM 207 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 8.414A pdb=" N ASNJM 229 " --> pdb=" O ILEJM 207 " (cutoff:3.500A) removed outlier: 6.809A pdb=" N ILEJM 227 " --> pdb=" O LEUJM 246 " (cutoff:3.500A) removed outlier: 7.193A pdb=" N ALAJM 248 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N ASNJM 229 " --> pdb=" O ALAJM 248 " (cutoff:3.500A) removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) removed outlier: 6.395A pdb=" N ALAJM 261 " --> pdb=" O TYRJM 280 " (cutoff:3.500A) Processing sheet with id=AW4, first strand: chain 'JM' and resid 297 through 299 removed outlier: 6.395A pdb=" N ALAJM 261 " --> pdb=" O TYRJM 280 " (cutoff:3.500A) removed outlier: 4.044A pdb=" N SERJM 264 " --> pdb=" O GLYJM 243 " (cutoff:3.500A) removed outlier: 6.767A pdb=" N TYRJM 245 " --> pdb=" O SERJM 264 " (cutoff:3.500A) removed outlier: 10.804A pdb=" N VALJM 266 " --> pdb=" O TYRJM 245 " (cutoff:3.500A) removed outlier: 10.200A pdb=" N ARGJM 247 " --> pdb=" O VALJM 266 " (cutoff:3.500A) removed outlier: 9.919A pdb=" N HISJM 268 " --> pdb=" O ARGJM 247 " (cutoff:3.500A) removed outlier: 6.166A pdb=" N GLNJM 249 " --> pdb=" O HISJM 268 " (cutoff:3.500A) removed outlier: 7.814A pdb=" N SERJM 270 " --> pdb=" O GLNJM 249 " (cutoff:3.500A) removed outlier: 6.128A pdb=" N SERJM 251 " --> pdb=" O SERJM 270 " (cutoff:3.500A) removed outlier: 7.999A pdb=" N LEUJM 272 " --> pdb=" O SERJM 251 " (cutoff:3.500A) removed outlier: 6.468A pdb=" N VALJM 253 " --> pdb=" O LEUJM 272 " (cutoff:3.500A) removed outlier: 6.809A pdb=" N ILEJM 227 " --> pdb=" O LEUJM 246 " (cutoff:3.500A) removed outlier: 7.193A pdb=" N ALAJM 248 " --> pdb=" O ILEJM 227 " (cutoff:3.500A) removed outlier: 7.068A pdb=" N ASNJM 229 " --> pdb=" O ALAJM 248 " (cutoff:3.500A) removed outlier: 4.457A pdb=" N VALJM 162 " --> pdb=" O LYSJM 182 " (cutoff:3.500A) removed outlier: 7.581A pdb=" N LEUJM 184 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 4.304A pdb=" N GLNJM 164 " --> pdb=" O LEUJM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERJM 186 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 5.304A pdb=" N ASNJM 166 " --> pdb=" O SERJM 186 " (cutoff:3.500A) removed outlier: 8.807A pdb=" N PHEJM 188 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 5.715A pdb=" N VALJM 168 " --> pdb=" O PHEJM 188 " (cutoff:3.500A) removed outlier: 7.089A pdb=" N ASNJM 190 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 7.848A pdb=" N SERJM 170 " --> pdb=" O ASNJM 190 " (cutoff:3.500A) removed outlier: 9.182A pdb=" N ARGJM 192 " --> pdb=" O SERJM 170 " (cutoff:3.500A) removed outlier: 10.891A pdb=" N ASNJM 172 " --> pdb=" O ARGJM 192 " (cutoff:3.500A) removed outlier: 11.946A pdb=" N LEUJM 194 " --> pdb=" O ASNJM 172 " (cutoff:3.500A) removed outlier: 10.327A pdb=" N GLNJM 174 " --> pdb=" O LEUJM 194 " (cutoff:3.500A) removed outlier: 10.970A pdb=" N METJM 196 " --> pdb=" O GLNJM 174 " (cutoff:3.500A) removed outlier: 9.712A pdb=" N VALJM 176 " --> pdb=" O METJM 196 " (cutoff:3.500A) removed outlier: 5.580A pdb=" N GLYJM 142 " --> pdb=" O VALJM 162 " (cutoff:3.500A) removed outlier: 7.117A pdb=" N GLNJM 164 " --> pdb=" O GLYJM 142 " (cutoff:3.500A) removed outlier: 6.736A pdb=" N THRJM 144 " --> pdb=" O GLNJM 164 " (cutoff:3.500A) removed outlier: 7.906A pdb=" N ASNJM 166 " --> pdb=" O THRJM 144 " (cutoff:3.500A) removed outlier: 6.895A pdb=" N LEUJM 146 " --> pdb=" O ASNJM 166 " (cutoff:3.500A) removed outlier: 7.750A pdb=" N VALJM 168 " --> pdb=" O LEUJM 146 " (cutoff:3.500A) removed outlier: 9.973A pdb=" N GLYJM 148 " --> pdb=" O VALJM 168 " (cutoff:3.500A) removed outlier: 9.900A pdb=" N SERJM 170 " --> pdb=" O GLYJM 148 " (cutoff:3.500A) removed outlier: 3.549A pdb=" N ASNJM 128 " --> pdb=" O ALAJM 147 " (cutoff:3.500A) removed outlier: 6.449A pdb=" N ASNJM 149 " --> pdb=" O ASNJM 128 " (cutoff:3.500A) removed outlier: 5.214A pdb=" N ARGJM 130 " --> pdb=" O ASNJM 149 " (cutoff:3.500A) removed outlier: 4.331A pdb=" N ASNJM 127 " --> pdb=" O LEUJM 60 " (cutoff:3.500A) removed outlier: 5.146A pdb=" N THRJM 62 " --> pdb=" O ASNJM 127 " (cutoff:3.500A) removed outlier: 7.547A pdb=" N LEUJM 129 " --> pdb=" O THRJM 62 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ASNJM 57 " --> pdb=" O VALJM 106 " (cutoff:3.500A) removed outlier: 7.856A pdb=" N ILEJM 108 " --> pdb=" O ASNJM 57 " (cutoff:3.500A) removed outlier: 6.629A pdb=" N ASNJM 59 " --> pdb=" O ILEJM 108 " (cutoff:3.500A) removed outlier: 8.241A pdb=" N THRJM 110 " --> pdb=" O ASNJM 59 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N HISJM 61 " --> pdb=" O THRJM 110 " (cutoff:3.500A) removed outlier: 3.524A pdb=" N VALJM 69 " --> pdb=" O ARGJM 42 " (cutoff:3.500A) Processing sheet with id=AW5, first strand: chain 'JM' and resid 287 through 292 removed outlier: 6.395A pdb=" N ALAJM 261 " --> pdb=" O TYRJM 280 " (cutoff:3.500A) Processing sheet with id=AW6, first strand: chain 'JM' and resid 81 through 84 removed outlier: 3.560A pdb=" N ARGJM 82 " --> pdb=" O SERJM 93 " (cutoff:3.500A) removed outlier: 3.744A pdb=" N SERJM 93 " --> pdb=" O ARGJM 82 " (cutoff:3.500A) removed outlier: 3.536A pdb=" N ILEJM 84 " --> pdb=" O TYRJM 91 " (cutoff:3.500A) removed outlier: 4.309A pdb=" N LEUJM 94 " --> pdb=" O GLNJM 53 " (cutoff:3.500A) removed outlier: 3.884A pdb=" N LEUJM 136 " --> pdb=" O LYSJM 154 " (cutoff:3.500A) Processing sheet with id=AW7, first strand: chain 'JN' and resid 48 through 52 removed outlier: 6.716A pdb=" N VALJN 59 " --> pdb=" O ASNJN 49 " (cutoff:3.500A) removed outlier: 4.872A pdb=" N CYSJN 51 " --> pdb=" O ARGJN 57 " (cutoff:3.500A) removed outlier: 6.494A pdb=" N ARGJN 57 " --> pdb=" O CYSJN 51 " (cutoff:3.500A) removed outlier: 5.005A pdb=" N LEUJN 58 " --> pdb=" O SERJN 66 " (cutoff:3.500A) Processing sheet with id=AW8, first strand: chain 'JN' and resid 101 through 102 removed outlier: 4.573A pdb=" N VALJN 101 " --> pdb=" O SERJN 109 " (cutoff:3.500A) Processing sheet with id=AW9, first strand: chain 'Jd' and resid 118 through 127 removed outlier: 3.562A pdb=" N ASPJd 125 " --> pdb=" O ALAJd 83 " (cutoff:3.500A) removed outlier: 6.146A pdb=" N ALAJd 83 " --> pdb=" O ASPJd 125 " (cutoff:3.500A) removed outlier: 3.539A pdb=" N ALAKC 267 " --> pdb=" O SERJd 84 " (cutoff:3.500A) Processing sheet with id=AX1, first strand: chain 'Jd' and resid 105 through 109 Processing sheet with id=AX2, first strand: chain 'Jf' and resid 210 through 215 removed outlier: 7.148A pdb=" N TRPJf 221 " --> pdb=" O GLNJf 213 " (cutoff:3.500A) removed outlier: 5.381A pdb=" N VALJf 215 " --> pdb=" O ARGJf 219 " (cutoff:3.500A) removed outlier: 7.316A pdb=" N ARGJf 219 " --> pdb=" O VALJf 215 " (cutoff:3.500A) Processing sheet with id=AX3, first strand: chain 'Jf' and resid 237 through 238 removed outlier: 3.707A pdb=" N ILEJf 238 " --> pdb=" O GLYJf 242 " (cutoff:3.500A) removed outlier: 3.754A pdb=" N GLYJf 242 " --> pdb=" O ILEJf 238 " (cutoff:3.500A) removed outlier: 4.088A pdb=" N LEUJf 246 " --> pdb=" O LEUJf 255 " (cutoff:3.500A) Processing sheet with id=AX4, first strand: chain 'KC' and resid 105 through 106 removed outlier: 3.928A pdb=" N HISKC 139 " --> pdb=" O LEUKC 106 " (cutoff:3.500A) Processing sheet with id=AX5, first strand: chain 'KC' and resid 225 through 231 removed outlier: 6.924A pdb=" N TYRKC 225 " --> pdb=" O THRKC 250 " (cutoff:3.500A) removed outlier: 3.524A pdb=" N GLUKC 239 " --> pdb=" O ASPKC 236 " (cutoff:3.500A) Processing sheet with id=AX6, first strand: chain 'KC' and resid 225 through 231 removed outlier: 6.924A pdb=" N TYRKC 225 " --> pdb=" O THRKC 250 " (cutoff:3.500A) removed outlier: 7.351A pdb=" N ILELC 125 " --> pdb=" O LEULC 119 " (cutoff:3.500A) removed outlier: 7.107A pdb=" N LEULC 119 " --> pdb=" O ILELC 125 " (cutoff:3.500A) removed outlier: 6.809A pdb=" N ILELC 127 " --> pdb=" O LEULC 117 " (cutoff:3.500A) removed outlier: 6.773A pdb=" N LEULC 117 " --> pdb=" O ILELC 127 " (cutoff:3.500A) removed outlier: 6.978A pdb=" N ASPLC 129 " --> pdb=" O ASNLC 115 " (cutoff:3.500A) removed outlier: 6.638A pdb=" N VALLC 109 " --> pdb=" O ALALC 135 " (cutoff:3.500A) removed outlier: 4.848A pdb=" N ASNLC 115 " --> pdb=" O THRLH 329 " (cutoff:3.500A) removed outlier: 4.355A pdb=" N THRLH 329 " --> pdb=" O ASNLC 115 " (cutoff:3.500A) removed outlier: 6.161A pdb=" N ALALH 302 " --> pdb=" O VALLH 297 " (cutoff:3.500A) removed outlier: 5.425A pdb=" N VALLH 297 " --> pdb=" O ALALH 302 " (cutoff:3.500A) removed outlier: 4.720A pdb=" N ALALH 304 " --> pdb=" O LEULH 295 " (cutoff:3.500A) removed outlier: 3.862A pdb=" N THRLH 318 " --> pdb=" O SERLH 348 " (cutoff:3.500A) Processing sheet with id=AX7, first strand: chain 'KD' and resid 121 through 122 Processing sheet with id=AX8, first strand: chain 'KD' and resid 121 through 122 removed outlier: 6.478A pdb=" N ILEKK 114 " --> pdb=" O PHEKK 155 " (cutoff:3.500A) removed outlier: 8.128A pdb=" N GLNKK 157 " --> pdb=" O ILEKK 114 " (cutoff:3.500A) removed outlier: 6.224A pdb=" N VALKK 116 " --> pdb=" O GLNKK 157 " (cutoff:3.500A) removed outlier: 7.548A pdb=" N LEUKK 159 " --> pdb=" O VALKK 116 " (cutoff:3.500A) removed outlier: 7.864A pdb=" N SERKK 118 " --> pdb=" O LEUKK 159 " (cutoff:3.500A) removed outlier: 5.958A pdb=" N ALAKK 113 " --> pdb=" O ARGKK 185 " (cutoff:3.500A) removed outlier: 4.586A pdb=" N ARGKK 185 " --> pdb=" O ALAKK 113 " (cutoff:3.500A) Processing sheet with id=AX9, first strand: chain 'KD' and resid 105 through 109 removed outlier: 6.287A pdb=" N ARGKD 105 " --> pdb=" O VALKD 154 " (cutoff:3.500A) removed outlier: 7.800A pdb=" N LEUKD 156 " --> pdb=" O ARGKD 105 " (cutoff:3.500A) removed outlier: 6.503A pdb=" N ARGKD 107 " --> pdb=" O LEUKD 156 " (cutoff:3.500A) removed outlier: 8.074A pdb=" N TYRKD 158 " --> pdb=" O ARGKD 107 " (cutoff:3.500A) removed outlier: 7.229A pdb=" N LEUKD 109 " --> pdb=" O TYRKD 158 " (cutoff:3.500A) Processing sheet with id=AY1, first strand: chain 'KL' and resid 115 through 119 Processing sheet with id=AY2, first strand: chain 'KM' and resid 287 through 292 removed outlier: 10.188A pdb=" N ARGKM 247 " --> pdb=" O VALKM 266 " (cutoff:3.500A) removed outlier: 9.921A pdb=" N HISKM 268 " --> pdb=" O ARGKM 247 " (cutoff:3.500A) removed outlier: 6.132A pdb=" N GLNKM 249 " --> pdb=" O HISKM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERKM 270 " --> pdb=" O GLNKM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERKM 251 " --> pdb=" O SERKM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUKM 272 " --> pdb=" O SERKM 251 " (cutoff:3.500A) removed outlier: 6.486A pdb=" N VALKM 253 " --> pdb=" O LEUKM 272 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILEKM 227 " --> pdb=" O LEUKM 246 " (cutoff:3.500A) removed outlier: 7.292A pdb=" N ALAKM 248 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.101A pdb=" N ASNKM 229 " --> pdb=" O ALAKM 248 " (cutoff:3.500A) removed outlier: 6.015A pdb=" N ILEKM 207 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ASNKM 229 " --> pdb=" O ILEKM 207 " (cutoff:3.500A) removed outlier: 6.953A pdb=" N LYSKM 208 " --> pdb=" O GLYKM 187 " (cutoff:3.500A) removed outlier: 5.931A pdb=" N VALKM 189 " --> pdb=" O LYSKM 208 " (cutoff:3.500A) removed outlier: 4.382A pdb=" N VALKM 162 " --> pdb=" O LYSKM 182 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N LEUKM 184 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 4.268A pdb=" N GLNKM 164 " --> pdb=" O LEUKM 184 " (cutoff:3.500A) removed outlier: 7.344A pdb=" N SERKM 186 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 5.061A pdb=" N ASNKM 166 " --> pdb=" O SERKM 186 " (cutoff:3.500A) removed outlier: 8.848A pdb=" N PHEKM 188 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 5.691A pdb=" N VALKM 168 " --> pdb=" O PHEKM 188 " (cutoff:3.500A) removed outlier: 7.173A pdb=" N ASNKM 190 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERKM 170 " --> pdb=" O ASNKM 190 " (cutoff:3.500A) removed outlier: 9.140A pdb=" N ARGKM 192 " --> pdb=" O SERKM 170 " (cutoff:3.500A) removed outlier: 10.728A pdb=" N ASNKM 172 " --> pdb=" O ARGKM 192 " (cutoff:3.500A) removed outlier: 11.931A pdb=" N LEUKM 194 " --> pdb=" O ASNKM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNKM 174 " --> pdb=" O LEUKM 194 " (cutoff:3.500A) removed outlier: 10.816A pdb=" N METKM 196 " --> pdb=" O GLNKM 174 " (cutoff:3.500A) removed outlier: 9.613A pdb=" N VALKM 176 " --> pdb=" O METKM 196 " (cutoff:3.500A) removed outlier: 5.600A pdb=" N GLYKM 142 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N GLNKM 164 " --> pdb=" O GLYKM 142 " (cutoff:3.500A) removed outlier: 6.764A pdb=" N THRKM 144 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 7.831A pdb=" N ASNKM 166 " --> pdb=" O THRKM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUKM 146 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 7.671A pdb=" N VALKM 168 " --> pdb=" O LEUKM 146 " (cutoff:3.500A) removed outlier: 9.841A pdb=" N GLYKM 148 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 9.861A pdb=" N SERKM 170 " --> pdb=" O GLYKM 148 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNKM 128 " --> pdb=" O ALAKM 147 " (cutoff:3.500A) removed outlier: 6.545A pdb=" N ASNKM 149 " --> pdb=" O ASNKM 128 " (cutoff:3.500A) removed outlier: 5.173A pdb=" N ARGKM 130 " --> pdb=" O ASNKM 149 " (cutoff:3.500A) removed outlier: 4.368A pdb=" N ASNKM 127 " --> pdb=" O LEUKM 60 " (cutoff:3.500A) removed outlier: 5.094A pdb=" N THRKM 62 " --> pdb=" O ASNKM 127 " (cutoff:3.500A) removed outlier: 7.555A pdb=" N LEUKM 129 " --> pdb=" O THRKM 62 " (cutoff:3.500A) removed outlier: 6.600A pdb=" N ASNKM 57 " --> pdb=" O VALKM 106 " (cutoff:3.500A) removed outlier: 7.886A pdb=" N ILEKM 108 " --> pdb=" O ASNKM 57 " (cutoff:3.500A) removed outlier: 6.614A pdb=" N ASNKM 59 " --> pdb=" O ILEKM 108 " (cutoff:3.500A) removed outlier: 8.244A pdb=" N THRKM 110 " --> pdb=" O ASNKM 59 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N HISKM 61 " --> pdb=" O THRKM 110 " (cutoff:3.500A) removed outlier: 3.509A pdb=" N VALKM 69 " --> pdb=" O ARGKM 42 " (cutoff:3.500A) Processing sheet with id=AY3, first strand: chain 'KM' and resid 41 through 43 removed outlier: 3.509A pdb=" N VALKM 69 " --> pdb=" O ARGKM 42 " (cutoff:3.500A) removed outlier: 6.600A pdb=" N ASNKM 57 " --> pdb=" O VALKM 106 " (cutoff:3.500A) removed outlier: 7.886A pdb=" N ILEKM 108 " --> pdb=" O ASNKM 57 " (cutoff:3.500A) removed outlier: 6.614A pdb=" N ASNKM 59 " --> pdb=" O ILEKM 108 " (cutoff:3.500A) removed outlier: 8.244A pdb=" N THRKM 110 " --> pdb=" O ASNKM 59 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N HISKM 61 " --> pdb=" O THRKM 110 " (cutoff:3.500A) removed outlier: 4.368A pdb=" N ASNKM 127 " --> pdb=" O LEUKM 60 " (cutoff:3.500A) removed outlier: 5.094A pdb=" N THRKM 62 " --> pdb=" O ASNKM 127 " (cutoff:3.500A) removed outlier: 7.555A pdb=" N LEUKM 129 " --> pdb=" O THRKM 62 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNKM 128 " --> pdb=" O ALAKM 147 " (cutoff:3.500A) removed outlier: 6.545A pdb=" N ASNKM 149 " --> pdb=" O ASNKM 128 " (cutoff:3.500A) removed outlier: 5.173A pdb=" N ARGKM 130 " --> pdb=" O ASNKM 149 " (cutoff:3.500A) removed outlier: 5.600A pdb=" N GLYKM 142 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N GLNKM 164 " --> pdb=" O GLYKM 142 " (cutoff:3.500A) removed outlier: 6.764A pdb=" N THRKM 144 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 7.831A pdb=" N ASNKM 166 " --> pdb=" O THRKM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUKM 146 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 7.671A pdb=" N VALKM 168 " --> pdb=" O LEUKM 146 " (cutoff:3.500A) removed outlier: 9.841A pdb=" N GLYKM 148 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 9.861A pdb=" N SERKM 170 " --> pdb=" O GLYKM 148 " (cutoff:3.500A) removed outlier: 4.382A pdb=" N VALKM 162 " --> pdb=" O LYSKM 182 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N LEUKM 184 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 4.268A pdb=" N GLNKM 164 " --> pdb=" O LEUKM 184 " (cutoff:3.500A) removed outlier: 7.344A pdb=" N SERKM 186 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 5.061A pdb=" N ASNKM 166 " --> pdb=" O SERKM 186 " (cutoff:3.500A) removed outlier: 8.848A pdb=" N PHEKM 188 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 5.691A pdb=" N VALKM 168 " --> pdb=" O PHEKM 188 " (cutoff:3.500A) removed outlier: 7.173A pdb=" N ASNKM 190 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERKM 170 " --> pdb=" O ASNKM 190 " (cutoff:3.500A) removed outlier: 9.140A pdb=" N ARGKM 192 " --> pdb=" O SERKM 170 " (cutoff:3.500A) removed outlier: 10.728A pdb=" N ASNKM 172 " --> pdb=" O ARGKM 192 " (cutoff:3.500A) removed outlier: 11.931A pdb=" N LEUKM 194 " --> pdb=" O ASNKM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNKM 174 " --> pdb=" O LEUKM 194 " (cutoff:3.500A) removed outlier: 10.816A pdb=" N METKM 196 " --> pdb=" O GLNKM 174 " (cutoff:3.500A) removed outlier: 9.613A pdb=" N VALKM 176 " --> pdb=" O METKM 196 " (cutoff:3.500A) removed outlier: 3.548A pdb=" N THRKM 213 " --> pdb=" O ARGKM 192 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILEKM 227 " --> pdb=" O LEUKM 246 " (cutoff:3.500A) removed outlier: 7.292A pdb=" N ALAKM 248 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.101A pdb=" N ASNKM 229 " --> pdb=" O ALAKM 248 " (cutoff:3.500A) removed outlier: 10.188A pdb=" N ARGKM 247 " --> pdb=" O VALKM 266 " (cutoff:3.500A) removed outlier: 9.921A pdb=" N HISKM 268 " --> pdb=" O ARGKM 247 " (cutoff:3.500A) removed outlier: 6.132A pdb=" N GLNKM 249 " --> pdb=" O HISKM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERKM 270 " --> pdb=" O GLNKM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERKM 251 " --> pdb=" O SERKM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUKM 272 " --> pdb=" O SERKM 251 " (cutoff:3.500A) removed outlier: 6.486A pdb=" N VALKM 253 " --> pdb=" O LEUKM 272 " (cutoff:3.500A) Processing sheet with id=AY4, first strand: chain 'KM' and resid 297 through 299 removed outlier: 3.544A pdb=" N TYRKM 281 " --> pdb=" O LEUKM 299 " (cutoff:3.500A) removed outlier: 6.928A pdb=" N ILEKM 222 " --> pdb=" O LYSKM 242 " (cutoff:3.500A) removed outlier: 4.382A pdb=" N VALKM 162 " --> pdb=" O LYSKM 182 " (cutoff:3.500A) removed outlier: 7.457A pdb=" N LEUKM 184 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 4.268A pdb=" N GLNKM 164 " --> pdb=" O LEUKM 184 " (cutoff:3.500A) removed outlier: 7.344A pdb=" N SERKM 186 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 5.061A pdb=" N ASNKM 166 " --> pdb=" O SERKM 186 " (cutoff:3.500A) removed outlier: 8.848A pdb=" N PHEKM 188 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 5.691A pdb=" N VALKM 168 " --> pdb=" O PHEKM 188 " (cutoff:3.500A) removed outlier: 7.173A pdb=" N ASNKM 190 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 7.815A pdb=" N SERKM 170 " --> pdb=" O ASNKM 190 " (cutoff:3.500A) removed outlier: 9.140A pdb=" N ARGKM 192 " --> pdb=" O SERKM 170 " (cutoff:3.500A) removed outlier: 10.728A pdb=" N ASNKM 172 " --> pdb=" O ARGKM 192 " (cutoff:3.500A) removed outlier: 11.931A pdb=" N LEUKM 194 " --> pdb=" O ASNKM 172 " (cutoff:3.500A) removed outlier: 10.300A pdb=" N GLNKM 174 " --> pdb=" O LEUKM 194 " (cutoff:3.500A) removed outlier: 10.816A pdb=" N METKM 196 " --> pdb=" O GLNKM 174 " (cutoff:3.500A) removed outlier: 9.613A pdb=" N VALKM 176 " --> pdb=" O METKM 196 " (cutoff:3.500A) removed outlier: 5.600A pdb=" N GLYKM 142 " --> pdb=" O VALKM 162 " (cutoff:3.500A) removed outlier: 7.031A pdb=" N GLNKM 164 " --> pdb=" O GLYKM 142 " (cutoff:3.500A) removed outlier: 6.764A pdb=" N THRKM 144 " --> pdb=" O GLNKM 164 " (cutoff:3.500A) removed outlier: 7.831A pdb=" N ASNKM 166 " --> pdb=" O THRKM 144 " (cutoff:3.500A) removed outlier: 6.791A pdb=" N LEUKM 146 " --> pdb=" O ASNKM 166 " (cutoff:3.500A) removed outlier: 7.671A pdb=" N VALKM 168 " --> pdb=" O LEUKM 146 " (cutoff:3.500A) removed outlier: 9.841A pdb=" N GLYKM 148 " --> pdb=" O VALKM 168 " (cutoff:3.500A) removed outlier: 9.861A pdb=" N SERKM 170 " --> pdb=" O GLYKM 148 " (cutoff:3.500A) removed outlier: 3.581A pdb=" N ASNKM 128 " --> pdb=" O ALAKM 147 " (cutoff:3.500A) removed outlier: 6.545A pdb=" N ASNKM 149 " --> pdb=" O ASNKM 128 " (cutoff:3.500A) removed outlier: 5.173A pdb=" N ARGKM 130 " --> pdb=" O ASNKM 149 " (cutoff:3.500A) removed outlier: 4.368A pdb=" N ASNKM 127 " --> pdb=" O LEUKM 60 " (cutoff:3.500A) removed outlier: 5.094A pdb=" N THRKM 62 " --> pdb=" O ASNKM 127 " (cutoff:3.500A) removed outlier: 7.555A pdb=" N LEUKM 129 " --> pdb=" O THRKM 62 " (cutoff:3.500A) removed outlier: 6.600A pdb=" N ASNKM 57 " --> pdb=" O VALKM 106 " (cutoff:3.500A) removed outlier: 7.886A pdb=" N ILEKM 108 " --> pdb=" O ASNKM 57 " (cutoff:3.500A) removed outlier: 6.614A pdb=" N ASNKM 59 " --> pdb=" O ILEKM 108 " (cutoff:3.500A) removed outlier: 8.244A pdb=" N THRKM 110 " --> pdb=" O ASNKM 59 " (cutoff:3.500A) removed outlier: 6.841A pdb=" N HISKM 61 " --> pdb=" O THRKM 110 " (cutoff:3.500A) removed outlier: 3.509A pdb=" N VALKM 69 " --> pdb=" O ARGKM 42 " (cutoff:3.500A) Processing sheet with id=AY5, first strand: chain 'KM' and resid 287 through 292 removed outlier: 10.188A pdb=" N ARGKM 247 " --> pdb=" O VALKM 266 " (cutoff:3.500A) removed outlier: 9.921A pdb=" N HISKM 268 " --> pdb=" O ARGKM 247 " (cutoff:3.500A) removed outlier: 6.132A pdb=" N GLNKM 249 " --> pdb=" O HISKM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERKM 270 " --> pdb=" O GLNKM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERKM 251 " --> pdb=" O SERKM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUKM 272 " --> pdb=" O SERKM 251 " (cutoff:3.500A) removed outlier: 6.486A pdb=" N VALKM 253 " --> pdb=" O LEUKM 272 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILEKM 227 " --> pdb=" O LEUKM 246 " (cutoff:3.500A) removed outlier: 7.292A pdb=" N ALAKM 248 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.101A pdb=" N ASNKM 229 " --> pdb=" O ALAKM 248 " (cutoff:3.500A) removed outlier: 6.015A pdb=" N ILEKM 207 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.868A pdb=" N ASNKM 229 " --> pdb=" O ILEKM 207 " (cutoff:3.500A) removed outlier: 6.953A pdb=" N LYSKM 208 " --> pdb=" O GLYKM 187 " (cutoff:3.500A) removed outlier: 5.931A pdb=" N VALKM 189 " --> pdb=" O LYSKM 208 " (cutoff:3.500A) removed outlier: 6.928A pdb=" N ILEKM 222 " --> pdb=" O LYSKM 242 " (cutoff:3.500A) removed outlier: 3.544A pdb=" N TYRKM 281 " --> pdb=" O LEUKM 299 " (cutoff:3.500A) Processing sheet with id=AY6, first strand: chain 'KM' and resid 297 through 299 removed outlier: 3.544A pdb=" N TYRKM 281 " --> pdb=" O LEUKM 299 " (cutoff:3.500A) removed outlier: 6.928A pdb=" N ILEKM 222 " --> pdb=" O LYSKM 242 " (cutoff:3.500A) removed outlier: 3.548A pdb=" N THRKM 213 " --> pdb=" O ARGKM 192 " (cutoff:3.500A) removed outlier: 6.734A pdb=" N ILEKM 227 " --> pdb=" O LEUKM 246 " (cutoff:3.500A) removed outlier: 7.292A pdb=" N ALAKM 248 " --> pdb=" O ILEKM 227 " (cutoff:3.500A) removed outlier: 7.101A pdb=" N ASNKM 229 " --> pdb=" O ALAKM 248 " (cutoff:3.500A) removed outlier: 10.188A pdb=" N ARGKM 247 " --> pdb=" O VALKM 266 " (cutoff:3.500A) removed outlier: 9.921A pdb=" N HISKM 268 " --> pdb=" O ARGKM 247 " (cutoff:3.500A) removed outlier: 6.132A pdb=" N GLNKM 249 " --> pdb=" O HISKM 268 " (cutoff:3.500A) removed outlier: 7.795A pdb=" N SERKM 270 " --> pdb=" O GLNKM 249 " (cutoff:3.500A) removed outlier: 6.165A pdb=" N SERKM 251 " --> pdb=" O SERKM 270 " (cutoff:3.500A) removed outlier: 7.973A pdb=" N LEUKM 272 " --> pdb=" O SERKM 251 " (cutoff:3.500A) removed outlier: 6.486A pdb=" N VALKM 253 " --> pdb=" O LEUKM 272 " (cutoff:3.500A) Processing sheet with id=AY7, first strand: chain 'KM' and resid 81 through 84 removed outlier: 3.516A pdb=" N ARGKM 82 " --> pdb=" O SERKM 93 " (cutoff:3.500A) removed outlier: 3.742A pdb=" N SERKM 93 " --> pdb=" O ARGKM 82 " (cutoff:3.500A) removed outlier: 3.535A pdb=" N ILEKM 84 " --> pdb=" O TYRKM 91 " (cutoff:3.500A) removed outlier: 4.282A pdb=" N LEUKM 94 " --> pdb=" O GLNKM 53 " (cutoff:3.500A) Processing sheet with id=AY8, first strand: chain 'KN' and resid 48 through 52 removed outlier: 6.689A pdb=" N VALKN 59 " --> pdb=" O ASNKN 49 " (cutoff:3.500A) removed outlier: 4.893A pdb=" N CYSKN 51 " --> pdb=" O ARGKN 57 " (cutoff:3.500A) removed outlier: 6.544A pdb=" N ARGKN 57 " --> pdb=" O CYSKN 51 " (cutoff:3.500A) removed outlier: 4.902A pdb=" N LEUKN 58 " --> pdb=" O SERKN 66 " (cutoff:3.500A) Processing sheet with id=AY9, first strand: chain 'Kd' and resid 118 through 127 removed outlier: 3.750A pdb=" N ASPKd 125 " --> pdb=" O ALAKd 83 " (cutoff:3.500A) removed outlier: 6.246A pdb=" N ALAKd 83 " --> pdb=" O ASPKd 125 " (cutoff:3.500A) removed outlier: 3.652A pdb=" N ALALC 267 " --> pdb=" O SERKd 84 " (cutoff:3.500A) Processing sheet with id=AZ1, first strand: chain 'Kd' and resid 105 through 109 Processing sheet with id=AZ2, first strand: chain 'Kf' and resid 210 through 215 removed outlier: 7.098A pdb=" N TRPKf 221 " --> pdb=" O GLNKf 213 " (cutoff:3.500A) Processing sheet with id=AZ3, first strand: chain 'Kf' and resid 237 through 238 removed outlier: 3.659A pdb=" N LYSKf 245 " --> pdb=" O LEUKf 255 " (cutoff:3.500A) removed outlier: 7.272A pdb=" N LEUKf 255 " --> pdb=" O LYSKf 245 " (cutoff:3.500A) removed outlier: 5.259A pdb=" N ILEKf 247 " --> pdb=" O ARGKf 253 " (cutoff:3.500A) removed outlier: 7.605A pdb=" N ARGKf 253 " --> pdb=" O ILEKf 247 " (cutoff:3.500A) Processing sheet with id=AZ4, first strand: chain 'LC' and resid 105 through 106 removed outlier: 3.959A pdb=" N HISLC 139 " --> pdb=" O LEULC 106 " (cutoff:3.500A) Processing sheet with id=AZ5, first strand: chain 'LC' and resid 225 through 231 removed outlier: 6.691A pdb=" N TYRLC 225 " --> pdb=" O THRLC 250 " (cutoff:3.500A) removed outlier: 3.792A pdb=" N ASPLC 244 " --> pdb=" O LEULC 231 " (cutoff:3.500A) removed outlier: 3.504A pdb=" N GLULC 239 " --> pdb=" O ASPLC 236 " (cutoff:3.500A) Processing sheet with id=AZ6, first strand: chain 'LC' and resid 225 through 231 removed outlier: 6.691A pdb=" N TYRLC 225 " --> pdb=" O THRLC 250 " (cutoff:3.500A) removed outlier: 3.792A pdb=" N ASPLC 244 " --> pdb=" O LEULC 231 " (cutoff:3.500A) removed outlier: 7.295A pdb=" N ILEMC 125 " --> pdb=" O LEUMC 119 " (cutoff:3.500A) removed outlier: 7.058A pdb=" N LEUMC 119 " --> pdb=" O ILEMC 125 " (cutoff:3.500A) removed outlier: 6.867A pdb=" N ILEMC 127 " --> pdb=" O LEUMC 117 " (cutoff:3.500A) removed outlier: 6.824A pdb=" N LEUMC 117 " --> pdb=" O ILEMC 127 " (cutoff:3.500A) removed outlier: 6.947A pdb=" N ASPMC 129 " --> pdb=" O ASNMC 115 " (cutoff:3.500A) removed outlier: 6.636A pdb=" N VALMC 