# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1c8k # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/1c8k_POC.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_1c8k_0 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 5 134 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 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 -2.2547 3 0 3 0 0 0 0 1 2 0 0 0 69.437 0.666 0 0.666 0.666 -3 16 402 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 -0.7312 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 0 9 333 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 1 0 1 0 0 0 0 2 0 0 0 0 1 2 0 0 0 1 1 1 0 0 0 0 0 1 0 0 0 0 -0.121 4 3 0 1 0 0 0 0 0 0.5 1 0 94.747 0.666 0.666 0 0.666 1 13 281 0 1 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 3 0 0 1 0 1 2 0 2 0 0 0 0 2 0 0 0 0 2 2 0 0 0 1 5 4 0 0 0 0 1 0 0 0 0 0 -0.9793 11 10 0 1 0 0 0 0 0 1 4 3 318.638 0 0 0 0 6 21 686 0 3 0 0 0 0 1 0 0 1 0 0 0 4 2 0 0 0 0 0 0 0 7 4 0 0 7 0 3 1 0 3 0 0 0 0 7 0 1 0 0 3 7 1 0 0 2 6 1 4 0 0 0 0 1 0 0 0 0 -1.0218 14 9 4 1 0 0 0 4 0 0.5 1 9 359.344 0.333 0.333 0 0.333 -1 9 720 0 1 0 0 0 0 4 0 0 3 0 0 0 2 4 0 0 0 0 0 0 0 9 5 0 0 9 0 1 4 0 7 0 0 0 0 4 0 3 0 0 7 4 3 0 0 # 42.852 34.552 22.556 # ARG 770 Env_1c8k_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 102 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 0 6 0 0 0 0 0 6 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.4663 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 2 29 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 3 0 0 0 1 0 3 0 1 3 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 3 5 0 1 0 0 0 2 0 0 0 0 0 0.1099 11 8 1 2 0 0 0 1 0 2 0 9 305.205 0 0 0 0 -1 2 734 0 4 0 0 0 0 4 0 0 0 0 0 0 2 0 0 0 0 1 0 0 0 2 8 1 0 2 1 4 4 0 0 0 0 0 0 11 0 0 0 0 0 11 0 0 0 2 7 4 4 3 0 0 2 2 1 0 0 0 -5.1508 25 13 7 5 0 0 1 5 2 3 3 7 577.263 1.998 0.999 0.999 1.998 -5 54 1231 0 7 0 1 0 0 4 0 0 1 0 2 0 2 0 0 4 0 4 0 0 0 3 14 8 0 3 8 9 5 0 0 0 0 0 0 18 2 5 0 0 0 20 5 0 0 3 11 2 2 0 0 0 2 2 2 0 0 0 -3.6704 24 16 2 6 0 0 2 2 0 3 2 10 623.101 0.999 0.999 0 0.999 -0.5 41 352 0 3 0 4 0 0 2 0 0 2 0 1 1 0 0 0 5 0 3 0 0 3 3 10 8 3 3 8 4 6 3 1 1 0 0 0 7 2 13 0 0 2 9 13 0 0 # 37.9847 34.1293 20.4242 # PHE 771 Env_1c8k_2 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 11 318 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 3 0 0 0 0 0 0 0 0 3 0 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 5 212 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 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0057 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 3 114 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 1 0 1 0 1 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 1 0 1 0 0 0 1 1 0 1 0 0 -0.7201 7 3 1 2 1 0 0 1 0 1.5 0 4 153.888 0.666 0.666 0 0.666 -2 8 471 0 0 0 2 0 0 0 0 3 0 0 0 2 0 0 0 0 0 0 0 0 0 2 2 3 0 2 0 3 2 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 1 7 0 2 0 0 0 