# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1j4h # POINT_FILE ../DUDE/pocket_res_ptf_tian/1j4h_SUB_A_201.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_1j4h_0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 # 0 0 0 # TYR Env_1j4h_1 1 0 0 0 0 0 0 0 2 0 0 0 0 -0.8035 3 1 0 2 0 0 0 0 0 1 0 0 48.853 0.999 0.999 0 0.999 -2 8 147 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 49 0 0 0 1 0 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 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 1 0 1 2 0 0 0 0 1 0 0 0 -2.1241 6 2 3 1 0 0 1 2 1 0 0 3 147.172 0.666 0 0.666 0.666 -4 18 377 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 4 2 0 0 2 2 2 0 0 0 0 0 4 2 0 0 0 0 0 6 0 0 0 3 1 2 1 0 0 0 3 0 0 0 0 0 -0.1683 10 6 1 3 0 0 0 1 0 3 2 7 216.828 0.333 0 0.333 0.333 -3 14 391 0 1 0 2 0 0 0 0 0 0 0 0 0 2 0 3 0 0 2 0 0 0 2 3 5 0 2 5 1 2 0 0 0 0 0 9 1 0 0 0 0 0 10 0 0 0 0 4 4 1 1 0 0 0 0 0 0 0 0 -1.496 10 8 2 0 0 0 0 1 1 0 4 2 274.84 0 0 0 0 3 25 487 0 2 0 0 0 0 0 0 0 1 0 0 0 2 0 3 0 0 2 0 0 0 3 2 5 0 3 5 2 0 0 0 0 0 0 5 5 0 0 0 0 0 10 0 0 0 3 8 5 2 0 0 0 2 0 1 0 0 0 -1.1614 21 16 2 3 0 0 1 2 0 2 5 10 557.75 0 0 0 0 4 26 731 0 1 0 0 0 0 0 3 0 1 0 1 0 6 0 3 2 0 4 0 0 0 7 2 9 3 7 12 2 0 0 0 0 0 0 17 4 0 0 0 0 0 21 0 0 0 # -38.9567 31.79 30.3433 # ASP Env_1j4h_2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 78 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 -0.376 2 1 1 0 0 0 0 0 1 0 1 0 54.089 0 0 0 0 0 5 22 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 0 1 0 2 0 0 0 0 0 1 0 0 1 0 0 0 0 0 1 1 0 0 0 1 4 4 1 0 0 0 2 0 0 0 0 0 -1.551 12 9 1 2 0 0 0 1 0 2 4 6 304.817 0 0 0 0 1 21 178 0 0 0 0 0 0 0 1 0 1 1 0 0 3 0 0 1 3 0 2 0 0 7 0 4 1 10 2 0 0 0 0 3 0 0 9 0 0 0 0 0 3 9 0 0 0 4 10 8 4 0 0 0 4 0 0 0 0 0 -3.337 30 22 4 4 0 0 0 4 0 4 8 14 766.006 0 0 0 0 8 44 482 0 0 0 1 0 0 0 2 0 3 7 0 2 4 0 0 1 3 4 3 0 0 19 1 8 2 22 7 0 1 0 0 3 0 0 25 0 0 2 0 0 3 25 2 0 0 5 18 8 5 0 0 0 3 0 1 0 0 0 -3.6286 40 31 5 4 0 0 1 5 0 3 9 18 1086.35 0 0 0 0 11 63 833 0 0 0 4 0 0 0 1 0 4 7 0 4 3 0 0 2 5 7 3 0 0 21 4 14 1 26 10 0 4 0 0 5 0 1 33 1 0 0 0 0 5 35 0 0 0 # -40.295 39.7317 26.8867 # PHE Env_1j4h_3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 426 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.3821 2 1 1 0 0 0 0 1 0 0 0 1 47.647 0 0 0 0 0 1 176 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 1 1 0 0 1 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 3 3 1 0 0 0 2 0 0 0 0 0 -1.0748 11 8 1 2 0 0 0 1 0 2 3 7 284.238 0 0 0 0 1 13 569 0 0 0 0 0 0 0 0 0 0 0 3 0 6 0 0 0 1 1 0 0 0 6 3 2 0 7 1 3 0 0 0 1 0 0 10 0 0 0 0 0 1 10 0 0 0 2 4 6 1 0 0 0 0 0 1 0 0 0 -1.6725 14 12 1 1 0 0 1 1 0 0 7 3 372.607 0 0 0 0 7 40 359 0 0 0 0 0 0 0 0 0 0 0 1 0 4 1 0 0 3 3 2 0 0 7 1 6 0 10 