109 " --> pdb=" O ALAMC 135 " (cutoff:3.500A) removed outlier: 4.837A pdb=" N ASNMC 115 " --> pdb=" O THRMH 329 " (cutoff:3.500A) removed outlier: 4.354A pdb=" N THRMH 329 " --> pdb=" O ASNMC 115 " (cutoff:3.500A) removed outlier: 6.158A pdb=" N ALAMH 302 " --> pdb=" O VALMH 297 " (cutoff:3.500A) removed outlier: 5.323A pdb=" N VALMH 297 " --> pdb=" O ALAMH 302 " (cutoff:3.500A) removed outlier: 4.622A pdb=" N ALAMH 304 " --> pdb=" O LEUMH 295 " (cutoff:3.500A) removed outlier: 3.802A pdb=" N THRMH 318 " --> pdb=" O SERMH 348 " (cutoff:3.500A) Processing sheet with id=AZ7, first strand: chain 'LD' and resid 121 through 122 Processing sheet with id=AZ8, first strand: chain 'LD' and resid 121 through 122 removed outlier: 6.486A pdb=" N ILELK 114 " --> pdb=" O PHELK 155 " (cutoff:3.500A) removed outlier: 8.083A pdb=" N GLNLK 157 " --> pdb=" O ILELK 114 " (cutoff:3.500A) removed outlier: 6.220A pdb=" N VALLK 116 " --> pdb=" O GLNLK 157 " (cutoff:3.500A) removed outlier: 7.545A pdb=" N LEULK 159 " --> pdb=" O VALLK 116 " (cutoff:3.500A) removed outlier: 7.865A pdb=" N SERLK 118 " --> pdb=" O LEULK 159 " (cutoff:3.500A) removed outlier: 6.020A pdb=" N ALALK 113 " --> pdb=" O ARGLK 185 " (cutoff:3.500A) removed outlier: 4.600A pdb=" N ARGLK 185 " --> pdb=" O ALALK 113 " (cutoff:3.500A) Processing sheet with id=AZ9, first strand: chain 'LD' and resid 105 through 109 removed outlier: 6.271A pdb=" N ARGLD 105 " --> pdb=" O VALLD 154 " (cutoff:3.500A) removed outlier: 7.759A pdb=" N LEULD 156 " --> pdb=" O ARGLD 105 " (cutoff:3.500A) removed outlier: 6.470A pdb=" N ARGLD 107 " --> pdb=" O LEULD 156 " (cutoff:3.500A) removed outlier: 8.061A pdb=" N TYRLD 158 " --> pdb=" O ARGLD 107 " (cutoff:3.500A) removed outlier: 7.198A pdb=" N LEULD 109 " --> pdb=" O TYRLD 158 " (cutoff:3.500A) Processing sheet with id=BA1, first strand: chain 'LL' and resid 115 through 119 removed outlier: 3.649A pdb=" N THRLL 122 " --> pdb=" O TYRLL 119 " (cutoff:3.500A) Processing sheet with id=BA2, first strand: chain 'LM' and resid 41 through 43 removed outlier: 6.568A pdb=" N ASNLM 57 " --> pdb=" O VALLM 106 " (cutoff:3.500A) removed outlier: 7.882A pdb=" N ILELM 108 " --> pdb=" O ASNLM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNLM 59 " --> pdb=" O ILELM 108 " (cutoff:3.500A) removed outlier: 8.232A pdb=" N THRLM 110 " --> pdb=" O ASNLM 59 " (cutoff:3.500A) removed outlier: 6.812A pdb=" N HISLM 61 " --> pdb=" O THRLM 110 " (cutoff:3.500A) removed outlier: 6.343A pdb=" N VALLM 58 " --> pdb=" O THRLM 125 " (cutoff:3.500A) removed outlier: 8.517A pdb=" N ASNLM 127 " --> pdb=" O VALLM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEULM 60 " --> pdb=" O ASNLM 127 " (cutoff:3.500A) removed outlier: 7.771A pdb=" N LEULM 129 " --> pdb=" O LEULM 60 " (cutoff:3.500A) removed outlier: 9.010A pdb=" N THRLM 62 " --> pdb=" O LEULM 129 " (cutoff:3.500A) removed outlier: 3.585A pdb=" N ASNLM 128 " --> pdb=" O ALALM 147 " (cutoff:3.500A) removed outlier: 6.480A pdb=" N ASNLM 149 " --> pdb=" O ASNLM 128 " (cutoff:3.500A) removed outlier: 5.201A pdb=" N ARGLM 130 " --> pdb=" O ASNLM 149 " (cutoff:3.500A) removed outlier: 5.481A pdb=" N GLYLM 142 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 7.045A pdb=" N GLNLM 164 " --> pdb=" O GLYLM 142 " (cutoff:3.500A) removed outlier: 6.612A pdb=" N THRLM 144 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 7.872A pdb=" N ASNLM 166 " --> pdb=" O THRLM 144 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N LEULM 146 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 7.584A pdb=" N VALLM 168 " --> pdb=" O LEULM 146 " (cutoff:3.500A) removed outlier: 9.878A pdb=" N GLYLM 148 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 9.931A pdb=" N SERLM 170 " --> pdb=" O GLYLM 148 " (cutoff:3.500A) removed outlier: 4.372A pdb=" N VALLM 162 " --> pdb=" O LYSLM 182 " (cutoff:3.500A) removed outlier: 7.385A pdb=" N LEULM 184 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 4.236A pdb=" N GLNLM 164 " --> pdb=" O LEULM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERLM 186 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 5.085A pdb=" N ASNLM 166 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.862A pdb=" N PHELM 188 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 5.723A pdb=" N VALLM 168 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 7.157A pdb=" N ASNLM 190 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 7.744A pdb=" N SERLM 170 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 9.126A pdb=" N ARGLM 192 " --> pdb=" O SERLM 170 " (cutoff:3.500A) removed outlier: 10.752A pdb=" N ASNLM 172 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 11.898A pdb=" N LEULM 194 " --> pdb=" O ASNLM 172 " (cutoff:3.500A) removed outlier: 10.282A pdb=" N GLNLM 174 " --> pdb=" O LEULM 194 " (cutoff:3.500A) removed outlier: 10.888A pdb=" N METLM 196 " --> pdb=" O GLNLM 174 " (cutoff:3.500A) removed outlier: 9.645A pdb=" N VALLM 176 " --> pdb=" O METLM 196 " (cutoff:3.500A) removed outlier: 3.512A pdb=" N SERLM 203 " --> pdb=" O VALLM 183 " (cutoff:3.500A) removed outlier: 6.745A pdb=" N ILELM 222 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 7.052A pdb=" N LYSLM 244 " --> pdb=" O ILELM 222 " (cutoff:3.500A) removed outlier: 6.789A pdb=" N VALLM 260 " --> pdb=" O GLNLM 240 " (cutoff:3.500A) removed outlier: 5.556A pdb=" N LYSLM 242 " --> pdb=" O VALLM 260 " (cutoff:3.500A) removed outlier: 6.695A pdb=" N GLULM 262 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 3.580A pdb=" N LYSLM 244 " --> pdb=" O GLULM 262 " (cutoff:3.500A) removed outlier: 6.889A pdb=" N SERLM 264 " --> pdb=" O LYSLM 244 " (cutoff:3.500A) removed outlier: 6.096A pdb=" N LEULM 246 " --> pdb=" O SERLM 264 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALLM 266 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.902A pdb=" N ALALM 248 " --> pdb=" O VALLM 266 " (cutoff:3.500A) removed outlier: 5.507A pdb=" N HISLM 268 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 4.286A pdb=" N ARGLM 250 " --> pdb=" O HISLM 268 " (cutoff:3.500A) removed outlier: 7.377A pdb=" N SERLM 270 " --> pdb=" O ARGLM 250 " (cutoff:3.500A) removed outlier: 4.065A pdb=" N PHELM 252 " --> pdb=" O SERLM 270 " (cutoff:3.500A) removed outlier: 7.476A pdb=" N LEULM 272 " --> pdb=" O PHELM 252 " (cutoff:3.500A) removed outlier: 4.322A pdb=" N LYSLM 254 " --> pdb=" O LEULM 272 " (cutoff:3.500A) Processing sheet with id=BA3, first strand: chain 'LM' and resid 287 through 292 removed outlier: 6.789A pdb=" N VALLM 260 " --> pdb=" O GLNLM 240 " (cutoff:3.500A) removed outlier: 5.556A pdb=" N LYSLM 242 " --> pdb=" O VALLM 260 " (cutoff:3.500A) removed outlier: 6.695A pdb=" N GLULM 262 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 3.580A pdb=" N LYSLM 244 " --> pdb=" O GLULM 262 " (cutoff:3.500A) removed outlier: 6.889A pdb=" N SERLM 264 " --> pdb=" O LYSLM 244 " (cutoff:3.500A) removed outlier: 6.096A pdb=" N LEULM 246 " --> pdb=" O SERLM 264 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALLM 266 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.902A pdb=" N ALALM 248 " --> pdb=" O VALLM 266 " (cutoff:3.500A) removed outlier: 5.507A pdb=" N HISLM 268 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 4.286A pdb=" N ARGLM 250 " --> pdb=" O HISLM 268 " (cutoff:3.500A) removed outlier: 7.377A pdb=" N SERLM 270 " --> pdb=" O ARGLM 250 " (cutoff:3.500A) removed outlier: 4.065A pdb=" N PHELM 252 " --> pdb=" O SERLM 270 " (cutoff:3.500A) removed outlier: 7.476A pdb=" N LEULM 272 " --> pdb=" O PHELM 252 " (cutoff:3.500A) removed outlier: 4.322A pdb=" N LYSLM 254 " --> pdb=" O LEULM 272 " (cutoff:3.500A) removed outlier: 6.804A pdb=" N ILELM 227 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.206A pdb=" N ALALM 248 " --> pdb=" O ILELM 227 " (cutoff:3.500A) removed outlier: 7.059A pdb=" N ASNLM 229 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 7.025A pdb=" N LYSLM 208 " --> pdb=" O GLYLM 226 " (cutoff:3.500A) removed outlier: 7.239A pdb=" N VALLM 228 " --> pdb=" O LYSLM 208 " (cutoff:3.500A) removed outlier: 6.834A pdb=" N ASPLM 210 " --> pdb=" O VALLM 228 " (cutoff:3.500A) removed outlier: 8.880A pdb=" N ILELM 207 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.120A pdb=" N PHELM 188 " --> pdb=" O ILELM 207 " (cutoff:3.500A) removed outlier: 8.926A pdb=" N SERLM 209 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 8.077A pdb=" N ASNLM 190 " --> pdb=" O SERLM 209 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N THRLM 211 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 4.745A pdb=" N ARGLM 192 " --> pdb=" O THRLM 211 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N THRLM 213 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 4.372A pdb=" N VALLM 162 " --> pdb=" O LYSLM 182 " (cutoff:3.500A) removed outlier: 7.385A pdb=" N LEULM 184 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 4.236A pdb=" N GLNLM 164 " --> pdb=" O LEULM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERLM 186 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 5.085A pdb=" N ASNLM 166 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.862A pdb=" N PHELM 188 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 5.723A pdb=" N VALLM 168 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 7.157A pdb=" N ASNLM 190 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 7.744A pdb=" N SERLM 170 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 9.126A pdb=" N ARGLM 192 " --> pdb=" O SERLM 170 " (cutoff:3.500A) removed outlier: 10.752A pdb=" N ASNLM 172 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 11.898A pdb=" N LEULM 194 " --> pdb=" O ASNLM 172 " (cutoff:3.500A) removed outlier: 10.282A pdb=" N GLNLM 174 " --> pdb=" O LEULM 194 " (cutoff:3.500A) removed outlier: 10.888A pdb=" N METLM 196 " --> pdb=" O GLNLM 174 " (cutoff:3.500A) removed outlier: 9.645A pdb=" N VALLM 176 " --> pdb=" O METLM 196 " (cutoff:3.500A) removed outlier: 5.481A pdb=" N GLYLM 142 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 7.045A pdb=" N GLNLM 164 " --> pdb=" O GLYLM 142 " (cutoff:3.500A) removed outlier: 6.612A pdb=" N THRLM 144 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 7.872A pdb=" N ASNLM 166 " --> pdb=" O THRLM 144 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N LEULM 146 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 7.584A pdb=" N VALLM 168 " --> pdb=" O LEULM 146 " (cutoff:3.500A) removed outlier: 9.878A pdb=" N GLYLM 148 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 9.931A pdb=" N SERLM 170 " --> pdb=" O GLYLM 148 " (cutoff:3.500A) removed outlier: 3.585A pdb=" N ASNLM 128 " --> pdb=" O ALALM 147 " (cutoff:3.500A) removed outlier: 6.480A pdb=" N ASNLM 149 " --> pdb=" O ASNLM 128 " (cutoff:3.500A) removed outlier: 5.201A pdb=" N ARGLM 130 " --> pdb=" O ASNLM 149 " (cutoff:3.500A) removed outlier: 6.343A pdb=" N VALLM 58 " --> pdb=" O THRLM 125 " (cutoff:3.500A) removed outlier: 8.517A pdb=" N ASNLM 127 " --> pdb=" O VALLM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEULM 60 " --> pdb=" O ASNLM 127 " (cutoff:3.500A) removed outlier: 7.771A pdb=" N LEULM 129 " --> pdb=" O LEULM 60 " (cutoff:3.500A) removed outlier: 9.010A pdb=" N THRLM 62 " --> pdb=" O LEULM 129 " (cutoff:3.500A) removed outlier: 6.568A pdb=" N ASNLM 57 " --> pdb=" O VALLM 106 " (cutoff:3.500A) removed outlier: 7.882A pdb=" N ILELM 108 " --> pdb=" O ASNLM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNLM 59 " --> pdb=" O ILELM 108 " (cutoff:3.500A) removed outlier: 8.232A pdb=" N THRLM 110 " --> pdb=" O ASNLM 59 " (cutoff:3.500A) removed outlier: 6.812A pdb=" N HISLM 61 " --> pdb=" O THRLM 110 " (cutoff:3.500A) Processing sheet with id=BA4, first strand: chain 'LM' and resid 41 through 43 removed outlier: 6.568A pdb=" N ASNLM 57 " --> pdb=" O VALLM 106 " (cutoff:3.500A) removed outlier: 7.882A pdb=" N ILELM 108 " --> pdb=" O ASNLM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNLM 59 " --> pdb=" O ILELM 108 " (cutoff:3.500A) removed outlier: 8.232A pdb=" N THRLM 110 " --> pdb=" O ASNLM 59 " (cutoff:3.500A) removed outlier: 6.812A pdb=" N HISLM 61 " --> pdb=" O THRLM 110 " (cutoff:3.500A) removed outlier: 6.343A pdb=" N VALLM 58 " --> pdb=" O THRLM 125 " (cutoff:3.500A) removed outlier: 8.517A pdb=" N ASNLM 127 " --> pdb=" O VALLM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEULM 60 " --> pdb=" O ASNLM 127 " (cutoff:3.500A) removed outlier: 7.771A pdb=" N LEULM 129 " --> pdb=" O LEULM 60 " (cutoff:3.500A) removed outlier: 9.010A pdb=" N THRLM 62 " --> pdb=" O LEULM 129 " (cutoff:3.500A) removed outlier: 3.585A pdb=" N ASNLM 128 " --> pdb=" O ALALM 147 " (cutoff:3.500A) removed outlier: 6.480A pdb=" N ASNLM 149 " --> pdb=" O ASNLM 128 " (cutoff:3.500A) removed outlier: 5.201A pdb=" N ARGLM 130 " --> pdb=" O ASNLM 149 " (cutoff:3.500A) removed outlier: 5.481A pdb=" N GLYLM 142 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 7.045A pdb=" N GLNLM 164 " --> pdb=" O GLYLM 142 " (cutoff:3.500A) removed outlier: 6.612A pdb=" N THRLM 144 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 7.872A pdb=" N ASNLM 166 " --> pdb=" O THRLM 144 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N LEULM 146 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 7.584A pdb=" N VALLM 168 " --> pdb=" O LEULM 146 " (cutoff:3.500A) removed outlier: 9.878A pdb=" N GLYLM 148 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 9.931A pdb=" N SERLM 170 " --> pdb=" O GLYLM 148 " (cutoff:3.500A) removed outlier: 4.372A pdb=" N VALLM 162 " --> pdb=" O LYSLM 182 " (cutoff:3.500A) removed outlier: 7.385A pdb=" N LEULM 184 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 4.236A pdb=" N GLNLM 164 " --> pdb=" O LEULM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERLM 186 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 5.085A pdb=" N ASNLM 166 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.862A pdb=" N PHELM 188 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 5.723A pdb=" N VALLM 168 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 7.157A pdb=" N ASNLM 190 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 7.744A pdb=" N SERLM 170 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 9.126A pdb=" N ARGLM 192 " --> pdb=" O SERLM 170 " (cutoff:3.500A) removed outlier: 10.752A pdb=" N ASNLM 172 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 11.898A pdb=" N LEULM 194 " --> pdb=" O ASNLM 172 " (cutoff:3.500A) removed outlier: 10.282A pdb=" N GLNLM 174 " --> pdb=" O LEULM 194 " (cutoff:3.500A) removed outlier: 10.888A pdb=" N METLM 196 " --> pdb=" O GLNLM 174 " (cutoff:3.500A) removed outlier: 9.645A pdb=" N VALLM 176 " --> pdb=" O METLM 196 " (cutoff:3.500A) removed outlier: 3.512A pdb=" N SERLM 203 " --> pdb=" O VALLM 183 " (cutoff:3.500A) removed outlier: 6.745A pdb=" N ILELM 222 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 7.052A pdb=" N LYSLM 244 " --> pdb=" O ILELM 222 " (cutoff:3.500A) removed outlier: 6.789A pdb=" N VALLM 260 " --> pdb=" O GLNLM 240 " (cutoff:3.500A) removed outlier: 5.556A pdb=" N LYSLM 242 " --> pdb=" O VALLM 260 " (cutoff:3.500A) removed outlier: 6.695A pdb=" N GLULM 262 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 3.580A pdb=" N LYSLM 244 " --> pdb=" O GLULM 262 " (cutoff:3.500A) removed outlier: 6.889A pdb=" N SERLM 264 " --> pdb=" O LYSLM 244 " (cutoff:3.500A) removed outlier: 6.096A pdb=" N LEULM 246 " --> pdb=" O SERLM 264 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALLM 266 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.902A pdb=" N ALALM 248 " --> pdb=" O VALLM 266 " (cutoff:3.500A) removed outlier: 5.507A pdb=" N HISLM 268 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 4.286A pdb=" N ARGLM 250 " --> pdb=" O HISLM 268 " (cutoff:3.500A) removed outlier: 7.377A pdb=" N SERLM 270 " --> pdb=" O ARGLM 250 " (cutoff:3.500A) removed outlier: 4.065A pdb=" N PHELM 252 " --> pdb=" O SERLM 270 " (cutoff:3.500A) removed outlier: 7.476A pdb=" N LEULM 272 " --> pdb=" O PHELM 252 " (cutoff:3.500A) removed outlier: 4.322A pdb=" N LYSLM 254 " --> pdb=" O LEULM 272 " (cutoff:3.500A) removed outlier: 3.796A pdb=" N TYRLM 281 " --> pdb=" O LEULM 299 " (cutoff:3.500A) Processing sheet with id=BA5, first strand: chain 'LM' and resid 297 through 299 removed outlier: 3.796A pdb=" N TYRLM 281 " --> pdb=" O LEULM 299 " (cutoff:3.500A) removed outlier: 6.789A pdb=" N VALLM 260 " --> pdb=" O GLNLM 240 " (cutoff:3.500A) removed outlier: 5.556A pdb=" N LYSLM 242 " --> pdb=" O VALLM 260 " (cutoff:3.500A) removed outlier: 6.695A pdb=" N GLULM 262 " --> pdb=" O LYSLM 242 " (cutoff:3.500A) removed outlier: 3.580A pdb=" N LYSLM 244 " --> pdb=" O GLULM 262 " (cutoff:3.500A) removed outlier: 6.889A pdb=" N SERLM 264 " --> pdb=" O LYSLM 244 " (cutoff:3.500A) removed outlier: 6.096A pdb=" N LEULM 246 " --> pdb=" O SERLM 264 " (cutoff:3.500A) removed outlier: 7.075A pdb=" N VALLM 266 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.902A pdb=" N ALALM 248 " --> pdb=" O VALLM 266 " (cutoff:3.500A) removed outlier: 5.507A pdb=" N HISLM 268 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 4.286A pdb=" N ARGLM 250 " --> pdb=" O HISLM 268 " (cutoff:3.500A) removed outlier: 7.377A pdb=" N SERLM 270 " --> pdb=" O ARGLM 250 " (cutoff:3.500A) removed outlier: 4.065A pdb=" N PHELM 252 " --> pdb=" O SERLM 270 " (cutoff:3.500A) removed outlier: 7.476A pdb=" N LEULM 272 " --> pdb=" O PHELM 252 " (cutoff:3.500A) removed outlier: 4.322A pdb=" N LYSLM 254 " --> pdb=" O LEULM 272 " (cutoff:3.500A) removed outlier: 6.804A pdb=" N ILELM 227 " --> pdb=" O LEULM 246 " (cutoff:3.500A) removed outlier: 7.206A pdb=" N ALALM 248 " --> pdb=" O ILELM 227 " (cutoff:3.500A) removed outlier: 7.059A pdb=" N ASNLM 229 " --> pdb=" O ALALM 248 " (cutoff:3.500A) removed outlier: 7.025A pdb=" N LYSLM 208 " --> pdb=" O GLYLM 226 " (cutoff:3.500A) removed outlier: 7.239A pdb=" N VALLM 228 " --> pdb=" O LYSLM 208 " (cutoff:3.500A) removed outlier: 6.834A pdb=" N ASPLM 210 " --> pdb=" O VALLM 228 " (cutoff:3.500A) removed outlier: 8.880A pdb=" N ILELM 207 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.120A pdb=" N PHELM 188 " --> pdb=" O ILELM 207 " (cutoff:3.500A) removed outlier: 8.926A pdb=" N SERLM 209 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 8.077A pdb=" N ASNLM 190 " --> pdb=" O SERLM 209 " (cutoff:3.500A) removed outlier: 7.988A pdb=" N THRLM 211 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 4.745A pdb=" N ARGLM 192 " --> pdb=" O THRLM 211 " (cutoff:3.500A) removed outlier: 3.525A pdb=" N THRLM 213 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 4.372A pdb=" N VALLM 162 " --> pdb=" O LYSLM 182 " (cutoff:3.500A) removed outlier: 7.385A pdb=" N LEULM 184 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 4.236A pdb=" N GLNLM 164 " --> pdb=" O LEULM 184 " (cutoff:3.500A) removed outlier: 7.403A pdb=" N SERLM 186 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 5.085A pdb=" N ASNLM 166 " --> pdb=" O SERLM 186 " (cutoff:3.500A) removed outlier: 8.862A pdb=" N PHELM 188 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 5.723A pdb=" N VALLM 168 " --> pdb=" O PHELM 188 " (cutoff:3.500A) removed outlier: 7.157A pdb=" N ASNLM 190 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 7.744A pdb=" N SERLM 170 " --> pdb=" O ASNLM 190 " (cutoff:3.500A) removed outlier: 9.126A pdb=" N ARGLM 192 " --> pdb=" O SERLM 170 " (cutoff:3.500A) removed outlier: 10.752A pdb=" N ASNLM 172 " --> pdb=" O ARGLM 192 " (cutoff:3.500A) removed outlier: 11.898A pdb=" N LEULM 194 " --> pdb=" O ASNLM 172 " (cutoff:3.500A) removed outlier: 10.282A pdb=" N GLNLM 174 " --> pdb=" O LEULM 194 " (cutoff:3.500A) removed outlier: 10.888A pdb=" N METLM 196 " --> pdb=" O GLNLM 174 " (cutoff:3.500A) removed outlier: 9.645A pdb=" N VALLM 176 " --> pdb=" O METLM 196 " (cutoff:3.500A) removed outlier: 5.481A pdb=" N GLYLM 142 " --> pdb=" O VALLM 162 " (cutoff:3.500A) removed outlier: 7.045A pdb=" N GLNLM 164 " --> pdb=" O GLYLM 142 " (cutoff:3.500A) removed outlier: 6.612A pdb=" N THRLM 144 " --> pdb=" O GLNLM 164 " (cutoff:3.500A) removed outlier: 7.872A pdb=" N ASNLM 166 " --> pdb=" O THRLM 144 " (cutoff:3.500A) removed outlier: 6.797A pdb=" N LEULM 146 " --> pdb=" O ASNLM 166 " (cutoff:3.500A) removed outlier: 7.584A pdb=" N VALLM 168 " --> pdb=" O LEULM 146 " (cutoff:3.500A) removed outlier: 9.878A pdb=" N GLYLM 148 " --> pdb=" O VALLM 168 " (cutoff:3.500A) removed outlier: 9.931A pdb=" N SERLM 170 " --> pdb=" O GLYLM 148 " (cutoff:3.500A) removed outlier: 3.585A pdb=" N ASNLM 128 " --> pdb=" O ALALM 147 " (cutoff:3.500A) removed outlier: 6.480A pdb=" N ASNLM 149 " --> pdb=" O ASNLM 128 " (cutoff:3.500A) removed outlier: 5.201A pdb=" N ARGLM 130 " --> pdb=" O ASNLM 149 " (cutoff:3.500A) removed outlier: 6.343A pdb=" N VALLM 58 " --> pdb=" O THRLM 125 " (cutoff:3.500A) removed outlier: 8.517A pdb=" N ASNLM 127 " --> pdb=" O VALLM 58 " (cutoff:3.500A) removed outlier: 7.006A pdb=" N LEULM 60 " --> pdb=" O ASNLM 127 " (cutoff:3.500A) removed outlier: 7.771A pdb=" N LEULM 129 " --> pdb=" O LEULM 60 " (cutoff:3.500A) removed outlier: 9.010A pdb=" N THRLM 62 " --> pdb=" O LEULM 129 " (cutoff:3.500A) removed outlier: 6.568A pdb=" N ASNLM 57 " --> pdb=" O VALLM 106 " (cutoff:3.500A) removed outlier: 7.882A pdb=" N ILELM 108 " --> pdb=" O ASNLM 57 " (cutoff:3.500A) removed outlier: 6.607A pdb=" N ASNLM 59 " --> pdb=" O ILELM 108 " (cutoff:3.500A) removed outlier: 8.232A pdb=" N THRLM 110 " --> pdb=" O ASNLM 59 " (cutoff:3.500A) removed outlier: 6.812A pdb=" N HISLM 61 " --> pdb=" O THRLM 110 " (cutoff:3.500A) Processing sheet with id=BA6, first strand: chain 'LM' and resid 287 through 292 removed outlier: 3.796A pdb=" N TYRLM 281 " --> pdb=" O LEULM 299 " (cutoff:3.500A) Processing sheet with id=BA7, first strand: chain 'LM' and resid 81 through 84 removed outlier: 3.734A pdb=" N SERLM 93 " --> pdb=" O ARGLM 82 " (cutoff:3.500A) removed outlier: 3.672A pdb=" N ILELM 84 " --> pdb=" O TYRLM 91 " (cutoff:3.500A) removed outlier: 4.256A pdb=" N LEULM 94 " --> pdb=" O GLNLM 53 " (cutoff:3.500A) removed outlier: 3.795A pdb=" N LEULM 136 " --> pdb=" O LYSLM 154 " (cutoff:3.500A) Processing sheet with id=BA8, first strand: chain 'LN' and resid 48 through 52 removed outlier: 6.708A pdb=" N VALLN 59 " --> pdb=" O ASNLN 49 " (cutoff:3.500A) removed outlier: 4.857A pdb=" N CYSLN 51 " --> pdb=" O ARGLN 57 " (cutoff:3.500A) removed outlier: 6.467A pdb=" N ARGLN 57 " --> pdb=" O CYSLN 51 " (cutoff:3.500A) removed outlier: 4.990A pdb=" N LEULN 58 " --> pdb=" O SERLN 66 " (cutoff:3.500A) Processing sheet with id=BA9, first strand: chain 'Ld' and resid 118 through 127 removed outlier: 3.597A pdb=" N ASPLd 125 " --> pdb=" O ALALd 83 " (cutoff:3.500A) removed outlier: 6.229A pdb=" N ALALd 83 " --> pdb=" O ASPLd 125 " (cutoff:3.500A) removed outlier: 3.538A pdb=" N ALAMC 267 " --> pdb=" O SERLd 84 " (cutoff:3.500A) Processing sheet with id=BB1, first strand: chain 'Ld' and resid 105 through 109 Processing sheet with id=BB2, first strand: chain 'Lf' and resid 210 through 216 removed outlier: 7.142A pdb=" N TRPLf 221 " --> pdb=" O GLNLf 213 " (cutoff:3.500A) removed outlier: 5.359A pdb=" N VALLf 215 " --> pdb=" O ARGLf 219 " (cutoff:3.500A) removed outlier: 7.382A pdb=" N ARGLf 219 " --> pdb=" O VALLf 215 " (cutoff:3.500A) Processing sheet with id=BB3, first strand: chain 'Lf' and resid 237 through 238 removed outlier: 3.908A pdb=" N LYSLf 245 " --> pdb=" O LEULf 255 " (cutoff:3.500A) removed outlier: 7.355A pdb=" N LEULf 255 " --> pdb=" O LYSLf 245 " (cutoff:3.500A) removed outlier: 5.423A pdb=" N ILELf 247 " --> pdb=" O ARGLf 253 " (cutoff:3.500A) removed outlier: 7.686A pdb=" N ARGLf 253 " --> pdb=" O ILELf 247 " (cutoff:3.500A) Processing sheet with id=BB4, first strand: chain 'MC' and resid 105 through 106 removed outlier: 3.941A pdb=" N HISMC 139 " --> pdb=" O LEUMC 106 " (cutoff:3.500A) Processing sheet with id=BB5, first strand: chain 'MD' and resid 121 through 122 Processing sheet with id=BB6, first strand: chain 'MD' and resid 121 through 122 removed outlier: 6.453A pdb=" N ILEMK 114 " --> pdb=" O PHEMK 155 " (cutoff:3.500A) removed outlier: 8.043A pdb=" N GLNMK 157 " --> pdb=" O ILEMK 114 " (cutoff:3.500A) removed outlier: 6.190A pdb=" N VALMK 116 " --> pdb=" O GLNMK 157 " (cutoff:3.500A) removed outlier: 7.490A pdb=" N LEUMK 159 " --> pdb=" O VALMK 116 " (cutoff:3.500A) removed outlier: 7.803A pdb=" N SERMK 118 " --> pdb=" O LEUMK 159 " (cutoff:3.500A) removed outlier: 5.939A pdb=" N ALAMK 113 " --> pdb=" O ARGMK 185 " (cutoff:3.500A) removed outlier: 4.576A pdb=" N ARGMK 185 " --> pdb=" O ALAMK 113 " (cutoff:3.500A) Processing sheet with id=BB7, first strand: chain 'MD' and resid 105 through 109 removed outlier: 6.190A pdb=" N ARGMD 105 " --> pdb=" O VALMD 154 " (cutoff:3.500A) removed outlier: 7.748A pdb=" N LEUMD 156 " --> pdb=" O ARGMD 105 " (cutoff:3.500A) removed outlier: 6.467A pdb=" N ARGMD 107 " --> pdb=" O LEUMD 156 " (cutoff:3.500A) removed outlier: 8.080A pdb=" N TYRMD 158 " --> pdb=" O ARGMD 107 " (cutoff:3.500A) removed outlier: 7.174A pdb=" N LEUMD 109 " --> pdb=" O TYRMD 158 " (cutoff:3.500A) Processing sheet with id=BB8, first strand: chain 'ML' and resid 115 through 119 removed outlier: 3.561A pdb=" N THRML 122 " --> pdb=" O TYRML 119 " (cutoff:3.500A) Processing sheet with id=BB9, first strand: chain 'MM' and resid 41 through 43 removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 5.759A pdb=" N ALAMM 220 " --> pdb=" O GLNMM 240 " (cutoff:3.500A) removed outlier: 6.806A pdb=" N LYSMM 242 " --> pdb=" O ALAMM 220 " (cutoff:3.500A) removed outlier: 6.433A pdb=" N ILEMM 222 " --> pdb=" O LYSMM 242 " (cutoff:3.500A) removed outlier: 6.825A pdb=" N LYSMM 244 " --> pdb=" O ILEMM 222 " (cutoff:3.500A) removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) Processing sheet with id=BC1, first strand: chain 'MM' and resid 287 through 292 removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) removed outlier: 6.792A pdb=" N ILEMM 227 " --> pdb=" O LEUMM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAMM 248 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 7.088A pdb=" N ASNMM 229 " --> pdb=" O ALAMM 248 " (cutoff:3.500A) removed outlier: 6.113A pdb=" N ILEMM 207 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 8.024A pdb=" N ASNMM 229 " --> pdb=" O ILEMM 207 " (cutoff:3.500A) removed outlier: 6.996A pdb=" N LYSMM 208 " --> pdb=" O GLYMM 187 " (cutoff:3.500A) removed outlier: 6.066A pdb=" N VALMM 189 " --> pdb=" O LYSMM 208 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) Processing sheet with