0 1 0 1 0 0 -1.4253 12 8 2 1 1 0 0 2 0 0.5 0 5 337.012 0.333 0.333 0 0.333 3 17 399 0 0 0 2 0 0 0 0 1 0 0 0 9 0 0 0 0 0 0 0 0 0 9 2 1 0 9 0 1 2 0 0 12 0 0 0 0 0 0 0 0 12 0 0 0 0 4 4 2 2 0 0 0 2 0 0 0 0 0 0.0457 14 10 2 2 0 0 0 2 0 2 2 10 372.384 0 0 0 0 0 14 632 1 0 0 2 0 0 0 0 0 0 0 4 3 0 0 0 0 2 2 0 0 0 4 6 4 0 6 2 4 2 0 0 10 0 0 2 0 0 2 0 0 10 2 2 0 0 # 34.898 46.4595 29.833 # HIS 614 Env_1c8k_3 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1825 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 10 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 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.3819 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 20 2 0 0 0 0 0 0 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 0 0 0 0 0 0 2 0 0 0 0 2 0 0 2 0 0 1 0 0 0 2 0 0 0 0 1 -0.203 6 2 1 3 0 0 0 1 0 2 0 5 115.639 0 0 0 0 -4 0 90 3 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 1 5 0 0 1 5 0 0 0 1 0 0 0 0 0 1 0 5 0 0 0 1 5 0 0 2 6 2 4 1 0 0 2 0 0 0 0 0 -2.6516 17 10 5 2 0 0 0 4.5 0.5 2 2 10 406.214 0.333 0 0.333 0.333 -4 18 610 2 1 4 1 0 0 0 1 0 0 0 0 0 0 3 0 0 0 5 0 0 0 5 2 9 1 5 10 1 1 0 0 0 0 0 0 3 1 13 0 0 0 4 13 0 0 4 11 4 2 2 0 0 3 0 0 0 0 0 -2.2333 26 19 4 3 0 0 0 2.5 1.5 3 3 11 720.848 0.666 0 0.666 0.666 4 39 961 2 3 3 3 0 0 0 2 0 0 0 0 0 3 7 0 0 0 3 0 0 0 12 6 6 2 12 8 3 3 0 0 0 0 0 0 6 3 17 0 0 0 9 17 0 0 4 5 7 3 0 0 1 5 0 0 0 0 0 -3.3058 25 16 4 5 0 0 0 3 0 5 7 8 586.732 0 0 0 0 -1.5 46 860 1 1 3 1 0 1 0 1 1 1 0 4 0 4 2 0 0 0 3 0 0 2 8 6 8 3 8 8 6 1 2 0 4 0 0 1 1 1 18 0 0 4 3 18 0 0 # 33.355 34.951 34.061 # ALA 610 Env_1c8k_4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 654 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 0 0 0 6 0 0 0 0 6 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0342 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 109 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 0 1 0 0 0 0 1 0 0 2 2 0 1 0 0 0 3 0 0 0 0 0 -0.9437 8 4 1 3 0 0 0 1 0 3 0 8 182.659 0 0 0 0 -4 0 532 0 0 0 0 0 0 1 0 0 0 0 0 0 7 0 0 0 0 0 0 0 0 7 1 0 0 7 0 0 1 0 1 0 0 0 0 0 0 7 0 0 1 0 7 0 0 3 8 0 3 0 0 0 2 0 0 0 0 0 -1.1849 16 11 3 2 0 0 0 3 0 2 0 7 431.37 0 0 0 0 1 16 838 0 0 6 0 0 0 8 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 8 6 0 2 6 0 8 0 4 0 0 0 0 0 2 10 0 0 4 2 10 0 0 5 6 6 3 0 0 0 1 3 0 0 0 1 -2.0718 25 17 3 5 0 0 0 3 0 2.5 6 11 597.8 1.665 1.665 0 1.665 0 37 1036 3 0 3 3 0 0 7 0 0 0 0 0 0 2 0 0 0 0 6 0 0 1 5 10 9 1 5 9 0 10 1 5 0 0 0 0 0 4 16 0 0 5 4 16 0 0 # 40.217 34.0303 32.783 # PHE 285 Env_1c8k_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 10 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 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 -2.2547 3 0 3 0 0 0 0 1 2 0 0 0 69.437 0.666 0 0.666 0.666 -3 16 30 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0.0572 3 3 0 0 0 0 0 0 0 0 0 0 100.53 0 0 0 0 2 6 32 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 1 0 0 0 0 0 0 0 1 2 0 0 0 1 