3 1 0 0 0 3 0 0 9 0 1 1 0 0 3 10 1 0 0 2 8 8 1 1 0 0 5 1 0 0 0 0 -4.011 26 18 2 6 0 0 0 1.5 0.5 5.5 8 10 639.615 0.666 0.333 0.333 0.666 4 46 655 0 1 0 0 1 0 2 0 0 0 0 1 0 5 1 1 0 2 4 8 0 0 14 4 8 0 16 6 2 2 0 0 2 0 0 17 2 2 3 0 0 2 21 3 0 0 # -40.2983 37.685 36.5083 # PHE Env_1j4h_4 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.8541 3 1 1 1 0 0 0 1 0 1 0 0 56.502 0 0 0 0 -2 11 441 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0644 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 147 0 0 0 0 0 1 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 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0035 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 147 0 0 0 0 0 1 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 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.2447 6 3 1 2 0 0 0 1 0 2 0 6 137.655 0 0 0 0 -3 0 584 0 0 0 0 0 2 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 2 2 0 4 2 0 0 0 0 0 0 0 2 2 2 0 0 0 4 2 0 0 2 2 0 1 2 0 0 1 2 0 0 0 0 -3.1409 10 4 3 3 0 0 0 2 1 2 0 5 223.872 1.665 0.999 0.666 1.665 -6 23 1000 0 2 0 0 0 2 3 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 7 2 1 0 3 4 3 0 0 3 0 0 0 3 2 2 0 0 3 5 2 0 0 0 3 1 2 0 0 0 0 0 0 0 0 0 -0.1014 6 4 2 0 0 0 0 2 0 0 0 2 149.383 0.333 0 0.333 0.333 1 10 577 0 1 0 0 0 0 2 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 5 0 1 0 1 3 2 0 0 1 0 0 0 2 2 1 0 0 1 4 1 0 0 # -32.0933 51.1333 38.3533 # GLN Env_1j4h_5 0 0 1 0 0 0 0 0 0 0 0 0 0 0.8076 1 1 0 0 0 0 0 0 0 0 0 0 20.579 0.333 0 0.333 0.333 0 5 130 0 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 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 3 0 0 0 0 0 0 0 0 -2.2062 4 1 3 0 0 0 0 1 2 0 0 0 102.947 0.666 0 0.666 0.666 -3 19 520 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 1 0 0 0 0 0 0 1 1 0 0 0 -1.015 4 2 0 2 0 0 1 0 0 0.5 1 0 85.383 0.333 0.333 0 0.333 -1 17 279 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 2 0 0 2 1 1 0 2 2 0 0 0 0 0 0 0 0 4 0 0 0 0 1 1 4 0 0 0 0 0 0 0 0 0 0 -0.0442 6 6 0 0 0 0 0 0 0 0 4 0 160.173 0.333 0.333 0 0.333 5 18 355 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 2 4 0 0 4 1 1 0 4 2 0 0 0 0 0 0 0 0 6 0 0 0 0 0 2 1 0 0 0 0 1 1 0 0 0 0 -1.6517 5 3 0 2 0 0 0 0 0 1.5 1 2 113.23 0.333 0.333 0 0.333 0 8 426 0 1 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 4 1 0 0 1 1 3 0 2 3 0 0 0 0 0 0 0 0 5 0 0 0 0 3 4 0 3 0 0 0 1 1 0 0 0 0 -0.4857 12 7 3 2 0 0 0 3 0 1.5 0 8 289.681 0.666 0.666 0 0.666 -3 7 960 0 3 0 3 0 0 1 2 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 7 3 2 0 5 3 4 0 6 5 0 0 0 0 0 1 0 0 11 0 1 0 0 # -34.51 54.49 28.54 # ARG Env_1j4h_6 0 0 1 0 0 0 2 0 0 0 0 0 0 -0.6593 3 1 2 0 0 0 0 1 1 0 3 0 61.237 0 0 0 1 -2 11 276 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 