id=BC2, first strand: chain 'MM' and resid 41 through 43 removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 3.560A pdb=" N THRMM 213 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 6.792A pdb=" N ILEMM 227 " --> pdb=" O LEUMM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAMM 248 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 7.088A pdb=" N ASNMM 229 " --> pdb=" O ALAMM 248 " (cutoff:3.500A) removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) Processing sheet with id=BC3, first strand: chain 'MM' and resid 297 through 299 removed outlier: 3.543A pdb=" N TYRMM 281 " --> pdb=" O LEUMM 299 " (cutoff:3.500A) removed outlier: 6.408A pdb=" N ALAMM 261 " --> pdb=" O TYRMM 280 " (cutoff:3.500A) removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) removed outlier: 5.759A pdb=" N ALAMM 220 " --> pdb=" O GLNMM 240 " (cutoff:3.500A) removed outlier: 6.806A pdb=" N LYSMM 242 " --> pdb=" O ALAMM 220 " (cutoff:3.500A) removed outlier: 6.433A pdb=" N ILEMM 222 " --> pdb=" O LYSMM 242 " (cutoff:3.500A) removed outlier: 6.825A pdb=" N LYSMM 244 " --> pdb=" O ILEMM 222 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) Processing sheet with id=BC4, first strand: chain 'MM' and resid 41 through 43 removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 6.996A pdb=" N LYSMM 208 " --> pdb=" O GLYMM 187 " (cutoff:3.500A) removed outlier: 6.066A pdb=" N VALMM 189 " --> pdb=" O LYSMM 208 " (cutoff:3.500A) removed outlier: 6.113A pdb=" N ILEMM 207 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 8.024A pdb=" N ASNMM 229 " --> pdb=" O ILEMM 207 " (cutoff:3.500A) removed outlier: 6.792A pdb=" N ILEMM 227 " --> pdb=" O LEUMM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAMM 248 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 7.088A pdb=" N ASNMM 229 " --> pdb=" O ALAMM 248 " (cutoff:3.500A) removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) removed outlier: 6.408A pdb=" N ALAMM 261 " --> pdb=" O TYRMM 280 " (cutoff:3.500A) removed outlier: 3.543A pdb=" N TYRMM 281 " --> pdb=" O LEUMM 299 " (cutoff:3.500A) Processing sheet with id=BC5, first strand: chain 'MM' and resid 297 through 299 removed outlier: 3.543A pdb=" N TYRMM 281 " --> pdb=" O LEUMM 299 " (cutoff:3.500A) removed outlier: 6.408A pdb=" N ALAMM 261 " --> pdb=" O TYRMM 280 " (cutoff:3.500A) removed outlier: 4.218A pdb=" N SERMM 264 " --> pdb=" O GLYMM 243 " (cutoff:3.500A) removed outlier: 6.752A pdb=" N TYRMM 245 " --> pdb=" O SERMM 264 " (cutoff:3.500A) removed outlier: 10.674A pdb=" N VALMM 266 " --> pdb=" O TYRMM 245 " (cutoff:3.500A) removed outlier: 10.247A pdb=" N ARGMM 247 " --> pdb=" O VALMM 266 " (cutoff:3.500A) removed outlier: 9.971A pdb=" N HISMM 268 " --> pdb=" O ARGMM 247 " (cutoff:3.500A) removed outlier: 6.159A pdb=" N GLNMM 249 " --> pdb=" O HISMM 268 " (cutoff:3.500A) removed outlier: 7.818A pdb=" N SERMM 270 " --> pdb=" O GLNMM 249 " (cutoff:3.500A) removed outlier: 6.118A pdb=" N SERMM 251 " --> pdb=" O SERMM 270 " (cutoff:3.500A) removed outlier: 7.969A pdb=" N LEUMM 272 " --> pdb=" O SERMM 251 " (cutoff:3.500A) removed outlier: 6.438A pdb=" N VALMM 253 " --> pdb=" O LEUMM 272 " (cutoff:3.500A) removed outlier: 6.792A pdb=" N ILEMM 227 " --> pdb=" O LEUMM 246 " (cutoff:3.500A) removed outlier: 7.240A pdb=" N ALAMM 248 " --> pdb=" O ILEMM 227 " (cutoff:3.500A) removed outlier: 7.088A pdb=" N ASNMM 229 " --> pdb=" O ALAMM 248 " (cutoff:3.500A) removed outlier: 3.560A pdb=" N THRMM 213 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 4.384A pdb=" N VALMM 162 " --> pdb=" O LYSMM 182 " (cutoff:3.500A) removed outlier: 7.466A pdb=" N LEUMM 184 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 4.263A pdb=" N GLNMM 164 " --> pdb=" O LEUMM 184 " (cutoff:3.500A) removed outlier: 7.369A pdb=" N SERMM 186 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 5.258A pdb=" N ASNMM 166 " --> pdb=" O SERMM 186 " (cutoff:3.500A) removed outlier: 8.902A pdb=" N PHEMM 188 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 5.774A pdb=" N VALMM 168 " --> pdb=" O PHEMM 188 " (cutoff:3.500A) removed outlier: 7.151A pdb=" N ASNMM 190 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 7.785A pdb=" N SERMM 170 " --> pdb=" O ASNMM 190 " (cutoff:3.500A) removed outlier: 9.165A pdb=" N ARGMM 192 " --> pdb=" O SERMM 170 " (cutoff:3.500A) removed outlier: 10.751A pdb=" N ASNMM 172 " --> pdb=" O ARGMM 192 " (cutoff:3.500A) removed outlier: 11.911A pdb=" N LEUMM 194 " --> pdb=" O ASNMM 172 " (cutoff:3.500A) removed outlier: 10.324A pdb=" N GLNMM 174 " --> pdb=" O LEUMM 194 " (cutoff:3.500A) removed outlier: 10.867A pdb=" N METMM 196 " --> pdb=" O GLNMM 174 " (cutoff:3.500A) removed outlier: 9.615A pdb=" N VALMM 176 " --> pdb=" O METMM 196 " (cutoff:3.500A) removed outlier: 5.661A pdb=" N GLYMM 142 " --> pdb=" O VALMM 162 " (cutoff:3.500A) removed outlier: 7.103A pdb=" N GLNMM 164 " --> pdb=" O GLYMM 142 " (cutoff:3.500A) removed outlier: 6.676A pdb=" N THRMM 144 " --> pdb=" O GLNMM 164 " (cutoff:3.500A) removed outlier: 7.825A pdb=" N ASNMM 166 " --> pdb=" O THRMM 144 " (cutoff:3.500A) removed outlier: 6.756A pdb=" N LEUMM 146 " --> pdb=" O ASNMM 166 " (cutoff:3.500A) removed outlier: 7.592A pdb=" N VALMM 168 " --> pdb=" O LEUMM 146 " (cutoff:3.500A) removed outlier: 9.873A pdb=" N GLYMM 148 " --> pdb=" O VALMM 168 " (cutoff:3.500A) removed outlier: 9.906A pdb=" N SERMM 170 " --> pdb=" O GLYMM 148 " (cutoff:3.500A) removed outlier: 3.541A pdb=" N ASNMM 128 " --> pdb=" O ALAMM 147 " (cutoff:3.500A) removed outlier: 6.474A pdb=" N ASNMM 149 " --> pdb=" O ASNMM 128 " (cutoff:3.500A) removed outlier: 5.194A pdb=" N ARGMM 130 " --> pdb=" O ASNMM 149 " (cutoff:3.500A) removed outlier: 6.325A pdb=" N VALMM 58 " --> pdb=" O THRMM 125 " (cutoff:3.500A) removed outlier: 8.507A pdb=" N ASNMM 127 " --> pdb=" O VALMM 58 " (cutoff:3.500A) removed outlier: 6.972A pdb=" N LEUMM 60 " --> pdb=" O ASNMM 127 " (cutoff:3.500A) removed outlier: 7.754A pdb=" N LEUMM 129 " --> pdb=" O LEUMM 60 " (cutoff:3.500A) removed outlier: 9.092A pdb=" N THRMM 62 " --> pdb=" O LEUMM 129 " (cutoff:3.500A) removed outlier: 3.971A pdb=" N THRMM 110 " --> pdb=" O HISMM 61 " (cutoff:3.500A) Processing sheet with id=BC6, first strand: chain 'MM' and resid 287 through 292 removed outlier: 6.408A pdb=" N ALAMM 261 " --> pdb=" O TYRMM 280 " (cutoff:3.500A) removed outlier: 3.543A pdb=" N TYRMM 281 " --> pdb=" O LEUMM 299 " (cutoff:3.500A) Processing sheet with id=BC7, first strand: chain 'MM' and resid 81 through 84 removed outlier: 3.507A pdb=" N ILEMM 84 " --> pdb=" O TYRMM 91 " (cutoff:3.500A) removed outlier: 4.311A pdb=" N LEUMM 94 " --> pdb=" O GLNMM 53 " (cutoff:3.500A) Processing sheet with id=BC8, first strand: chain 'MN' and resid 48 through 52 removed outlier: 6.708A pdb=" N VALMN 59 " --> pdb=" O ASNMN 49 " (cutoff:3.500A) removed outlier: 4.864A pdb=" N CYSMN 51 " --> pdb=" O ARGMN 57 " (cutoff:3.500A) removed outlier: 6.458A pdb=" N ARGMN 57 " --> pdb=" O CYSMN 51 " (cutoff:3.500A) removed outlier: 4.957A pdb=" N LEUMN 58 " --> pdb=" O SERMN 66 " (cutoff:3.500A) Processing sheet with id=BC9, first strand: chain 'Md' and resid 105 through 109 Processing sheet with id=BD1, first strand: chain 'Mf' and resid 211 through 215 removed outlier: 6.946A pdb=" N TRPMf 221 " --> pdb=" O GLNMf 213 " (cutoff:3.500A) Processing sheet with id=BD2, first strand: chain 'Mf' and resid 237 through 238 removed outlier: 3.815A pdb=" N ILEMf 238 " --> pdb=" O GLYMf 242 " (cutoff:3.500A) removed outlier: 3.700A pdb=" N GLYMf 242 " --> pdb=" O ILEMf 238 " (cutoff:3.500A) removed outlier: 4.184A pdb=" N LEUMf 246 " --> pdb=" O LEUMf 255 " (cutoff:3.500A) 7462 hydrogen bonds defined for protein. 20862 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: 135.18 Time building geometry restraints manager: 35.27 seconds NOTE: a complete listing of the restraints can be obtained by requesting output of .geo file. Histogram of bond lengths: 1.22 - 1.34: 42985 1.34 - 1.46: 30268 1.46 - 1.59: 63178 1.59 - 1.71: 4 1.71 - 1.83: 845 Bond restraints: 137280 Sorted by residual: bond pdb=" C PROGD 28 " pdb=" N PROGD 29 " ideal model delta sigma weight residual 1.334 1.395 -0.061 2.34e-02 1.83e+03 6.82e+00 bond pdb=" C PROBD 28 " pdb=" N PROBD 29 " ideal model delta sigma weight residual 1.334 1.390 -0.056 2.34e-02 1.83e+03 5.77e+00 bond pdb=" C PROLD 28 " pdb=" N PROLD 29 " ideal model delta sigma weight residual 1.334 1.389 -0.055 2.34e-02 1.83e+03 5.47e+00 bond pdb=" C PROJD 28 " pdb=" N PROJD 29 " ideal model delta sigma weight residual 1.334 1.388 -0.055 2.34e-02 1.83e+03 5.44e+00 bond pdb=" C PROAD 28 " pdb=" N PROAD 29 " ideal model delta sigma weight residual 1.334 1.388 -0.055 2.34e-02 1.83e+03 5.43e+00 ... (remaining 137275 not shown) Histogram of bond angle deviations from ideal: 96.72 - 104.58: 2059 104.58 - 112.45: 70232 112.45 - 120.31: 54407 120.31 - 128.18: 58170 128.18 - 136.04: 928 Bond angle restraints: 185796 Sorted by residual: angle pdb=" C TYRED 77 " pdb=" N ASNED 78 " pdb=" CA ASNED 78 " ideal model delta sigma weight residual 122.08 130.92 -8.84 1.47e+00 4.63e-01 3.62e+01 angle pdb=" C PROCd 74 " pdb=" N ASNCd 75 " pdb=" CA ASNCd 75 " ideal model delta sigma weight residual 121.54 131.63 -10.09 1.91e+00 2.74e-01 2.79e+01 angle pdb=" C PROId 74 " pdb=" N ASNId 75 " pdb=" CA ASNId 75 " ideal model delta sigma weight residual 121.54 131.58 -10.04 1.91e+00 2.74e-01 2.76e+01 angle pdb=" C PROBd 74 " pdb=" N ASNBd 75 " pdb=" CA ASNBd 75 " ideal model delta sigma weight residual 121.54 131.57 -10.03 1.91e+00 2.74e-01 2.76e+01 angle pdb=" C PROGd 74 " pdb=" N ASNGd 75 " pdb=" CA ASNGd 75 " ideal model delta sigma weight residual 121.54 131.52 -9.98 1.91e+00 2.74e-01 2.73e+01 ... (remaining 185791 not shown) Histogram of dihedral angle deviations from ideal: 0.00 - 18.32: 75569 18.32 - 36.63: 6452 36.63 - 54.95: 1030 54.95 - 73.27: 170 73.27 - 91.58: 109 Dihedral angle restraints: 83330 sinusoidal: 33332 harmonic: 49998 Sorted by residual: dihedral pdb=" CB CYSFN 84 " pdb=" SG CYSFN 84 " pdb=" SG CYSFN 112 " pdb=" CB CYSFN 112 " ideal model delta sinusoidal sigma weight residual -86.00 -128.75 42.75 1 1.00e+01 1.00e-02 2.55e+01 dihedral pdb=" CA ASNGD 78 " pdb=" C ASNGD 78 " pdb=" N LEUGD 79 " pdb=" CA LEUGD 79 " ideal model delta harmonic sigma weight residual 180.00 155.98 24.02 0 5.00e+00 4.00e-02 2.31e+01 dihedral pdb=" CA HISLM 256 " pdb=" C HISLM 256 " pdb=" N ASPLM 257 " pdb=" CA ASPLM 257 " ideal model delta harmonic sigma weight residual -180.00 -156.30 -23.70 0 5.00e+00 4.00e-02 2.25e+01 ... (remaining 83327 not shown) Histogram of chiral volume deviations from ideal: 0.000 - 0.056: 16490 0.056 - 0.112: 3389 0.112 - 0.169: 1029 0.169 - 0.225: 92 0.225 - 0.281: 21 Chirality restraints: 21021 Sorted by residual: chirality pdb=" CB ILEEf 262 " pdb=" CA ILEEf 262 " pdb=" CG1 ILEEf 262 " pdb=" CG2 ILEEf 262 " both_signs ideal model delta sigma weight residual False 2.64 2.36 0.28 2.00e-01 2.50e+01 1.97e+00 chirality pdb=" CB ILECf 262 " pdb=" CA ILECf 262 " pdb=" CG1 ILECf 262 " pdb=" CG2 ILECf 262 " both_signs ideal model delta sigma weight residual False 2.64 2.36 0.28 2.00e-01 2.50e+01 1.96e+00 chirality pdb=" CB ILEFf 262 " pdb=" CA ILEFf 262 " pdb=" CG1 ILEFf 262 " pdb=" CG2 ILEFf 262 " both_signs ideal model delta sigma weight residual False 2.64 2.37 0.28 2.00e-01 2.50e+01 1.93e+00 ... (remaining 21018 not shown) Planarity restraints: 23738 Sorted by residual: delta sigma weight rms_deltas residual plane pdb=" C ILEMf 216 " -0.056 5.00e-02 4.00e+02 8.60e-02 1.18e+01 pdb=" N PROMf 217 " 0.149 5.00e-02 4.00e+02 pdb=" CA PROMf 217 " -0.044 5.00e-02 4.00e+02 pdb=" CD PROMf 217 " -0.048 5.00e-02 4.00e+02 delta sigma weight rms_deltas residual plane pdb=" C ILEIf 216 " 0.056 5.00e-02 4.00e+02 8.50e-02 1.16e+01 pdb=" N PROIf 217 " -0.147 5.00e-02 4.00e+02 pdb=" CA PROIf 217 " 0.044 5.00e-02 4.00e+02 pdb=" CD PROIf 217 " 0.047 5.00e-02 4.00e+02 delta sigma weight rms_deltas residual plane pdb=" C ILEEf 216 " 0.056 5.00e-02 4.00e+02 8.49e-02 1.15e+01 pdb=" N PROEf 217 " -0.147 5.00e-02 4.00e+02 pdb=" CA PROEf 217 " 0.044 5.00e-02 4.00e+02 pdb=" CD PROEf 217 " 0.047 5.00e-02 4.00e+02 ... (remaining 23735 not shown) Histogram of nonbonded interaction distances: 2.29 - 2.82: 34173 2.82 - 3.34: 107734 3.34 - 3.86: 212998 3.86 - 4.38: 240776 4.38 - 4.90: 433233 Nonbonded interactions: 1028914 Sorted by model distance: nonbonded pdb=" OD2 ASPCM 278 " pdb=" OH TYRCM 280 " model vdw 2.294 2.440 nonbonded pdb=" OD2 ASPLM 278 " pdb=" OH TYRLM 280 " model vdw 2.299 2.440 nonbonded pdb=" OG SERHD 34 " pdb=" OD1 ASPHd 36 " model vdw 2.307 2.440 nonbonded pdb=" OD2 ASPKM 278 " pdb=" OH TYRKM 280 " model vdw 2.310 2.440 nonbonded pdb=" OG SERKD 34 " pdb=" OD1 ASPKd 36 " model vdw 2.313 2.440 ... (remaining 1028909 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 'AC' selection = chain 'BC' selection = chain 'CC' selection = chain 'DC' selection = chain 'EC' selection = chain 'FC' selection = chain 'GC' selection = chain 'HC' selection = chain 'IC' selection = chain 'JC' selection = chain 'KC' selection = chain 'LC' selection = chain 'MC' } ncs_group { reference = (chain 'AD' and resid 25 through 160) selection = chain 'Ad' selection = (chain 'BD' and resid 25 through 160) selection = chain 'Bd' selection = (chain 'CD' and resid 25 through 160) selection = chain 'Cd' selection = (chain 'DD' and resid 25 through 160) selection = chain 'Dd' selection = (chain 'ED' and resid 25 through 160) selection = chain 'Ed' selection = (chain 'FD' and resid 25 through 160) selection = chain 'Fd' selection = (chain 'GD' and resid 25 through 160) selection = chain 'Gd' selection = (chain 'HD' and resid 25 through 160) selection = chain 'Hd' selection = (chain 'ID' and resid 25 through 160) selection = chain 'Id' selection = (chain 'JD' and resid 25 through 160) selection = chain 'Jd' selection = (chain 'KD' and resid 25 through 160) selection = chain 'Kd' selection = (chain 'LD' and resid 25 through 160) selection = chain 'Ld' selection = (chain 'MD' and resid 25 through 160) selection = chain 'Md' } ncs_group { reference = chain 'AH' selection = chain 'BH' selection = chain 'CH' selection = chain 'DH' selection = chain 'EH' selection = chain 'FH' selection = chain 'GH' selection = chain 'HH' selection = chain 'IH' selection = chain 'JH' selection = chain 'KH' selection = chain 'LH' selection = chain 'MH' } ncs_group { reference = chain 'AK' selection = chain 'BK' selection = chain 'CK' selection = chain 'DK' selection = chain 'EK' selection = chain 'FK' selection = chain 'GK' selection = chain 'HK' selection = chain 'IK' selection = chain 'JK' selection = chain 'KK' selection = chain 'LK' selection = chain 'MK' } ncs_group { reference = chain 'AL' selection = chain 'BL' selection = chain 'CL' selection = chain 'DL' selection = chain 'EL' selection = chain 'FL' selection = chain 'GL' selection = chain 'HL' selection = chain 'IL' selection = chain 'JL' selection = chain 'KL' selection = chain 'LL' selection = chain 'ML' } ncs_group { reference = chain 'AM' selection = chain 'BM' selection = chain 'CM' selection = chain 'DM' selection = chain 'EM' selection = chain 'FM' selection = chain 'GM' selection = chain 'HM' selection = chain 'IM' selection = chain 'JM' selection = chain 'KM' selection = chain 'LM' selection = chain 'MM' } ncs_group { reference = chain 'AN' selection = chain 'BN' selection = chain 'CN' selection = chain 'DN' selection = chain 'EN' selection = chain 'FN' selection = chain 'GN' selection = chain 'HN' selection = chain 'IN' selection = chain 'JN' selection = chain 'KN' selection = chain 'LN' selection = chain 'MN' } ncs_group { reference = chain 'AU' selection = chain 'BU' selection = chain 'CU' selection = chain 'DU' selection = chain 'EU' selection = chain 'FU' selection = chain 'GU' selection = chain 'HU' selection = chain 'IU' selection = chain 'JU' selection = chain 'KU' selection = chain 'LU' selection = chain 'MU' } ncs_group { reference = chain 'Af' selection = chain 'Bf' selection = chain 'Cf' selection = chain 'Df' selection = chain 'Ef' selection = chain 'Ff' selection = chain 'Gf' selection = chain 'Hf' selection = chain 'If' selection = chain 'Jf' selection = chain 'Kf' selection = chain 'Lf' selection = chain 'Mf' } 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: 6.400 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: 0.110 Extract box with map and model: 27.240 Check model and map are aligned: 1.440 Set scattering table: 0.870 Process input model: 336.940 Find NCS groups from input model: 7.900 Set up NCS constraints: 2.770 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:12.540 Set ADP refinement strategy: 0.000 Make a string to write initial .geo file:0.000 Internal consistency checks: 0.000 Total: 396.240 ------------------------------------------------------------------------------- Set refinement monitor ********************** ------------------------------------------------------------------------------- Setup refinement engine *********************** ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8300 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 : 0.003 0.098 137280 Z= 0.221 Angle : 0.753 12.823 185796 Z= 0.404 Chirality : 0.052 0.281 21021 Planarity : 0.006 0.086 23738 Dihedral : 14.024 91.585 50947 Min Nonbonded Distance : 2.294 Molprobity Statistics. All-atom Clashscore : 3.05 Ramachandran Plot: Outliers : 0.00 % Allowed : 4.69 % Favored : 95.31 % Rotamer: Outliers : 0.07 % Allowed : 0.27 % Favored : 99.66 % 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: -0.51 (0.06), residues: 16835 helix: 0.63 (0.07), residues: 4225 sheet: 0.56 (0.08), residues: 4511 loop : -1.41 (0.06), residues: 8099 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.021 0.002 TRPJC 184 HIS 0.003 0.001 HISDN 88 PHE 0.018 0.001 PHEEd 25 TYR 0.033 0.001 TYRGC 155 ARG 0.012 0.000 ARGMK 130 *********************** REFINEMENT MACRO_CYCLE 1 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2490 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 10 poor density : 2480 time to evaluate : 11.573 Fit side-chains revert: symmetry clash revert: symmetry clash REVERT: AM 141 GLU cc_start: 0.6915 (tm-30) cc_final: 0.6405 (tm-30) REVERT: AN 44 LYS cc_start: 0.8494 (mtpt) cc_final: 0.8266 (mtpp) REVERT: Af 219 ARG cc_start: 0.7118 (ptp90) cc_final: 0.6672 (ptp90) REVERT: BL 189 MET cc_start: 0.8998 (tpp) cc_final: 0.8780 (tpp) REVERT: BM 70 MET cc_start: 0.5178 (mpp) cc_final: 0.4918 (mpt) REVERT: BN 44 LYS cc_start: 0.8253 (mtpp) cc_final: 0.7908 (mmtt) REVERT: Bd 80 GLN cc_start: 0.8916 (mm-40) cc_final: 0.8441 (mp-120) REVERT: CD 126 GLU cc_start: 0.7987 (pt0) cc_final: 0.7753 (pt0) REVERT: CL 103 ARG cc_start: 0.7360 (mtp-110) cc_final: 0.6973 (ttm-80) REVERT: CM 196 MET cc_start: 0.7959 (mtp) cc_final: 0.7703 (mtm) REVERT: DM 197 TYR cc_start: 0.7166 (m-80) cc_final: 0.6833 (m-80) REVERT: DM 208 LYS cc_start: 0.8022 (ttpt) cc_final: 0.7775 (ttmt) REVERT: Dd 68 ASP cc_start: 0.8077 (t70) cc_final: 0.7667 (t0) REVERT: Ef 253 ARG cc_start: 0.7531 (ptp-170) cc_final: 0.7128 (pmm-80) REVERT: FD 152 GLN cc_start: 0.8828 (mt0) cc_final: 0.8609 (mt0) REVERT: FM 208 LYS cc_start: 0.8224 (ttpt) cc_final: 0.8008 (ttpm) REVERT: GL 206 GLU cc_start: 0.7413 (tp30) cc_final: 0.7082 (tp30) REVERT: GM 196 MET cc_start: 0.7962 (mtt) cc_final: 0.7648 (mtt) REVERT: Gf 262 ILE cc_start: 0.7930 (mp) cc_final: 0.7723 (tt) REVERT: Hf 261 VAL cc_start: 0.8527 (p) cc_final: 0.8263 (t) REVERT: IH 329 THR cc_start: 0.8401 (m) cc_final: 0.8197 (m) REVERT: IK 181 GLU cc_start: 0.8024 (mt-10) cc_final: 0.7628 (mt-10) REVERT: IM 313 ASP cc_start: 0.7899 (m-30) cc_final: 0.7569 (m-30) REVERT: IN 44 LYS cc_start: 0.8326 (mtmt) cc_final: 0.8014 (mtpp) REVERT: Id 155 GLU cc_start: 0.7863 (tt0) cc_final: 0.7511 (tt0) REVERT: If 243 MET cc_start: 0.7002 (tpp) cc_final: 0.6744 (ttm) REVERT: JH 354 MET cc_start: 0.8963 (ptp) cc_final: 0.8626 (ptp) REVERT: JL 55 ARG cc_start: 0.7077 (ttp80) cc_final: 0.6577 (ttp80) REVERT: Jf 219 ARG cc_start: 0.7382 (ttm-80) cc_final: 0.7111 (mtm-85) REVERT: Jf 253 ARG cc_start: 0.7992 (ptp-170) cc_final: 0.7780 (ptp-170) REVERT: KN 94 GLN cc_start: 0.8116 (OUTLIER) cc_final: 0.7865 (pp30) REVERT: LL 103 ARG cc_start: 0.7338 (mtp-110) cc_final: 0.6995 (ttm-80) REVERT: LM 141 GLU cc_start: 0.6931 (tm-30) cc_final: 0.6656 (tm-30) REVERT: MN 94 GLN cc_start: 0.7910 (OUTLIER) cc_final: 0.7662 (pp30) REVERT: Md 155 GLU cc_start: 0.7894 (tt0) cc_final: 0.7509 (tt0) REVERT: Mf 243 MET cc_start: 0.7038 (tpp) cc_final: 0.6528 (ttm) outliers start: 10 outliers final: 1 residues processed: 2489 average time/residue: 2.1266 time to fit residues: 7350.5477 Evaluate side-chains 1994 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 3 poor density : 1991 time to evaluate : 13.688 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain GC residue 209 MET Chi-restraints excluded: chain KN residue 94 GLN Chi-restraints excluded: chain MN residue 94 GLN Rotamers are restrained with sigma=5.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1394 optimal weight: 10.0000 chunk 1251 optimal weight: 1.9990 chunk 694 optimal weight: 10.0000 chunk 427 optimal weight: 7.9990 chunk 844 optimal weight: 6.9990 chunk 668 optimal weight: 5.9990 chunk 1294 optimal weight: 9.9990 chunk 500 optimal weight: 1.9990 chunk 786 optimal weight: 2.9990 chunk 963 optimal weight: 9.9990 chunk 1499 optimal weight: 7.9990 overall best weight: 3.9990 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AC 82 GLN AH 277 ASN AH 350 HIS AK 72 GLN AL 160 GLN AL 221 HIS ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BC 35 GLN BD 75 ASN BD 80 GLN BH 308 ASN BH 350 HIS BL 160 GLN BM 40 GLN Bd 80 GLN CC 35 GLN CC 82 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DL 160 GLN DM 40 GLN EC 35 GLN EC 82 GLN ED 75 ASN ED 80 GLN EK 72 GLN EL 160 GLN EL 221 HIS EM 40 GLN Ed 31 ASN FC 35 GLN FC 82 GLN FC 104 ASN FD 75 ASN FH 308 ASN FL 221 HIS FM 40 GLN GC 35 GLN GC 104 ASN GH 308 ASN GK 72 GLN GL 160 GLN HC 35 GLN HC 104 ASN HH 277 ASN HH 350 HIS HK 87 GLN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** Hf 213 GLN IC 35 GLN IC 190 GLN IH 308 ASN IK 87 GLN IL 160 GLN IM 40 GLN IN 115 GLN JC 35 GLN JH 350 HIS JL 221 HIS ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** JN 115 GLN KC 82 GLN KK 72 GLN KL 160 GLN KM 40 GLN KN 94 GLN KN 115 GLN LC 35 GLN ** LD 78 ASN ** both conformations clash, **PLEASE CHECK MANUALLY** LH 350 HIS LL 160 GLN LM 40 GLN LM 316 ASN MC 35 GLN MC 69 GLN MC 82 GLN MC 104 ASN MK 72 GLN ML 183 GLN MM 40 GLN MN 94 GLN Total number of N/Q/H flips: 79 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8553 moved from start: 0.2089 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.008 0.055 137280 Z= 0.504 Angle : 0.790 17.180 185796 Z= 0.421 Chirality : 0.053 0.276 21021 Planarity : 0.006 0.087 23738 Dihedral : 5.817 33.522 18833 Min Nonbonded Distance : 2.203 Molprobity Statistics. All-atom Clashscore : 4.63 Ramachandran Plot: Outliers : 0.01 % Allowed : 5.42 % Favored : 94.58 % Rotamer: Outliers : 2.53 % Allowed : 10.62 % Favored : 86.86 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.06 % 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: -0.23 (0.06), residues: 16835 helix: 1.84 (0.08), residues: 4238 sheet: 0.39 (0.08), residues: 4485 loop : -1.63 (0.06), residues: 8112 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.029 0.003 TRPKM 236 HIS 0.007 0.001 HISGC 241 PHE 0.022 0.003 PHEHL 135 TYR 0.033 0.003 TYRGM 281 ARG 0.017 0.001 ARGLM 145 *********************** REFINEMENT MACRO_CYCLE 2 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2399 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 369 poor density : 2030 time to evaluate : 11.755 Fit side-chains REVERT: AC 228 HIS cc_start: 0.7391 (OUTLIER) cc_final: 0.6995 (p90) REVERT: AD 130 GLU cc_start: 0.8218 (mm-30) cc_final: 0.8014 (mm-30) REVERT: AH 332 ASP cc_start: 0.8430 (OUTLIER) cc_final: 0.8118 (p0) REVERT: AM 141 GLU cc_start: 0.7310 (tm-30) cc_final: 0.6789 (tm-30) REVERT: AM 145 ARG cc_start: 0.6743 (OUTLIER) cc_final: 0.6418 (mpp-170) REVERT: Ad 36 ASP cc_start: 0.7708 (OUTLIER) cc_final: 0.6982 (p0) REVERT: Ad 43 GLU cc_start: 0.8824 (OUTLIER) cc_final: 0.8611 (mt-10) REVERT: Ad 59 GLU cc_start: 0.7944 (OUTLIER) cc_final: 0.7578 (mt-10) REVERT: Ad 68 ASP cc_start: 0.8393 (t70) cc_final: 0.8056 (t0) REVERT: Af 219 ARG cc_start: 0.7355 (ptp90) cc_final: 0.6758 (ptp90) REVERT: BC 153 MET cc_start: 0.8780 (mtp) cc_final: 0.8553 (mmm) REVERT: BH 279 LEU cc_start: 0.9077 (OUTLIER) cc_final: 0.8766 (mp) REVERT: BH 332 ASP cc_start: 0.8510 (OUTLIER) cc_final: 0.8183 (p0) REVERT: BH 339 MET cc_start: 0.8953 (ptm) cc_final: 0.8753 (ptp) REVERT: BL 134 MET cc_start: 0.8890 (mmm) cc_final: 0.8662 (mmt) REVERT: BL 136 SER cc_start: 0.9320 (OUTLIER) cc_final: 0.9116 (t) REVERT: BM 301 MET cc_start: 0.9127 (OUTLIER) cc_final: 0.8674 (mmm) REVERT: BN 100 LEU cc_start: 0.7924 (OUTLIER) cc_final: 0.7709 (mp) REVERT: Bd 82 ARG cc_start: 0.8984 (mmm-85) cc_final: 0.8686 (mmt90) REVERT: Bd 152 GLN cc_start: 0.7954 (OUTLIER) cc_final: 0.7205 (mt0) REVERT: Bf 261 VAL cc_start: 0.8649 (OUTLIER) cc_final: 0.8410 (t) REVERT: CC 228 HIS cc_start: 0.7385 (OUTLIER) cc_final: 0.6597 (p-80) REVERT: CD 53 LEU cc_start: 0.9301 (OUTLIER) cc_final: 0.9057 (mp) REVERT: CK 130 ARG cc_start: 0.8169 (mtt-85) cc_final: 0.7896 (mtt-85) REVERT: CL 103 ARG cc_start: 0.7507 (mtp-110) cc_final: 0.7092 (ttm-80) REVERT: CL 110 GLN cc_start: 0.8539 (OUTLIER) cc_final: 0.8022 (tt0) REVERT: CL 230 GLU cc_start: 0.8520 (OUTLIER) cc_final: 0.7530 (mt-10) REVERT: CM 292 MET cc_start: 0.9078 (mtm) cc_final: 0.8681 (mtt) REVERT: Cd 36 ASP cc_start: 0.7829 (OUTLIER) cc_final: 0.7605 (p0) REVERT: Cd 59 GLU cc_start: 0.7803 (OUTLIER) cc_final: 0.7577 (mt-10) REVERT: Cd 145 ILE cc_start: 0.9134 (OUTLIER) cc_final: 0.8658 (mt) REVERT: DC 218 MET cc_start: 0.8486 (mtm) cc_final: 0.8246 (mtp) REVERT: DM 197 TYR cc_start: 0.7234 (m-80) cc_final: 0.6915 (m-80) REVERT: DN 100 LEU cc_start: 0.8137 (OUTLIER) cc_final: 0.7787 (mp) REVERT: Dd 68 ASP cc_start: 0.8372 (t70) cc_final: 0.7963 (t0) REVERT: Dd 152 GLN cc_start: 0.8093 (OUTLIER) cc_final: 0.7222 (mt0) REVERT: EK 142 GLU cc_start: 0.8549 (tm-30) cc_final: 0.8306 (tm-30) REVERT: Ed 27 LYS cc_start: 0.9116 (OUTLIER) cc_final: 0.8629 (mttt) REVERT: Ed 100 LYS cc_start: 0.8286 (mtmt) cc_final: 0.8019 (ttmm) REVERT: Ed 134 ASP cc_start: 0.8848 (t0) cc_final: 0.8625 (t0) REVERT: Ed 152 GLN cc_start: 0.8300 (OUTLIER) cc_final: 0.7942 (mt0) REVERT: FD 152 GLN cc_start: 0.8990 (mt0) cc_final: 0.8730 (mt0) REVERT: Fd 152 GLN cc_start: 0.8205 (OUTLIER) cc_final: 0.7729 (mt0) REVERT: GC 65 SER cc_start: 0.8303 (m) cc_final: 0.8004 (t) REVERT: GC 209 MET cc_start: 0.9331 (mtt) cc_final: 0.9061 (mtt) REVERT: GC 228 HIS cc_start: 0.7117 (OUTLIER) cc_final: 0.6646 (p90) REVERT: GD 155 GLU cc_start: 0.8525 (tt0) cc_final: 0.8235 (tt0) REVERT: GL 108 ASP cc_start: 0.7765 (m-30) cc_final: 0.7547 (m-30) REVERT: Gd 100 LYS cc_start: 0.8213 (OUTLIER) cc_final: 0.7754 (ttmt) REVERT: Gd 152 GLN cc_start: 0.7955 (OUTLIER) cc_final: 0.7387 (mt0) REVERT: Gf 262 ILE cc_start: 0.8362 (mp) cc_final: 0.8062 (tt) REVERT: HD 68 ASP cc_start: 0.7883 (t0) cc_final: 0.7591 (t0) REVERT: HH 332 ASP cc_start: 0.8518 (OUTLIER) cc_final: 0.7890 (p0) REVERT: HL 110 GLN cc_start: 0.8450 (OUTLIER) cc_final: 0.7493 (tm-30) REVERT: HL 204 LYS cc_start: 0.9005 (OUTLIER) cc_final: 0.8158 (tttt) REVERT: HL 230 GLU cc_start: 0.8653 (OUTLIER) cc_final: 0.7940 (mm-30) REVERT: Hd 36 ASP cc_start: 0.7878 (OUTLIER) cc_final: 0.7467 (p0) REVERT: Hd 126 GLU cc_start: 0.7292 (tt0) cc_final: 0.6975 (tt0) REVERT: Hd 152 GLN cc_start: 0.8184 (OUTLIER) cc_final: 0.7729 (mt0) REVERT: Hf 261 VAL cc_start: 0.8709 (p) cc_final: 0.8408 (t) REVERT: IC 65 SER cc_start: 0.8460 (m) cc_final: 0.8183 (t) REVERT: IC 123 GLN cc_start: 0.8443 (mt0) cc_final: 0.8224 (mt0) REVERT: IC 228 HIS cc_start: 0.7221 (OUTLIER) cc_final: 0.6362 (p-80) REVERT: ID 52 MET cc_start: 0.8682 (mmm) cc_final: 0.8447 (mmm) REVERT: IH 339 MET cc_start: 0.9028 (ptm) cc_final: 0.8824 (ptp) REVERT: IK 181 GLU cc_start: 0.8211 (mt-10) cc_final: 0.7813 (mt-10) REVERT: IN 100 LEU cc_start: 0.7976 (OUTLIER) cc_final: 0.7646 (mp) REVERT: Id 107 ARG cc_start: 0.8161 (OUTLIER) cc_final: 0.7536 (ptt90) REVERT: Id 126 GLU cc_start: 0.7357 (tp30) cc_final: 0.7149 (tt0) REVERT: Id 152 GLN cc_start: 0.7870 (OUTLIER) cc_final: 0.7204 (mt0) REVERT: If 262 ILE cc_start: 0.8471 (mt) cc_final: 0.7848 (tt) REVERT: JD 86 ASP cc_start: 0.8391 (t0) cc_final: 0.8094 (t70) REVERT: JK 107 LYS cc_start: 0.9270 (OUTLIER) cc_final: 0.8713 (mttp) REVERT: JK 150 ASP cc_start: 0.6993 (t0) cc_final: 0.6775 (t0) REVERT: JK 174 ARG cc_start: 0.7839 (mmm160) cc_final: 0.7597 (mmt-90) REVERT: JM 145 ARG cc_start: 0.6658 (tpp-160) cc_final: 0.5666 (mmm160) REVERT: JN 100 LEU cc_start: 0.7976 (OUTLIER) cc_final: 0.7614 (mp) REVERT: KC 196 GLU cc_start: 0.7989 (OUTLIER) cc_final: 0.7753 (tt0) REVERT: KH 279 LEU cc_start: 0.9118 (OUTLIER) cc_final: 0.8800 (mp) REVERT: KH 332 ASP cc_start: 0.8454 (OUTLIER) cc_final: 0.7811 (p0) REVERT: KL 103 ARG cc_start: 0.7362 (mtp-110) cc_final: 0.6853 (ttm-80) REVERT: KL 110 GLN cc_start: 0.8631 (OUTLIER) cc_final: 0.8393 (tt0) REVERT: KL 230 GLU cc_start: 0.8627 (OUTLIER) cc_final: 0.7994 (mm-30) REVERT: KM 145 ARG cc_start: 0.6390 (mpp-170) cc_final: 0.5946 (mpp-170) REVERT: Kd 152 GLN cc_start: 0.8139 (OUTLIER) cc_final: 0.7846 (mt0) REVERT: Kd 160 LYS cc_start: 0.6114 (OUTLIER) cc_final: 0.5892 (mtmm) REVERT: LL 103 ARG cc_start: 0.7455 (mtp-110) cc_final: 0.7074 (ttm-80) REVERT: LN 44 LYS cc_start: 0.8500 (mmtt) cc_final: 0.8298 (mtpp) REVERT: Ld 36 ASP cc_start: 0.7870 (OUTLIER) cc_final: 0.7350 (p0) REVERT: Lf 219 ARG cc_start: 0.7377 (ptp90) cc_final: 0.7154 (ptp90) REVERT: Lf 243 MET cc_start: 0.7496 (ttm) cc_final: 0.7200 (ttp) REVERT: MC 65 SER cc_start: 0.8647 (m) cc_final: 0.8429 (t) REVERT: MK 50 ASP cc_start: 0.8789 (m-30) cc_final: 0.8535 (m-30) REVERT: MK 127 LYS cc_start: 0.8396 (mtpp) cc_final: 0.8187 (mtpp) REVERT: MK 130 ARG cc_start: 0.8077 (mtt90) cc_final: 0.7854 (mtt-85) REVERT: MK 174 ARG cc_start: 0.7917 (mmt90) cc_final: 0.7657 (mpt180) REVERT: ML 110 GLN cc_start: 0.8598 (OUTLIER) cc_final: 0.8003 (tp40) REVERT: ML 190 MET cc_start: 0.8485 (OUTLIER) cc_final: 0.8230 (tmm) REVERT: Md 145 ILE cc_start: 0.9033 (OUTLIER) cc_final: 0.8828 (mm) REVERT: Md 152 GLN cc_start: 0.8182 (OUTLIER) cc_final: 0.7733 (mt0) REVERT: Md 155 GLU cc_start: 0.8080 (tt0) cc_final: 0.7834 (tt0) REVERT: Mf 243 MET cc_start: 0.6973 (tpp) cc_final: 0.6524 (ttm) outliers start: 369 outliers final: 153 residues processed: 2193 average time/residue: 2.1111 time to fit residues: 6471.7314 Evaluate side-chains 2117 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 205 poor density : 1912 time to evaluate : 11.467 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 75 ASN Chi-restraints excluded: chain AD residue 123 THR Chi-restraints excluded: chain AH residue 332 ASP Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 145 ARG Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 43 GLU Chi-restraints excluded: chain Ad residue 59 GLU Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain Af residue 212 ILE Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 228 HIS Chi-restraints excluded: chain BD residue 75 ASN Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BH residue 279 LEU Chi-restraints excluded: chain BH residue 332 ASP Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 136 SER Chi-restraints excluded: chain BL residue 212 ASN Chi-restraints excluded: chain BL residue 230 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BM residue 301 MET Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 58 VAL Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain Bf residue 261 VAL Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CD residue 53 LEU Chi-restraints excluded: chain CK residue 45 VAL Chi-restraints excluded: chain CK residue 107 LYS Chi-restraints excluded: chain CK residue 177 ASN Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 212 ASN Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CL residue 230 GLU Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CM residue 301 MET Chi-restraints excluded: chain CN residue 45 MET Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 58 VAL Chi-restraints excluded: chain Cd residue 59 GLU Chi-restraints excluded: chain Cd residue 123 THR Chi-restraints excluded: chain Cd residue 145 ILE Chi-restraints excluded: chain Cf residue 212 ILE Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 234 THR Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 72 THR Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 45 VAL Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 62 ASN Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 58 VAL Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 152 GLN Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain Df residue 232 VAL Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain ED residue 50 ASP Chi-restraints excluded: chain ED residue 75 ASN Chi-restraints excluded: chain EN residue 45 MET Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 27 LYS Chi-restraints excluded: chain Ed residue 59 GLU Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 111 LYS Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ed residue 154 VAL Chi-restraints excluded: chain Ef residue 212 ILE Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 30 SER Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 75 ASN Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain GC residue 30 SER Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GC residue 259 SER Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 75 ASN Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GD residue 123 THR Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 46 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GM residue 301 MET Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain Gd residue 100 LYS Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gd residue 152 GLN Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 30 SER Chi-restraints excluded: chain HD residue 75 ASN Chi-restraints excluded: chain HD residue 123 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HK residue 177 ASN Chi-restraints excluded: chain HL residue 110 GLN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 204 LYS Chi-restraints excluded: chain HL residue 230 GLU Chi-restraints excluded: chain HN residue 45 MET Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 58 VAL Chi-restraints excluded: chain Hd residue 152 GLN Chi-restraints excluded: chain IC residue 30 SER Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain IC residue 249 ILE Chi-restraints excluded: chain ID residue 72 THR Chi-restraints excluded: chain IK residue 45 VAL Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IN residue 82 MET Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 107 ARG Chi-restraints excluded: chain Id residue 123 THR Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 152 GLN Chi-restraints excluded: chain If residue 212 ILE Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 75 ASN Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JK residue 107 LYS Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 136 SER Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 234 GLU Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 196 GLU Chi-restraints excluded: chain KC residue 214 LYS Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 234 THR Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 75 ASN Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KH residue 279 LEU Chi-restraints excluded: chain KH residue 332 ASP Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KL residue 110 GLN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 227 ILE Chi-restraints excluded: chain Kd residue 59 GLU Chi-restraints excluded: chain Kd residue 152 GLN Chi-restraints excluded: chain Kd residue 154 VAL Chi-restraints excluded: chain Kd residue 160 LYS Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LD residue 75 ASN Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 45 VAL Chi-restraints excluded: chain LK residue 107 LYS Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LM residue 262 GLU Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 58 VAL Chi-restraints excluded: chain Ld residue 62 ILE Chi-restraints excluded: chain Ld residue 84 SER Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain ML residue 110 GLN Chi-restraints excluded: chain ML residue 190 MET Chi-restraints excluded: chain MM residue 301 MET Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 82 MET Chi-restraints excluded: chain Md residue 145 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 212 ILE Chi-restraints excluded: chain Mf residue 232 VAL Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=4.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 833 optimal weight: 3.9990 chunk 465 optimal weight: 5.9990 chunk 1247 optimal weight: 4.9990 chunk 1020 optimal weight: 0.9990 chunk 413 optimal weight: 0.8980 chunk 1501 optimal weight: 0.9980 chunk 1622 optimal weight: 3.9990 chunk 1337 optimal weight: 0.9990 chunk 1489 optimal weight: 7.9990 chunk 512 optimal weight: 0.5980 chunk 1204 optimal weight: 4.9990 overall best weight: 0.8984 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AH 335 HIS AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BD 78 ASN BD 80 GLN BH 308 ASN BL 160 GLN CC 149 GLN CK 72 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** CN 104 ASN DC 104 ASN DD 80 GLN DL 160 GLN EC 35 GLN ED 80 GLN EM 316 ASN GL 160 GLN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 308 ASN IL 160 GLN IN 104 ASN JH 335 HIS ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN Kd 80 GLN ** LD 78 ASN ** both conformations clash, **PLEASE CHECK MANUALLY** LH 335 HIS LL 160 GLN MC 104 ASN MH 335 HIS ML 183 GLN MN 104 ASN Total number of N/Q/H flips: 31 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8470 moved from start: 0.1841 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.002 0.044 137280 Z= 0.164 Angle : 0.536 9.833 185796 Z= 0.290 Chirality : 0.044 0.180 21021 Planarity : 0.004 0.067 23738 Dihedral : 5.010 27.095 18824 Min Nonbonded Distance : 2.219 Molprobity Statistics. All-atom Clashscore : 5.00 Ramachandran Plot: Outliers : 0.00 % Allowed : 4.25 % Favored : 95.75 % Rotamer: Outliers : 2.15 % Allowed : 13.37 % Favored : 84.48 % 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: 16835 helix: 2.61 (0.08), residues: 4238 sheet: 0.59 (0.08), residues: 4303 loop : -1.46 (0.06), residues: 8294 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.019 0.001 TRPHM 236 HIS 0.004 0.001 HISEM 256 PHE 0.015 0.001 PHEBd 25 TYR 0.016 0.001 TYRFM 281 ARG 0.007 0.000 ARGML 103 *********************** REFINEMENT MACRO_CYCLE 3 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2371 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 314 poor density : 2057 time to evaluate : 11.509 Fit side-chains revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7256 (OUTLIER) cc_final: 0.6858 (p90) REVERT: AD 85 VAL cc_start: 0.8909 (OUTLIER) cc_final: 0.8637 (t) REVERT: AH 332 ASP cc_start: 0.8351 (OUTLIER) cc_final: 0.8055 (p0) REVERT: AM 141 GLU cc_start: 0.7399 (tm-30) cc_final: 0.6898 (tm-30) REVERT: Ad 36 ASP cc_start: 0.6866 (OUTLIER) cc_final: 0.6137 (p0) REVERT: Ad 59 GLU cc_start: 0.7608 (OUTLIER) cc_final: 0.7195 (mm-30) REVERT: Ad 68 ASP cc_start: 0.8347 (t70) cc_final: 0.7848 (t0) REVERT: Ad 111 LYS cc_start: 0.7600 (pmtt) cc_final: 0.7076 (ptmm) REVERT: Af 219 ARG cc_start: 0.7250 (ptp90) cc_final: 0.6805 (ptp90) REVERT: BH 332 ASP cc_start: 0.8409 (OUTLIER) cc_final: 0.8147 (p0) REVERT: BM 301 MET cc_start: 0.9073 (OUTLIER) cc_final: 0.8769 (mmm) REVERT: BN 100 LEU cc_start: 0.7931 (OUTLIER) cc_final: 0.7675 (mp) REVERT: Bd 82 ARG cc_start: 0.8929 (mmm-85) cc_final: 0.8521 (mmt90) REVERT: Bd 152 GLN cc_start: 0.7838 (OUTLIER) cc_final: 0.7198 (mt0) REVERT: Bf 261 VAL cc_start: 0.8628 (OUTLIER) cc_final: 0.8377 (t) REVERT: CC 228 HIS cc_start: 0.7247 (OUTLIER) cc_final: 0.6551 (p-80) REVERT: CH 332 ASP cc_start: 0.8069 (OUTLIER) cc_final: 0.7849 (p0) REVERT: CK 130 ARG cc_start: 0.7933 (mtt-85) cc_final: 0.7684 (mtt-85) REVERT: CL 110 GLN cc_start: 0.8249 (OUTLIER) cc_final: 0.7842 (tp40) REVERT: CM 141 GLU cc_start: 0.6842 (tm-30) cc_final: 0.6543 (tm-30) REVERT: CM 145 ARG cc_start: 0.6440 (OUTLIER) cc_final: 0.5723 (mpp-170) REVERT: CM 262 GLU cc_start: 0.8262 (OUTLIER) cc_final: 0.7797 (pm20) REVERT: CM 292 MET cc_start: 0.9005 (mtm) cc_final: 0.8599 (mtt) REVERT: Cd 36 ASP cc_start: 0.7294 (OUTLIER) cc_final: 0.6709 (p0) REVERT: Cf 253 ARG cc_start: 0.7867 (OUTLIER) cc_final: 0.7098 (mtp180) REVERT: DC 228 HIS cc_start: 0.6953 (OUTLIER) cc_final: 0.6468 (p-80) REVERT: DK 174 ARG cc_start: 0.7921 (OUTLIER) cc_final: 0.7706 (mmm160) REVERT: DM 197 TYR cc_start: 0.7207 (m-80) cc_final: 0.6886 (m-80) REVERT: DN 100 LEU cc_start: 0.8127 (OUTLIER) cc_final: 0.7759 (mp) REVERT: Dd 36 ASP cc_start: 0.7137 (OUTLIER) cc_final: 0.6537 (p0) REVERT: Dd 68 ASP cc_start: 0.8272 (t70) cc_final: 0.7857 (t0) REVERT: EC 261 GLU cc_start: 0.8239 (pm20) cc_final: 0.8022 (pm20) REVERT: ED 75 ASN cc_start: 0.8414 (OUTLIER) cc_final: 0.8023 (p0) REVERT: Ed 152 GLN cc_start: 0.8275 (OUTLIER) cc_final: 0.8015 (mt0) REVERT: FC 228 HIS cc_start: 0.6806 (OUTLIER) cc_final: 0.6281 (p90) REVERT: FD 152 GLN cc_start: 0.8924 (mt0) cc_final: 0.8659 (mt0) REVERT: Fd 152 GLN cc_start: 0.8194 (OUTLIER) cc_final: 0.7849 (mt0) REVERT: GC 228 HIS cc_start: 0.7061 (OUTLIER) cc_final: 0.6625 (p90) REVERT: GD 155 GLU cc_start: 0.8476 (tt0) cc_final: 0.8197 (tt0) REVERT: GM 70 MET cc_start: 0.5115 (mpp) cc_final: 0.4662 (mmm) REVERT: Gd 62 ILE cc_start: 0.8438 (OUTLIER) cc_final: 0.8030 (pt) REVERT: Gf 262 ILE cc_start: 0.8288 (mp) cc_final: 0.7998 (tt) REVERT: HC 228 HIS cc_start: 0.7052 (OUTLIER) cc_final: 0.6439 (p90) REVERT: HD 68 ASP cc_start: 0.7691 (t0) cc_final: 0.7428 (t0) REVERT: HH 332 ASP cc_start: 0.8478 (OUTLIER) cc_final: 0.7831 (p0) REVERT: HH 359 GLU cc_start: 0.8138 (mt-10) cc_final: 0.7905 (mt-10) REVERT: HM 68 GLU cc_start: 0.5200 (OUTLIER) cc_final: 0.4437 (pm20) REVERT: HM 145 ARG cc_start: 0.6798 (mpp-170) cc_final: 0.5861 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8630 (OUTLIER) cc_final: 0.8352 (pp) REVERT: Hd 36 ASP cc_start: 0.7324 (OUTLIER) cc_final: 0.6593 (p0) REVERT: Hd 126 GLU cc_start: 0.7305 (tt0) cc_final: 0.7003 (tt0) REVERT: Hd 145 ILE cc_start: 0.9079 (OUTLIER) cc_final: 0.8478 (mt) REVERT: Hd 152 GLN cc_start: 0.8126 (OUTLIER) cc_final: 0.7761 (mt0) REVERT: Hf 261 VAL cc_start: 0.8643 (p) cc_final: 0.8375 (t) REVERT: IC 65 SER cc_start: 0.8361 (m) cc_final: 0.8111 (t) REVERT: IC 123 GLN cc_start: 0.8315 (mt0) cc_final: 0.8080 (mt0) REVERT: IC 228 HIS cc_start: 0.7007 (OUTLIER) cc_final: 0.6248 (p-80) REVERT: IK 181 GLU cc_start: 0.8187 (mt-10) cc_final: 0.7792 (mt-10) REVERT: IM 141 GLU cc_start: 0.7151 (tm-30) cc_final: 0.6824 (tm-30) REVERT: Id 36 ASP cc_start: 0.7101 (OUTLIER) cc_final: 0.6821 (p0) REVERT: If 262 ILE cc_start: 0.8362 (mt) cc_final: 0.7765 (tt) REVERT: JD 86 ASP cc_start: 0.8153 (t0) cc_final: 0.7854 (t70) REVERT: JK 150 ASP cc_start: 0.6620 (t0) cc_final: 0.6417 (t0) REVERT: JK 174 ARG cc_start: 0.7806 (mmm160) cc_final: 0.7601 (mmt90) REVERT: JM 145 ARG cc_start: 0.6665 (tpp-160) cc_final: 0.5782 (mmm160) REVERT: KH 332 ASP cc_start: 0.8379 (OUTLIER) cc_final: 0.7731 (p0) REVERT: KK 55 LYS cc_start: 0.8355 (tttp) cc_final: 0.8005 (tttp) REVERT: KK 150 ASP cc_start: 0.6881 (t0) cc_final: 0.6646 (t0) REVERT: KL 212 ASN cc_start: 0.7843 (OUTLIER) cc_final: 0.7624 (p0) REVERT: KL 230 GLU cc_start: 0.8602 (OUTLIER) cc_final: 0.7945 (mm-30) REVERT: KM 141 GLU cc_start: 0.7105 (tm-30) cc_final: 0.6903 (tm-30) REVERT: KM 145 ARG cc_start: 0.6540 (mpp-170) cc_final: 0.6191 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7238 (ttp) cc_final: 0.6960 (mtm) REVERT: LC 228 HIS cc_start: 0.7167 (OUTLIER) cc_final: 0.6616 (p90) REVERT: LL 103 ARG cc_start: 0.7406 (mtp-110) cc_final: 0.7021 (ttm-80) REVERT: Lf 219 ARG cc_start: 0.7414 (ptp90) cc_final: 0.7182 (ptp90) REVERT: Lf 243 MET cc_start: 0.7442 (ttm) cc_final: 0.7140 (ttp) REVERT: MC 69 GLN cc_start: 0.7749 (OUTLIER) cc_final: 0.7094 (mp10) REVERT: MK 130 ARG cc_start: 0.7878 (mtt90) cc_final: 0.7650 (mtt-85) REVERT: MK 174 ARG cc_start: 0.7886 (mmt90) cc_final: 0.7682 (mpt180) REVERT: MM 141 GLU cc_start: 0.7374 (tm-30) cc_final: 0.6844 (tm-30) REVERT: Md 36 ASP cc_start: 0.7279 (OUTLIER) cc_final: 0.6806 (p0) REVERT: Md 152 GLN cc_start: 0.8025 (OUTLIER) cc_final: 0.7661 (mt0) REVERT: Md 155 GLU cc_start: 0.8051 (tt0) cc_final: 0.7818 (tt0) REVERT: Mf 243 MET cc_start: 0.6877 (tpp) cc_final: 0.6395 (ttm) outliers start: 314 outliers final: 134 residues processed: 2183 average time/residue: 2.0956 time to fit residues: 6396.0556 Evaluate side-chains 2140 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 177 poor density : 1963 time to evaluate : 11.502 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AH residue 332 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 54 GLU Chi-restraints excluded: chain Ad residue 58 VAL Chi-restraints excluded: chain Ad residue 59 GLU Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain Ad residue 145 ILE Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 65 SER Chi-restraints excluded: chain BD residue 75 ASN Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BH residue 332 ASP Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BM residue 301 MET Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 58 VAL Chi-restraints excluded: chain Bd residue 59 GLU Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 150 ASN Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain Bf residue 261 VAL Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CD residue 61 VAL Chi-restraints excluded: chain CH residue 332 ASP Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 58 VAL Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 65 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 174 ARG Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 54 GLU Chi-restraints excluded: chain Dd residue 58 VAL Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Df residue 232 VAL Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain ED residue 75 ASN Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 145 ILE Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FH residue 278 ASP Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 133 THR Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 30 SER Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 75 ASN Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GL residue 204 LYS Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 62 ILE Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 30 SER Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HD residue 61 VAL Chi-restraints excluded: chain HD residue 75 ASN Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HK residue 177 ASN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 62 ASN Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 58 VAL Chi-restraints excluded: chain Hd residue 145 ILE Chi-restraints excluded: chain Hd residue 152 GLN Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain ID residue 71 LEU Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 58 VAL Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 75 ASN Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 332 ASP Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 65 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 72 THR Chi-restraints excluded: chain LD residue 75 ASN Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 58 VAL Chi-restraints excluded: chain Ld residue 84 SER Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 232 VAL Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MC residue 69 GLN Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain ML residue 111 LYS Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 58 VAL Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=4.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1483 optimal weight: 10.0000 chunk 1129 optimal weight: 6.9990 chunk 779 optimal weight: 1.9990 chunk 166 optimal weight: 3.9990 chunk 716 optimal weight: 10.0000 chunk 1008 optimal weight: 1.9990 chunk 1507 optimal weight: 3.9990 chunk 1595 optimal weight: 3.9990 chunk 787 optimal weight: 4.9990 chunk 1428 optimal weight: 3.9990 chunk 430 optimal weight: 3.9990 overall best weight: 3.1990 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BD 75 ASN BD 80 GLN BH 308 ASN BL 160 GLN BL 183 GLN CC 69 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DH 350 HIS DL 160 GLN EC 35 GLN ED 75 ASN FD 75 ASN GL 160 GLN HH 277 ASN HL 110 GLN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 350 HIS IL 160 GLN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN LC 104 ASN ** LD 78 ASN ** both conformations clash, **PLEASE CHECK MANUALLY** LL 160 GLN Ld 75 ASN MC 104 ASN ML 110 GLN ML 183 GLN Total number of N/Q/H flips: 29 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8549 moved from start: 0.2262 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.006 0.060 137280 Z= 0.409 Angle : 0.698 14.300 185796 Z= 0.373 Chirality : 0.049 0.204 21021 Planarity : 0.005 0.059 23738 Dihedral : 5.495 30.540 18824 Min Nonbonded Distance : 2.191 Molprobity Statistics. All-atom Clashscore : 5.01 Ramachandran Plot: Outliers : 0.00 % Allowed : 5.67 % Favored : 94.33 % Rotamer: Outliers : 3.18 % Allowed : 14.23 % Favored : 82.59 % Cbeta Deviations : 0.00 % Peptide Plane: Cis-proline : 0.00 % Cis-general : 0.00 % Twisted Proline : 0.00 % Twisted General : 0.01 % 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: 0.08 (0.06), residues: 16835 helix: 2.59 (0.08), residues: 4199 sheet: 0.35 (0.08), residues: 4524 loop : -1.59 (0.06), residues: 8112 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.023 0.003 TRPHM 236 HIS 0.005 0.001 HISBL 177 PHE 0.016 0.002 PHEGd 25 TYR 0.029 0.002 TYRJM 281 ARG 0.008 0.001 ARGHL 103 *********************** REFINEMENT MACRO_CYCLE 4 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2425 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 464 poor density : 1961 time to evaluate : 11.704 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7311 (OUTLIER) cc_final: 0.6901 (p90) REVERT: AD 59 GLU cc_start: 0.8190 (tt0) cc_final: 0.7865 (tt0) REVERT: AD 85 VAL cc_start: 0.9034 (OUTLIER) cc_final: 0.8719 (t) REVERT: AH 332 ASP cc_start: 0.8409 (OUTLIER) cc_final: 0.8099 (p0) REVERT: AL 110 GLN cc_start: 0.8466 (OUTLIER) cc_final: 0.8166 (tt0) REVERT: AL 134 MET cc_start: 0.9008 (OUTLIER) cc_final: 0.8762 (mtp) REVERT: AM 88 ASN cc_start: 0.5772 (t0) cc_final: 0.5369 (m-40) REVERT: Ad 36 ASP cc_start: 0.7652 (OUTLIER) cc_final: 0.6804 (p0) REVERT: Ad 59 GLU cc_start: 0.7637 (OUTLIER) cc_final: 0.7265 (mm-30) REVERT: Ad 68 ASP cc_start: 0.8430 (t70) cc_final: 0.8120 (t0) REVERT: Ad 111 LYS cc_start: 0.7772 (pmtt) cc_final: 0.7239 (ptmm) REVERT: Af 219 ARG cc_start: 0.7471 (ptp90) cc_final: 0.6977 (ptp90) REVERT: BH 332 ASP cc_start: 0.8511 (OUTLIER) cc_final: 0.8200 (p0) REVERT: BL 110 GLN cc_start: 0.8670 (tm-30) cc_final: 0.8465 (tt0) REVERT: BM 68 GLU cc_start: 0.5445 (OUTLIER) cc_final: 0.4767 (pm20) REVERT: BM 301 MET cc_start: 0.9133 (OUTLIER) cc_final: 0.8757 (mmm) REVERT: BN 51 CYS cc_start: 0.7557 (OUTLIER) cc_final: 0.7234 (t) REVERT: BN 100 LEU cc_start: 0.7935 (OUTLIER) cc_final: 0.7721 (mp) REVERT: Bd 82 ARG cc_start: 0.8984 (mmm-85) cc_final: 0.8607 (mmt90) REVERT: Bd 152 GLN cc_start: 0.7923 (OUTLIER) cc_final: 0.7227 (mt0) REVERT: Bf 243 MET cc_start: 0.7051 (mtp) cc_final: 0.6697 (ttp) REVERT: CC 228 HIS cc_start: 0.7354 (OUTLIER) cc_final: 0.6602 (p-80) REVERT: CD 53 LEU cc_start: 0.9284 (OUTLIER) cc_final: 0.9050 (mp) REVERT: CK 130 ARG cc_start: 0.8164 (mtt-85) cc_final: 0.7891 (mtt-85) REVERT: CL 110 GLN cc_start: 0.8502 (OUTLIER) cc_final: 0.8153 (tp40) REVERT: CL 230 GLU cc_start: 0.8495 (OUTLIER) cc_final: 0.7619 (mt-10) REVERT: CM 141 GLU cc_start: 0.7010 (tm-30) cc_final: 0.6665 (tm-30) REVERT: CM 145 ARG cc_start: 0.6324 (OUTLIER) cc_final: 0.5576 (mpp-170) REVERT: CM 292 MET cc_start: 0.9084 (mtm) cc_final: 0.8682 (mtt) REVERT: CN 100 LEU cc_start: 0.8034 (OUTLIER) cc_final: 0.7602 (mp) REVERT: Cd 145 ILE cc_start: 0.9143 (OUTLIER) cc_final: 0.8672 (mt) REVERT: Cf 253 ARG cc_start: 0.7930 (OUTLIER) cc_final: 0.7203 (mtp180) REVERT: DC 228 HIS cc_start: 0.6895 (OUTLIER) cc_final: 0.6334 (p-80) REVERT: DK 56 MET cc_start: 0.8992 (mtt) cc_final: 0.8569 (mtm) REVERT: DK 174 ARG cc_start: 0.7973 (OUTLIER) cc_final: 0.7750 (mmm160) REVERT: DL 230 GLU cc_start: 0.8643 (OUTLIER) cc_final: 0.8057 (mt-10) REVERT: DM 197 TYR cc_start: 0.7204 (m-80) cc_final: 0.6849 (m-80) REVERT: DN 100 LEU cc_start: 0.8090 (OUTLIER) cc_final: 0.7731 (mp) REVERT: Dd 36 ASP cc_start: 0.7558 (OUTLIER) cc_final: 0.6881 (p0) REVERT: Dd 68 ASP cc_start: 0.8334 (t70) cc_final: 0.7965 (t0) REVERT: Dd 126 GLU cc_start: 0.7298 (tp30) cc_final: 0.7051 (tt0) REVERT: EK 142 GLU cc_start: 0.8467 (tm-30) cc_final: 0.8245 (tm-30) REVERT: Ed 27 LYS cc_start: 0.9107 (OUTLIER) cc_final: 0.8606 (mttt) REVERT: Ed 62 ILE cc_start: 0.8595 (OUTLIER) cc_final: 0.8393 (pp) REVERT: Ed 100 LYS cc_start: 0.8266 (mtmt) cc_final: 0.8007 (ttmm) REVERT: Ed 152 GLN cc_start: 0.8295 (OUTLIER) cc_final: 0.8004 (mt0) REVERT: FD 152 GLN cc_start: 0.8962 (mt0) cc_final: 0.8698 (mt0) REVERT: Fd 36 ASP cc_start: 0.8026 (OUTLIER) cc_final: 0.7662 (p0) REVERT: Fd 152 GLN cc_start: 0.8233 (OUTLIER) cc_final: 0.7833 (mt0) REVERT: GC 65 SER cc_start: 0.8267 (m) cc_final: 0.7948 (t) REVERT: GC 228 HIS cc_start: 0.7151 (OUTLIER) cc_final: 0.6642 (p90) REVERT: GC 244 ASP cc_start: 0.8419 (OUTLIER) cc_final: 0.8213 (t0) REVERT: GD 155 GLU cc_start: 0.8500 (tt0) cc_final: 0.8220 (tt0) REVERT: Gd 62 ILE cc_start: 0.8499 (OUTLIER) cc_final: 0.8112 (pt) REVERT: Gd 152 GLN cc_start: 0.8252 (OUTLIER) cc_final: 0.8032 (mt0) REVERT: HC 228 HIS cc_start: 0.7277 (OUTLIER) cc_final: 0.6515 (p90) REVERT: HD 68 ASP cc_start: 0.7925 (t0) cc_final: 0.7651 (t0) REVERT: HD 126 GLU cc_start: 0.8429 (pt0) cc_final: 0.8209 (pt0) REVERT: HH 332 ASP cc_start: 0.8524 (OUTLIER) cc_final: 0.7881 (p0) REVERT: HL 230 GLU cc_start: 0.8633 (OUTLIER) cc_final: 0.7941 (mm-30) REVERT: HM 68 GLU cc_start: 0.5196 (OUTLIER) cc_final: 0.4437 (pm20) REVERT: HN 51 CYS cc_start: 0.7897 (OUTLIER) cc_final: 0.7509 (t) REVERT: Hd 30 ILE cc_start: 0.8802 (OUTLIER) cc_final: 0.8587 (pp) REVERT: Hd 36 ASP cc_start: 0.7761 (OUTLIER) cc_final: 0.7326 (p0) REVERT: Hd 126 GLU cc_start: 0.7349 (tt0) cc_final: 0.7089 (tt0) REVERT: Hd 145 ILE cc_start: 0.9109 (OUTLIER) cc_final: 0.8476 (mt) REVERT: Hd 152 GLN cc_start: 0.8221 (OUTLIER) cc_final: 0.7849 (mt0) REVERT: Hf 261 VAL cc_start: 0.8663 (OUTLIER) cc_final: 0.8407 (t) REVERT: IC 65 SER cc_start: 0.8486 (m) cc_final: 0.8210 (t) REVERT: IC 123 GLN cc_start: 0.8446 (mt0) cc_final: 0.8219 (mt0) REVERT: IC 153 MET cc_start: 0.8868 (mmm) cc_final: 0.8639 (mmm) REVERT: IC 228 HIS cc_start: 0.7254 (OUTLIER) cc_final: 0.6398 (p-80) REVERT: IC 231 LEU cc_start: 0.6901 (OUTLIER) cc_final: 0.6601 (mt) REVERT: IK 181 GLU cc_start: 0.8204 (mt-10) cc_final: 0.7808 (mt-10) REVERT: IL 212 ASN cc_start: 0.7960 (OUTLIER) cc_final: 0.7617 (p0) REVERT: IM 141 GLU cc_start: 0.7035 (tm-30) cc_final: 0.6597 (tm-30) REVERT: IN 51 CYS cc_start: 0.7665 (OUTLIER) cc_final: 0.7316 (t) REVERT: IN 100 LEU cc_start: 0.8035 (OUTLIER) cc_final: 0.7702 (mp) REVERT: Id 36 ASP cc_start: 0.7568 (OUTLIER) cc_final: 0.7185 (p0) REVERT: Id 107 ARG cc_start: 0.8079 (OUTLIER) cc_final: 0.7089 (ptp90) REVERT: Id 152 GLN cc_start: 0.7911 (OUTLIER) cc_final: 0.7503 (mt0) REVERT: If 262 ILE cc_start: 0.8449 (mt) cc_final: 0.7863 (tt) REVERT: JD 86 ASP cc_start: 0.8366 (t0) cc_final: 0.8028 (t70) REVERT: JK 150 ASP cc_start: 0.6862 (t0) cc_final: 0.6627 (t0) REVERT: JK 174 ARG cc_start: 0.7870 (mmm160) cc_final: 0.7654 (mmt90) REVERT: JL 230 GLU cc_start: 0.8691 (OUTLIER) cc_final: 0.8192 (mt-10) REVERT: JM 145 ARG cc_start: 0.6699 (tpp-160) cc_final: 0.5846 (mmm160) REVERT: JN 100 LEU cc_start: 0.8003 (OUTLIER) cc_final: 0.7636 (mp) REVERT: KH 332 ASP cc_start: 0.8487 (OUTLIER) cc_final: 0.7821 (p0) REVERT: KK 150 ASP cc_start: 0.6935 (t0) cc_final: 0.6675 (t0) REVERT: KL 230 GLU cc_start: 0.8619 (OUTLIER) cc_final: 0.7995 (mm-30) REVERT: KM 68 GLU cc_start: 0.5479 (OUTLIER) cc_final: 0.4795 (pm20) REVERT: KN 51 CYS cc_start: 0.7942 (OUTLIER) cc_final: 0.7594 (t) REVERT: Kd 152 GLN cc_start: 0.8147 (OUTLIER) cc_final: 0.7896 (mt0) REVERT: Kf 243 MET cc_start: 0.7238 (ttp) cc_final: 0.6999 (mtm) REVERT: LC 228 HIS cc_start: 0.7220 (OUTLIER) cc_final: 0.6666 (p90) REVERT: LL 103 ARG cc_start: 0.7449 (mtp-110) cc_final: 0.7051 (ttm-80) REVERT: LN 44 LYS cc_start: 0.8737 (mmmt) cc_final: 0.8503 (mtpp) REVERT: Ld 36 ASP cc_start: 0.7712 (OUTLIER) cc_final: 0.7260 (p0) REVERT: Lf 219 ARG cc_start: 0.7566 (ptp90) cc_final: 0.7211 (ptp90) REVERT: Lf 243 MET cc_start: 0.7403 (ttm) cc_final: 0.7148 (ttp) REVERT: MC 65 SER cc_start: 0.8679 (m) cc_final: 0.8348 (t) REVERT: MK 174 ARG cc_start: 0.7953 (mmt90) cc_final: 0.7700 (mpt180) REVERT: MM 141 GLU cc_start: 0.7422 (tm-30) cc_final: 0.6940 (tm-30) REVERT: Md 36 ASP cc_start: 0.7914 (OUTLIER) cc_final: 0.7405 (p0) REVERT: Md 152 GLN cc_start: 0.8146 (OUTLIER) cc_final: 0.7720 (mt0) REVERT: Md 155 GLU cc_start: 0.8082 (tt0) cc_final: 0.7783 (tt0) REVERT: Mf 243 MET cc_start: 0.6825 (tpp) cc_final: 0.6346 (ttm) outliers start: 464 outliers final: 249 residues processed: 2192 average time/residue: 2.0804 time to fit residues: 6378.3462 Evaluate side-chains 2226 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 313 poor density : 1913 time to evaluate : 11.523 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 221 VAL Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 75 ASN Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AD residue 123 THR Chi-restraints excluded: chain AH residue 329 THR Chi-restraints excluded: chain AH residue 332 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 110 GLN Chi-restraints excluded: chain AL residue 134 MET Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 136 LEU Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 58 VAL Chi-restraints excluded: chain Ad residue 59 GLU Chi-restraints excluded: chain Ad residue 62 ILE Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain Ad residue 145 ILE Chi-restraints excluded: chain Af residue 212 ILE Chi-restraints excluded: chain Af residue 243 MET Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 221 VAL Chi-restraints excluded: chain BC residue 228 HIS Chi-restraints excluded: chain BC residue 258 ASN Chi-restraints excluded: chain BD residue 38 THR Chi-restraints excluded: chain BD residue 50 ASP Chi-restraints excluded: chain BD residue 75 ASN Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BH residue 316 ASN Chi-restraints excluded: chain BH residue 328 MET Chi-restraints excluded: chain BH residue 332 ASP Chi-restraints excluded: chain BK residue 107 LYS Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 131 LYS Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BL residue 230 GLU Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BM residue 301 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 58 VAL Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CD residue 53 LEU Chi-restraints excluded: chain CD residue 61 VAL Chi-restraints excluded: chain CD residue 85 VAL Chi-restraints excluded: chain CK residue 45 VAL Chi-restraints excluded: chain CK residue 57 MET Chi-restraints excluded: chain CK residue 177 ASN Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CL residue 230 GLU Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CM residue 274 THR Chi-restraints excluded: chain CM residue 299 LEU Chi-restraints excluded: chain CM residue 301 MET Chi-restraints excluded: chain CN residue 82 MET Chi-restraints excluded: chain CN residue 100 LEU Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 58 VAL Chi-restraints excluded: chain Cd residue 145 ILE Chi-restraints excluded: chain Cf residue 212 ILE Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 221 VAL Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 234 THR Chi-restraints excluded: chain DD residue 50 ASP Chi-restraints excluded: chain DD residue 72 THR Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 45 VAL Chi-restraints excluded: chain DK residue 57 MET Chi-restraints excluded: chain DK residue 174 ARG Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 58 VAL Chi-restraints excluded: chain Dd residue 61 VAL Chi-restraints excluded: chain Dd residue 62 ILE Chi-restraints excluded: chain Dd residue 124 LYS Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain EC residue 226 VAL Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain ED residue 75 ASN Chi-restraints excluded: chain EK residue 45 VAL Chi-restraints excluded: chain EK residue 57 MET Chi-restraints excluded: chain EK residue 107 LYS Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 136 LEU Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 227 ILE Chi-restraints excluded: chain EM residue 242 LYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 27 LYS Chi-restraints excluded: chain Ed residue 59 GLU Chi-restraints excluded: chain Ed residue 62 ILE Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ef residue 212 ILE Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 30 SER Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 75 ASN Chi-restraints excluded: chain FH residue 278 ASP Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 133 THR Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 183 VAL Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 30 SER Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GC residue 244 ASP Chi-restraints excluded: chain GC residue 259 SER Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 75 ASN Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GK residue 177 ASN Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 183 VAL Chi-restraints excluded: chain GM residue 301 MET Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 84 CYS Chi-restraints excluded: chain Gd residue 62 ILE Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gd residue 152 GLN Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 30 SER Chi-restraints excluded: chain HC residue 221 VAL Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HC residue 229 THR Chi-restraints excluded: chain HC residue 244 ASP Chi-restraints excluded: chain HD residue 61 VAL Chi-restraints excluded: chain HD residue 75 ASN Chi-restraints excluded: chain HD residue 85 VAL Chi-restraints excluded: chain HD residue 123 THR Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HL residue 230 GLU Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 278 ASP Chi-restraints excluded: chain HM residue 292 MET Chi-restraints excluded: chain HN residue 45 MET Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 58 VAL Chi-restraints excluded: chain Hd residue 59 GLU Chi-restraints excluded: chain Hd residue 145 ILE Chi-restraints excluded: chain Hd residue 152 GLN Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 30 SER Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain IC residue 231 LEU Chi-restraints excluded: chain IC residue 244 ASP Chi-restraints excluded: chain IC residue 249 ILE Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 72 THR Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IK residue 122 LYS Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 58 VAL Chi-restraints excluded: chain Id residue 107 ARG Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain Id residue 152 GLN Chi-restraints excluded: chain If residue 212 ILE Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 244 ASP Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 50 ASP Chi-restraints excluded: chain JD residue 75 ASN Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 55 LYS Chi-restraints excluded: chain JK residue 129 GLU Chi-restraints excluded: chain JL residue 212 ASN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JL residue 230 GLU Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JM residue 234 GLU Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 58 VAL Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 30 SER Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 234 THR Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 38 THR Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 332 ASP Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KK residue 129 GLU Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 50 ASP Chi-restraints excluded: chain Kd residue 59 GLU Chi-restraints excluded: chain Kd residue 152 GLN Chi-restraints excluded: chain Kd residue 154 VAL Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 53 LEU Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 45 VAL Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 262 GLU Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 54 GLU Chi-restraints excluded: chain Ld residue 58 VAL Chi-restraints excluded: chain Ld residue 59 GLU Chi-restraints excluded: chain Ld residue 67 LYS Chi-restraints excluded: chain Ld residue 84 SER Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MC residue 69 GLN Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain MH residue 354 MET Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain ML residue 111 LYS Chi-restraints excluded: chain ML residue 190 MET Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MM residue 301 MET Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain MN residue 82 MET Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 58 VAL Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 212 ILE Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=3.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1329 optimal weight: 6.9990 chunk 905 optimal weight: 8.9990 chunk 23 optimal weight: 0.7980 chunk 1188 optimal weight: 0.9990 chunk 658 optimal weight: 0.9980 chunk 1361 optimal weight: 2.9990 chunk 1103 optimal weight: 7.9990 chunk 1 optimal weight: 0.9980 chunk 814 optimal weight: 2.9990 chunk 1432 optimal weight: 1.9990 chunk 402 optimal weight: 0.5980 overall best weight: 0.8782 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BD 80 GLN BD 138 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DL 160 GLN EC 35 GLN FD 75 ASN FL 110 GLN GC 82 GLN GL 160 GLN HH 277 ASN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 308 ASN IH 335 HIS IL 160 GLN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN KN 104 ASN ** LD 78 ASN ** both conformations clash, **PLEASE CHECK MANUALLY** LD 80 GLN LL 160 GLN Ld 75 ASN ML 110 GLN ML 183 GLN Total number of N/Q/H flips: 25 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8473 moved from start: 0.2042 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.003 0.043 137280 Z= 0.165 Angle : 0.525 10.255 185796 Z= 0.283 Chirality : 0.044 0.172 21021 Planarity : 0.004 0.061 23738 Dihedral : 4.877 25.367 18824 Min Nonbonded Distance : 2.208 Molprobity Statistics. All-atom Clashscore : 5.29 Ramachandran Plot: Outliers : 0.00 % Allowed : 4.28 % Favored : 95.72 % Rotamer: Outliers : 2.57 % Allowed : 15.80 % Favored : 81.64 % 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: 0.38 (0.07), residues: 16835 helix: 2.92 (0.08), residues: 4225 sheet: 0.48 (0.08), residues: 4459 loop : -1.41 (0.06), residues: 8151 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.017 0.001 TRPHM 236 HIS 0.004 0.001 HISEM 256 PHE 0.016 0.001 PHEAd 25 TYR 0.015 0.001 TYRBM 281 ARG 0.010 0.000 ARGML 103 *********************** REFINEMENT MACRO_CYCLE 5 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2391 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 375 poor density : 2016 time to evaluate : 10.569 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7232 (OUTLIER) cc_final: 0.6837 (p90) REVERT: AD 55 MET cc_start: 0.8545 (tmm) cc_final: 0.8261 (ttp) REVERT: AD 59 GLU cc_start: 0.7961 (tt0) cc_final: 0.7601 (tt0) REVERT: AD 85 VAL cc_start: 0.8948 (OUTLIER) cc_final: 0.8641 (t) REVERT: AH 332 ASP cc_start: 0.8340 (OUTLIER) cc_final: 0.8048 (p0) REVERT: AK 46 ASP cc_start: 0.7798 (p0) cc_final: 0.7511 (p0) REVERT: AM 88 ASN cc_start: 0.5641 (t0) cc_final: 0.5230 (m-40) REVERT: Ad 36 ASP cc_start: 0.6846 (OUTLIER) cc_final: 0.6142 (p0) REVERT: Ad 59 GLU cc_start: 0.7375 (mt-10) cc_final: 0.7095 (mm-30) REVERT: Ad 111 LYS cc_start: 0.7646 (pmtt) cc_final: 0.7192 (ptmm) REVERT: Af 219 ARG cc_start: 0.7362 (ptp90) cc_final: 0.6917 (ptp90) REVERT: BD 75 ASN cc_start: 0.8205 (OUTLIER) cc_final: 0.7865 (p0) REVERT: BH 332 ASP cc_start: 0.8422 (OUTLIER) cc_final: 0.8175 (p0) REVERT: BL 131 LYS cc_start: 0.9145 (OUTLIER) cc_final: 0.8938 (mmmt) REVERT: BL 163 ILE cc_start: 0.8920 (OUTLIER) cc_final: 0.8242 (mm) REVERT: BM 68 GLU cc_start: 0.5442 (OUTLIER) cc_final: 0.4836 (pm20) REVERT: BM 141 GLU cc_start: 0.7419 (tm-30) cc_final: 0.7028 (tm-30) REVERT: BM 301 MET cc_start: 0.9066 (OUTLIER) cc_final: 0.8769 (mmm) REVERT: BN 45 MET cc_start: 0.6919 (OUTLIER) cc_final: 0.6447 (mtt) REVERT: BN 51 CYS cc_start: 0.7540 (OUTLIER) cc_final: 0.7224 (t) REVERT: BN 100 LEU cc_start: 0.7931 (OUTLIER) cc_final: 0.7668 (mp) REVERT: Bd 82 ARG cc_start: 0.8943 (mmm-85) cc_final: 0.8618 (mmt90) REVERT: Bf 243 MET cc_start: 0.7051 (mtp) cc_final: 0.6673 (ttp) REVERT: CC 209 MET cc_start: 0.8902 (mtt) cc_final: 0.8506 (mtm) REVERT: CC 228 HIS cc_start: 0.7214 (OUTLIER) cc_final: 0.6542 (p-80) REVERT: CK 130 ARG cc_start: 0.7939 (mtt-85) cc_final: 0.7648 (mtt-85) REVERT: CL 110 GLN cc_start: 0.8329 (OUTLIER) cc_final: 0.7945 (tp40) REVERT: CL 212 ASN cc_start: 0.7577 (OUTLIER) cc_final: 0.7188 (p0) REVERT: CM 141 GLU cc_start: 0.7299 (tm-30) cc_final: 0.6879 (tm-30) REVERT: CM 145 ARG cc_start: 0.6400 (OUTLIER) cc_final: 0.5633 (mpp-170) REVERT: CN 51 CYS cc_start: 0.7697 (OUTLIER) cc_final: 0.7291 (t) REVERT: Cf 253 ARG cc_start: 0.7870 (OUTLIER) cc_final: 0.7117 (mtp180) REVERT: DC 228 HIS cc_start: 0.6822 (OUTLIER) cc_final: 0.6278 (p-80) REVERT: DD 36 ASP cc_start: 0.7086 (OUTLIER) cc_final: 0.6808 (p0) REVERT: DK 174 ARG cc_start: 0.7902 (OUTLIER) cc_final: 0.7699 (mmm160) REVERT: DL 230 GLU cc_start: 0.8582 (OUTLIER) cc_final: 0.8080 (mt-10) REVERT: DM 197 TYR cc_start: 0.7255 (m-80) cc_final: 0.6873 (m-80) REVERT: DN 100 LEU cc_start: 0.8123 (OUTLIER) cc_final: 0.7660 (mp) REVERT: Dd 36 ASP cc_start: 0.7187 (OUTLIER) cc_final: 0.6500 (p0) REVERT: Dd 68 ASP cc_start: 0.8315 (t70) cc_final: 0.7908 (t0) REVERT: Dd 126 GLU cc_start: 0.7235 (tp30) cc_final: 0.6988 (tt0) REVERT: ED 75 ASN cc_start: 0.8351 (OUTLIER) cc_final: 0.8009 (p0) REVERT: EH 354 MET cc_start: 0.8686 (ptp) cc_final: 0.8361 (ptp) REVERT: EL 212 ASN cc_start: 0.7616 (OUTLIER) cc_final: 0.7235 (p0) REVERT: EM 69 VAL cc_start: 0.3432 (OUTLIER) cc_final: 0.3070 (p) REVERT: Ed 62 ILE cc_start: 0.8667 (OUTLIER) cc_final: 0.8447 (pp) REVERT: Ed 152 GLN cc_start: 0.8237 (OUTLIER) cc_final: 0.7996 (mt0) REVERT: FC 228 HIS cc_start: 0.6818 (OUTLIER) cc_final: 0.6290 (p90) REVERT: FD 152 GLN cc_start: 0.8918 (mt0) cc_final: 0.8645 (mt0) REVERT: Fd 36 ASP cc_start: 0.7266 (OUTLIER) cc_final: 0.6679 (p0) REVERT: Fd 62 ILE cc_start: 0.8355 (OUTLIER) cc_final: 0.7978 (pt) REVERT: Ff 230 LEU cc_start: 0.6801 (OUTLIER) cc_final: 0.6523 (tt) REVERT: GC 228 HIS cc_start: 0.7067 (OUTLIER) cc_final: 0.6654 (p90) REVERT: GD 155 GLU cc_start: 0.8471 (tt0) cc_final: 0.8180 (tt0) REVERT: Gd 62 ILE cc_start: 0.8374 (OUTLIER) cc_final: 0.7926 (pt) REVERT: HC 228 HIS cc_start: 0.7076 (OUTLIER) cc_final: 0.6431 (p90) REVERT: HD 68 ASP cc_start: 0.7717 (t0) cc_final: 0.7437 (t0) REVERT: HH 332 ASP cc_start: 0.8497 (OUTLIER) cc_final: 0.7869 (p0) REVERT: HK 86 ASP cc_start: 0.8156 (t70) cc_final: 0.7926 (t0) REVERT: HL 230 GLU cc_start: 0.8604 (OUTLIER) cc_final: 0.7725 (mt-10) REVERT: HM 68 GLU cc_start: 0.5173 (OUTLIER) cc_final: 0.4392 (pm20) REVERT: HM 141 GLU cc_start: 0.7356 (tm-30) cc_final: 0.6907 (tm-30) REVERT: Hd 30 ILE cc_start: 0.8749 (OUTLIER) cc_final: 0.8527 (pp) REVERT: Hd 36 ASP cc_start: 0.7269 (OUTLIER) cc_final: 0.6543 (p0) REVERT: Hd 126 GLU cc_start: 0.7402 (tt0) cc_final: 0.7165 (tt0) REVERT: Hd 145 ILE cc_start: 0.9083 (OUTLIER) cc_final: 0.8480 (mt) REVERT: Hd 152 GLN cc_start: 0.8137 (OUTLIER) cc_final: 0.7805 (mt0) REVERT: Hf 261 VAL cc_start: 0.8643 (p) cc_final: 0.8414 (t) REVERT: IC 123 GLN cc_start: 0.8324 (mt0) cc_final: 0.8087 (mt0) REVERT: IC 228 HIS cc_start: 0.7109 (OUTLIER) cc_final: 0.6277 (p-80) REVERT: ID 71 LEU cc_start: 0.8899 (OUTLIER) cc_final: 0.8687 (mt) REVERT: IK 181 GLU cc_start: 0.8178 (mt-10) cc_final: 0.7785 (mt-10) REVERT: IL 110 GLN cc_start: 0.8398 (OUTLIER) cc_final: 0.7910 (tt0) REVERT: IL 212 ASN cc_start: 0.7619 (OUTLIER) cc_final: 0.7355 (p0) REVERT: IL 230 GLU cc_start: 0.8619 (OUTLIER) cc_final: 0.8116 (mt-10) REVERT: IN 51 CYS cc_start: 0.7593 (OUTLIER) cc_final: 0.7245 (t) REVERT: IN 100 LEU cc_start: 0.8078 (OUTLIER) cc_final: 0.7764 (mp) REVERT: Id 36 ASP cc_start: 0.6988 (OUTLIER) cc_final: 0.6658 (p0) REVERT: Id 152 GLN cc_start: 0.7680 (OUTLIER) cc_final: 0.7312 (mt0) REVERT: If 262 ILE cc_start: 0.8342 (mt) cc_final: 0.7798 (tt) REVERT: JD 86 ASP cc_start: 0.8142 (t0) cc_final: 0.7835 (t70) REVERT: JK 107 LYS cc_start: 0.9117 (OUTLIER) cc_final: 0.8614 (mttp) REVERT: JK 150 ASP cc_start: 0.6692 (t0) cc_final: 0.6472 (t0) REVERT: JK 174 ARG cc_start: 0.7787 (mmm160) cc_final: 0.7552 (mmt90) REVERT: JL 110 GLN cc_start: 0.8364 (OUTLIER) cc_final: 0.7838 (tp40) REVERT: JM 145 ARG cc_start: 0.6724 (tpp-160) cc_final: 0.5867 (mmm160) REVERT: JN 100 LEU cc_start: 0.7976 (OUTLIER) cc_final: 0.7594 (mp) REVERT: Jd 54 GLU cc_start: 0.7726 (OUTLIER) cc_final: 0.7427 (tp30) REVERT: KC 131 THR cc_start: 0.9456 (t) cc_final: 0.9247 (t) REVERT: KK 55 LYS cc_start: 0.8366 (tttp) cc_final: 0.8020 (tttp) REVERT: KK 56 MET cc_start: 0.8877 (mtt) cc_final: 0.8560 (mtt) REVERT: KK 150 ASP cc_start: 0.6878 (t0) cc_final: 0.6646 (t0) REVERT: KL 212 ASN cc_start: 0.7774 (OUTLIER) cc_final: 0.7527 (p0) REVERT: KL 230 GLU cc_start: 0.8609 (OUTLIER) cc_final: 0.7955 (mm-30) REVERT: KM 68 GLU cc_start: 0.5499 (OUTLIER) cc_final: 0.4784 (pm20) REVERT: Kd 152 GLN cc_start: 0.8063 (OUTLIER) cc_final: 0.7835 (mt0) REVERT: Kf 243 MET cc_start: 0.7228 (ttp) cc_final: 0.7001 (mtm) REVERT: LC 228 HIS cc_start: 0.7166 (OUTLIER) cc_final: 0.6604 (p90) REVERT: Ld 36 ASP cc_start: 0.7085 (OUTLIER) cc_final: 0.6736 (p0) REVERT: Lf 219 ARG cc_start: 0.7568 (ptp90) cc_final: 0.7235 (ptp90) REVERT: Lf 243 MET cc_start: 0.7405 (ttm) cc_final: 0.7160 (ttp) REVERT: MD 126 GLU cc_start: 0.8164 (pt0) cc_final: 0.7938 (pt0) REVERT: MK 174 ARG cc_start: 0.7932 (mmt90) cc_final: 0.7730 (mpt180) REVERT: MM 141 GLU cc_start: 0.7356 (tm-30) cc_final: 0.6977 (tm-30) REVERT: Md 36 ASP cc_start: 0.7258 (OUTLIER) cc_final: 0.6619 (p0) REVERT: Md 107 ARG cc_start: 0.8067 (ptp90) cc_final: 0.7808 (ttm170) REVERT: Md 152 GLN cc_start: 0.7980 (OUTLIER) cc_final: 0.7682 (mt0) REVERT: Md 155 GLU cc_start: 0.8039 (tt0) cc_final: 0.7740 (tt0) REVERT: Mf 243 MET cc_start: 0.6921 (tpp) cc_final: 0.6436 (ttm) outliers start: 375 outliers final: 187 residues processed: 2203 average time/residue: 2.0723 time to fit residues: 6400.6908 Evaluate side-chains 2192 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 252 poor density : 1940 time to evaluate : 11.563 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AH residue 332 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 58 VAL Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain Ad residue 145 ILE Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 65 SER Chi-restraints excluded: chain BD residue 75 ASN Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BH residue 316 ASN Chi-restraints excluded: chain BH residue 332 ASP Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 131 LYS Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BM residue 301 MET Chi-restraints excluded: chain BN residue 45 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 58 VAL Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 95 THR Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CD residue 61 VAL Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 212 ASN Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 146 LEU Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 58 VAL Chi-restraints excluded: chain Cd residue 160 LYS Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 65 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 36 ASP Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 174 ARG Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 54 GLU Chi-restraints excluded: chain Dd residue 58 VAL Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 124 LYS Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain EC residue 209 MET Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 75 ASN Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 57 MET Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EL residue 212 ASN Chi-restraints excluded: chain EM residue 69 VAL Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 242 LYS Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 58 VAL Chi-restraints excluded: chain Ed residue 61 VAL Chi-restraints excluded: chain Ed residue 62 ILE Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 145 ILE Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 278 ASP Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 41 PHE Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 62 ILE Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 230 LEU Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 30 SER Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GC residue 259 SER Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 75 ASN Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GK residue 177 ASN Chi-restraints excluded: chain GL residue 204 LYS Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 136 LEU Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 62 ILE Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 30 SER Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HD residue 61 VAL Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HL residue 230 GLU Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 62 ASN Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 58 VAL Chi-restraints excluded: chain Hd residue 145 ILE Chi-restraints excluded: chain Hd residue 152 GLN Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 61 VAL Chi-restraints excluded: chain ID residue 71 LEU Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain IL residue 110 GLN Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IL residue 230 GLU Chi-restraints excluded: chain IM residue 127 ASN Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 259 SER Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 58 VAL Chi-restraints excluded: chain Id residue 97 ARG Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain Id residue 152 GLN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 107 LYS Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JM residue 242 LYS Chi-restraints excluded: chain JN residue 44 LYS Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 54 GLU Chi-restraints excluded: chain Jd residue 62 ILE Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 129 GLU Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 50 ASP Chi-restraints excluded: chain Kd residue 58 VAL Chi-restraints excluded: chain Kd residue 62 ILE Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kd residue 152 GLN Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 65 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 84 SER Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 232 VAL Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain ML residue 110 GLN Chi-restraints excluded: chain ML residue 111 LYS Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=3.