# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3kgc # POINT_FILE ./pocket_res_ptf/3kgc_ZK1_B_263.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_3kgc_0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0013 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 54 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 2 1 1 2 0 0 0 1 0 0 0 0 0 -0.0841 7 4 2 1 0 0 0 2 0 1 1 5 160.877 0 0 0 0 -1 3 382 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 5 0 0 0 0 1 5 1 0 6 1 0 0 0 0 0 0 0 0 0 7 0 0 0 0 7 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 -0.9703 3 2 0 1 0 0 0 0 0 1 2 1 64.536 0 0 0 0 1 6 214 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 2 0 0 0 0 1 2 0 0 2 1 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 1 7 2 2 1 0 0 0 0 0 0 0 0 -2.2278 13 10 3 0 0 0 0 2.5 0.5 0 2 6 373.825 0.333 0 0.333 0.333 3 23 471 0 1 0 0 0 0 0 3 0 0 1 3 3 0 0 0 0 0 2 0 0 0 4 4 2 3 4 5 4 0 0 0 5 0 0 1 0 0 7 0 0 5 1 7 0 0 5 7 1 3 2 0 0 4 0 0 1 0 0 -1.8359 23 13 5 4 1 0 0 3.5 1.5 4 1 11 569.684 0.666 0 0.666 0.666 -2 38 560 1 3 3 0 0 0 0 5 0 1 2 1 4 0 0 0 0 0 1 2 0 0 10 4 4 5 10 9 4 0 0 0 11 0 0 2 0 0 10 0 0 11 2 10 0 0 4 17 0 5 0 0 0 3 1 1 0 0 0 -4.1195 31 21 5 5 0 0 1 5 0 3.5 0 14 824.601 0.666 0.666 0 0.666 1 38 748 3 1 3 2 0 0 0 4 0 3 4 1 1 0 2 0 1 0 1 5 0 0 18 4 5 4 18 9 2 2 0 0 6 0 0 8 2 0 15 0 0 6 10 15 0 0 # 5.27 32.01 -7.96 Env_3kgc_1 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0265 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 3 0 2 0 0 0 1 0 0 0 0 0 -0.0273 8 5 2 1 0 0 0 2 0 1 0 5 207.318 0 0 0 0 -1 4 18 1 0 0 0 0 0 0 0 0 0 1 0 0 0 6 0 0 0 0 0 0 0 8 0 0 0 8 0 0 0 0 0 0 0 0 8 0 0 0 0 0 0 8 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 -0.5689 2 1 0 1 0 0 0 0 0 1 1 1 32.073 0 0 0 0 0 2 14 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 5 9 1 0 0 0 0 0 0 0 0 0 -1.6067 17 16 1 0 0 0 0 1 0 0 10 4 474.465 0 0 0 0 11 42 168 3 0 0 0 0 0 0 0 0 0 3 0 0 2 0 0 0 0 9 0 0 0 8 0 9 0 8 9 0 0 0 0 0 0 0 12 2 2 1 0 0 0 16 1 0 0 4 3 5 2 0 0 0 2 0 3 0 1 0 -2.5626 20 12 2 5 1 0 3.5 2 0 2 7 7 464.625 0 0 0 0 -1 49 270 0 0 0 0 1 0 0 2 0 1 2 0 0 1 0 0 1 0 12 0 0 0 4 0 14 2 4 16 0 0 0 0 1 0 0 9 6 1 3 0 0 1 16 3 0 0 2 16 8 1 0 0 0 3 0 1 1 0 0 -4.4043 32 26 1 4 1 0 1 1 0 3 8 10 895.761 0 0 0 0 14 56 488 0 0 0 0 1 0 2 4 0 3 3 0 5 3 0 0 3 0 8 0 0 0 14 2 12 4 14 16 0 2 0 0 5 0 2 17 1 3 4 0 0 5 23 4 0 0 # 5.35 39.16 -3.43 Env_3kgc_2 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0013 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 14 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 2 1 0 2 0 0 0 1 0 0 0 0 0 -0.2199 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 66 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 2 0 6 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 -1.3273 4 2 0 2 0 0 0 0 0 2 2 2 70.088 0 0 0 0 0 5 38 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 2 0 0 0 1 0 2 1 1 3 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 4 7 5 4 0 0 0 2 0 0 0 0 0 -1.9559 22 16 4 2 0 0 0 4 0 2 5 14 580.751 0 0 0 0 2 26 209 0 0 0 0 0 0 0 5 0 2 4 0 1 2 2 0 3 0 3 0 0 0 11 0 6 5 11 11 0 0 0 0 0 0 0 17 0 2 3 0 0 0 19 3 0 0 5 15 4 3 0 0 0 3 0 1 0 0 0 -0.8646 31 24 3 4 0 0 1 3 0 3 5 15 851.461 0 0 0 0 6 35 414 1 0 0 0 0 0 0 0 0 4 2 1 5 7 6 0 4 0 1 0 0 0 25 1 5 0 25 5 1 0 0 0 0 0 0 18 0 7 6 0 0 0 25 6 0 0 4 12 4 4 0 0 0 7 0 2 1 0 0 -5.5901 34 20 4 9 1 0 2 4 0 7 4 18 834.143 0 0 0 0 0 42 656 1 0 0 0 0 0 0 0 0 4 4 5 2 6 5 6 0 0 1 0 0 0 22 5 7 0 22 7 5 0 0 0 0 0 0 22 0 4 8 