# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3ln1 # POINT_FILE ./pocket_res_ptf/3ln1_CEL_A_682.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_3ln1_0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0249 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 18 0 0 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 1 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 1 0 0 0 -0.6476 7 3 2 2 0 0 1 2 0 1 0 5 157.455 0 0 0 0 -4 3 148 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 5 0 0 0 0 0 0 1 0 5 1 1 6 0 0 0 0 6 0 0 0 1 0 0 0 0 6 1 0 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 53 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 2 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 5 3 5 2 0 0 0 2 0 0 0 0 0 -0.2928 17 13 2 2 0 0 0 2 0 2 6 10 433.074 0 0 0 0 2 22 540 0 0 0 0 0 2 0 2 2 0 3 0 0 0 0 0 0 0 7 1 0 0 4 0 11 2 4 11 2 0 0 0 8 0 0 0 2 0 7 0 0 8 2 7 0 0 1 8 1 4 0 0 1 2 0 1 0 0 0 -4.795 18 10 5 3 0 0 1 4.5 0.5 2 2 7 453.036 0 0 0 0.5 -4 36 570 0 0 0 0 0 6 0 1 4 0 2 0 0 0 0 0 0 0 3 2 0 0 4 0 13 1 4 10 4 0 0 0 10 0 0 0 4 0 4 0 0 10 4 4 0 0 3 13 6 2 0 0 0 2 0 0 0 0 0 -1.8906 26 22 2 2 0 0 0 2 0 2 6 6 721.733 0 0 0 0 11 46 674 0 0 0 0 0 4 0 0 6 1 3 0 0 2 0 0 1 0 4 5 0 0 11 0 15 0 11 9 6 0 0 0 17 0 0 0 2 4 3 0 0 17 6 3 0 0 # 28.68 -23.23 -20.33 Env_3ln1_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 23 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 -0.2263 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 107 4 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 5 0 0 1 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 -1.1166 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -2 1 46 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 2 0 0 1 2 1 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 3 5 0 3 0 0 0 1 0 0 0 0 0 0.1411 12 8 3 1 0 0 0 3 0 1 0 9 321.985 0 0 0 0 -2 4 122 0 0 0 0 0 0 0 2 0 0 2 0 0 1 4 2 0 0 0 1 0 0 8 0 2 2 8 4 0 0 0 0 12 0 0 0 0 0 0 0 0 12 0 0 0 0 3 13 1 3 3 0 0 3 0 1 0 0 0 -4.0565 27 17 6 4 0 0 1 4 2 3 0 15 720.226 0.999 0 0.999 0.999 -4 37 613 0 6 0 0 0 0 4 0 0 0 7 0 1 3 1 3 0 0 0 2 0 0 14 10 3 0 14 3 6 4 0 0 27 0 0 0 0 0 0 0 0 27 0 0 0 0 3 8 5 2 0 0 0 2 2 0 0 0 0 -3.1794 22 16 2 4 0 0 0 2 0 3 5 6 561.878 0.999 0.999 0 0.999 7 41 432 0 1 0 0 0 0 4 0 0 0 3 1 1 6 0 1 0 0 0 5 0 0 15 6 1 0 15 1 2 4 0 0 22 0 0 0 0 0 0 0 0 22 0 0 0 0 # 34.89 -20.77 -13.45 Env_3ln1_2 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0874 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 0 0 0 0 0 0 0 0 0 1 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 0.0938 