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 536 optimal weight: 0.8980 chunk 1437 optimal weight: 0.9980 chunk 315 optimal weight: 5.9990 chunk 936 optimal weight: 0.9990 chunk 393 optimal weight: 1.9990 chunk 1597 optimal weight: 0.0870 chunk 1326 optimal weight: 0.5980 chunk 739 optimal weight: 3.9990 chunk 132 optimal weight: 0.6980 chunk 528 optimal weight: 0.0040 chunk 838 optimal weight: 40.0000 overall best weight: 0.4570 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BD 80 GLN BL 110 GLN BL 160 GLN CC 149 GLN CL 160 GLN CL 183 GLN DC 104 ASN DL 160 GLN FD 75 ASN FD 80 GLN FD 138 GLN HL 160 GLN ID 138 GLN IH 308 ASN IN 104 ASN Id 80 GLN JD 80 GLN JN 104 ASN KH 277 ASN KN 104 ASN Kd 80 GLN LL 160 GLN Ld 75 ASN MK 72 GLN ML 183 GLN Total number of N/Q/H flips: 26 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8423 moved from start: 0.1946 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.002 0.054 137280 Z= 0.131 Angle : 0.488 11.278 185796 Z= 0.260 Chirality : 0.043 0.248 21021 Planarity : 0.004 0.057 23738 Dihedral : 4.453 22.964 18824 Min Nonbonded Distance : 2.181 Molprobity Statistics. All-atom Clashscore : 5.30 Ramachandran Plot: Outliers : 0.01 % Allowed : 4.55 % Favored : 95.44 % Rotamer: Outliers : 2.27 % Allowed : 16.47 % Favored : 81.26 % 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: 0.70 (0.07), residues: 16835 helix: 3.17 (0.08), residues: 4225 sheet: 0.73 (0.08), residues: 4381 loop : -1.22 (0.06), residues: 8229 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.020 0.001 TRPFM 206 HIS 0.003 0.000 HISMM 256 PHE 0.017 0.001 PHEAd 25 TYR 0.014 0.001 TYRHD 162 ARG 0.012 0.000 ARGHL 103 *********************** REFINEMENT MACRO_CYCLE 6 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2396 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 331 poor density : 2065 time to evaluate : 11.887 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7016 (OUTLIER) cc_final: 0.6658 (p90) REVERT: AD 55 MET cc_start: 0.8570 (tmm) cc_final: 0.8207 (ttp) REVERT: AK 46 ASP cc_start: 0.7757 (p0) cc_final: 0.7551 (p0) REVERT: AK 86 ASP cc_start: 0.8313 (t70) cc_final: 0.8064 (t0) REVERT: AM 88 ASN cc_start: 0.5653 (t0) cc_final: 0.5221 (m-40) REVERT: Ad 36 ASP cc_start: 0.6617 (OUTLIER) cc_final: 0.5943 (p0) REVERT: Ad 111 LYS cc_start: 0.7533 (pmtt) cc_final: 0.7160 (ptmm) REVERT: Af 219 ARG cc_start: 0.7387 (ptp90) cc_final: 0.6940 (ptp90) REVERT: BH 359 GLU cc_start: 0.8311 (mt-10) cc_final: 0.7977 (mt-10) REVERT: BK 129 GLU cc_start: 0.7957 (OUTLIER) cc_final: 0.7570 (mt-10) REVERT: BL 163 ILE cc_start: 0.8902 (OUTLIER) cc_final: 0.8222 (mm) REVERT: BM 68 GLU cc_start: 0.5402 (OUTLIER) cc_final: 0.4808 (pm20) REVERT: BN 51 CYS cc_start: 0.7523 (OUTLIER) cc_final: 0.7180 (t) REVERT: Bd 59 GLU cc_start: 0.7490 (tt0) cc_final: 0.7278 (tt0) REVERT: Bd 82 ARG cc_start: 0.8895 (mmm-85) cc_final: 0.8694 (mtp180) REVERT: Bf 243 MET cc_start: 0.7016 (mtp) cc_final: 0.6651 (ttp) REVERT: CC 209 MET cc_start: 0.8717 (OUTLIER) cc_final: 0.8488 (ttm) REVERT: CC 228 HIS cc_start: 0.7168 (OUTLIER) cc_final: 0.6489 (p-80) REVERT: CL 108 ASP cc_start: 0.7821 (m-30) cc_final: 0.7558 (m-30) REVERT: CL 110 GLN cc_start: 0.8238 (OUTLIER) cc_final: 0.7813 (tp40) REVERT: CL 212 ASN cc_start: 0.7466 (OUTLIER) cc_final: 0.7163 (p0) REVERT: CM 70 MET cc_start: 0.5591 (mpp) cc_final: 0.5356 (mpt) REVERT: CM 141 GLU cc_start: 0.7482 (tm-30) cc_final: 0.7116 (tm-30) REVERT: CM 262 GLU cc_start: 0.8204 (OUTLIER) cc_final: 0.7761 (pm20) REVERT: CN 94 GLN cc_start: 0.7966 (pp30) cc_final: 0.7564 (pp30) REVERT: Cd 54 GLU cc_start: 0.7507 (OUTLIER) cc_final: 0.7199 (tp30) REVERT: Cf 253 ARG cc_start: 0.7849 (OUTLIER) cc_final: 0.7086 (mtp180) REVERT: DC 228 HIS cc_start: 0.6819 (OUTLIER) cc_final: 0.6288 (p-80) REVERT: DD 155 GLU cc_start: 0.8517 (tt0) cc_final: 0.8245 (tt0) REVERT: DL 230 GLU cc_start: 0.8595 (OUTLIER) cc_final: 0.8105 (mt-10) REVERT: DM 164 GLN cc_start: 0.6500 (OUTLIER) cc_final: 0.6032 (tm-30) REVERT: DM 197 TYR cc_start: 0.7203 (m-80) cc_final: 0.6811 (m-80) REVERT: DM 301 MET cc_start: 0.9027 (mmp) cc_final: 0.8505 (mmm) REVERT: DN 100 LEU cc_start: 0.8087 (OUTLIER) cc_final: 0.7818 (tp) REVERT: Dd 36 ASP cc_start: 0.6941 (OUTLIER) cc_final: 0.6311 (p0) REVERT: Dd 68 ASP cc_start: 0.8281 (t70) cc_final: 0.7852 (t0) REVERT: Dd 82 ARG cc_start: 0.8539 (mmt90) cc_final: 0.8262 (mmt90) REVERT: Df 230 LEU cc_start: 0.6951 (OUTLIER) cc_final: 0.6723 (tt) REVERT: EK 55 LYS cc_start: 0.8521 (OUTLIER) cc_final: 0.8233 (tttp) REVERT: EM 69 VAL cc_start: 0.3386 (OUTLIER) cc_final: 0.3045 (p) REVERT: EM 141 GLU cc_start: 0.7239 (tm-30) cc_final: 0.6876 (tm-30) REVERT: EM 145 ARG cc_start: 0.5747 (mtm-85) cc_final: 0.5198 (mpp80) REVERT: Ed 36 ASP cc_start: 0.7031 (p0) cc_final: 0.6551 (p0) REVERT: FC 228 HIS cc_start: 0.6847 (OUTLIER) cc_final: 0.6343 (p90) REVERT: FD 152 GLN cc_start: 0.8924 (mt0) cc_final: 0.8681 (mt0) REVERT: FM 145 ARG cc_start: 0.6677 (mpp-170) cc_final: 0.6297 (mpp-170) REVERT: Fd 36 ASP cc_start: 0.7073 (OUTLIER) cc_final: 0.6555 (p0) REVERT: Ff 230 LEU cc_start: 0.6816 (OUTLIER) cc_final: 0.6556 (tt) REVERT: GC 228 HIS cc_start: 0.7086 (OUTLIER) cc_final: 0.6652 (p90) REVERT: GD 155 GLU cc_start: 0.8467 (tt0) cc_final: 0.8174 (tt0) REVERT: GM 70 MET cc_start: 0.5192 (mpp) cc_final: 0.4642 (mmm) REVERT: Gf 219 ARG cc_start: 0.7574 (ttm-80) cc_final: 0.7286 (ttm-80) REVERT: Gf 262 ILE cc_start: 0.8371 (mp) cc_final: 0.8156 (tt) REVERT: HC 228 HIS cc_start: 0.6907 (OUTLIER) cc_final: 0.6303 (p90) REVERT: HD 68 ASP cc_start: 0.7547 (t0) cc_final: 0.7266 (t0) REVERT: HH 332 ASP cc_start: 0.8439 (OUTLIER) cc_final: 0.7787 (p0) REVERT: HK 86 ASP cc_start: 0.8122 (t70) cc_final: 0.7914 (t0) REVERT: HM 68 GLU cc_start: 0.5190 (OUTLIER) cc_final: 0.4383 (pm20) REVERT: HM 141 GLU cc_start: 0.7414 (tm-30) cc_final: 0.7135 (tm-30) REVERT: HM 145 ARG cc_start: 0.6808 (mpp-170) cc_final: 0.6083 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8749 (OUTLIER) cc_final: 0.8538 (pp) REVERT: Hd 36 ASP cc_start: 0.6985 (OUTLIER) cc_final: 0.6252 (p0) REVERT: Hf 261 VAL cc_start: 0.8672 (OUTLIER) cc_final: 0.8460 (t) REVERT: IC 123 GLN cc_start: 0.8329 (mt0) cc_final: 0.8094 (mt0) REVERT: IC 228 HIS cc_start: 0.7049 (OUTLIER) cc_final: 0.6338 (p-80) REVERT: ID 125 ASP cc_start: 0.8749 (t70) cc_final: 0.8495 (t70) REVERT: IK 181 GLU cc_start: 0.8172 (mt-10) cc_final: 0.7762 (mt-10) REVERT: IM 141 GLU cc_start: 0.7053 (OUTLIER) cc_final: 0.6732 (tm-30) REVERT: IN 51 CYS cc_start: 0.7568 (OUTLIER) cc_final: 0.7239 (t) REVERT: Id 36 ASP cc_start: 0.6763 (OUTLIER) cc_final: 0.6256 (p0) REVERT: Id 155 GLU cc_start: 0.8049 (tt0) cc_final: 0.7699 (tt0) REVERT: If 262 ILE cc_start: 0.8311 (mt) cc_final: 0.7762 (tt) REVERT: JD 86 ASP cc_start: 0.8093 (t0) cc_final: 0.7830 (t70) REVERT: JL 110 GLN cc_start: 0.8272 (OUTLIER) cc_final: 0.7715 (tp40) REVERT: JM 145 ARG cc_start: 0.6582 (tpp-160) cc_final: 0.5837 (mmm160) REVERT: JN 45 MET cc_start: 0.6691 (OUTLIER) cc_final: 0.5767 (mtt) REVERT: JN 100 LEU cc_start: 0.7987 (OUTLIER) cc_final: 0.7603 (mp) REVERT: KC 131 THR cc_start: 0.9450 (t) cc_final: 0.9192 (t) REVERT: KD 50 ASP cc_start: 0.7956 (p0) cc_final: 0.7732 (p0) REVERT: KK 55 LYS cc_start: 0.8347 (tttp) cc_final: 0.8007 (tttp) REVERT: KK 150 ASP cc_start: 0.6823 (t0) cc_final: 0.6605 (t0) REVERT: KL 230 GLU cc_start: 0.8637 (OUTLIER) cc_final: 0.7823 (mt-10) REVERT: KM 68 GLU cc_start: 0.5647 (OUTLIER) cc_final: 0.4842 (pm20) REVERT: KM 143 THR cc_start: 0.4396 (OUTLIER) cc_final: 0.4162 (m) REVERT: KM 145 ARG cc_start: 0.6574 (mpp-170) cc_final: 0.6288 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7231 (ttp) cc_final: 0.6995 (mtm) REVERT: Kf 262 ILE cc_start: 0.8402 (mt) cc_final: 0.7699 (tt) REVERT: LC 228 HIS cc_start: 0.6967 (OUTLIER) cc_final: 0.6547 (p90) REVERT: Ld 36 ASP cc_start: 0.6867 (OUTLIER) cc_final: 0.6542 (p0) REVERT: Lf 219 ARG cc_start: 0.7576 (ptp90) cc_final: 0.7156 (ptp90) REVERT: Lf 243 MET cc_start: 0.7487 (ttm) cc_final: 0.7201 (ttp) REVERT: MD 50 ASP cc_start: 0.7909 (p0) cc_final: 0.7683 (p0) REVERT: MM 141 GLU cc_start: 0.7231 (OUTLIER) cc_final: 0.6867 (tm-30) REVERT: MM 145 ARG cc_start: 0.6892 (mpp-170) cc_final: 0.5643 (mpp-170) REVERT: Md 107 ARG cc_start: 0.7944 (ptp90) cc_final: 0.7701 (ttm170) REVERT: Md 152 GLN cc_start: 0.7835 (OUTLIER) cc_final: 0.7618 (mt0) REVERT: Md 155 GLU cc_start: 0.8021 (tt0) cc_final: 0.7800 (tt0) REVERT: Mf 219 ARG cc_start: 0.7427 (ttm-80) cc_final: 0.7158 (ttm-80) REVERT: Mf 243 MET cc_start: 0.7051 (tpp) cc_final: 0.6465 (ttm) outliers start: 331 outliers final: 134 residues processed: 2233 average time/residue: 2.0378 time to fit residues: 6388.9508 Evaluate side-chains 2136 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 179 poor density : 1957 time to evaluate : 11.474 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain BC residue 65 SER Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain CC residue 209 MET Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 212 ASN Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 54 GLU Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 65 SER Chi-restraints excluded: chain DC residue 209 MET Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DM residue 164 GLN Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 124 LYS Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Df residue 230 LEU Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 55 LYS Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 69 VAL Chi-restraints excluded: chain EM residue 136 LEU Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 59 GLU Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Ff residue 230 LEU Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GD residue 38 THR Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 36 ASP Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 144 THR Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 184 LEU Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 116 THR Chi-restraints excluded: chain IC residue 226 VAL Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain ID residue 71 LEU Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IM residue 141 GLU Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 242 LYS Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 97 ARG Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JN residue 45 MET Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain JN residue 62 ASN Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 38 THR Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KM residue 143 THR Chi-restraints excluded: chain KM residue 183 VAL Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 65 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 232 VAL Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 141 GLU Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 62 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=2.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1540 optimal weight: 9.9990 chunk 180 optimal weight: 4.9990 chunk 910 optimal weight: 0.8980 chunk 1166 optimal weight: 0.7980 chunk 903 optimal weight: 1.9990 chunk 1344 optimal weight: 8.9990 chunk 892 optimal weight: 1.9990 chunk 1591 optimal weight: 0.8980 chunk 995 optimal weight: 5.9990 chunk 970 optimal weight: 9.9990 chunk 734 optimal weight: 6.9990 overall best weight: 1.3184 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BL 110 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** FH 277 ASN FL 110 GLN FN 104 ASN GD 75 ASN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IL 160 GLN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN KN 104 ASN LL 160 GLN LN 49 ASN ML 183 GLN Total number of N/Q/H flips: 16 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8478 moved from start: 0.2084 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.003 0.043 137280 Z= 0.200 Angle : 0.547 9.718 185796 Z= 0.292 Chirality : 0.044 0.232 21021 Planarity : 0.004 0.056 23738 Dihedral : 4.698 27.058 18824 Min Nonbonded Distance : 2.212 Molprobity Statistics. All-atom Clashscore : 5.15 Ramachandran Plot: Outliers : 0.01 % Allowed : 4.84 % Favored : 95.16 % Rotamer: Outliers : 2.27 % Allowed : 17.09 % Favored : 80.64 % 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: 0.61 (0.07), residues: 16835 helix: 3.16 (0.08), residues: 4225 sheet: 0.74 (0.08), residues: 4277 loop : -1.33 (0.06), residues: 8333 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.018 0.002 TRPFM 206 HIS 0.003 0.001 HISBM 256 PHE 0.015 0.001 PHEBd 25 TYR 0.021 0.001 TYRJM 281 ARG 0.012 0.000 ARGHL 103 *********************** REFINEMENT MACRO_CYCLE 7 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2296 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 332 poor density : 1964 time to evaluate : 11.924 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7118 (OUTLIER) cc_final: 0.6726 (p90) REVERT: AD 55 MET cc_start: 0.8619 (tmm) cc_final: 0.8346 (ttp) REVERT: AK 86 ASP cc_start: 0.8352 (t70) cc_final: 0.8099 (t0) REVERT: AM 70 MET cc_start: 0.5981 (mpp) cc_final: 0.5602 (mpp) REVERT: AM 88 ASN cc_start: 0.5695 (t0) cc_final: 0.5304 (m-40) REVERT: Ad 36 ASP cc_start: 0.6894 (OUTLIER) cc_final: 0.6198 (p0) REVERT: Ad 111 LYS cc_start: 0.7563 (pmtt) cc_final: 0.7180 (ptmm) REVERT: Af 219 ARG cc_start: 0.7443 (ptp90) cc_final: 0.6990 (ptp90) REVERT: BK 55 LYS cc_start: 0.8339 (tttp) cc_final: 0.8012 (tttp) REVERT: BK 130 ARG cc_start: 0.7798 (mtt180) cc_final: 0.7559 (mtm180) REVERT: BL 163 ILE cc_start: 0.8954 (OUTLIER) cc_final: 0.8282 (mm) REVERT: BM 68 GLU cc_start: 0.5451 (OUTLIER) cc_final: 0.4800 (pm20) REVERT: BM 141 GLU cc_start: 0.7155 (tm-30) cc_final: 0.6942 (tm-30) REVERT: BN 45 MET cc_start: 0.6773 (OUTLIER) cc_final: 0.6362 (mtt) REVERT: Bd 152 GLN cc_start: 0.8029 (OUTLIER) cc_final: 0.7736 (mt0) REVERT: Bf 243 MET cc_start: 0.7031 (mtp) cc_final: 0.6674 (ttp) REVERT: CC 209 MET cc_start: 0.8861 (mtt) cc_final: 0.8573 (mtm) REVERT: CC 228 HIS cc_start: 0.7232 (OUTLIER) cc_final: 0.6510 (p-80) REVERT: CK 130 ARG cc_start: 0.7949 (mtt-85) cc_final: 0.7691 (mtt-85) REVERT: CL 108 ASP cc_start: 0.7876 (m-30) cc_final: 0.7607 (m-30) REVERT: CL 110 GLN cc_start: 0.8378 (OUTLIER) cc_final: 0.8012 (tp40) REVERT: CM 141 GLU cc_start: 0.7272 (tm-30) cc_final: 0.6892 (tm-30) REVERT: CM 262 GLU cc_start: 0.8267 (OUTLIER) cc_final: 0.7812 (pm20) REVERT: CN 51 CYS cc_start: 0.7691 (OUTLIER) cc_final: 0.7290 (t) REVERT: Cf 253 ARG cc_start: 0.7846 (OUTLIER) cc_final: 0.7093 (mtp180) REVERT: DC 228 HIS cc_start: 0.6850 (OUTLIER) cc_final: 0.6303 (p-80) REVERT: DK 56 MET cc_start: 0.9001 (mtt) cc_final: 0.8717 (mtt) REVERT: DL 230 GLU cc_start: 0.8617 (OUTLIER) cc_final: 0.8114 (mt-10) REVERT: DM 197 TYR cc_start: 0.7192 (m-80) cc_final: 0.6787 (m-80) REVERT: DN 100 LEU cc_start: 0.8073 (OUTLIER) cc_final: 0.7816 (tp) REVERT: Dd 36 ASP cc_start: 0.7289 (OUTLIER) cc_final: 0.6567 (p0) REVERT: Dd 68 ASP cc_start: 0.8307 (t70) cc_final: 0.7875 (t0) REVERT: Dd 82 ARG cc_start: 0.8548 (mmt90) cc_final: 0.8345 (mmt90) REVERT: Df 230 LEU cc_start: 0.6974 (OUTLIER) cc_final: 0.6747 (tt) REVERT: EK 55 LYS cc_start: 0.8539 (OUTLIER) cc_final: 0.8280 (tttp) REVERT: EM 69 VAL cc_start: 0.3080 (OUTLIER) cc_final: 0.2798 (p) REVERT: EM 141 GLU cc_start: 0.7240 (tm-30) cc_final: 0.6882 (tm-30) REVERT: EM 145 ARG cc_start: 0.5743 (mtm-85) cc_final: 0.5122 (mpp80) REVERT: EM 242 LYS cc_start: 0.8231 (OUTLIER) cc_final: 0.7983 (mttm) REVERT: EN 104 ASN cc_start: 0.8935 (m110) cc_final: 0.8732 (m110) REVERT: Ed 152 GLN cc_start: 0.8254 (OUTLIER) cc_final: 0.7957 (mt0) REVERT: FD 152 GLN cc_start: 0.8952 (mt0) cc_final: 0.8710 (mt0) REVERT: FM 143 THR cc_start: 0.4720 (OUTLIER) cc_final: 0.4389 (m) REVERT: Fd 36 ASP cc_start: 0.7295 (OUTLIER) cc_final: 0.6759 (p0) REVERT: GC 209 MET cc_start: 0.8813 (OUTLIER) cc_final: 0.8595 (tpp) REVERT: GC 228 HIS cc_start: 0.7076 (OUTLIER) cc_final: 0.6655 (p90) REVERT: GM 70 MET cc_start: 0.5217 (mpp) cc_final: 0.4727 (mmm) REVERT: HC 228 HIS cc_start: 0.7045 (OUTLIER) cc_final: 0.6352 (p90) REVERT: HD 68 ASP cc_start: 0.7607 (t0) cc_final: 0.7321 (t0) REVERT: HH 332 ASP cc_start: 0.8498 (OUTLIER) cc_final: 0.7854 (p0) REVERT: HK 86 ASP cc_start: 0.8138 (t70) cc_final: 0.7907 (t0) REVERT: HL 110 GLN cc_start: 0.8428 (OUTLIER) cc_final: 0.8075 (tp-100) REVERT: HM 68 GLU cc_start: 0.5200 (OUTLIER) cc_final: 0.4380 (pm20) REVERT: HM 141 GLU cc_start: 0.7379 (tm-30) cc_final: 0.7011 (tm-30) REVERT: HM 145 ARG cc_start: 0.6824 (mpp-170) cc_final: 0.5980 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8763 (OUTLIER) cc_final: 0.8550 (pp) REVERT: Hd 36 ASP cc_start: 0.7207 (OUTLIER) cc_final: 0.6432 (p0) REVERT: Hf 261 VAL cc_start: 0.8630 (OUTLIER) cc_final: 0.8423 (t) REVERT: IC 65 SER cc_start: 0.8423 (m) cc_final: 0.8132 (t) REVERT: IC 123 GLN cc_start: 0.8378 (mt0) cc_final: 0.8161 (mt0) REVERT: IC 218 MET cc_start: 0.8367 (mtm) cc_final: 0.8141 (mtp) REVERT: IC 228 HIS cc_start: 0.7117 (OUTLIER) cc_final: 0.6284 (p-80) REVERT: IL 110 GLN cc_start: 0.8423 (OUTLIER) cc_final: 0.7958 (tt0) REVERT: IM 141 GLU cc_start: 0.7075 (tm-30) cc_final: 0.6822 (tm-30) REVERT: IN 51 CYS cc_start: 0.7619 (OUTLIER) cc_final: 0.7273 (t) REVERT: IN 100 LEU cc_start: 0.8022 (OUTLIER) cc_final: 0.7690 (mp) REVERT: Id 36 ASP cc_start: 0.6992 (OUTLIER) cc_final: 0.6472 (p0) REVERT: Id 152 GLN cc_start: 0.7604 (OUTLIER) cc_final: 0.7375 (mt0) REVERT: If 262 ILE cc_start: 0.8294 (mt) cc_final: 0.7750 (tt) REVERT: JD 86 ASP cc_start: 0.8210 (t0) cc_final: 0.7926 (t70) REVERT: JL 110 GLN cc_start: 0.8416 (OUTLIER) cc_final: 0.8162 (tt0) REVERT: JM 145 ARG cc_start: 0.6683 (tpp-160) cc_final: 0.5856 (mmm160) REVERT: JN 45 MET cc_start: 0.6657 (OUTLIER) cc_final: 0.5702 (mtt) REVERT: JN 100 LEU cc_start: 0.8003 (OUTLIER) cc_final: 0.7603 (mp) REVERT: Jd 54 GLU cc_start: 0.7720 (OUTLIER) cc_final: 0.7443 (tp30) REVERT: KC 131 THR cc_start: 0.9456 (t) cc_final: 0.9238 (t) REVERT: KD 50 ASP cc_start: 0.8032 (p0) cc_final: 0.7830 (p0) REVERT: KK 55 LYS cc_start: 0.8352 (tttp) cc_final: 0.8001 (tttp) REVERT: KK 56 MET cc_start: 0.8956 (mtt) cc_final: 0.8679 (mtt) REVERT: KK 150 ASP cc_start: 0.6914 (t0) cc_final: 0.6677 (t0) REVERT: KL 230 GLU cc_start: 0.8646 (OUTLIER) cc_final: 0.7956 (mm-30) REVERT: KM 68 GLU cc_start: 0.5713 (OUTLIER) cc_final: 0.4887 (pm20) REVERT: KM 143 THR cc_start: 0.4228 (OUTLIER) cc_final: 0.3934 (m) REVERT: KM 145 ARG cc_start: 0.6585 (mpp-170) cc_final: 0.6262 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7242 (ttp) cc_final: 0.7005 (mtm) REVERT: Kf 262 ILE cc_start: 0.8420 (mt) cc_final: 0.7708 (tt) REVERT: LC 228 HIS cc_start: 0.7028 (OUTLIER) cc_final: 0.6567 (p90) REVERT: Ld 36 ASP cc_start: 0.7125 (OUTLIER) cc_final: 0.6764 (p0) REVERT: Lf 219 ARG cc_start: 0.7595 (ptp90) cc_final: 0.7168 (ptp90) REVERT: Lf 243 MET cc_start: 0.7499 (ttm) cc_final: 0.7216 (ttp) REVERT: MM 141 GLU cc_start: 0.7312 (OUTLIER) cc_final: 0.6931 (tm-30) REVERT: Md 152 GLN cc_start: 0.7728 (OUTLIER) cc_final: 0.7472 (mt0) REVERT: Md 155 GLU cc_start: 0.8041 (tt0) cc_final: 0.7837 (tt0) REVERT: Mf 219 ARG cc_start: 0.7435 (ttm-80) cc_final: 0.7114 (ttm-80) REVERT: Mf 243 MET cc_start: 0.7065 (tpp) cc_final: 0.6482 (ttm) outliers start: 332 outliers final: 206 residues processed: 2128 average time/residue: 2.0600 time to fit residues: 6132.0890 Evaluate side-chains 2178 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 254 poor density : 1924 time to evaluate : 11.480 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 69 GLN Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 144 SER Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 221 VAL Chi-restraints excluded: chain BC residue 228 HIS Chi-restraints excluded: chain BD residue 38 THR Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BN residue 45 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 62 ASN Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 95 THR Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CK residue 177 ASN Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 183 VAL Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 50 ASP Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 36 ASP Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DM residue 41 PHE Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain Df residue 230 LEU Chi-restraints excluded: chain EC residue 209 MET Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 55 LYS Chi-restraints excluded: chain EK residue 129 GLU Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 69 VAL Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 242 LYS Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 62 ASN Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 145 ILE Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 133 THR Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 143 THR Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 45 MET Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 54 GLU Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 209 MET Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GC residue 259 SER Chi-restraints excluded: chain GD residue 38 THR Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GL residue 204 LYS Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 183 VAL Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 36 ASP Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 30 SER Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HC residue 244 ASP Chi-restraints excluded: chain HD residue 75 ASN Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HK residue 177 ASN Chi-restraints excluded: chain HL residue 110 GLN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 144 THR Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 184 LEU Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 62 ASN Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 226 VAL Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 61 VAL Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IL residue 110 GLN Chi-restraints excluded: chain IL residue 219 ILE Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 242 LYS Chi-restraints excluded: chain IM residue 259 SER Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain Id residue 152 GLN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 244 ASP Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 38 THR Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 127 ASN Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JN residue 45 MET Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain JN residue 62 ASN Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 54 GLU Chi-restraints excluded: chain Jd residue 109 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 38 THR Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KK residue 129 GLU Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KM residue 143 THR Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain KN residue 62 ASN Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LM residue 262 GLU Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 59 GLU Chi-restraints excluded: chain Ld residue 67 LYS Chi-restraints excluded: chain Ld residue 84 SER Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 354 MET Chi-restraints excluded: chain MK residue 72 GLN Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 141 GLU Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 44 LYS Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 50 ASP Chi-restraints excluded: chain Md residue 62 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 232 VAL Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=2.