2 0 0 6 7 0 2 0 0 0 4 1 0 0 0 1 -0.222 21 13 2 6 0 0 0 2 0 4.5 0 12 509.649 0.666 0.666 0 0.666 -4 16 185 3 1 6 4 0 0 0 0 0 1 0 3 0 0 2 0 0 0 0 0 0 1 6 8 6 1 6 6 4 4 1 0 0 0 0 0 0 5 16 0 0 0 5 16 0 0 3 10 2 7 0 0 0 3 1 0 0 0 0 -4.9499 26 15 7 4 0 0 0 7 0 3.5 2 17 646.542 0.333 0.333 0 0.333 -4 24 299 4 3 5 3 0 0 0 1 0 2 0 4 0 2 2 0 0 0 0 0 0 0 10 10 5 1 10 6 7 3 0 0 0 0 0 0 0 5 21 0 0 0 5 21 0 0 5 11 4 4 0 0 1 7 0 0 0 0 0 -3.3923 32 20 5 7 0 0 0 4 0 7 2 18 807.365 0 0 0 0 -4 23 417 3 1 4 0 0 0 0 5 0 6 0 3 0 2 4 0 0 0 1 0 0 3 15 4 5 8 15 10 4 0 3 0 0 0 0 0 2 8 22 0 0 0 10 22 0 0 # 29.732 31.202 33.263 # ARG 569 Env_1c8k_6 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 77 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 0 1 0 0 0 0 0 1 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.2123 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 332 0 0 0 0 0 0 0 3 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 1 3 1 4 0 0 0 0 0 0 0 0 4 0 1 0 0 0 4 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 -0.5748 1 0 0 1 0 0 0 0 0 1 0 1 11.494 0 0 0 0 -1 0 41 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 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 2 4 0 2 0 0 0 1 0 0 0 0 0 -0.0938 9 6 2 1 0 0 0 2 0 1 0 7 240.828 0 0 0 0 -1 2 429 2 0 0 0 0 0 0 0 1 0 0 0 0 0 3 0 0 0 3 0 0 0 5 0 4 0 5 3 1 0 0 0 1 0 0 0 3 0 5 0 0 1 3 5 0 0 0 7 1 0 0 1 0 1 0 0 0 0 0 -1.1851 10 8 1 1 0 0 0 0 1 1 1 3 300.153 1 0 1 1 3 18 454 2 0 0 0 0 0 0 0 1 0 0 3 0 0 2 0 0 0 2 0 0 0 4 3 3 0 4 2 4 0 0 0 4 0 0 0 2 0 4 0 0 4 2 4 0 0 4 3 3 1 0 0 0 2 2 0 0 0 0 -1.0507 15 10 1 4 0 0 0 1 0 3 3 4 353.67 0.999 0.999 0 0.999 1 30 776 3 0 2 0 0 0 3 0 2 0 0 2 0 1 0 0 0 0 2 0 0 0 4 5 6 0 4 4 4 3 0 0 4 0 0 1 0 0 10 0 0 4 1 10 0 0 # 35.34 39.676 35.937 # GLY 612 Env_1c8k_7 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 11 195 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 3 0 0 0 0 0 0 0 0 0 3 0 0 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 65 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 1 2 0 0 0 0 0 0 0 0 -2.1458 5 2 3 0 0 0 0 2 1 0 0 2 130.015 0.666 0 0.666 0.666 -2 13 463 0 2 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 2 3 0 3 0 0 0 0 2 0 0 0 0 3 2 0 0 0 3 5 1 1 0 0 0 0 0 0 0 0 0 2.411 10 9 1 0 0 0 0 1 0 0 0 5 302.796 0.333 0 0.333 0.333 2 10 637 0 1 0 0 0 0 1 0 0 2 0 0 0 0 6 0 0 0 0 0 0 0 8 2 0 0 8 0 1 1 0 7 0 0 0 0 1 0 2 0 0 7 1 2 0 0 0 5 1 1 1 0 0 3 0 0 0 0 0 -3.2172 11 6 2 3 0 0 0 1 1 3 1 5 263.269 0 0 0 0 -1 19 506 1 2 0 0 0 0 1 0 0 5 0 0 0 1 1 0 0 0 0 0 0 0 8 3 0 0 8 0 2 1 0 3 0 0 0 0 3 0 5 0 0 3 3 5 0 0 2 3 4 2 0 0 0 2 0 0 0 0 0 -1.5188 13 9 2 2 0 0 0 2 0 2 4 7 324.896 0 0 0 0 2 18 551 3 1 1 0 0 0 0 0 0 1 1 0 0 4 0 0 0 0 0 2 0 0 11 1 1 0 11 1 1 0 0 3 0 0 0 0 3 2 5 0 0 3 5 5 0 0 # 42.827 32.6613 25.8347 # GLU 382 Env_1c8k_8 0 0 0 1 0 0 0 0 0 0 0 0 0 -0.2547 1 0 1 0 0 0 0 1 0 0 0 1 14.137 0 0 0 0 -1 0 29 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 