# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3lan # POINT_FILE ./pocket_res_ptf/3lan_KBT_A_561.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_3lan_0 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 37 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 1 0 0 0 0 0 0 1 0 0 0 2 1 0 2 0 0 0 1 0 0 0 0 0 -0.2465 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 309 0 0 0 0 0 0 0 0 0 0 1 0 0 4 1 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 5 0 1 0 0 0 0 6 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 -0.814 4 3 0 1 0 0 0 0 0 1 3 1 85.115 0 0 0 0 2 8 173 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 3 0 1 0 0 0 0 4 0 0 0 2 8 2 2 0 0 0 3 0 0 0 0 0 -1.9253 17 12 2 3 0 0 0 2 0 3 2 10 450.898 0 0 0 0 2 16 1121 0 0 0 0 0 0 1 0 0 0 10 0 0 2 4 0 0 0 0 0 0 0 16 1 0 0 16 0 0 1 0 0 0 0 0 12 0 4 1 0 0 0 16 1 0 0 3 8 1 3 0 0 0 1 0 0 0 0 0 -0.1432 16 12 3 1 0 0 0 3 0 1 1 9 449.036 0 0 0 0 2 15 716 0 0 0 0 0 0 3 0 1 0 3 0 0 1 5 0 0 2 1 0 0 0 9 3 4 0 11 1 1 3 0 0 0 0 0 9 0 5 2 0 0 0 14 2 0 0 2 12 3 3 0 0 1 2 0 0 0 0 0 -3.4845 23 17 4 2 0 0 0 3.5 0.5 2 4 9 639.031 0 0 0 0.5 3 35 1523 0 0 0 0 0 1 6 0 4 0 2 3 0 0 3 0 0 1 2 1 0 0 6 9 8 0 7 3 7 6 0 0 0 0 0 10 0 3 10 0 0 0 13 10 0 0 # 5.7 8.31 23.09 Env_3lan_1 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 26 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 1 161 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 1 0 0 1 0 5 0 1 5 0 0 0 0 0 0 1 0 0 0 5 0 0 0 1 5 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 -1.5178 5 3 0 2 0 0 0 0 0 2 3 2 96.609 0 0 0 0 1 8 176 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 3 1 0 0 2 0 3 0 2 3 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 2 6 2 1 0 0 0 2 0 0 0 0 0 -1.3616 13 10 1 2 0 0 0 1 0 2 2 7 358.247 0 0 0 0 3 15 345 1 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 6 4 0 0 7 0 6 0 7 6 0 0 0 1 0 0 4 1 0 0 7 0 0 1 5 7 0 0 6 9 2 5 0 0 1 4 0 0 0 0 0 -2.122 27 17 6 4 0 0 0 5 1 4 4 19 674.059 0 0 0 0 -5 20 1267 2 0 0 3 0 0 0 3 0 0 5 7 0 0 2 0 0 2 2 1 0 0 10 10 4 3 12 5 7 3 0 5 0 0 7 4 0 2 9 0 0 5 13 9 0 0 6 18 5 4 0 1 1 6 0 1 0 0 0 -3.3813 42 29 6 7 0 0 1 4 2 6 6 20 1102.85 1 0 1 1 3 58 1664 2 0 2 4 0 2 0 4 0 0 6 11 0 0 2 0 0 6 3 0 0 0 10 15 13 4 16 11 11 4 0 6 1 0 4 14 0 3 14 0 0 7 21 14 0 0 # 2.53 17 11.56 Env_3lan_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 21 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 2 0 2 0 0 0 1 0 0 0 0 0 -0.0225 7 4 2 1 0 0 0 2 0 1 0 5 173.808 0 0 0 0 -1 3 192 0 0 0 0 0 0 1 0 1 0 5 0 0 0 0 0 0 0 0 0 0 0 5 1 1 0 5 0 1 1 0 0 0 0 0 6 0 0 1 0 0 0 6 1 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.5618 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 3 107 0 0 0 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 2 1 0 0 2 0 0 1 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 2 7 2 2 0 0 0 2 0 1 0 0 0 -1.9005 16 11 2 3 0 0 1 2 0 2 2 9 417.109 0 0 0 0 -1 17 558 0 0 0 0 0 0 3 0 6 0 1 1 0 2 0 0 0 2 1 0 0 0 3 4 9 0 5 1 7 3 0 0 0 0 0 8 0 0 8 0 0 0 8 8 0 0 5 8 6 4 0 0 2 2 0 0 0 0 0 -1.3039 27 19 6 2 0 0 0 5 1 2 9 14 684.193 0 0 0 1 1 36 983 0 0 0 0 0 0 1 0 3 0 2 1 0 4 4 0 2 3 7 0 0 0 10 2 15 0 13 9 4 1 0 0 0 0 0 16 0 4 7 0 0 0 20 7 0 0 4 18 9 5 0 0 0 3 2 0 0 0 0 -4.6925 41 31 5 5 0 0 0 5 0 4 9 16 1084.54 0.999 0.999 0 0.999 9 