# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3tku # POINT_FILE 3tku_M77.ptf # PROPERTIES ATOM_TYPE_IS_C, ATOM_TYPE_IS_CT, ATOM_TYPE_IS_CA, # PROPERTIES ATOM_TYPE_IS_N, ATOM_TYPE_IS_N2, ATOM_TYPE_IS_N3, # PROPERTIES ATOM_TYPE_IS_NA, ATOM_TYPE_IS_O, ATOM_TYPE_IS_O2, # PROPERTIES ATOM_TYPE_IS_OH, ATOM_TYPE_IS_S, ATOM_TYPE_IS_SH, # PROPERTIES ATOM_TYPE_IS_OTHER, PARTIAL_CHARGE, ELEMENT_IS_ANY, # PROPERTIES ELEMENT_IS_C, ELEMENT_IS_N, ELEMENT_IS_O, ELEMENT_IS_S, # PROPERTIES ELEMENT_IS_OTHER, HYDROXYL, AMIDE, AMINE, CARBONYL, # PROPERTIES RING_SYSTEM, PEPTIDE, VDW_VOLUME, CHARGE, NEG_CHARGE, # PROPERTIES POS_CHARGE, CHARGE_WITH_HIS, HYDROPHOBICITY, MOBILITY, # PROPERTIES SOLVENT_ACCESSIBILITY, RESIDUE_NAME_IS_ALA, # PROPERTIES RESIDUE_NAME_IS_ARG, RESIDUE_NAME_IS_ASN, RESIDUE_NAME_IS_ASP, # PROPERTIES RESIDUE_NAME_IS_CYS, RESIDUE_NAME_IS_GLN, RESIDUE_NAME_IS_GLU, # PROPERTIES RESIDUE_NAME_IS_GLY, RESIDUE_NAME_IS_HIS, RESIDUE_NAME_IS_ILE, # PROPERTIES RESIDUE_NAME_IS_LEU, RESIDUE_NAME_IS_LYS, RESIDUE_NAME_IS_MET, # PROPERTIES RESIDUE_NAME_IS_PHE, RESIDUE_NAME_IS_PRO, RESIDUE_NAME_IS_SER, # PROPERTIES RESIDUE_NAME_IS_THR, RESIDUE_NAME_IS_TRP, RESIDUE_NAME_IS_TYR, # PROPERTIES RESIDUE_NAME_IS_VAL, RESIDUE_NAME_IS_HOH, # PROPERTIES RESIDUE_NAME_IS_OTHER, RESIDUE_CLASS1_IS_HYDROPHOBIC, # PROPERTIES RESIDUE_CLASS1_IS_CHARGED, RESIDUE_CLASS1_IS_POLAR, # PROPERTIES RESIDUE_CLASS1_IS_UNKNOWN, RESIDUE_CLASS2_IS_NONPOLAR, # PROPERTIES RESIDUE_CLASS2_IS_POLAR, RESIDUE_CLASS2_IS_BASIC, # PROPERTIES RESIDUE_CLASS2_IS_ACIDIC, RESIDUE_CLASS2_IS_UNKNOWN, # PROPERTIES SECONDARY_STRUCTURE1_IS_3HELIX, SECONDARY_STRUCTURE1_IS_4HELIX, # PROPERTIES SECONDARY_STRUCTURE1_IS_5HELIX, SECONDARY_STRUCTURE1_IS_BRIDGE, # PROPERTIES SECONDARY_STRUCTURE1_IS_STRAND, SECONDARY_STRUCTURE1_IS_TURN, # PROPERTIES SECONDARY_STRUCTURE1_IS_BEND, SECONDARY_STRUCTURE1_IS_COIL, # PROPERTIES SECONDARY_STRUCTURE1_IS_HET, SECONDARY_STRUCTURE1_IS_UNKNOWN, # PROPERTIES SECONDARY_STRUCTURE2_IS_HELIX, SECONDARY_STRUCTURE2_IS_BETA, # PROPERTIES SECONDARY_STRUCTURE2_IS_COIL, SECONDARY_STRUCTURE2_IS_HET, # PROPERTIES SECONDARY_STRUCTURE2_IS_UNKNOWN # SHELLS 6 # SHELL_WIDTH 1.25 # VERBOSITY 0 Env_3tku_0 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.7992 3 1 1 1 0 0 0 1 0 1 0 0 56.502 0 0 0 0 -2 8 177 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 59 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0.6114 2 2 0 0 0 0 0 0 0 0 0 2 67.02 0 0 0 0 0 0 118 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 3 5 2 4 0 0 0 2 0 0 0 0 0 -1.6282 16 10 4 2 0 0 0 4 0 2 2 11 394.716 0 0 0 0 -2 8 1011 0 0 5 0 0 0 2 0 0 0 0 3 0 0 0 0 0 6 0 0 0 0 0 5 11 0 6 5 3 2 0 0 11 0 0 2 0 3 0 0 0 11 5 0 0 0 2 5 5 1 0 0 3 3 1 0 0 0 0 -2.4219 20 12 4 4 0 0 0 2 2 3.5 8 8 454.469 0.333 0.333 0 1.333 -5 36 1049 0 0 2 0 0 0 3 0 7 0 2 2 0 0 0 0 0 4 0 0 0 0 2 5 13 0 6 2 9 3 0 0 9 0 0 9 0 2 0 0 0 9 11 0 0 0 3 6 2 4 0 0 0 2 1 0 0 0 0 -2.9161 18 11 4 3 0 0 0 4 0 2.5 2 7 445.666 0.666 0.666 0 0.666 0 31 861 0 0 3 0 0 0 4 0 2 0 3 2 2 0 0 0 0 2 0 0 0 0 5 6 7 0 7 3 