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 3 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 -0.0338 2 2 0 0 0 0 0 0 0 0 2 0 47.1 0 0 0 0 0 5 184 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0074 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 92 0 0 0 0 0 0 0 0 1 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 1 0 0 0 1 1 1 1 0 0 0 2 0 0 0 0 0 -1.0923 6 3 1 2 0 0 0 1 0 2 1 5 130.666 0 0 0 0 -2 4 569 0 0 0 0 0 0 0 0 3 0 0 0 0 0 2 0 0 0 1 0 0 0 2 0 4 0 2 1 3 0 0 0 0 0 3 0 3 0 0 0 0 0 6 0 0 0 3 3 3 1 0 0 0 1 0 1 0 0 0 -0.7851 12 9 1 2 0 0 1 1 0 1 4 5 304.538 0 0 0 0 1 23 907 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 0 0 0 5 0 0 0 4 0 6 2 4 7 1 0 0 0 0 0 1 0 9 0 2 0 0 0 10 2 0 0 2 11 1 3 0 0 0 1 0 0 0 0 0 -0.8323 18 14 3 1 0 0 0 3 0 1 1 10 516.056 0 0 0 0 4 14 1027 0 0 0 0 0 0 0 4 0 10 0 0 0 0 2 0 0 0 2 0 0 0 12 0 2 4 12 6 0 0 0 0 0 0 6 0 11 0 1 0 0 0 17 1 0 0 # -29.365 36.445 30.305 # HIS Env_1j4h_7 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 20 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 0 0 0 0 0 0 1 0 0 0 0 1 0 0 1 3 0 1 0 0 0 0 0 0 0 0 0 -0.2414 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 4 100 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 1 1 0 1 0 0 0 2 0 0 0 0 0 -0.9524 5 2 1 2 0 0 0 1 0 2 0 4 104.145 0 0 0 0 -2 3 232 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 1 1 0 0 3 1 1 0 3 1 1 0 0 1 1 0 0 0 0 1 2 0 0 2 1 2 0 0 4 4 0 3 0 0 0 2 0 1 0 0 0 -1.1894 14 8 3 3 0 0 1 3 0 2 1 11 337.705 0 0 0 0 -5 12 617 5 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 3 2 0 0 7 2 4 1 8 4 2 0 0 1 4 0 0 0 7 2 0 0 0 5 9 0 0 0 1 10 7 2 0 0 0 1 0 0 0 0 0 -2.8568 21 18 2 1 0 0 0 2 0 1 7 7 582.141 0 0 0 0 10 34 892 0 2 0 0 0 0 0 2 0 2 1 0 0 0 0 0 0 4 7 3 0 0 6 2 11 2 10 9 2 0 0 1 8 0 0 3 6 3 0 0 0 9 12 0 0 0 2 11 4 2 0 0 1 4 0 0 0 0 0 -2.2239 24 17 3 4 0 0 0 2 1 4 5 10 624.659 0 0 0 0 5 34 890 0 1 0 1 0 0 6 1 0 2 1 0 0 2 1 0 0 4 4 1 0 0 7 8 8 1 11 5 1 7 0 4 10 0 0 5 2 1 2 0 0 14 8 2 0 0 # -34.97 44.42 29.85 # ILE Env_1j4h_8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 12 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 -0.6021 2 1 0 1 0 0 0 0 0 1 0 1 45.004 0 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 1 5 2 2 0 0 0 1 0 0 0 1 0 -2.0149 12 8 2 1 1 0 0.5 2 0 1 2 5 320.391 0 0 0 0 1 17 153 0 0 0 0 3 0 0 0 0 0 0 0 1 3 0 0 0 2 0 3 0 0 7 0 5 0 9 3 0 0 0 0 2 0 0 7 0 3 0 0 0 2 10 0 0 0 4 17 6 4 0 0 0 3 1 0 0 0 0 -3.7816 35 27 4 4 0 0 0 4 0 3.5 6 17 956.119 0.333 0.333 0 0.333 9 47 1111 0 0 0 0 3 0 5 0 0 0 5 3 3 3 0 0 0 6 0 7 0 0 18 8 9 0 24 3 3 5 0 0 12 0 0 14 5 2 2 0 0 12 21 2 0 0 9 13 6 6 0 0 0 6 1 0 0 0 0 -2.5145 41 28 6 7 0 0 0 6 0 6.5 6 24 1026.52 0.999 0.999 0 0.999 -1 44 1668 0 0 0 0 0 