# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3hl5 # POINT_FILE ./pocket_res_ptf/3hl5_9JZ_A_1.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_3hl5_0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 30 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.2047 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 118 0 0 0 0 0 0 0 4 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 4 1 4 0 0 0 0 0 0 0 4 0 0 1 0 0 0 4 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 7 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 1 1 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 1 0 0 3 7 1 2 0 0 0 2 0 1 0 0 0 -1.2389 16 11 2 3 0 0 1 2 0 2 2 9 417.109 0 0 0 0 0 21 588 0 0 0 0 0 0 0 3 0 0 5 4 0 0 0 0 0 0 3 1 0 0 6 4 3 3 6 6 4 0 0 0 0 0 0 10 0 0 6 0 0 0 10 6 0 0 2 7 4 3 0 1 0 0 0 0 0 0 0 -2.7258 17 13 4 0 0 0 0 3 1 0 4 6 483.595 1 0 1 1 6 37 602 0 0 0 0 1 0 0 1 0 0 3 4 0 2 0 0 1 0 2 3 0 0 8 4 4 1 8 5 4 0 0 0 0 0 0 12 0 0 5 0 0 0 12 5 0 0 2 11 4 1 0 0 0 2 0 0 0 1 0 -0.6317 21 17 1 2 1 0 0.5 1 0 2 4 9 593.476 0 0 0 0 5 25 895 0 0 0 0 5 0 0 2 0 0 2 5 0 2 0 0 2 0 2 1 0 0 5 5 9 2 5 11 5 0 0 0 0 0 0 8 1 0 12 0 0 0 9 12 0 0 # 9.63 9.1 -14.54 Env_3hl5_1 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0518 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 22 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 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 1 0 2 0 0 0 1 0 0 0 0 0 -0.3149 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 196 0 0 0 0 0 0 0 1 0 0 4 0 0 0 0 0 1 0 0 0 0 0 4 0 1 1 4 2 0 0 0 0 0 0 0 5 0 0 1 0 0 0 5 1 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 -0.6268 3 2 0 1 0 0 0 0 0 1 0 1 78.514 0 0 0 0 1 5 74 0 0 0 0 0 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 0 0 1 2 1 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 5 0 2 0 0 1 2 0 0 0 0 0 -2.1415 11 6 3 2 0 0 0 2 1 2 1 7 272.901 0 0 0 0 -3 10 422 0 0 0 0 0 0 0 2 0 0 1 0 0 0 0 0 4 1 0 3 0 0 4 0 5 2 5 6 0 0 0 0 0 0 0 6 0 0 5 0 0 0 6 5 0 0 4 4 8 2 0 0 0 2 0 2 0 0 0 -2.3057 22 16 2 4 0 0 2 2 0 2 9 9 546.951 0 0 0 0 2 50 830 0 0 0 2 0 0 0 2 0 0 0 3 0 3 0 0 2 4 3 3 0 0 6 5 9 2 10 7 3 2 0 0 0 0 0 7 1 0 14 0 0 0 8 14 0 0 3 10 10 3 0 0 1 1 1 0 0 0 0 -3.0482 29 23 4 2 0 0 0 3 1 1.5 11 10 765.693 0.333 0.333 0 0.333 10 50 1695 0 0 0 4 1 1 0 1 0 0 0 8 0 2 0 0 0 9 2 1 0 0 3 12 13 1 12 5 8 4 0 0 5 0 0 7 2 0 15 0 0 5 9 15 0 0 # 9.89 12.46 -16.29 Env_3hl5_2 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 78 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 0 0 0 1 0 0 0 0 1 0 0 2 1 0 2 0 0 0 1 0 1 0 0 0 -0.6162 7 3 2 2 0 0 1 2 0 1 0 5 157.455 0 0 0 0 -4 3 513 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 5 0 0 0 0 0 1 1 5 0 1 5 0 1 0 0 0 0 0 1 0 0 6 0 0 0 1 6 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 -0.8116 2 1 0 1 0 0 0 0 0 1 0 1 45.004 0 0 0 0 0 2 100 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 1 0 0 3 6 1 3 0 0 1 1 2 0 0 0 0 -2.3726 17 10 4 3 0 0 0 3 1 2 2 9 417.938 0.999 0.999 0 0.999 -4 19 801 0 0 0 8 0 0 0 0 0 0 3 3 0 0 0 0 0 3 0 0 0 0 3 11 3 0 6 0 3 8 0 0 0 0 0 3 5 0 9 0 0 0 8 9 0 0 3 10 4 2 0 0 0 3 0 0 0 0 0 -1.1323 22 17 2 3 0 0 0 2 0 3 4 9 573.713 0.333 0.333 0 0.333 4 33 847 0 0 0 5 0 0 0 2 0 0 2 4 0 0 0 0 0 6 0 3 0 0 5 9 6 2 11 2 4 5 0 0 0 0 0 7 3 0 12 0 0 0 10 12 0 0 3 5 2 0 0 1 0 3 2 0 0 0 0 -2.8329 16 10 1 5 0 0 0 0 1 4 2 8 417.388 1.666 0.666 1 1.666 1 27 680 0 0 0 2 0 0 1 2 0 0 1 2 0 0 0 0 0 4 0 4 0 0 5 5 4 2 9 2 2 3 0 0 0 0 0 6 1 1 8 0 0 0 8 8 0 0 # 12.77 14.16 -18.07 Env_3hl5_3 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0274 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 141 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 2 1 0 2 0 0 0 1 0 0 0 0 0 -0.0728 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 729 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 4 1 0 0 0 0 1 5 0 4 1 1 0 0 0 5 0 0 0 0 0 1 0 0 5 0 1 0 0 0 0 4 0 0 0 0 1 0 0 0 0 0 -1.0089 5 4 0 1 0 0 0 0 0 1 4 1 105.694 0 0 0 0 2 12 657 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 4 0 0 0 0 0 1 4 0 4 0 1 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 3 6 5 2 0 0 1 3 0 0 0 0 0 -1.5625 20 14 3 3 0 0 0 2 1 3 6 10 505.646 0 0 0 0 1 25 1261 2 0 0 0 0 1 0 0 2 0 0 4 0 0 2 0 0 2 7 0 0 0 4 4 12 0 6 8 6 0 0 0 11 0 0 0 2 0 7 0 0 11 2 7 0 0 2 7 5 2 0 0 1 1 0 1 0 0 0 -2.4529 19 14 3 2 0 0 1 2.5 0.5 1 7 8 498.768 0 0 0 0.5 2 47 1044 2 0 0 0 0 2 0 0 4 0 1 1 0 0 2 0 0 3 4 0 0 0 5 1 13 0 8 6 5 0 0 0 10 0 0 1 4 0 4 0 0 10 5 4 0 0 2 7 3 1 0 1 1 3 0 0 0 0 0 -2.5043 18 12 3 3 0 0 0 1.5 1.5 3 4 5 471.477 1 0 1 1.5 1 33 711 1 0 0 0 0 3 2 1 5 0 2 2 0 0 2 0 0 0 0 0 0 0 5 4 8 1 5 4 7 2 0 0 11 0 0 3 4 0 0 0 0 11 7 0 0 0 # 1.46 11.76 -17.84