4 4 0 0 10 0 0 5 0 3 0 0 0 10 8 0 0 0 # -8.139 -61.056 34.101 # 3tku_A_419_M77_108_N_1_A Env_3tku_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 450 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 6 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 -0.647 3 2 1 0 0 0 0 0 1 0 3 0 67.679 0 0 0 0 0 9 225 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 1 5 1 1 0 0 1 2 0 0 0 0 0 -1.4808 11 7 2 2 0 0 0 1.5 0.5 2 2 5 285.285 0 0 0 0.5 1 14 589 0 0 0 0 0 0 1 0 1 0 2 3 0 1 0 0 0 3 0 0 0 0 3 4 4 0 6 0 4 1 0 1 6 0 0 0 3 1 0 0 0 7 4 0 0 0 4 9 5 1 0 0 1 5 0 0 0 0 0 -1.9682 25 18 2 5 0 0 0 1.5 0.5 5 6 11 648.037 0 0 0 0.5 -1 42 1203 0 0 5 0 0 0 1 0 4 0 6 5 0 2 0 0 0 2 0 0 0 0 8 6 11 0 10 5 9 1 0 2 9 0 0 1 8 5 0 0 0 11 14 0 0 0 3 8 3 6 0 1 0 1 0 0 0 0 0 -3.0243 22 14 7 1 0 0 0 6 1 1 3 11 546.195 1 0 1 1 2 27 1045 0 0 6 0 0 0 2 0 4 0 6 1 0 3 0 0 0 0 0 0 0 0 9 3 10 0 9 6 5 2 0 3 6 0 0 4 5 4 0 0 0 9 13 0 0 0 # -4.528 -55.132 35.283 # 3tku_A_419_M77_110_W_1_A Env_3tku_2 0 0 0 0 0 0 1 0 0 0 0 0 0 -0.3418 1 0 1 0 0 0 0 0 1 0 1 0 20.579 0 0 0 0 -1 4 75 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 -0.3031 5 5 0 0 0 0 0 0 0 0 5 0 114.779 0 0 0 0 3 17 375 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 5 0 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 -0.9451 3 2 0 1 0 0 0 0 0 1 2 0 64.536 0 0 0 0 1 13 229 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 3 0 2 1 0 0 0 0 2 0 0 0 0 1 0 0 0 2 1 0 0 0 3 5 1 3 0 0 0 3 0 0 0 0 0 -2.0751 15 9 3 3 0 0 0 3 0 3 1 8 368.855 0 0 0 0 -2 16 1226 0 0 8 0 0 0 2 0 0 0 0 1 0 0 0 0 0 4 0 0 0 0 0 3 12 0 4 8 1 2 0 0 5 0 0 1 0 9 0 0 0 5 10 0 0 0 3 5 0 3 0 0 1 1 0 0 0 0 0 -0.6806 13 8 4 1 0 0 0 3.5 0.5 1 1 7 339.925 0 0 0 0.5 -2 15 635 0 0 2 0 0 0 2 0 2 0 0 6 0 0 0 0 0 1 0 0 0 0 0 8 5 0 1 2 8 2 0 0 7 0 0 3 1 2 0 0 0 7 6 0 0 0 1 7 5 2 0 1 1 4 0 0 0 0 0 -4.8803 21 13 4 4 0 0 0 2.5 1.5 4 6 9 522.582 1 0 1 1.5 0 38 1143 0 0 4 1 0 0 3 0 4 0 3 2 0 3 0 0 0 1 0 0 0 0 6 6 9 0 7 4 6 4 0 3 4 0 0 6 5 2 1 0 0 7 13 1 0 0 # -7.129 -55.927 35.202 # 3tku_A_419_M77_110_W_2_A Env_3tku_3 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.7992 3 1 1 1 0 0 0 1 0 1 0 0 56.502 0 0 0 0 -2 8 237 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 79 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4014 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 158 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 2 2 1 0 0 0 1 2 0 0 0 0 0 -0.426 8 5 1 2 0 0 0 0 1 2 2 5 204.128 0 0 0 0 -2 8 916 0 0 2 0 0 0 4 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 4 4 0 2 2 0 4 0 0 2 0 0 0 0 6 0 0 0 2 6 0 0 0 1 1 6 3 0 0 2 0 1 0 0 0 0 -2.4451 14 8 5 1 0 0 0 4 1 0.5 8 2 291.003 0.666 0.666 0 1.666 -2 38 1072 0 0 1 1 0 0 3 0 5 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 10 0 4 1 5 4 0 0 4 0 0 6 0 3 1 0 0 4 9 1 0 0 3 7 2 2 0 0 0 2 3 0 0 0 0 -2.8017 19 12 2 5 0 0 0 2 0 3.5 2 5 455.953 1.332 1.332 0 1.332 0 36 1026 0 0 2 5 0 0 2 0 3 0 0 4 0 0 0 0 0 3 0 0 0 0 0 11 8 0 3 2 7 7 0 0 7 0 0 5 0 2 5 0 0 7 7 5 0 0 # -10.93 -55.534 34.05 # 3tku_A_419_M77_147_N_1_A