1 11 1 0 0 3 2 1 5 0 0 4 4 0 9 0 0 18 13 9 1 22 6 2 11 0 0 11 0 0 18 3 3 6 0 0 11 24 6 0 0 # -41.5617 43.6117 36.8917 # PHE Env_1j4h_9 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 0 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 55 0 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 1 3 1 4 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 -1.2613 3 1 0 2 0 0 0 0 0 2 1 2 49.509 0 0 0 0 -1 3 58 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 1 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 3 8 11 2 0 0 0 2 0 0 0 0 0 -1.5609 26 22 2 2 0 0 0 2 0 2 11 10 699.719 0 0 0 0 11 45 845 0 0 0 3 0 0 0 0 0 0 0 0 5 12 0 0 4 0 1 1 0 0 18 3 5 0 18 5 0 3 0 0 0 0 0 26 0 0 0 0 0 0 26 0 0 0 4 9 3 6 0 0 0 2 0 1 1 0 0 -2.9871 26 16 6 3 1 0 1 6 0 2 3 16 660.739 0 0 0 0 0 24 1196 0 0 0 3 0 0 0 0 0 0 1 4 2 7 0 1 1 0 5 2 0 0 12 7 7 0 12 7 4 3 0 0 0 0 0 24 0 0 2 0 0 0 24 2 0 0 5 16 4 1 0 0 1 4 1 1 0 0 0 -2.8015 33 25 2 6 0 0 1 1 1 4.5 6 13 889.976 0.666 0.666 0 0.666 5 56 1166 0 0 0 6 0 0 0 0 0 0 7 5 0 2 0 2 0 3 5 3 0 0 12 11 10 0 15 7 5 6 0 0 3 0 0 28 0 0 2 0 0 3 28 2 0 0 # -41.34 36 25.35 # GLY Env_1j4h_10 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 306 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 -0.6021 2 1 0 1 0 0 0 0 0 1 0 1 45.004 0 0 0 0 0 1 51 0 0 0 0 0 0 0 1 0 0 0 0 0 1 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 3 10 0 4 0 0 0 1 0 0 0 0 0 -0.8977 18 13 4 1 0 0 0 4 0 1 0 11 503.672 0 0 0 0 2 16 701 0 0 0 2 0 0 0 2 0 4 3 0 3 4 0 0 0 0 0 0 0 0 14 2 0 2 14 2 0 2 0 0 0 0 2 11 2 0 3 0 0 0 15 3 0 0 3 11 2 1 0 0 0 5 0 0 0 0 0 -3.3469 22 16 1 5 0 0 0 1 0 5 2 12 593.789 0 0 0 0 4 24 1186 0 0 0 3 0 0 0 1 0 5 5 4 2 2 0 0 0 0 0 0 0 0 14 7 0 1 14 1 4 3 0 0 0 0 1 13 4 0 4 0 0 0 18 4 0 0 5 9 7 4 0 0 0 3 2 0 0 0 0 -2.8819 30 21 4 5 0 0 0 4 0 4 7 14 755.218 0.999 0.999 0 0.999 4 41 1176 0 0 0 3 0 0 0 0 0 4 5 4 1 4 0 1 2 0 3 3 0 0 17 7 6 0 17 6 4 3 0 0 0 0 3 22 2 0 3 0 0 0 27 3 0 0 # -37.315 34.8067 24.6517 # PHE Env_1j4h_11 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 10 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 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 4 0 1 0 0 0 0 0 0 0 0 0 -0.9045 5 4 1 0 0 0 0 1 0 0 0 2 148.177 0 0 0 0 2 7 50 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 5 0 0 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0.3718 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 166 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 2 0 1 0 1 0 0 0 3 1 0 0 2 9 3 1 0 0 0 3 0 0 0 0 0 -2.6593 18 14 1 3 0 0 0 1 0 3 3 10 490.85 0 0 0 0 3 19 1187 0 0 0 0 0 0 0 2 5 3 2 0 0 0 3 0 0 0 3 0 0 0 8 0 8 2 8 5 5 0 0 0 0 0 5 1 6 0 6 0 0 0 12 6 0 0 2 10 6 3 0 0 0 1 0 0 0 0 0 -1.63 22 18 3 1 0 0 0 3 0 1 7 5 596.278 0 0 0 0 10 44 