# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1q4x # POINT_FILE ./pocket_res_ptf/1q4x_G24_A_462.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_1q4x_0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0597 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 35 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 2 2 0 2 0 0 0 1 0 0 0 0 0 -0.3947 7 4 2 1 0 0 0 2 0 1 0 5 173.808 0 0 0 0 -1 3 239 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 1 0 0 0 0 0 6 0 1 0 6 1 0 0 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 -1.2447 4 2 0 2 0 0 0 0 0 2 0 2 90.008 0 0 0 0 0 5 113 0 0 0 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 3 8 0 3 0 0 0 1 0 1 0 0 0 -0.177 16 11 3 2 0 0 1 3 0 1 0 10 439.672 0 0 0 0 -2 8 594 3 0 0 0 0 0 0 0 0 4 0 1 0 1 2 0 5 0 0 0 0 0 10 1 5 0 10 5 1 0 0 0 16 0 0 0 0 0 0 0 0 16 0 0 0 0 3 14 1 4 0 0 0 2 0 0 1 0 0 -2.8428 25 18 4 2 1 0 0 4 0 2 1 13 712.54 0 0 0 0 5 27 924 1 0 1 0 0 0 0 0 0 7 0 3 1 3 4 0 5 0 0 0 0 0 16 3 6 0 16 6 3 0 0 0 23 0 0 0 1 0 1 0 0 23 1 1 0 0 3 10 4 3 0 0 0 4 0 0 0 0 0 -2.1686 24 17 3 4 0 0 0 3 0 4 4 9 605.286 0 0 0 0 4 29 715 1 0 3 0 0 0 0 0 2 2 0 1 1 8 4 0 2 0 0 0 0 0 16 1 7 0 16 5 3 0 0 0 19 0 0 0 3 0 2 0 0 19 3 2 0 0 # 12.09 19.19 45.07 Env_1q4x_1 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0337 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 17 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 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 -0.3948 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 115 4 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 1 1 0 0 2 0 0 0 0 0 -2.9243 4 0 2 2 0 0 0 1.5 0.5 2 0 2 71.846 0.333 0 0.333 0.333 -4 9 123 0 1 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 2 1 1 0 2 1 1 0 0 0 3 0 0 0 1 0 0 0 0 3 1 0 0 0 5 7 1 4 2 0 0 2 0 0 1 0 0 -0.3106 22 13 6 2 1 0 0 4.5 1.5 2 0 13 560.833 0.666 0 0.666 0.666 -4 25 739 0 4 1 0 0 0 0 0 0 7 0 0 1 0 5 0 4 0 0 0 0 0 13 4 5 0 13 5 4 0 0 0 21 0 0 0 1 0 0 0 0 21 1 0 0 0 2 14 0 3 0 0 0 2 0 1 0 0 0 -2.5721 22 16 3 3 0 0 1 3 0 2 0 11 618.716 0 0 0 0 1 21 596 0 5 4 0 0 0 0 0 0 5 0 0 1 0 0 0 5 0 0 2 0 0 8 5 9 0 8 9 5 0 0 0 18 0 0 0 4 0 0 0 0 18 4 0 0 0 2 20 0 1 1 0 0 4 0 1 0 0 0 -4.2314 29 22 2 5 0 0 1 1.5 0.5 4 0 10 838.919 0.333 0 0.333 0.333 9 42 781 2 2 2 0 0 0 0 0 0 10 2 0 3 0 0 0 6 0 0 2 0 0 19 2 8 0 19 8 2 0 0 0 24 0 0 1 2 2 0 0 0 24 5 0 0 0 # 12.87 16.75 49.36 Env_1q4x_2 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 29 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 1 138 0 0 1 0 0 0 0 0 0 0 4 0 0 0 0 0 1 0 0 0 0 0 4 0 2 0 4 2 0 0 0 0 0 0 0 5 1 0 0 0 0 0 6 0 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 58 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 2 0 1 0 2 1 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 2 7 0 4 0 0 0 1 0 0 0 0 0 -1.7215 14 9 4 1 0 0 0 4 0 1 0 9 369.632 0 0 0 0 -1 10 254 0 0 3 0 0 0 1 1 0 1 1 0 3 0 0 0 4 0 0 0 0 0 5 1 7 1 5 8 0 1 0 0 1 0 0 8 5 0 0 0 0 1 13 0 0 0 4 10 0 1 2 0 0 2 0 1 0 0 0 -1.4174 20 14 3 3 0 0 1 1.5 1.5 2 0 11 555.499 0.333 0 0.333 0.333 -1 21 321 4 2 2 0 0 0 2 2 0 1 3 0 3 0 0 0 1 0 0 0 0 0 11 4 3 2 11 5 2 2 0 0 3 0 0 9 8 0 0 0 0 3 17 0 0 0 3 15 3 3 1 0 0 6 1 0 1 0 0 -5.7591 33 21 4 7 1 0 0 3.5 0.5 6.5 2 11 863.555 0.999 0.333 0.666 0.999 5 55 694 7 7 2 0 0 0 4 1 0 2 1 0 3 2 0 0 0 0 0 4 0 0 19 11 2 1 19 3 7 4 0 0 12 0 0 9 11 1 0 0 0 12 21 0 0 0 # 19.85 20.56 48.52 Env_1q4x_3 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0237 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 16 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 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 -0.2712 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 71 0 0 0 0 1 0 1 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 4 1 1 0 4 1 0 1 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 1 0 0 0 0 0 1 0 0 1 0 0 -0.8398 3 1 0 1 1 0 0 0 0 1 0 1 71.525 0 0 0 0 1 5 35 0 0 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 2 0 1 0 2 1 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 2 9 2 4 0 0 0 1 0 1 0 1 0 -2.404 20 13 4 2 1 0 1.5 4 0 1 2 9 533.372 0 0 0 0 1 28 199 0 0 0 0 6 0 4 0 0 1 0 0 5 2 0 2 0 0 0 0 0 0 8 4 8 0 8 8 0 4 0 0 20 0 0 0 0 0 0 0 0 20 0 0 0 0 3 8 4 1 0 0 1 3 0 0 1 0 0 -1.0079 21 15 2 3 1 0 0 1.5 0.5 3 5 11 545.098 0.333 0.333 0 0.833 0 26 305 0 0 0 0 1 0 2 3 3 4 0 1 3 2 0 2 0 0 0 0 0 0 9 3 6 3 9 6 4 2 0 0 21 0 0 0 0 0 0 0 0 21 0 0 0 0 5 9 3 2 0 0 1 6 2 0 0 1 0 -5.025 29 17 3 8 1 0 0.5 2.5 0.5 7 4 14 715.373 0.666 0.666 0 1.166 -3 35 337 0 0 0 0 3 0 2 4 3 6 3 1 1 2 0 1 0 0 0 3 0 0 15 3 7 4 15 8 4 2 0 0 29 0 0 0 0 0 0 0 0 29 0 0 0 0 # 9.32 25.15 53.42 Env_1q4x_4 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0024 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 25 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 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 -0.2389 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 181 0 0 0 0 0 0 0 0 1 0 0 0 0 4 0 0 1 0 0 0 0 0 4 0 2 0 4 1 1 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 -1.2495 4 2 0 2 0 0 0 0 0 2 2 2 70.088 0 0 0 0 0 5 138 0 0 0 0 0 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 1 0 3 0 1 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 4 7 3 4 0 0 0 2 0 0 0 0 0 -0.6581 20 14 4 2 0 0 0 4 0 2 3 13 527.709 0 0 0 0 0 18 697 2 0 0 0 0 0 0 0 3 4 0 1 0 5 0 2 3 0 0 0 0 0 11 1 8 0 11 5 4 0 0 0 20 0 0 0 0 0 0 0 0 20 0 0 0 0 2 13 3 2 0 0 0 2 0 1 1 0 0 -2.7025 24 18 2 3 1 0 1 2 0 2 3 11 671.211 0 0 0 0 6 29 989 1 0 0 0 0 0 0 1 1 7 0 3 2 4 0 2 3 0 0 0 0 0 14 3 6 1 14 6 4 0 0 0 21 0 0 2 1 0 0 0 0 21 3 0 0 0 3 12 6 2 0 0 1 3 0 1 0 0 0 -3.4098 28 21 3 4 0 0 1 2.5 0.5 3 7 8 749.884 0 0 0 0.5 7 51 1412 2 0 0 0 0 0 2 1 2 4 2 4 2 5 1 2 1 0 0 0 0 0 16 6 5 1 16 4 6 2 0 0 22 0 0 4 1 0 1 0 0 22 5 1 0 0 # 15.39 21.79 41.28 Env_1q4x_5 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 7 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 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 -0.2472 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 116 0 0 0 0 0 1 0 0 0 0 4 1 0 0 0 0 0 0 0 0 0 0 4 1 1 0 4 1 1 