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 984 optimal weight: 2.9990 chunk 635 optimal weight: 9.9990 chunk 950 optimal weight: 4.9990 chunk 479 optimal weight: 7.9990 chunk 312 optimal weight: 6.9990 chunk 308 optimal weight: 3.9990 chunk 1011 optimal weight: 4.9990 chunk 1084 optimal weight: 0.8980 chunk 786 optimal weight: 0.0000 chunk 148 optimal weight: 0.3980 chunk 1250 optimal weight: 0.0050 overall best weight: 0.8600 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AH 277 ASN AL 110 GLN AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BL 110 GLN BL 160 GLN BM 128 ASN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** CN 104 ASN DL 110 GLN DL 160 GLN DN 104 ASN FL 110 GLN GD 75 ASN GN 104 ASN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** HM 127 ASN IH 308 ASN IL 160 GLN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN KN 104 ASN LL 160 GLN ML 183 GLN Total number of N/Q/H flips: 25 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8453 moved from start: 0.2069 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.002 0.045 137280 Z= 0.159 Angle : 0.516 9.270 185796 Z= 0.275 Chirality : 0.043 0.216 21021 Planarity : 0.004 0.059 23738 Dihedral : 4.552 25.922 18824 Min Nonbonded Distance : 2.200 Molprobity Statistics. All-atom Clashscore : 5.33 Ramachandran Plot: Outliers : 0.01 % Allowed : 4.43 % Favored : 95.57 % Rotamer: Outliers : 2.25 % Allowed : 17.41 % Favored : 80.35 % 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: 0.67 (0.07), residues: 16835 helix: 3.20 (0.08), residues: 4225 sheet: 0.74 (0.08), residues: 4264 loop : -1.27 (0.06), residues: 8346 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.021 0.001 TRPHM 206 HIS 0.003 0.000 HISMM 256 PHE 0.016 0.001 PHEBd 25 TYR 0.015 0.001 TYRFM 281 ARG 0.013 0.000 ARGCL 103 *********************** REFINEMENT MACRO_CYCLE 8 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2293 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 328 poor density : 1965 time to evaluate : 11.710 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7053 (OUTLIER) cc_final: 0.6655 (p90) REVERT: AD 55 MET cc_start: 0.8630 (tmm) cc_final: 0.8331 (ttp) REVERT: AK 86 ASP cc_start: 0.8337 (t70) cc_final: 0.8091 (t0) REVERT: AM 70 MET cc_start: 0.6186 (mpp) cc_final: 0.5832 (mpp) REVERT: AM 88 ASN cc_start: 0.5709 (t0) cc_final: 0.5308 (m-40) REVERT: Ad 36 ASP cc_start: 0.6622 (OUTLIER) cc_final: 0.5902 (p0) REVERT: Ad 111 LYS cc_start: 0.7595 (pmtt) cc_final: 0.7307 (ptmm) REVERT: Af 219 ARG cc_start: 0.7445 (ptp90) cc_final: 0.6952 (ptp90) REVERT: BK 55 LYS cc_start: 0.8315 (tttp) cc_final: 0.7987 (tttp) REVERT: BK 129 GLU cc_start: 0.8069 (OUTLIER) cc_final: 0.7663 (mt-10) REVERT: BL 110 GLN cc_start: 0.8496 (OUTLIER) cc_final: 0.8195 (tt0) REVERT: BL 163 ILE cc_start: 0.8935 (OUTLIER) cc_final: 0.8260 (mm) REVERT: BM 68 GLU cc_start: 0.5449 (OUTLIER) cc_final: 0.4805 (pm20) REVERT: BM 141 GLU cc_start: 0.7367 (tm-30) cc_final: 0.7117 (tm-30) REVERT: BN 45 MET cc_start: 0.6750 (OUTLIER) cc_final: 0.6361 (mtt) REVERT: Bd 36 ASP cc_start: 0.7222 (p0) cc_final: 0.6742 (p0) REVERT: Bd 152 GLN cc_start: 0.7955 (OUTLIER) cc_final: 0.7701 (mt0) REVERT: Bf 243 MET cc_start: 0.7003 (mtp) cc_final: 0.6640 (ttp) REVERT: CC 209 MET cc_start: 0.8803 (mtt) cc_final: 0.8385 (ttm) REVERT: CC 228 HIS cc_start: 0.7195 (OUTLIER) cc_final: 0.6493 (p-80) REVERT: CK 130 ARG cc_start: 0.7905 (mtt-85) cc_final: 0.7691 (mtt-85) REVERT: CL 108 ASP cc_start: 0.7863 (m-30) cc_final: 0.7595 (m-30) REVERT: CL 110 GLN cc_start: 0.8260 (OUTLIER) cc_final: 0.7860 (tp40) REVERT: CL 175 ARG cc_start: 0.7325 (OUTLIER) cc_final: 0.7065 (ttm170) REVERT: CL 212 ASN cc_start: 0.7542 (OUTLIER) cc_final: 0.7137 (p0) REVERT: CM 141 GLU cc_start: 0.7246 (tm-30) cc_final: 0.6879 (tm-30) REVERT: CM 262 GLU cc_start: 0.8224 (OUTLIER) cc_final: 0.7778 (pm20) REVERT: CN 51 CYS cc_start: 0.7670 (OUTLIER) cc_final: 0.7270 (t) REVERT: Cf 253 ARG cc_start: 0.7837 (OUTLIER) cc_final: 0.7086 (mtp180) REVERT: DC 228 HIS cc_start: 0.6839 (OUTLIER) cc_final: 0.6296 (p-80) REVERT: DL 230 GLU cc_start: 0.8595 (OUTLIER) cc_final: 0.8099 (mt-10) REVERT: DM 197 TYR cc_start: 0.7141 (m-80) cc_final: 0.6700 (m-80) REVERT: DM 301 MET cc_start: 0.9028 (mmp) cc_final: 0.8551 (mmm) REVERT: DN 100 LEU cc_start: 0.8100 (OUTLIER) cc_final: 0.7835 (tp) REVERT: Dd 36 ASP cc_start: 0.7067 (OUTLIER) cc_final: 0.6421 (p0) REVERT: Dd 68 ASP cc_start: 0.8295 (t70) cc_final: 0.7879 (t0) REVERT: Df 230 LEU cc_start: 0.7004 (OUTLIER) cc_final: 0.6777 (tt) REVERT: EK 46 ASP cc_start: 0.7740 (p0) cc_final: 0.7493 (p0) REVERT: EK 55 LYS cc_start: 0.8548 (OUTLIER) cc_final: 0.8268 (tttp) REVERT: EM 69 VAL cc_start: 0.3068 (OUTLIER) cc_final: 0.2790 (p) REVERT: EM 141 GLU cc_start: 0.7345 (tm-30) cc_final: 0.7108 (tm-30) REVERT: EM 145 ARG cc_start: 0.5788 (mtm-85) cc_final: 0.5249 (mpp80) REVERT: Ed 152 GLN cc_start: 0.8218 (OUTLIER) cc_final: 0.7931 (mt0) REVERT: FD 152 GLN cc_start: 0.8949 (mt0) cc_final: 0.8700 (mt0) REVERT: FM 184 LEU cc_start: 0.6963 (pp) cc_final: 0.6601 (mt) REVERT: Fd 36 ASP cc_start: 0.7115 (OUTLIER) cc_final: 0.6534 (p0) REVERT: GC 209 MET cc_start: 0.8796 (OUTLIER) cc_final: 0.8547 (tpp) REVERT: GC 228 HIS cc_start: 0.7011 (OUTLIER) cc_final: 0.6593 (p90) REVERT: GM 70 MET cc_start: 0.5228 (mpp) cc_final: 0.4665 (mmm) REVERT: HC 228 HIS cc_start: 0.6927 (OUTLIER) cc_final: 0.6291 (p90) REVERT: HD 68 ASP cc_start: 0.7547 (t0) cc_final: 0.7267 (t0) REVERT: HH 332 ASP cc_start: 0.8489 (OUTLIER) cc_final: 0.7839 (p0) REVERT: HK 86 ASP cc_start: 0.8163 (t70) cc_final: 0.7945 (t0) REVERT: HL 110 GLN cc_start: 0.8366 (OUTLIER) cc_final: 0.8002 (tp-100) REVERT: HM 68 GLU cc_start: 0.5199 (OUTLIER) cc_final: 0.4375 (pm20) REVERT: HM 141 GLU cc_start: 0.7458 (tm-30) cc_final: 0.7205 (tm-30) REVERT: HM 145 ARG cc_start: 0.6828 (mpp-170) cc_final: 0.6154 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8796 (OUTLIER) cc_final: 0.8549 (pp) REVERT: Hd 36 ASP cc_start: 0.7019 (OUTLIER) cc_final: 0.6248 (p0) REVERT: Hf 261 VAL cc_start: 0.8645 (OUTLIER) cc_final: 0.8429 (t) REVERT: IC 123 GLN cc_start: 0.8357 (mt0) cc_final: 0.8101 (mt0) REVERT: IC 228 HIS cc_start: 0.7013 (OUTLIER) cc_final: 0.6278 (p-80) REVERT: IL 110 GLN cc_start: 0.8364 (OUTLIER) cc_final: 0.7874 (tt0) REVERT: IL 212 ASN cc_start: 0.7632 (OUTLIER) cc_final: 0.7367 (p0) REVERT: IM 141 GLU cc_start: 0.6985 (OUTLIER) cc_final: 0.6703 (tm-30) REVERT: IM 145 ARG cc_start: 0.6675 (OUTLIER) cc_final: 0.6212 (mpp-170) REVERT: IN 51 CYS cc_start: 0.7594 (OUTLIER) cc_final: 0.7249 (t) REVERT: IN 100 LEU cc_start: 0.8034 (OUTLIER) cc_final: 0.7716 (mp) REVERT: Id 36 ASP cc_start: 0.6870 (OUTLIER) cc_final: 0.6435 (p0) REVERT: If 262 ILE cc_start: 0.8236 (mt) cc_final: 0.7721 (tt) REVERT: JD 86 ASP cc_start: 0.8142 (t0) cc_final: 0.7867 (t70) REVERT: JL 110 GLN cc_start: 0.8361 (OUTLIER) cc_final: 0.7824 (tp40) REVERT: JM 127 ASN cc_start: 0.4341 (OUTLIER) cc_final: 0.3982 (p0) REVERT: JM 145 ARG cc_start: 0.6683 (tpp-160) cc_final: 0.5858 (mmm160) REVERT: JN 45 MET cc_start: 0.6659 (OUTLIER) cc_final: 0.5663 (mtt) REVERT: JN 100 LEU cc_start: 0.8002 (OUTLIER) cc_final: 0.7605 (mp) REVERT: Jd 54 GLU cc_start: 0.7614 (OUTLIER) cc_final: 0.7351 (mt-10) REVERT: KC 131 THR cc_start: 0.9454 (t) cc_final: 0.9225 (t) REVERT: KD 50 ASP cc_start: 0.7944 (p0) cc_final: 0.7739 (p0) REVERT: KD 85 VAL cc_start: 0.8869 (OUTLIER) cc_final: 0.8616 (t) REVERT: KH 308 ASN cc_start: 0.8082 (m-40) cc_final: 0.7878 (m-40) REVERT: KK 45 VAL cc_start: 0.8266 (OUTLIER) cc_final: 0.8024 (m) REVERT: KK 55 LYS cc_start: 0.8354 (tttp) cc_final: 0.8003 (tttp) REVERT: KK 56 MET cc_start: 0.8948 (mtt) cc_final: 0.8641 (mtt) REVERT: KK 150 ASP cc_start: 0.6884 (t0) cc_final: 0.6650 (t0) REVERT: KL 103 ARG cc_start: 0.7350 (mtp-110) cc_final: 0.6772 (ttm-80) REVERT: KL 110 GLN cc_start: 0.8671 (OUTLIER) cc_final: 0.8162 (tt0) REVERT: KL 230 GLU cc_start: 0.8645 (OUTLIER) cc_final: 0.7874 (mt-10) REVERT: KM 68 GLU cc_start: 0.5721 (OUTLIER) cc_final: 0.4888 (pm20) REVERT: KM 135 ASP cc_start: 0.4053 (t0) cc_final: 0.3850 (m-30) REVERT: KM 143 THR cc_start: 0.4111 (OUTLIER) cc_final: 0.3788 (m) REVERT: KM 145 ARG cc_start: 0.6527 (mpp-170) cc_final: 0.6181 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7231 (ttp) cc_final: 0.6995 (mtm) REVERT: Kf 262 ILE cc_start: 0.8405 (mt) cc_final: 0.7713 (tt) REVERT: LC 228 HIS cc_start: 0.6982 (OUTLIER) cc_final: 0.6558 (p90) REVERT: LM 145 ARG cc_start: 0.6484 (mpp-170) cc_final: 0.6197 (mpp-170) REVERT: LN 100 LEU cc_start: 0.7918 (OUTLIER) cc_final: 0.7592 (mp) REVERT: Ld 36 ASP cc_start: 0.6992 (OUTLIER) cc_final: 0.6642 (p0) REVERT: Lf 219 ARG cc_start: 0.7581 (ptp90) cc_final: 0.7162 (ptp90) REVERT: Lf 243 MET cc_start: 0.7502 (ttm) cc_final: 0.7226 (ttp) REVERT: MM 141 GLU cc_start: 0.7402 (OUTLIER) cc_final: 0.7041 (tm-30) REVERT: MM 145 ARG cc_start: 0.6783 (mpp-170) cc_final: 0.5414 (mpp-170) REVERT: Md 52 MET cc_start: 0.8911 (OUTLIER) cc_final: 0.6962 (mpt) REVERT: Md 152 GLN cc_start: 0.7666 (OUTLIER) cc_final: 0.7451 (mt0) REVERT: Md 155 GLU cc_start: 0.8039 (tt0) cc_final: 0.7823 (tt0) REVERT: Mf 219 ARG cc_start: 0.7414 (ttm-80) cc_final: 0.7109 (ttm-80) REVERT: Mf 243 MET cc_start: 0.7061 (tpp) cc_final: 0.6731 (tpt) outliers start: 328 outliers final: 210 residues processed: 2128 average time/residue: 2.0275 time to fit residues: 6043.4460 Evaluate side-chains 2200 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 268 poor density : 1932 time to evaluate : 11.438 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 69 GLN Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 38 THR Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 54 GLU Chi-restraints excluded: chain Af residue 243 MET Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 221 VAL Chi-restraints excluded: chain BC residue 228 HIS Chi-restraints excluded: chain BD residue 38 THR Chi-restraints excluded: chain BD residue 61 VAL Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 110 GLN Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BN residue 45 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 62 ASN Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 95 THR Chi-restraints excluded: chain Bd residue 141 LYS Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CK residue 163 LYS Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 175 ARG Chi-restraints excluded: chain CL residue 212 ASN Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 144 THR Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 183 VAL Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 45 MET Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 50 ASP Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 36 ASP Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 110 GLN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DM residue 41 PHE Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 54 GLU Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain Df residue 230 LEU Chi-restraints excluded: chain EC residue 209 MET Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain ED residue 59 GLU Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 55 LYS Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 69 VAL Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 259 SER Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 62 ILE Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ed residue 160 LYS Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 54 GLU Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 209 MET Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GD residue 38 THR Chi-restraints excluded: chain GD residue 75 ASN Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GK residue 177 ASN Chi-restraints excluded: chain GL residue 204 LYS Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 183 VAL Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 36 ASP Chi-restraints excluded: chain Gd residue 95 THR Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HC residue 244 ASP Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HK residue 177 ASN Chi-restraints excluded: chain HL residue 110 GLN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 144 THR Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 292 MET Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 62 ILE Chi-restraints excluded: chain Hd residue 63 THR Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 226 VAL Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain IC residue 249 ILE Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 61 VAL Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IK residue 122 LYS Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain IL residue 110 GLN Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IL residue 219 ILE Chi-restraints excluded: chain IM residue 141 GLU Chi-restraints excluded: chain IM residue 145 ARG Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 259 SER Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 97 ARG Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 244 ASP Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 127 ASN Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JN residue 45 MET Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain JN residue 62 ASN Chi-restraints excluded: chain JN residue 100 LEU Chi-restraints excluded: chain Jd residue 36 ASP Chi-restraints excluded: chain Jd residue 54 GLU Chi-restraints excluded: chain Jd residue 62 ILE Chi-restraints excluded: chain Jd residue 109 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 85 VAL Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 110 GLN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KM residue 143 THR Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 50 ASP Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 45 VAL Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 67 LYS Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 354 MET Chi-restraints excluded: chain MK residue 72 GLN Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 141 GLU Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 44 LYS Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 50 ASP Chi-restraints excluded: chain Md residue 52 MET Chi-restraints excluded: chain Md residue 62 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 232 VAL Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=1.50 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1447 optimal weight: 0.8980 chunk 1524 optimal weight: 10.0000 chunk 1390 optimal weight: 4.9990 chunk 1482 optimal weight: 6.9990 chunk 892 optimal weight: 2.9990 chunk 646 optimal weight: 0.9990 chunk 1164 optimal weight: 2.9990 chunk 455 optimal weight: 6.9990 chunk 1339 optimal weight: 4.9990 chunk 1402 optimal weight: 0.0020 chunk 1477 optimal weight: 6.9990 overall best weight: 1.5794 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 110 GLN AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DC 35 GLN DL 110 GLN DL 160 GLN FL 110 GLN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 308 ASN IL 160 GLN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KC 35 GLN KL 160 GLN KN 104 ASN Kd 80 GLN LL 160 GLN ML 183 GLN Total number of N/Q/H flips: 19 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8492 moved from start: 0.2185 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.003 0.057 137280 Z= 0.230 Angle : 0.572 8.928 185796 Z= 0.305 Chirality : 0.045 0.239 21021 Planarity : 0.004 0.065 23738 Dihedral : 4.794 27.983 18824 Min Nonbonded Distance : 2.166 Molprobity Statistics. All-atom Clashscore : 5.20 Ramachandran Plot: Outliers : 0.01 % Allowed : 5.05 % Favored : 94.95 % Rotamer: Outliers : 2.40 % Allowed : 17.51 % Favored : 80.09 % 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: 0.57 (0.07), residues: 16835 helix: 3.10 (0.08), residues: 4225 sheet: 0.68 (0.08), residues: 4303 loop : -1.33 (0.06), residues: 8307 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.026 0.002 TRPIM 206 HIS 0.003 0.001 HISAL 221 PHE 0.015 0.001 PHEId 25 TYR 0.023 0.002 TYRJM 281 ARG 0.014 0.000 ARGHL 103 *********************** REFINEMENT MACRO_CYCLE 9 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2294 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 350 poor density : 1944 time to evaluate : 11.727 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7144 (OUTLIER) cc_final: 0.6736 (p90) REVERT: AD 55 MET cc_start: 0.8629 (tmm) cc_final: 0.8339 (tmm) REVERT: AM 88 ASN cc_start: 0.5753 (t0) cc_final: 0.5358 (m-40) REVERT: Ad 36 ASP cc_start: 0.7043 (OUTLIER) cc_final: 0.6237 (p0) REVERT: Ad 111 LYS cc_start: 0.7500 (pmtt) cc_final: 0.7229 (ptmm) REVERT: Af 219 ARG cc_start: 0.7487 (ptp90) cc_final: 0.7033 (ptp90) REVERT: BK 55 LYS cc_start: 0.8378 (tttp) cc_final: 0.8051 (tttp) REVERT: BL 163 ILE cc_start: 0.8969 (OUTLIER) cc_final: 0.8298 (mm) REVERT: BM 68 GLU cc_start: 0.5474 (OUTLIER) cc_final: 0.4819 (pm20) REVERT: BN 45 MET cc_start: 0.6805 (OUTLIER) cc_final: 0.6402 (mtt) REVERT: BN 51 CYS cc_start: 0.7543 (OUTLIER) cc_final: 0.7233 (t) REVERT: BN 100 LEU cc_start: 0.7916 (OUTLIER) cc_final: 0.7646 (mp) REVERT: Bd 152 GLN cc_start: 0.7967 (OUTLIER) cc_final: 0.7711 (mt0) REVERT: Bf 243 MET cc_start: 0.7007 (mtp) cc_final: 0.6642 (ttp) REVERT: CC 209 MET cc_start: 0.8903 (mtt) cc_final: 0.8564 (mtm) REVERT: CC 228 HIS cc_start: 0.7241 (OUTLIER) cc_final: 0.6521 (p-80) REVERT: CK 130 ARG cc_start: 0.8000 (mtt-85) cc_final: 0.7799 (mtt-85) REVERT: CL 108 ASP cc_start: 0.7927 (m-30) cc_final: 0.7653 (m-30) REVERT: CL 110 GLN cc_start: 0.8423 (OUTLIER) cc_final: 0.8067 (tp40) REVERT: CM 68 GLU cc_start: 0.5060 (OUTLIER) cc_final: 0.4196 (pp20) REVERT: CM 141 GLU cc_start: 0.7246 (tm-30) cc_final: 0.6929 (tm-30) REVERT: CM 145 ARG cc_start: 0.6348 (OUTLIER) cc_final: 0.5984 (mpp-170) REVERT: CM 214 ILE cc_start: 0.8616 (OUTLIER) cc_final: 0.8315 (mp) REVERT: CN 51 CYS cc_start: 0.7721 (OUTLIER) cc_final: 0.7322 (t) REVERT: Cf 253 ARG cc_start: 0.7867 (OUTLIER) cc_final: 0.7137 (mtp180) REVERT: DC 228 HIS cc_start: 0.6853 (OUTLIER) cc_final: 0.6294 (p-80) REVERT: DL 230 GLU cc_start: 0.8603 (OUTLIER) cc_final: 0.8052 (mt-10) REVERT: DM 197 TYR cc_start: 0.7165 (m-80) cc_final: 0.6719 (m-80) REVERT: DN 100 LEU cc_start: 0.8116 (OUTLIER) cc_final: 0.7859 (tp) REVERT: Dd 36 ASP cc_start: 0.7428 (OUTLIER) cc_final: 0.6717 (p0) REVERT: Dd 68 ASP cc_start: 0.8312 (t70) cc_final: 0.7927 (t0) REVERT: Df 230 LEU cc_start: 0.7096 (OUTLIER) cc_final: 0.6878 (tt) REVERT: EK 55 LYS cc_start: 0.8546 (OUTLIER) cc_final: 0.8301 (tttp) REVERT: EM 69 VAL cc_start: 0.2996 (OUTLIER) cc_final: 0.2726 (p) REVERT: Ed 36 ASP cc_start: 0.7208 (OUTLIER) cc_final: 0.6592 (p0) REVERT: Ed 152 GLN cc_start: 0.8259 (OUTLIER) cc_final: 0.7952 (mt0) REVERT: FD 152 GLN cc_start: 0.8951 (mt0) cc_final: 0.8691 (mt0) REVERT: FM 145 ARG cc_start: 0.6497 (mpp-170) cc_final: 0.6103 (mpp-170) REVERT: Fd 36 ASP cc_start: 0.7419 (OUTLIER) cc_final: 0.6814 (p0) REVERT: GC 209 MET cc_start: 0.8806 (OUTLIER) cc_final: 0.7550 (mpp) REVERT: GC 228 HIS cc_start: 0.7091 (OUTLIER) cc_final: 0.6663 (p90) REVERT: GM 70 MET cc_start: 0.5259 (mpp) cc_final: 0.4760 (mmm) REVERT: HC 228 HIS cc_start: 0.7053 (OUTLIER) cc_final: 0.6355 (p90) REVERT: HD 68 ASP cc_start: 0.7628 (t0) cc_final: 0.7343 (t0) REVERT: HH 332 ASP cc_start: 0.8527 (OUTLIER) cc_final: 0.7876 (p0) REVERT: HL 110 GLN cc_start: 0.8453 (OUTLIER) cc_final: 0.8144 (tp40) REVERT: HM 68 GLU cc_start: 0.5193 (OUTLIER) cc_final: 0.4370 (pm20) REVERT: HM 141 GLU cc_start: 0.7374 (tm-30) cc_final: 0.7159 (tm-30) REVERT: HM 145 ARG cc_start: 0.6781 (mpp-170) cc_final: 0.6014 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8709 (OUTLIER) cc_final: 0.8490 (pp) REVERT: Hd 36 ASP cc_start: 0.7346 (OUTLIER) cc_final: 0.6571 (p0) REVERT: Hf 261 VAL cc_start: 0.8645 (OUTLIER) cc_final: 0.8433 (t) REVERT: IC 65 SER cc_start: 0.8502 (m) cc_final: 0.8200 (t) REVERT: IC 218 MET cc_start: 0.8444 (mtm) cc_final: 0.8195 (mtp) REVERT: IC 228 HIS cc_start: 0.7133 (OUTLIER) cc_final: 0.6289 (p-80) REVERT: IL 110 GLN cc_start: 0.8458 (OUTLIER) cc_final: 0.8008 (tt0) REVERT: IL 212 ASN cc_start: 0.7746 (OUTLIER) cc_final: 0.7454 (p0) REVERT: IM 141 GLU cc_start: 0.6886 (OUTLIER) cc_final: 0.6675 (tm-30) REVERT: IM 145 ARG cc_start: 0.6678 (OUTLIER) cc_final: 0.6206 (mpp-170) REVERT: IN 51 CYS cc_start: 0.7653 (OUTLIER) cc_final: 0.7305 (t) REVERT: IN 100 LEU cc_start: 0.8017 (OUTLIER) cc_final: 0.7684 (mp) REVERT: Id 36 ASP cc_start: 0.7098 (OUTLIER) cc_final: 0.6561 (p0) REVERT: If 262 ILE cc_start: 0.8256 (mt) cc_final: 0.7731 (tt) REVERT: JD 86 ASP cc_start: 0.8268 (t0) cc_final: 0.7978 (t70) REVERT: JL 110 GLN cc_start: 0.8455 (OUTLIER) cc_final: 0.8187 (tt0) REVERT: JM 145 ARG cc_start: 0.6694 (tpp-160) cc_final: 0.5869 (mmm160) REVERT: JN 45 MET cc_start: 0.6703 (OUTLIER) cc_final: 0.5687 (mtt) REVERT: Jd 54 GLU cc_start: 0.7736 (OUTLIER) cc_final: 0.7482 (mt-10) REVERT: Jd 111 LYS cc_start: 0.7659 (pmtt) cc_final: 0.7417 (ttpt) REVERT: KC 131 THR cc_start: 0.9459 (t) cc_final: 0.9248 (t) REVERT: KH 308 ASN cc_start: 0.8188 (m-40) cc_final: 0.7987 (m-40) REVERT: KH 332 ASP cc_start: 0.8325 (OUTLIER) cc_final: 0.7742 (p0) REVERT: KK 150 ASP cc_start: 0.6937 (t0) cc_final: 0.6705 (t0) REVERT: KL 103 ARG cc_start: 0.7362 (mtp-110) cc_final: 0.6793 (ttm-80) REVERT: KL 110 GLN cc_start: 0.8783 (OUTLIER) cc_final: 0.8296 (tt0) REVERT: KL 230 GLU cc_start: 0.8647 (OUTLIER) cc_final: 0.7960 (mm-30) REVERT: KM 68 GLU cc_start: 0.5731 (OUTLIER) cc_final: 0.4899 (pm20) REVERT: KM 135 ASP cc_start: 0.4075 (t0) cc_final: 0.3865 (m-30) REVERT: KM 143 THR cc_start: 0.4212 (OUTLIER) cc_final: 0.3881 (m) REVERT: KM 145 ARG cc_start: 0.6511 (mpp-170) cc_final: 0.6148 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7224 (ttp) cc_final: 0.6976 (mtm) REVERT: Kf 262 ILE cc_start: 0.8423 (mt) cc_final: 0.7717 (tt) REVERT: LC 228 HIS cc_start: 0.7048 (OUTLIER) cc_final: 0.6587 (p90) REVERT: LM 68 GLU cc_start: 0.5282 (OUTLIER) cc_final: 0.4611 (pm20) REVERT: LN 100 LEU cc_start: 0.7913 (OUTLIER) cc_final: 0.7588 (mp) REVERT: Ld 36 ASP cc_start: 0.7241 (OUTLIER) cc_final: 0.6860 (p0) REVERT: Lf 219 ARG cc_start: 0.7627 (ptp90) cc_final: 0.7280 (ptp90) REVERT: Lf 243 MET cc_start: 0.7407 (ttm) cc_final: 0.7147 (ttp) REVERT: MM 141 GLU cc_start: 0.7475 (OUTLIER) cc_final: 0.7069 (tm-30) REVERT: MM 145 ARG cc_start: 0.6767 (mpp-170) cc_final: 0.6500 (mpp-170) REVERT: Md 152 GLN cc_start: 0.7751 (OUTLIER) cc_final: 0.7499 (mt0) REVERT: Md 155 GLU cc_start: 0.8034 (tt0) cc_final: 0.7807 (tt0) REVERT: Mf 243 MET cc_start: 0.7086 (tpp) cc_final: 0.6720 (tpt) outliers start: 350 outliers final: 224 residues processed: 2122 average time/residue: 2.0964 time to fit residues: 6206.7356 Evaluate side-chains 2205 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 280 poor density : 1925 time to evaluate : 10.770 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 69 GLN Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 38 THR Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 54 GLU Chi-restraints excluded: chain Af residue 243 MET Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 221 VAL Chi-restraints excluded: chain BC residue 228 HIS Chi-restraints excluded: chain BD residue 38 THR Chi-restraints excluded: chain BD residue 61 VAL Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BN residue 45 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 62 ASN Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 95 THR Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CK residue 163 LYS Chi-restraints excluded: chain CK residue 177 ASN Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 68 GLU Chi-restraints excluded: chain CM residue 144 THR Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 183 VAL Chi-restraints excluded: chain CM residue 214 ILE Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 50 ASP Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 36 ASP Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DM residue 41 PHE Chi-restraints excluded: chain DM residue 262 GLU Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 52 MET Chi-restraints excluded: chain Dd residue 54 GLU Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain Df residue 230 LEU Chi-restraints excluded: chain EC residue 209 MET Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain ED residue 75 ASN Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 55 LYS Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 69 VAL Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 227 ILE Chi-restraints excluded: chain EM residue 259 SER Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 36 ASP Chi-restraints excluded: chain Ed residue 61 VAL Chi-restraints excluded: chain Ed residue 62 ILE Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 145 ILE Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ed residue 160 LYS Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 133 THR Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 54 GLU Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 209 MET Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GD residue 47 SER Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GK residue 177 ASN Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 183 VAL Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 95 THR Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 221 VAL Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HC residue 244 ASP Chi-restraints excluded: chain HD residue 61 VAL Chi-restraints excluded: chain HD residue 85 VAL Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HL residue 110 GLN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HL residue 219 ILE Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 144 THR Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 292 MET Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 59 GLU Chi-restraints excluded: chain Hd residue 63 THR Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 226 VAL Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain IC residue 249 ILE Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 61 VAL Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IK residue 122 LYS Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain IL residue 110 GLN Chi-restraints excluded: chain IL residue 136 SER Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IL residue 219 ILE Chi-restraints excluded: chain IM residue 141 GLU Chi-restraints excluded: chain IM residue 145 ARG Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 259 SER Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 97 ARG Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain Id residue 150 ASN Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 244 ASP Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 38 THR Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 129 GLU Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 127 ASN Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JN residue 45 MET Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain Jd residue 54 GLU Chi-restraints excluded: chain Jd residue 62 ILE Chi-restraints excluded: chain Jd residue 109 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 38 THR Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 332 ASP Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KK residue 129 GLU Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 110 GLN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KM residue 143 THR Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 50 ASP Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 45 VAL Chi-restraints excluded: chain LK residue 170 LEU Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 219 ILE Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 68 GLU Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 59 GLU Chi-restraints excluded: chain Ld residue 67 LYS Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain MH residue 354 MET Chi-restraints excluded: chain MK residue 72 GLN Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 141 GLU Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain MN residue 100 LEU Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 50 ASP Chi-restraints excluded: chain Md residue 62 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 232 VAL Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=1.