61 1787 0 0 0 1 0 0 3 0 0 0 6 3 0 2 11 0 4 7 4 0 0 0 19 7 15 0 26 8 3 4 0 3 0 0 0 24 0 9 5 0 0 3 33 5 0 0 # 3.3 11.77 20.15 Env_3lan_3 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 65 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 0 0 1 0 0 0 0 1 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 1 358 0 0 0 0 0 0 0 1 0 0 4 1 0 0 0 0 0 0 0 0 0 0 4 1 0 1 4 1 1 0 0 1 0 0 1 0 0 0 4 0 0 1 1 4 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 5 139 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 1 0 0 0 0 0 0 2 0 0 1 0 2 0 0 3 4 1 2 0 0 0 3 0 0 0 0 0 -2.0227 13 8 2 3 0 0 0 2 0 3 1 9 334.139 0 0 0 0 -2 10 474 2 0 1 0 0 0 0 2 0 0 1 4 0 0 2 0 0 0 1 0 0 0 5 4 2 2 5 4 4 0 0 7 0 0 4 0 0 0 2 0 0 7 4 2 0 0 4 9 4 3 0 0 0 2 0 0 0 0 0 -0.8064 22 17 3 2 0 0 0 3 0 2 5 12 569.367 0 0 0 0 3 25 783 2 0 1 0 0 0 0 0 2 0 0 4 0 0 1 0 0 0 12 0 0 0 3 4 15 0 3 13 6 0 0 4 0 0 8 0 0 0 10 0 0 4 8 10 0 0 2 9 5 3 0 2 1 5 1 1 0 0 0 -6.9264 29 16 6 7 0 0 1 3 3 5.5 6 10 719.989 2.333 0.333 2 2.333 1 57 1043 1 0 2 0 0 0 1 0 2 2 0 7 0 0 3 0 0 2 8 1 0 0 7 8 14 0 9 10 9 1 0 5 4 0 5 0 0 0 15 0 0 9 5 15 0 0 # 7.96 17.75 13.36 Env_3lan_4 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 66 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 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 0.0938 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 297 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 4 0 0 4 0 2 0 4 2 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 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 4 154 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 3 0 0 3 0 1 0 3 1 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 5 1 2 0 0 1 1 0 1 0 0 0 -0.5088 13 8 3 2 0 0 1 2.5 0.5 1 2 8 338.595 0 0 0 0.5 -5 12 162 0 0 0 0 0 0 0 2 2 0 0 0 0 0 0 3 5 0 0 1 0 0 1 0 10 2 1 10 2 0 0 0 2 0 0 11 0 0 0 0 0 2 11 0 0 0 2 5 4 3 0 0 1 2 0 1 0 0 0 -2.6051 18 11 4 3 0 0 1 3.5 0.5 2 5 8 431.405 0 0 0 0.5 -1 25 553 0 0 0 0 0 0 0 1 3 0 0 4 0 2 0 3 1 0 0 4 0 0 6 4 7 1 6 5 7 0 0 0 3 0 0 11 0 2 2 0 0 3 13 2 0 0 3 16 2 1 0 0 0 4 0 1 0 0 0 -2.5258 27 21 1 5 0 0 1 1 0 4 2 13 767.002 0 0 0 0 5 28 965 0 0 0 0 0 0 0 1 1 2 0 6 0 2 2 4 0 0 4 5 0 0 11 6 9 1 11 9 7 0 0 0 3 0 0 16 0 4 4 0 0 3 20 4 0 0 # 11.2 6.42 14.55 Env_3lan_5 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 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 1 221 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 4 1 0 0 2 0 4 0 2 4 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 -1.5178 5 3 0 2 0 0 0 0 0 2 3 2 96.609 0 0 0 0 1 8 178 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 3 0 0 0 1 0 4 0 1 4 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 2 6 2 2 0 0 0 1 0 0 0 0 0 -1.0302 13 10 2 1 0 0 0 2 0 1 2 8 360.89 0 0 0 0 2 12 220 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 1 0 4 5 0 0 8 0 5 0 8 5 0 0 0 0 0 0 0 13 0 0 0 0 0 0 13 0 0 0 5 13 2 4 0 0 0 4 0 0 0 0 0 -2.2515 28 20 4 4 0 0 0 4 0 4 3 15 739.873 0 0 0 0 4 29 434 0 0 0 2 0 0 0 1 0 4 6 0 0 0 0 0 2 0 6 7 0 0 17 2 8 1 17 9 0 2 0 0 0 0 0 28 0 0 0 0 0 0 28 0 0 0 5 16 3 3 0 0 0 2 0 1 0 0 0 -2.0216 30 24 3 3 0 0 1 3 0 2 3 14 852.898 0.333 0.333 0 0.333 7 39 752 0 0 0 3 0 3 0 1 0 3 5 0 0 1 0 0 2 0 4 8 0 0 17 3 9 1 17 10 0 3 0 0 0 0 0 30 0 0 0 0 0 0 30 0 0 0 # 15.11 10.38 18.94