0 0 0 26 8 0 0 # 9.96 41.44 -4.16 Env_3kgc_3 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0397 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 42 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 2 0 2 0 0 0 1 0 0 0 0 0 -0.3105 7 4 2 1 0 0 0 2 0 1 0 5 173.808 0 0 0 0 -1 3 215 0 0 0 0 0 0 5 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 5 1 0 1 1 0 5 0 0 1 0 0 6 0 0 0 0 0 1 6 0 0 0 1 0 0 0 0 0 0 2 1 0 0 0 0 -1.1491 4 1 0 3 0 0 0 0 0 2.5 0 2 57.704 0.666 0.666 0 0.666 -3 7 86 0 0 0 0 0 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 2 0 1 1 1 0 2 0 0 0 0 0 3 0 0 1 0 0 0 3 1 0 0 2 6 0 5 0 0 0 0 1 3 0 0 0 -3.3694 17 8 5 4 0 0 3 5 0 0.5 0 10 404.373 0.333 0.333 0 0.333 -7 14 104 0 0 0 0 0 0 1 1 0 2 4 0 1 0 0 6 2 0 0 0 0 0 7 1 8 1 7 9 0 1 0 0 7 0 0 9 0 0 1 0 0 7 9 1 0 0 5 16 0 2 0 0 0 3 0 2 0 0 0 -1.7144 28 21 2 5 0 0 2 2 0 3 0 14 800.78 0 0 0 0 3 29 150 0 0 2 0 0 0 0 2 0 5 7 0 3 0 0 4 4 0 1 0 0 0 15 0 11 2 15 13 0 0 0 0 10 0 0 16 0 0 2 0 0 10 16 2 0 0 3 10 0 3 0 1 0 5 1 0 0 0 0 -4.9715 23 13 4 6 0 0 0 3 1 5.5 1 10 567.588 1.333 0.333 1 1.333 -4 38 307 0 0 4 1 0 0 1 0 0 2 5 2 2 0 0 1 4 0 1 0 0 0 9 4 10 0 9 10 2 2 0 0 10 0 0 11 0 1 1 0 0 10 12 1 0 0 # 11.25 34.85 4.96 Env_3kgc_4 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0388 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 17 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 2 2 0 2 0 0 0 1 0 1 0 0 0 -0.7592 8 4 2 2 0 0 1 2 0 1 0 5 190.965 0 0 0 0 -3 5 114 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 6 0 0 0 0 0 2 0 6 0 2 6 0 0 0 0 0 0 0 7 0 0 1 0 0 0 7 1 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 -1.1358 2 0 0 2 0 0 0 0 0 2 0 2 22.988 0 0 0 0 -2 0 10 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 7 3 2 1 0 0 2 0 0 0 0 0 -2.0509 17 12 3 2 0 0 0 2.5 0.5 2 3 9 450.902 0.333 0 0.333 0.333 2 21 190 0 1 0 0 0 0 0 1 0 4 4 0 0 0 1 0 1 0 5 0 0 0 9 1 6 1 9 7 1 0 0 0 1 0 0 11 0 0 5 0 0 1 11 5 0 0 3 11 4 3 2 0 0 0 0 0 0 0 0 -2.1555 23 18 5 0 0 0 0 3.5 1.5 0 4 7 643.77 0.666 0 0.666 0.666 5 52 369 0 4 0 0 0 0 0 3 0 1 4 1 0 2 1 0 3 0 4 0 0 0 8 5 7 3 8 10 5 0 0 0 4 0 0 15 0 0 4 0 0 4 15 4 0 0 3 13 8 1 0 0 0 3 0 2 0 0 0 -2.6849 30 24 1 5 0 0 2 1 0 3 8 10 819.377 0 0 0 0 10 54 662 1 2 0 0 0 0 0 3 0 2 1 5 0 4 3 0 2 0 7 0 0 0 11 7 9 3 11 12 7 0 0 0 2 0 0 20 0 0 8 0 0 2 20 8 0 0 # 11.12 37.51 -5.47 Env_3kgc_5 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0397 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 63 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 2 1 0 2 0 0 0 1 0 0 0 0 0 -0.3241 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 387 0 0 0 0 0 0 4 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 4 1 0 1 1 0 4 0 0 0 0 4 0 1 0 1 0 0 0 5 1 0 0 1 1 0 0 0 0 0 1 1 0 0 0 0 -0.5676 4 2 0 2 0 0 0 0 0 1.5 0 1 79.72 0.666 0.666 0 0.666 -1 9 273 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 3 0 0 1 0 0 3 0 0 0 0 3 0 0 0 1 0 0 0 3 1 0 0 2 4 1 2 0 0 0 3 1 1 0 0 0 -2.9795 14 7 2 5 0 0 1 2 0 3.5 1 9 321.631 0.333 0.333 0 0.333 -5 11 598 0 0 0 0 0 0 1 0 0 2 3 0 0 0 0 5 0 0 1 2 0 0 7 1 6 0 7 6 0 1 0 0 0 0 3 0 6 0 5 0 0 0 9 5 0 0 3 12 2 2 0 0 0 0 0 1 0 0 0 0.5146 20 17 2 1 0 0 1 2 0 0 2 9 595.181 0 0 0 0 7 27 258 0 0 0 0 0 0 0 0 0 4 1 0 1 0 4 0 0 0 7 3 0 0 13 0 7 0 13 7 0 0 0 0 1 0 3 1 9 0 6 0 0 1 13 6 0 0 2 11 3 2 0 0 0 2 0 0 1 0 0 -3.8007 21 16 2 2 1 0 0 2 0 2 5 5 567.114 0 0 0 0 8 45 563 0 0 0 0 0 0 0 0 0 2 2 0 5 0 4 0 0 0 6 2 0 0 15 0 6 0 15 6 0 0 0 0 0 0 2 7 5 0 7 0 0 0 14 7 0 0 # -0.98 34.97 0.08