1218 1 0 0 0 0 0 0 2 2 3 4 0 0 3 4 0 0 0 3 0 0 0 15 0 5 2 15 5 2 0 0 0 0 0 2 5 7 0 8 0 0 0 14 8 0 0 6 12 5 4 0 0 2 6 0 1 0 0 0 -3.5555 36 23 6 7 0 0 1 5 1 6 7 21 907.228 0 0 0 1 -4 38 2496 5 0 0 0 0 0 0 4 3 1 2 0 0 4 9 0 2 0 6 0 0 0 21 0 11 4 21 12 3 0 0 0 0 0 3 5 23 0 5 0 0 0 31 5 0 0 # -31.78 37.09 23.99 # ILE Env_1j4h_12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 54 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 6 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 -0.647 3 2 1 0 0 0 0 0 1 0 3 0 67.679 0 0 0 0 0 9 27 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 6 5 0 0 0 0 0 0 0 0 0 0 -1.9545 11 11 0 0 0 0 0 0 0 0 5 0 327.723 0 0 0 0 11 26 231 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 1 3 4 0 0 7 0 4 0 8 3 0 0 0 0 2 0 0 9 0 0 0 0 0 2 9 0 0 0 2 9 14 1 0 0 0 1 0 0 0 0 0 -2.2609 27 25 1 1 0 0 0 1 0 1 15 4 734.778 0 0 0 0 20 67 451 0 0 0 0 0 0 0 0 0 0 1 0 0 12 0 0 0 4 4 6 0 0 19 0 8 0 23 4 0 0 0 0 4 0 0 20 0 3 0 0 0 4 23 0 0 0 6 15 4 5 0 0 0 5 0 1 0 0 0 -3.0335 36 25 5 6 0 0 1 5 0 5 4 22 955.106 0 0 0 0 2 36 671 0 0 0 2 0 0 1 2 2 5 2 0 0 8 0 0 0 0 4 10 0 0 25 3 6 2 25 6 2 3 0 0 7 0 0 23 0 2 4 0 0 7 25 4 0 0 # -41.745 40.9917 31.9517 # TRP Env_1j4h_13 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 # 0 0 0 # TYR Env_1j4h_14 1 0 0 0 0 0 0 0 2 0 0 0 0 -0.832 3 1 0 2 0 0 0 0 0 1 0 0 48.853 0.999 0.999 0 0.999 -2 11 297 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 99 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 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.056 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 99 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 0 0 0 1 0 0 0 0 1 0 0 2 9 0 2 0 0 0 1 0 0 0 0 0 -0.4052 14 11 2 1 0 0 0 2 0 1 0 8 408.378 0 0 0 0 1 12 1047 0 0 0 0 0 0 3 0 0 0 0 4 4 3 0 0 0 0 0 0 0 0 7 7 0 0 7 0 4 3 0 0 0 0 0 7 0 4 3 0 0 0 11 3 0 0 4 3 2 2 0 1 0 4 0 0 0 0 0 -1.5536 16 9 3 4 0 0 0 2 1 4 2 11 389.43 1 0 1 1 -1 14 1142 0 0 0 0 0 1 1 0 0 0 0 6 2 4 0 0 0 0 0 2 0 0 8 7 1 0 8 1 6 1 0 0 0 0 0 8 0 6 2 0 0 0 14 2 0 0 0 7 5 3 0 0 0 1 0 1 1 0 0 -3.8966 18 12 3 2 1 0 1 3 0 1 5 8 464.758 0 0 0 0 4 32 1129 0 0 0 0 0 3 0 0 0 0 2 2 2 5 0 0 1 0 0 3 0 0 12 2 4 0 12 4 2 0 0 0 0 0 0 9 2 4 3 0 0 0 15 3 0 0 # -36.4567 42.2233 41.3067 # GLU Env_1j4h_15 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 80 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 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.8386 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 320 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.4229 6 3 1 2 0 0 0 1 0 2 0 5 137.655 0 0 0 0 -2 3 428 0 0 0 0 0 0 0 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 2 4 2 0 0 0 0 0 0 1 0 5 0 0 0 0 0 6 0 0 0 0 3 0 1 0 0 0 1 0 0 0 0 0 -1.1114 5 3 