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 -1.2161 4 2 0 2 0 0 0 0 0 2 0 2 90.008 0 0 0 0 0 5 108 0 1 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 2 1 1 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 3 7 2 3 0 0 0 2 0 1 0 0 0 -1.7307 18 12 3 3 0 0 1 3 0 2 2 11 470.698 0 0 0 0 -1 17 556 0 1 1 0 0 3 0 4 0 0 1 3 0 2 0 2 1 0 0 0 0 0 3 4 7 4 3 11 4 0 0 0 15 0 0 0 2 0 1 0 0 15 2 1 0 0 3 13 3 5 0 0 0 2 0 1 0 0 0 -3.6254 27 19 5 3 0 0 1 5 0 2 3 15 726.553 0 0 0 0 3 27 778 1 2 2 0 0 1 0 5 0 0 5 1 0 3 0 1 3 0 0 3 0 0 12 3 7 5 12 12 3 0 0 0 13 0 0 3 8 0 3 0 0 13 11 3 0 0 9 14 4 4 0 0 0 5 1 0 0 0 0 -1.2299 37 27 4 6 0 0 0 4 0 5.5 4 18 970.526 0.666 0.666 0 0.666 2 47 916 2 2 4 3 0 2 0 6 0 0 3 2 0 4 0 3 2 0 0 4 0 0 13 7 11 6 13 17 4 3 0 0 19 0 0 5 8 0 5 0 0 19 13 5 0 0 # 19.38 29.45 43.79 Env_1q4x_6 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 30 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 0 1 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 1 161 0 0 0 0 0 0 0 2 0 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 0 2 4 2 0 0 0 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 0 2 0 0 1 0 0 1 0 0 0 0 0 -1.4894 4 2 1 1 0 0 0 0.5 0.5 1 0 1 102.943 0.333 0 0.333 0.333 0 11 175 0 1 0 0 0 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 1 0 1 2 1 1 0 0 0 1 0 0 0 3 0 0 0 0 1 3 0 0 0 1 4 1 1 1 0 0 3 0 0 0 0 0 -1.7624 11 6 2 3 0 0 0 1.5 0.5 3 0 7 261.177 0.666 0 0.666 0.666 -3 15 358 0 2 0 0 0 0 0 5 0 0 2 1 0 0 0 0 0 0 0 1 0 0 3 3 0 5 3 5 3 0 0 0 5 0 0 0 6 0 0 0 0 5 6 0 0 0 4 11 1 6 1 0 0 1 0 0 0 0 0 -2.0204 24 16 7 1 0 0 0 6 1 1 1 15 646.066 0 0 0 0 -3 22 613 0 3 1 0 0 0 0 3 1 0 4 3 0 0 0 3 0 0 0 6 0 0 10 6 5 3 10 7 7 0 0 0 21 0 0 0 3 0 0 0 0 21 3 0 0 0 3 12 3 1 0 0 1 4 0 1 0 0 0 -2.7713 25 18 2 5 0 0 1 1.5 0.5 4 4 11 674.12 0 0 0 0.5 4 37 823 0 1 3 0 0 1 0 1 2 1 3 3 2 2 0 2 0 0 0 4 0 0 12 4 8 1 12 7 6 0 0 0 24 0 0 0 1 0 0 0 0 24 1 0 0 0 # 13.59 31.25 44.72 Env_1q4x_7 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0237 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 27 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 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 -0.1705 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 110 0 0 0 0 0 0 0 0 0 1 0 0 4 0 0 1 0 0 0 0 0 0 5 0 1 0 5 1 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.1341 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 2 44 0 0 0 0 0 0 0 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 3 10 0 3 0 0 0 2 0 1 1 0 0 -1.8749 20 13 3 3 1 0 1 3 0 2 0 10 544.707 0 0 0 0 1 21 131 0 4 0 0 1 0 2 0 0 4 1 0 3 0 0 4 0 0 0 1 0 0 9 6 5 0 9 5 4 2 0 0 20 0 0 0 0 0 0 0 0 20 0 0 0 0 3 10 0 3 1 0 0 3 0 0 1 0 0 -2.2077 21 13 4 3 1 0 0 3 1 3 0 15 559.623 0 0 0 0 -2 12 145 4 3 0 0 3 0 2 0 0 1 3 0 3 0 0 1 0 0 0 1 0 0 12 5 4 0 12 4 3 2 0 0 21 0 0 0 0 0 0 0 0 21 0 0 0 0 3 14 1 4 1 0 0 3 0 0 0 1 0 -2.8938 27 18 5 3 1 0 0.5 4.5 0.5 3 0 12 732.229 0.666 0 0.666 0.666 1 40 164 5 3 0 0 4 1 1 0 0 4 3 0 3 0 0 0 0 0 0 3 0 0 18 4 5 0 18 5 3 1 0 0 27 0 0 0 0 0 0 0 0 27 0 0 0 0 # 13.4 22.29 53.94