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 973 optimal weight: 8.9990 chunk 1568 optimal weight: 0.8980 chunk 957 optimal weight: 1.9990 chunk 743 optimal weight: 1.9990 chunk 1090 optimal weight: 7.9990 chunk 1644 optimal weight: 0.8980 chunk 1513 optimal weight: 3.9990 chunk 1309 optimal weight: 3.9990 chunk 135 optimal weight: 0.6980 chunk 1011 optimal weight: 2.9990 chunk 803 optimal weight: 1.9990 overall best weight: 1.2984 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 110 GLN AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BL 110 GLN BL 160 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DC 35 GLN DL 110 GLN DL 160 GLN EN 104 ASN FL 110 GLN GD 80 GLN HH 277 ASN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 308 ASN IL 160 GLN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KL 160 GLN KN 104 ASN LL 160 GLN Ld 75 ASN ML 183 GLN Total number of N/Q/H flips: 23 ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8481 moved from start: 0.2197 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.003 0.053 137280 Z= 0.201 Angle : 0.554 8.844 185796 Z= 0.295 Chirality : 0.044 0.228 21021 Planarity : 0.004 0.067 23738 Dihedral : 4.736 27.942 18824 Min Nonbonded Distance : 2.181 Molprobity Statistics. All-atom Clashscore : 5.32 Ramachandran Plot: Outliers : 0.01 % Allowed : 4.69 % Favored : 95.31 % Rotamer: Outliers : 2.05 % Allowed : 17.99 % Favored : 79.96 % 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: 0.59 (0.07), residues: 16835 helix: 3.10 (0.08), residues: 4225 sheet: 0.68 (0.08), residues: 4303 loop : -1.30 (0.06), residues: 8307 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.027 0.002 TRPIM 206 HIS 0.003 0.001 HISBM 256 PHE 0.016 0.001 PHEKM 41 TYR 0.019 0.001 TYRJM 281 ARG 0.015 0.000 ARGHL 103 ********************** REFINEMENT MACRO_CYCLE 10 OF 10 ************************ ------------------------------------------------------------------------------- Update Rama plot phi/psi targets (oldfield only) ************************************************ 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Re-set Ramachandran plot restraints *********************************** favored: oldfield allowed: oldfield outlier: oldfield 33670 Ramachandran restraints generated. 16835 Oldfield, 0 Emsley, 16835 emsley8k and 0 Phi/Psi/2. ------------------------------------------------------------------------------- Optimize residue side-chains **************************** Evaluate side-chains 2243 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 299 poor density : 1944 time to evaluate : 11.677 Fit side-chains revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash revert: symmetry clash REVERT: AC 228 HIS cc_start: 0.7102 (OUTLIER) cc_final: 0.6679 (p90) REVERT: AD 55 MET cc_start: 0.8623 (tmm) cc_final: 0.8334 (tmm) REVERT: AK 86 ASP cc_start: 0.8357 (t70) cc_final: 0.8105 (t0) REVERT: AK 130 ARG cc_start: 0.7798 (mtt180) cc_final: 0.7581 (mtm-85) REVERT: AM 88 ASN cc_start: 0.5773 (t0) cc_final: 0.5360 (m-40) REVERT: Ad 36 ASP cc_start: 0.6862 (OUTLIER) cc_final: 0.6138 (p0) REVERT: Ad 68 ASP cc_start: 0.8170 (t0) cc_final: 0.7969 (t0) REVERT: Ad 111 LYS cc_start: 0.7487 (pmtt) cc_final: 0.7227 (ptmm) REVERT: Af 219 ARG cc_start: 0.7431 (ptp90) cc_final: 0.6966 (ptp90) REVERT: BK 55 LYS cc_start: 0.8350 (tttp) cc_final: 0.8021 (tttp) REVERT: BL 163 ILE cc_start: 0.8954 (OUTLIER) cc_final: 0.8283 (mm) REVERT: BM 68 GLU cc_start: 0.5470 (OUTLIER) cc_final: 0.4822 (pm20) REVERT: BN 45 MET cc_start: 0.6806 (OUTLIER) cc_final: 0.6404 (mtt) REVERT: BN 51 CYS cc_start: 0.7525 (OUTLIER) cc_final: 0.7223 (t) REVERT: BN 100 LEU cc_start: 0.7917 (OUTLIER) cc_final: 0.7646 (mp) REVERT: Bd 152 GLN cc_start: 0.7930 (OUTLIER) cc_final: 0.7701 (mt0) REVERT: Bf 243 MET cc_start: 0.7011 (mtp) cc_final: 0.6650 (ttp) REVERT: CC 209 MET cc_start: 0.8885 (mtt) cc_final: 0.8547 (mtm) REVERT: CC 228 HIS cc_start: 0.7224 (OUTLIER) cc_final: 0.6522 (p-80) REVERT: CL 110 GLN cc_start: 0.8333 (OUTLIER) cc_final: 0.8007 (tp40) REVERT: CM 68 GLU cc_start: 0.5078 (OUTLIER) cc_final: 0.4224 (pp20) REVERT: CM 136 LEU cc_start: 0.5496 (tt) cc_final: 0.5138 (tm) REVERT: CM 141 GLU cc_start: 0.7185 (tm-30) cc_final: 0.6948 (tm-30) REVERT: CM 145 ARG cc_start: 0.6354 (OUTLIER) cc_final: 0.5983 (mpp-170) REVERT: CM 214 ILE cc_start: 0.8601 (OUTLIER) cc_final: 0.8307 (mp) REVERT: CN 51 CYS cc_start: 0.7667 (OUTLIER) cc_final: 0.7258 (t) REVERT: Cf 253 ARG cc_start: 0.7862 (OUTLIER) cc_final: 0.7135 (mtp180) REVERT: DC 228 HIS cc_start: 0.6841 (OUTLIER) cc_final: 0.6293 (p-80) REVERT: DL 111 LYS cc_start: 0.8007 (tppt) cc_final: 0.7800 (tppp) REVERT: DL 230 GLU cc_start: 0.8607 (OUTLIER) cc_final: 0.8107 (mt-10) REVERT: DM 197 TYR cc_start: 0.7163 (m-80) cc_final: 0.6716 (m-80) REVERT: DN 100 LEU cc_start: 0.8113 (OUTLIER) cc_final: 0.7852 (tp) REVERT: Dd 36 ASP cc_start: 0.7300 (OUTLIER) cc_final: 0.6618 (p0) REVERT: Dd 68 ASP cc_start: 0.8301 (t70) cc_final: 0.7918 (t0) REVERT: Df 230 LEU cc_start: 0.7092 (OUTLIER) cc_final: 0.6881 (tt) REVERT: EK 46 ASP cc_start: 0.7706 (p0) cc_final: 0.7462 (p0) REVERT: EK 55 LYS cc_start: 0.8562 (OUTLIER) cc_final: 0.8303 (tttp) REVERT: EM 145 ARG cc_start: 0.6079 (mtm-85) cc_final: 0.5239 (mpp80) REVERT: Ed 36 ASP cc_start: 0.7234 (OUTLIER) cc_final: 0.6777 (p0) REVERT: Ed 152 GLN cc_start: 0.8246 (OUTLIER) cc_final: 0.7957 (mt0) REVERT: FD 152 GLN cc_start: 0.8945 (mt0) cc_final: 0.8680 (mt0) REVERT: FN 104 ASN cc_start: 0.8979 (m110) cc_final: 0.8762 (m110) REVERT: Fd 36 ASP cc_start: 0.7285 (OUTLIER) cc_final: 0.6672 (p0) REVERT: GC 209 MET cc_start: 0.8804 (OUTLIER) cc_final: 0.7490 (mpp) REVERT: GC 228 HIS cc_start: 0.7014 (OUTLIER) cc_final: 0.6568 (p90) REVERT: GM 70 MET cc_start: 0.5274 (mpp) cc_final: 0.4708 (mmm) REVERT: GM 141 GLU cc_start: 0.7012 (tm-30) cc_final: 0.6676 (tm-30) REVERT: Gd 62 ILE cc_start: 0.8475 (OUTLIER) cc_final: 0.8127 (pp) REVERT: HC 228 HIS cc_start: 0.6986 (OUTLIER) cc_final: 0.6349 (p90) REVERT: HD 68 ASP cc_start: 0.7607 (t0) cc_final: 0.7330 (t0) REVERT: HH 332 ASP cc_start: 0.8511 (OUTLIER) cc_final: 0.7869 (p0) REVERT: HL 110 GLN cc_start: 0.8428 (OUTLIER) cc_final: 0.8111 (tp40) REVERT: HM 68 GLU cc_start: 0.5186 (OUTLIER) cc_final: 0.4358 (pm20) REVERT: HM 145 ARG cc_start: 0.6759 (mpp-170) cc_final: 0.5994 (mpp-170) REVERT: Hd 30 ILE cc_start: 0.8681 (OUTLIER) cc_final: 0.8466 (pp) REVERT: Hd 36 ASP cc_start: 0.7282 (OUTLIER) cc_final: 0.6510 (p0) REVERT: Hf 261 VAL cc_start: 0.8642 (OUTLIER) cc_final: 0.8435 (t) REVERT: IC 65 SER cc_start: 0.8499 (m) cc_final: 0.8193 (t) REVERT: IC 218 MET cc_start: 0.8420 (mtm) cc_final: 0.8149 (mtp) REVERT: IC 228 HIS cc_start: 0.7033 (OUTLIER) cc_final: 0.6270 (p-80) REVERT: IL 110 GLN cc_start: 0.8421 (OUTLIER) cc_final: 0.7959 (tt0) REVERT: IL 212 ASN cc_start: 0.7674 (OUTLIER) cc_final: 0.7380 (p0) REVERT: IM 145 ARG cc_start: 0.6863 (OUTLIER) cc_final: 0.6391 (mpp-170) REVERT: IN 51 CYS cc_start: 0.7604 (OUTLIER) cc_final: 0.7261 (t) REVERT: IN 100 LEU cc_start: 0.8068 (OUTLIER) cc_final: 0.7761 (mp) REVERT: Id 36 ASP cc_start: 0.7009 (OUTLIER) cc_final: 0.6616 (p0) REVERT: If 262 ILE cc_start: 0.8233 (mt) cc_final: 0.7724 (tt) REVERT: JD 86 ASP cc_start: 0.8231 (t0) cc_final: 0.7928 (t70) REVERT: JL 110 GLN cc_start: 0.8443 (OUTLIER) cc_final: 0.8175 (tt0) REVERT: JM 127 ASN cc_start: 0.4286 (OUTLIER) cc_final: 0.3909 (p0) REVERT: JM 145 ARG cc_start: 0.6689 (tpp-160) cc_final: 0.5879 (mmm160) REVERT: JN 45 MET cc_start: 0.6736 (OUTLIER) cc_final: 0.5682 (mtt) REVERT: Jd 54 GLU cc_start: 0.7639 (OUTLIER) cc_final: 0.7382 (mt-10) REVERT: Jd 111 LYS cc_start: 0.7709 (pmtt) cc_final: 0.7276 (ptmm) REVERT: KC 131 THR cc_start: 0.9462 (t) cc_final: 0.9236 (t) REVERT: KH 332 ASP cc_start: 0.8318 (OUTLIER) cc_final: 0.7734 (p0) REVERT: KK 55 LYS cc_start: 0.8374 (tttp) cc_final: 0.8066 (tttp) REVERT: KK 150 ASP cc_start: 0.6923 (t0) cc_final: 0.6695 (t0) REVERT: KL 110 GLN cc_start: 0.8759 (OUTLIER) cc_final: 0.8263 (tt0) REVERT: KL 230 GLU cc_start: 0.8636 (OUTLIER) cc_final: 0.7952 (mm-30) REVERT: KM 68 GLU cc_start: 0.5724 (OUTLIER) cc_final: 0.4888 (pm20) REVERT: KM 135 ASP cc_start: 0.4145 (t0) cc_final: 0.3927 (m-30) REVERT: KM 143 THR cc_start: 0.4201 (OUTLIER) cc_final: 0.3868 (m) REVERT: KM 145 ARG cc_start: 0.6505 (mpp-170) cc_final: 0.6140 (mpp-170) REVERT: Kf 243 MET cc_start: 0.7228 (ttp) cc_final: 0.6979 (mtm) REVERT: Kf 262 ILE cc_start: 0.8424 (mt) cc_final: 0.7719 (tt) REVERT: LC 228 HIS cc_start: 0.7023 (OUTLIER) cc_final: 0.6571 (p90) REVERT: LM 68 GLU cc_start: 0.5276 (OUTLIER) cc_final: 0.4604 (pm20) REVERT: LN 100 LEU cc_start: 0.7909 (OUTLIER) cc_final: 0.7585 (mp) REVERT: Ld 36 ASP cc_start: 0.7181 (OUTLIER) cc_final: 0.6814 (p0) REVERT: Lf 219 ARG cc_start: 0.7636 (ptp90) cc_final: 0.7291 (ptp90) REVERT: Lf 243 MET cc_start: 0.7382 (ttm) cc_final: 0.7119 (ttp) REVERT: MM 141 GLU cc_start: 0.7401 (OUTLIER) cc_final: 0.7084 (tm-30) REVERT: MM 145 ARG cc_start: 0.6749 (mpp-170) cc_final: 0.6472 (mpp-170) REVERT: Md 152 GLN cc_start: 0.7732 (OUTLIER) cc_final: 0.7484 (mt0) REVERT: Md 155 GLU cc_start: 0.8035 (tt0) cc_final: 0.7807 (tt0) REVERT: Mf 243 MET cc_start: 0.7021 (tpp) cc_final: 0.6502 (tpt) outliers start: 299 outliers final: 218 residues processed: 2099 average time/residue: 2.1036 time to fit residues: 6157.0229 Evaluate side-chains 2205 residues out of total 14599 non-(ALA, GLY, PRO) need fitting. rotamer outliers: 274 poor density : 1931 time to evaluate : 11.583 ------------------------------------------------------------------------------- Set rotamer restraints ********************** Chi-restraints excluded: chain AC residue 69 GLN Chi-restraints excluded: chain AC residue 228 HIS Chi-restraints excluded: chain AC residue 249 ILE Chi-restraints excluded: chain AC residue 259 SER Chi-restraints excluded: chain AD residue 38 THR Chi-restraints excluded: chain AD residue 85 VAL Chi-restraints excluded: chain AH residue 278 ASP Chi-restraints excluded: chain AK residue 57 MET Chi-restraints excluded: chain AK residue 129 GLU Chi-restraints excluded: chain AK residue 177 ASN Chi-restraints excluded: chain AL residue 136 SER Chi-restraints excluded: chain AL residue 212 ASN Chi-restraints excluded: chain AM residue 69 VAL Chi-restraints excluded: chain AM residue 183 VAL Chi-restraints excluded: chain AM residue 299 LEU Chi-restraints excluded: chain AN residue 51 CYS Chi-restraints excluded: chain AN residue 54 SER Chi-restraints excluded: chain Ad residue 36 ASP Chi-restraints excluded: chain Ad residue 54 GLU Chi-restraints excluded: chain Af residue 243 MET Chi-restraints excluded: chain BC residue 30 SER Chi-restraints excluded: chain BC residue 131 THR Chi-restraints excluded: chain BC residue 221 VAL Chi-restraints excluded: chain BD residue 38 THR Chi-restraints excluded: chain BD residue 61 VAL Chi-restraints excluded: chain BD residue 151 SER Chi-restraints excluded: chain BK residue 129 GLU Chi-restraints excluded: chain BK residue 177 ASN Chi-restraints excluded: chain BL residue 163 ILE Chi-restraints excluded: chain BL residue 223 SER Chi-restraints excluded: chain BM residue 68 GLU Chi-restraints excluded: chain BM residue 183 VAL Chi-restraints excluded: chain BM residue 262 GLU Chi-restraints excluded: chain BN residue 45 MET Chi-restraints excluded: chain BN residue 51 CYS Chi-restraints excluded: chain BN residue 62 ASN Chi-restraints excluded: chain BN residue 82 MET Chi-restraints excluded: chain BN residue 100 LEU Chi-restraints excluded: chain Bd residue 62 ILE Chi-restraints excluded: chain Bd residue 95 THR Chi-restraints excluded: chain Bd residue 144 SER Chi-restraints excluded: chain Bd residue 152 GLN Chi-restraints excluded: chain CC residue 228 HIS Chi-restraints excluded: chain CC residue 259 SER Chi-restraints excluded: chain CK residue 163 LYS Chi-restraints excluded: chain CK residue 177 ASN Chi-restraints excluded: chain CL residue 110 GLN Chi-restraints excluded: chain CL residue 136 SER Chi-restraints excluded: chain CL residue 223 SER Chi-restraints excluded: chain CM residue 68 GLU Chi-restraints excluded: chain CM residue 144 THR Chi-restraints excluded: chain CM residue 145 ARG Chi-restraints excluded: chain CM residue 183 VAL Chi-restraints excluded: chain CM residue 214 ILE Chi-restraints excluded: chain CM residue 234 GLU Chi-restraints excluded: chain CM residue 262 GLU Chi-restraints excluded: chain CN residue 51 CYS Chi-restraints excluded: chain Cd residue 36 ASP Chi-restraints excluded: chain Cd residue 50 ASP Chi-restraints excluded: chain Cd residue 160 LYS Chi-restraints excluded: chain Cf residue 253 ARG Chi-restraints excluded: chain DC residue 30 SER Chi-restraints excluded: chain DC residue 228 HIS Chi-restraints excluded: chain DC residue 249 ILE Chi-restraints excluded: chain DD residue 36 ASP Chi-restraints excluded: chain DH residue 332 ASP Chi-restraints excluded: chain DK residue 177 ASN Chi-restraints excluded: chain DL residue 110 GLN Chi-restraints excluded: chain DL residue 136 SER Chi-restraints excluded: chain DL residue 212 ASN Chi-restraints excluded: chain DL residue 230 GLU Chi-restraints excluded: chain DM residue 41 PHE Chi-restraints excluded: chain DM residue 262 GLU Chi-restraints excluded: chain DN residue 51 CYS Chi-restraints excluded: chain DN residue 54 SER Chi-restraints excluded: chain DN residue 100 LEU Chi-restraints excluded: chain Dd residue 36 ASP Chi-restraints excluded: chain Dd residue 54 GLU Chi-restraints excluded: chain Dd residue 109 LEU Chi-restraints excluded: chain Dd residue 144 SER Chi-restraints excluded: chain Dd residue 145 ILE Chi-restraints excluded: chain Dd residue 160 LYS Chi-restraints excluded: chain Df residue 230 LEU Chi-restraints excluded: chain EC residue 209 MET Chi-restraints excluded: chain EC residue 228 HIS Chi-restraints excluded: chain EC residue 249 ILE Chi-restraints excluded: chain ED residue 47 SER Chi-restraints excluded: chain EH residue 332 ASP Chi-restraints excluded: chain EK residue 55 LYS Chi-restraints excluded: chain EK residue 177 ASN Chi-restraints excluded: chain EM residue 183 VAL Chi-restraints excluded: chain EM residue 227 ILE Chi-restraints excluded: chain EM residue 259 SER Chi-restraints excluded: chain EN residue 51 CYS Chi-restraints excluded: chain EN residue 100 LEU Chi-restraints excluded: chain Ed residue 36 ASP Chi-restraints excluded: chain Ed residue 61 VAL Chi-restraints excluded: chain Ed residue 62 ILE Chi-restraints excluded: chain Ed residue 84 SER Chi-restraints excluded: chain Ed residue 144 SER Chi-restraints excluded: chain Ed residue 145 ILE Chi-restraints excluded: chain Ed residue 152 GLN Chi-restraints excluded: chain Ed residue 160 LYS Chi-restraints excluded: chain Ef residue 243 MET Chi-restraints excluded: chain FC residue 228 HIS Chi-restraints excluded: chain FC residue 249 ILE Chi-restraints excluded: chain FD residue 38 THR Chi-restraints excluded: chain FH residue 332 ASP Chi-restraints excluded: chain FK residue 45 VAL Chi-restraints excluded: chain FK residue 177 ASN Chi-restraints excluded: chain FL residue 136 SER Chi-restraints excluded: chain FL residue 212 ASN Chi-restraints excluded: chain FM residue 69 VAL Chi-restraints excluded: chain FM residue 259 SER Chi-restraints excluded: chain FN residue 51 CYS Chi-restraints excluded: chain FN residue 100 LEU Chi-restraints excluded: chain Fd residue 36 ASP Chi-restraints excluded: chain Fd residue 50 ASP Chi-restraints excluded: chain Fd residue 54 GLU Chi-restraints excluded: chain Fd residue 58 VAL Chi-restraints excluded: chain Fd residue 152 GLN Chi-restraints excluded: chain Ff residue 232 VAL Chi-restraints excluded: chain Ff residue 243 MET Chi-restraints excluded: chain GC residue 209 MET Chi-restraints excluded: chain GC residue 226 VAL Chi-restraints excluded: chain GC residue 228 HIS Chi-restraints excluded: chain GD residue 85 VAL Chi-restraints excluded: chain GH residue 329 THR Chi-restraints excluded: chain GH residue 332 ASP Chi-restraints excluded: chain GK residue 129 GLU Chi-restraints excluded: chain GK residue 177 ASN Chi-restraints excluded: chain GL residue 212 ASN Chi-restraints excluded: chain GM residue 69 VAL Chi-restraints excluded: chain GM residue 183 VAL Chi-restraints excluded: chain GN residue 54 SER Chi-restraints excluded: chain GN residue 62 ASN Chi-restraints excluded: chain Gd residue 62 ILE Chi-restraints excluded: chain Gd residue 95 THR Chi-restraints excluded: chain Gd residue 109 LEU Chi-restraints excluded: chain Gd residue 144 SER Chi-restraints excluded: chain Gf residue 222 LEU Chi-restraints excluded: chain Gf residue 261 VAL Chi-restraints excluded: chain HC residue 221 VAL Chi-restraints excluded: chain HC residue 228 HIS Chi-restraints excluded: chain HC residue 244 ASP Chi-restraints excluded: chain HD residue 61 VAL Chi-restraints excluded: chain HD residue 85 VAL Chi-restraints excluded: chain HH residue 329 THR Chi-restraints excluded: chain HH residue 332 ASP Chi-restraints excluded: chain HK residue 129 GLU Chi-restraints excluded: chain HL residue 110 GLN Chi-restraints excluded: chain HL residue 136 SER Chi-restraints excluded: chain HL residue 212 ASN Chi-restraints excluded: chain HL residue 219 ILE Chi-restraints excluded: chain HM residue 68 GLU Chi-restraints excluded: chain HM residue 144 THR Chi-restraints excluded: chain HM residue 183 VAL Chi-restraints excluded: chain HM residue 292 MET Chi-restraints excluded: chain HN residue 51 CYS Chi-restraints excluded: chain HN residue 100 LEU Chi-restraints excluded: chain Hd residue 30 ILE Chi-restraints excluded: chain Hd residue 36 ASP Chi-restraints excluded: chain Hd residue 63 THR Chi-restraints excluded: chain Hf residue 261 VAL Chi-restraints excluded: chain IC residue 85 LYS Chi-restraints excluded: chain IC residue 226 VAL Chi-restraints excluded: chain IC residue 228 HIS Chi-restraints excluded: chain ID residue 38 THR Chi-restraints excluded: chain ID residue 61 VAL Chi-restraints excluded: chain ID residue 85 VAL Chi-restraints excluded: chain IH residue 329 THR Chi-restraints excluded: chain IK residue 122 LYS Chi-restraints excluded: chain IK residue 177 ASN Chi-restraints excluded: chain IL residue 110 GLN Chi-restraints excluded: chain IL residue 136 SER Chi-restraints excluded: chain IL residue 212 ASN Chi-restraints excluded: chain IL residue 219 ILE Chi-restraints excluded: chain IM residue 145 ARG Chi-restraints excluded: chain IM residue 183 VAL Chi-restraints excluded: chain IM residue 259 SER Chi-restraints excluded: chain IN residue 51 CYS Chi-restraints excluded: chain IN residue 100 LEU Chi-restraints excluded: chain Id residue 36 ASP Chi-restraints excluded: chain Id residue 97 ARG Chi-restraints excluded: chain Id residue 144 SER Chi-restraints excluded: chain If residue 254 ILE Chi-restraints excluded: chain JC residue 244 ASP Chi-restraints excluded: chain JC residue 259 SER Chi-restraints excluded: chain JD residue 38 THR Chi-restraints excluded: chain JD residue 85 VAL Chi-restraints excluded: chain JH residue 329 THR Chi-restraints excluded: chain JK residue 129 GLU Chi-restraints excluded: chain JK residue 177 ASN Chi-restraints excluded: chain JL residue 110 GLN Chi-restraints excluded: chain JL residue 215 SER Chi-restraints excluded: chain JM residue 69 VAL Chi-restraints excluded: chain JM residue 127 ASN Chi-restraints excluded: chain JM residue 183 VAL Chi-restraints excluded: chain JN residue 44 LYS Chi-restraints excluded: chain JN residue 45 MET Chi-restraints excluded: chain JN residue 51 CYS Chi-restraints excluded: chain Jd residue 54 GLU Chi-restraints excluded: chain Jd residue 62 ILE Chi-restraints excluded: chain Jd residue 109 LEU Chi-restraints excluded: chain Jd residue 144 SER Chi-restraints excluded: chain Jf residue 261 VAL Chi-restraints excluded: chain Jf residue 262 ILE Chi-restraints excluded: chain KC residue 69 GLN Chi-restraints excluded: chain KC residue 78 ILE Chi-restraints excluded: chain KC residue 228 HIS Chi-restraints excluded: chain KC residue 259 SER Chi-restraints excluded: chain KD residue 38 THR Chi-restraints excluded: chain KD residue 151 SER Chi-restraints excluded: chain KH residue 278 ASP Chi-restraints excluded: chain KH residue 329 THR Chi-restraints excluded: chain KH residue 332 ASP Chi-restraints excluded: chain KH residue 338 GLU Chi-restraints excluded: chain KK residue 45 VAL Chi-restraints excluded: chain KK residue 177 ASN Chi-restraints excluded: chain KL residue 110 GLN Chi-restraints excluded: chain KL residue 136 SER Chi-restraints excluded: chain KL residue 212 ASN Chi-restraints excluded: chain KL residue 230 GLU Chi-restraints excluded: chain KM residue 68 GLU Chi-restraints excluded: chain KM residue 143 THR Chi-restraints excluded: chain KM residue 183 VAL Chi-restraints excluded: chain KN residue 51 CYS Chi-restraints excluded: chain Kd residue 36 ASP Chi-restraints excluded: chain Kd residue 50 ASP Chi-restraints excluded: chain Kd residue 95 THR Chi-restraints excluded: chain Kf residue 261 VAL Chi-restraints excluded: chain LC residue 30 SER Chi-restraints excluded: chain LC residue 228 HIS Chi-restraints excluded: chain LD residue 151 SER Chi-restraints excluded: chain LH residue 329 THR Chi-restraints excluded: chain LH residue 332 ASP Chi-restraints excluded: chain LK residue 45 VAL Chi-restraints excluded: chain LK residue 177 ASN Chi-restraints excluded: chain LL residue 136 SER Chi-restraints excluded: chain LL residue 219 ILE Chi-restraints excluded: chain LL residue 223 SER Chi-restraints excluded: chain LM residue 68 GLU Chi-restraints excluded: chain LM residue 183 VAL Chi-restraints excluded: chain LM residue 301 MET Chi-restraints excluded: chain LN residue 51 CYS Chi-restraints excluded: chain LN residue 62 ASN Chi-restraints excluded: chain LN residue 100 LEU Chi-restraints excluded: chain Ld residue 36 ASP Chi-restraints excluded: chain Ld residue 58 VAL Chi-restraints excluded: chain Ld residue 59 GLU Chi-restraints excluded: chain Ld residue 67 LYS Chi-restraints excluded: chain Ld residue 144 SER Chi-restraints excluded: chain Ld residue 152 GLN Chi-restraints excluded: chain Lf residue 261 VAL Chi-restraints excluded: chain MC residue 30 SER Chi-restraints excluded: chain MH residue 329 THR Chi-restraints excluded: chain MH residue 332 ASP Chi-restraints excluded: chain MH residue 354 MET Chi-restraints excluded: chain MK residue 72 GLN Chi-restraints excluded: chain MK residue 129 GLU Chi-restraints excluded: chain MK residue 177 ASN Chi-restraints excluded: chain ML residue 212 ASN Chi-restraints excluded: chain MM residue 69 VAL Chi-restraints excluded: chain MM residue 141 GLU Chi-restraints excluded: chain MM residue 183 VAL Chi-restraints excluded: chain MN residue 45 MET Chi-restraints excluded: chain MN residue 54 SER Chi-restraints excluded: chain MN residue 62 ASN Chi-restraints excluded: chain Md residue 36 ASP Chi-restraints excluded: chain Md residue 50 ASP Chi-restraints excluded: chain Md residue 62 ILE Chi-restraints excluded: chain Md residue 152 GLN Chi-restraints excluded: chain Mf residue 232 VAL Chi-restraints excluded: chain Mf residue 261 VAL Rotamers are restrained with sigma=1.00 ------------------------------------------------------------------------------- XYZ refinement ************** Weight determination summary: number of chunks: 1651 random chunks: chunk 1040 optimal weight: 0.8980 chunk 1395 optimal weight: 5.9990 chunk 401 optimal weight: 0.9980 chunk 1207 optimal weight: 0.7980 chunk 193 optimal weight: 0.9980 chunk 363 optimal weight: 4.9990 chunk 1311 optimal weight: 2.9990 chunk 549 optimal weight: 4.9990 chunk 1347 optimal weight: 20.0000 chunk 166 optimal weight: 5.9990 chunk 241 optimal weight: 0.0270 overall best weight: 0.7438 ------------------------------------------------------------------------------- NQH flips ********* Analyzing N/Q/H residues for possible flip corrections... Flipped N/Q/H residues before XYZ refinement: AL 110 GLN AL 160 GLN ** AM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** BL 110 GLN BL 160 GLN CC 149 GLN CL 160 GLN CL 183 GLN ** CM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** DC 35 GLN DL 110 GLN DL 160 GLN FL 110 GLN GL 160 GLN HH 277 ASN HL 160 GLN ** HM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** IH 308 ASN IN 104 ASN ** JM 40 GLN ** both conformations clash, **PLEASE CHECK MANUALLY** KC 35 GLN KL 160 GLN KN 104 ASN LL 160 GLN Ld 75 ASN ML 183 GLN Total number of N/Q/H flips: 22 ------------------------------------------------------------------------------- ADP refinement ************** |-group b-factor refinement (macro cycle = 0; iterations = 0)-----------------| | r_work = 0.3678 r_free = 0.3678 target = 0.141707 restraints weight = None | |-----------------------------------------------------------------------------| |-group b-factor refinement (macro cycle = 1; iterations = 36)----------------| | r_work = 0.3191 r_free = 0.3191 target = 0.102779 restraints weight = 176108.780| |-----------------------------------------------------------------------------| r_work (start): 0.3153 rms_B_bonded: 1.57 r_work: 0.2960 rms_B_bonded: 2.13 restraints_weight: 0.5000 r_work: 0.2853 rms_B_bonded: 3.41 restraints_weight: 0.2500 r_work (final): 0.2853 ------------------------------------------------------------------------------- Occupancy refinement ******************** ------------------------------------------------------------------------------- Overall statistics ****************** model-to-map fit, CC_mask: 0.8632 moved from start: 0.2131 Geometry Restraints Library: GeoStd + Monomer Library + CDL v1.2 Deviations from Ideal Values - rmsd, rmsZ for bonds and angles. Bond : 0.002 0.063 137280 Z= 0.152 Angle : 0.519 8.897 185796 Z= 0.276 Chirality : 0.043 0.231 21021 Planarity : 0.004 0.067 23738 Dihedral : 4.545 25.890 18824 Min Nonbonded Distance : 2.185 Molprobity Statistics. All-atom Clashscore : 5.42 Ramachandran Plot: Outliers : 0.00 % Allowed : 4.69 % Favored : 95.31 % Rotamer: Outliers : 1.94 % Allowed : 18.11 % Favored : 79.95 % 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: 0.68 (0.07), residues: 16835 helix: 3.18 (0.08), residues: 4225 sheet: 0.70 (0.08), residues: 4290 loop : -1.22 (0.06), residues: 8320 Max deviation from planes: Type MaxDev MeanDev LineInFile TRP 0.029 0.001 TRPIM 206 HIS 0.002 0.000 HISED 103 PHE 0.016 0.001 PHEBd 25 TYR 0.016 0.001 TYRIL 116 ARG 0.015 0.000 ARGHL 103 Origin is already at (0, 0, 0), no shifts will be applied =============================================================================== Job complete usr+sys time: 77827.25 seconds wall clock time: 1331 minutes 11.56 seconds (79871.56 seconds total)