1 1 0 0 0 1 0 1 0 4 126.161 0 0 0 0 -1 2 290 0 0 0 0 0 0 0 2 1 2 0 0 0 0 0 0 0 0 0 0 0 0 2 0 1 2 2 2 1 0 0 0 0 0 3 0 2 0 0 0 0 0 5 0 0 0 3 5 5 0 0 0 0 3 0 0 0 0 0 -0.2797 16 13 0 3 0 0 0 0 0 3 5 7 423.283 0 0 0 0 4 20 967 0 0 0 0 0 0 0 0 5 4 0 0 0 5 2 0 0 0 0 0 0 0 11 0 5 0 11 0 5 0 0 0 0 0 9 5 2 0 0 0 0 0 16 0 0 0 1 6 4 3 0 0 2 0 0 0 0 0 0 -2.544 16 11 5 0 0 0 0 4 1 0 6 6 417.781 0 0 0 1 1 32 1045 0 0 0 0 0 0 0 0 4 1 2 0 0 5 4 0 0 0 0 0 0 0 12 0 4 0 12 0 4 0 0 0 0 0 5 5 2 0 4 0 0 0 12 4 0 0 # -31.89 32.37 25.89 # ILE Env_1j4h_16 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1102 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 0 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 1 3 0 1 0 0 0 0 0 0 0 0 0 0.0709 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 5 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 1 1 1 1 0 0 0 1 0 0 0 0 0 -0.9686 5 3 1 1 0 0 0 1 0 1 1 3 119.172 0 0 0 0 0 7 100 0 0 0 0 0 0 0 0 0 0 2 0 0 1 0 0 1 0 0 1 0 0 4 0 1 0 4 1 0 0 0 0 0 0 0 4 0 0 1 0 0 0 4 1 0 0 0 6 2 0 0 0 0 4 0 0 0 0 0 -2.7915 12 8 0 4 0 0 0 0 0 4 2 6 300.078 0 0 0 0 2 15 244 2 0 0 0 0 0 0 0 0 4 0 0 1 2 0 0 2 0 0 1 0 0 10 0 2 0 10 2 0 0 0 0 0 0 0 8 1 0 3 0 0 0 9 3 0 0 4 12 5 5 0 0 0 2 0 0 0 0 0 -2.4099 28 21 5 2 0 0 0 5 0 2 5 14 756.496 0 0 0 0 6 36 702 3 0 0 0 0 0 0 0 0 6 4 0 2 6 0 0 3 0 0 4 0 0 25 0 3 0 25 3 0 0 0 0 0 0 1 17 1 0 9 0 0 0 19 9 0 0 7 17 5 7 0 0 1 4 0 1 0 0 0 -3.546 42 29 8 5 0 0 1 7 1 4 6 25 1119.52 0 0 0 0 1 39 1345 4 0 0 0 0 0 1 2 0 4 5 0 2 4 2 4 6 2 5 1 0 0 22 1 17 2 24 17 0 1 0 4 2 0 3 15 6 0 12 0 0 6 24 12 0 0 # -37.63 41.23 23.23 # LEU Env_1j4h_17 0 1 0 0 0 0 0 0 0 0 0 0 0 0.2985 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 24 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 0 0 1 0 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.7258 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 4 72 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 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 0 0 2 0 0 0 2 0 0 0 0 0 -0.8473 6 2 2 2 0 0 0 2 0 2 0 6 118.282 0 0 0 0 -4 0 290 0 0 0 0 0 0 2 0 0 1 0 0 0 0 0 0 0 0 0 3 0 0 4 2 0 0 4 0 0 2 0 0 0 0 0 0 0 3 3 0 0 0 3 3 0 0 1 4 6 1 0 0 0 1 0 0 0 0 0 -1.0381 13 11 1 1 0 0 0 1 0 1 6 5 334.481 0 0 0 0 6 21 324 0 0 0 0 0 0 3 0 0 3 0 0 0 3 0 0 0 4 0 0 0 0 6 3 4 0 10 0 0 3 0 0 5 0 0 3 0 0 5 0 0 5 3 5 0 0 3 9 8 3 0 0 1 2 1 0 0 0 0 -2.609 27 20 4 3 0 0 0 3 1 2.5 9 9 695.53 0.666 0.666 0 0.666 6 54 1024 0 1 0 0 0 2 7 0 0 3 0 0 0 6 0 0 0 8 0 0 0 0 9 8 10 0 17 2 1 7 0 0 14 0 0 6 0 0 7 0 0 14 6 7 0 0 6 5 4 4 0 0 0 2 2 1 0 0 0 -2.4709 24 15 4 5 0 0 1 4 0 3 4 14 586.73 0.999 0.999 0 0.999 -3 40 1368 0 3 0 0 0 2 4 2 0 1 0 0 3 5 0 0 0 2 1 1 0 0 10 7 5 2 12 5 3 4 0 0 10 0 0 8 1 0 5 0 0 10 9 5 0 0 # -37.49 43.33 34.44 # VAL