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 157 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 4 0 0 4 0 2 0 4 2 0 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 -1.7742 4 2 0 2 0 0 0 0 0 2 0 2 90.008 0 0 0 0 0 4 60 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 0 0 3 0 1 0 3 1 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 4 8 2 4 0 0 0 2 0 0 0 0 0 -1.6847 20 14 4 2 0 0 0 4 0 2 2 13 528.756 0 0 0 0 1 14 346 0 0 0 2 0 3 0 0 1 2 5 0 0 0 0 1 0 0 5 1 0 0 8 2 10 0 8 9 1 2 0 0 17 0 0 0 2 0 1 0 0 17 2 1 0 0 4 10 2 3 0 0 0 1 0 1 0 0 0 -1.4075 21 16 3 2 0 0 1 3 0 1 3 12 580.313 0 0 0 0 1 23 404 0 0 0 2 0 1 2 0 3 2 3 0 0 0 0 3 0 0 3 2 0 0 7 4 10 0 7 7 3 4 0 0 19 0 0 0 2 0 0 0 0 19 2 0 0 0 3 11 8 3 0 0 0 5 0 3 0 0 0 -6.084 33 22 3 8 0 0 3 3 0 5 8 9 824.079 0 0 0 0 5 71 510 0 0 0 1 0 4 2 1 3 5 5 0 0 5 0 2 0 0 3 2 0 0 17 3 12 1 17 10 3 3 0 0 25 0 0 0 3 2 3 0 0 25 5 3 0 0 # 32.8 -27.27 -19.32 Env_3ln1_3 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 35 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 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 1 230 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 5 1 0 5 1 0 0 0 0 0 0 0 1 1 4 0 0 0 2 4 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 5 125 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 1 0 0 0 1 0 2 0 0 1 1 2 0 0 3 7 3 4 0 0 0 2 0 1 0 0 0 -3.1164 20 13 4 3 0 0 1 4 0 2 3 11 521.648 0 0 0 0 -1 22 579 0 0 0 0 0 1 0 2 3 0 2 0 0 2 0 4 3 0 3 0 0 0 4 0 14 2 4 13 3 0 0 0 7 0 0 0 5 5 3 0 0 7 10 3 0 0 4 7 2 1 0 0 1 3 0 0 0 0 0 -0.3318 18 13 2 3 0 0 0 1.5 0.5 3 4 8 452.604 0 0 0 0.5 -2 27 522 0 0 0 0 0 3 0 0 4 0 3 0 0 3 0 2 2 0 1 0 0 0 6 0 12 0 6 8 4 0 0 0 8 0 0 0 2 7 1 0 0 8 9 1 0 0 4 8 9 5 0 0 3 6 0 2 0 0 0 -6.408 37 21 8 8 0 0 2 6 2 6 12 17 852.741 0 0 0 1 -6 62 1273 0 0 0 0 0 4 0 0 10 2 8 2 0 2 0 0 2 5 1 1 0 0 13 2 22 0 18 7 12 0 0 0 23 0 0 0 2 5 7 0 0 23 7 7 0 0 # 28.51 -21.25 -25.02 Env_3ln1_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 17 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 0 0 0 0 0 1 0 0 0 0 1 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 68 0 0 0 0 0 0 0 1 0 1 0 0 0 4 0 0 0 0 0 0 0 0 5 0 0 1 5 1 0 0 0 0 0 0 1 0 0 5 0 0 0 0 6 0 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 -0.6816 3 2 0 1 0 0 0 0 0 1 2 1 58.594 0 0 0 0 1 5 34 0 0 0 0 0 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 2 7 3 2 0 0 0 2 0 0 0 0 0 -1.6282 16 12 2 2 0 0 0 2 0 2 3 9 432.415 0 0 0 0 3 16 79 5 0 0 0 0 0 0 3 0 4 0 0 1 3 0 0 0 0 0 0 0 0 13 0 0 3 13 3 0 0 0 0 1 0 3 0 0 10 2 0 0 1 13 2 0 0 3 14 1 5 0 0 0 2 0 0 0 0 0 -2.1596 25 18 5 2 0 0 0 5 0 2 1 13 689.864 0 0 0 0 4 27 309 3 2 0 0 0 1 1 0 0 1 1 0 3 1 5 0 0 0 0 7 0 0 21 3 1 0 21 1 2 1 0 0 7 0 5 0 1 10 2 0 0 7 16 2 0 0 9 13 1 4 4 0 0 8 2 0 1 0 0 -4.3039 42 23 8 10 1 0 0 5 3 9 0 22 1025.25 1.998 0.999 0.999 1.998 -10 61 891 2 13 0 1 0 1 8 1 0 1 2 2 4 0 2 0 1 0 0 4 0 0 15 24 2 1 15 3 15 9 0 0 11 0 2 0 1 18 10 0 0 11 21 10 0 0 # 23.32 -22.55 -12.6 Env_3ln1_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 23 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 -0.3149 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 136 0 0 0 0 0 0 0 0 1 0 4 0 0 0 0 1 0 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 2 0 0 0 0 0 2 0 0 0 0 0 -1.1947 4 2 0 2 0 0 0 0 0 2 0 2 90.008 0 0 0 0 0 5 102 0 0 0 0 0 0 0 0 1 0 2 0 0 0 0 0 0 0 0 1 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 6 2 3 0 0 1 2 0 0 0 0 0 -1.1123 18 12 4 2 0 0 0 3.5 0.5 2 3 10 465.539 0 0 0 0.5 -4 21 488 0 0 0 0 0 4 0 1 6 0 1 0 0 0 0 3 0 0 1 2 0 0 3 0 14 1 3 9 6 0 0 0 15 0 0 0 3 0 0 0 0 15 3 0 0 0 1 6 4 2 0 0 1 2 0 2 0 0 0 -3.9809 18 11 3 4 0 0 2 2.5 0.5 2 5 6 440.367 0 0 0 0.5 0 35 390 0 0 0 0 0 4 0 1 2 1 0 0 0 3 0 3 0 0 1 3 0 0 7 0 10 1 7 9 2 0 0 0 12 0 1 0 3 2 0 0 0 12 6 0 0 0 2 10 13 3 0 0 0 1 1 0 0 0 0 -3.2003 30 25 3 2 0 0 0 3 0 1.5 13 7 797.109 0.333 0.333 0 0.333 16 61 394 0 0 0 3 0 3 0 1 0 4 0 0 0 8 0 1 0 1 8 1 0 0 13 3 13 1 14 13 0 3 0 0 14 0 1 0 4 8 3 0 0 14 13 3 0 0 # 27.96 -26.66 -18.89 Env_3ln1_6 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0874 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 31 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 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 -0.0069 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 152 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 4 0 0 5 1 0 0 5 0 0 1 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 -1.2063 3 2 0 1 0 0 0 0 0 1 0 1 78.514 0 0 0 0 1 4 66 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 2 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 6 0 4 0 0 0 3 1 0 0 0 0 -2.4459 17 9 4 4 0 0 0 4 0 3.5 0 13 406.757 0.333 0.333 0 0.333 -5 8 188 1 0 0 0 0 0 6 3 0 0 1 0 4 0 0 0 2 0 0 0 0 0 6 6 2 3 6 5 0 6 0 0 16 0 1 0 0 0 0 0 0 16 1 0 0 0 4 8 4 2 2 0 0 1 1 0 0 0 0 -1.2676 22 16 4 2 0 0 0 3 1 1.5 3 10 586.152 1.665 0.666 0.999 1.665 1 38 317 2 3 0 0 0 0 6 2 0 0 3 0 0 4 0 0 2 0 0 0 0 0 9 9 2 2 9 4 3 6 0 0 15 0 1 0 0 6 0 0 0 15 7 0 0 0 2 14 3 2 3 0 0 3 1 0 1 0 0 -5.0941 29 19 5 4 1 0 0 2.5 2.5 3.5 2 9 778.782 0.999 0.333 0.666 0.999 3 61 293 1 5 0 0 0 0 3 3 0 0 7 0 1 5 2 0 2 0 0 0 0 0 16 8 2 3 16 5 5 3 0 0 17 0 2 0 0 9 1 0 0 17 11 1 0 0 # 29.43 -19.6 -12.5