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 0.5941 5 5 0 0 0 0 0 0 0 0 0 2 167.55 0 0 0 0 2 4 145 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 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 -0.9624 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 162 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 3 0 0 0 1 0 4 0 1 4 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 2 5 0 1 0 0 0 3 0 0 0 0 0 -0.8885 11 7 1 3 0 0 0 1 0 3 0 4 270.258 0 0 0 0 -1 15 245 0 0 4 0 0 0 0 0 0 1 2 0 0 0 2 0 0 0 2 0 0 0 5 0 6 0 5 6 0 0 0 0 0 0 0 0 2 1 8 0 0 0 3 8 0 0 2 8 4 3 1 0 0 1 0 0 0 0 0 -3.3171 19 14 4 1 0 0 0 3.5 0.5 1 4 5 521.229 0.333 0 0.333 0.333 5 36 302 2 1 6 0 0 0 0 0 0 1 4 0 0 2 1 0 0 0 2 0 0 0 10 1 8 0 10 8 1 0 0 0 0 0 0 0 1 1 17 0 0 0 2 17 0 0 5 10 6 5 1 0 0 3 1 0 0 0 0 -3.3359 31 21 6 4 0 0 0 5.5 0.5 3.5 5 17 793.625 0.999 0.333 0.666 0.999 1 41 599 4 2 2 1 0 0 1 2 0 4 2 0 0 6 2 0 0 0 2 3 0 0 21 4 4 2 21 6 2 2 0 0 0 0 3 0 2 5 21 0 0 0 10 21 0 0 # 32.4018 32.1178 39.1332 # PRO 281 Env_1c8k_9 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 36 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 0 0 3 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 12 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 0 0 1 0 0 0 0 1 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0.6136 3 3 0 0 0 0 0 0 0 0 0 2 100.53 0 0 0 0 1 2 34 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 2 0 0 0 0 0 0 0 2 1 0 0 0 2 1 0 0 1 5 2 3 2 0 1 1 0 0 0 0 0 -2.9362 15 8 6 1 0 0 0 3.5 1.5 1 0 4 365.56 0.666 0 0.666 0.666 -3.5 26 332 0 5 6 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 7 6 2 0 6 5 2 2 0 0 0 0 0 0 7 8 0 0 0 7 8 0 0 6 4 3 3 1 1 1 4 0 1 0 0 1 -2.1635 25 13 6 6 0 0 1 3.5 1.5 4 1 13 604.824 1.333 0 1.333 1.333 -9 33 286 0 4 9 0 0 0 0 4 0 0 0 2 0 0 0 0 0 0 2 0 0 4 0 6 11 8 0 15 6 0 4 0 1 0 0 0 4 5 15 0 0 1 9 15 0 0 4 6 1 6 0 0 0 6 2 0 0 0 3 -6.2228 28 13 6 9 0 0 0 6 0 7 2 16 619.556 0.666 0.666 0 0.666 -9.5 25 495 0 1 5 0 0 0 2 3 0 3 2 4 0 1 1 0 0 0 2 0 0 4 7 7 7 7 7 10 5 2 4 0 7 0 0 0 4 3 14 0 0 7 7 14 0 0 # 31.9443 28.1507 30.2017 # ASP 283 Env_1c8k_10 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.7992 3 1 1 1 0 0 0 1 0 1 0 0 56.502 0 0 0 0 -2 8 135 0 0 3 0 0 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 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 45 0 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4014 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 90 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 2 4 1 0 0 0 0 2 1 2 0 0 0 -2.4123 12 7 0 5 0 0 2 0 0 2.5 1 4 299.02 0.333 0.333 0 0.333 -1 22 186 1 0 2 3 0 0 0 0 0 1 0 0 0 0 0 0 3 0 2 0 0 0 2 3 7 0 2 7 0 3 0 1 0 0 0 0 2 5 4 0 0 1 7 4 0 0 3 5 4 2 0 1 1 1 2 0 0 0 0 -2.4942 19 12 4 3 0 0 0 2 1 2 3 6 477.969 1.999 0.999 1 1.999 1 30 336 0 0 0 4 0 0 1 0 3 1 0 1 0 1 0 0 2 0 3 0 0 3 2 6 8 3 2 5 4 5 3 0 0 0 0 0 4 4 11 0 0 0 8 11 0 0 4 11 4 6 0 0 1 5 2 0 0 0 0 -5.6436 33 19 7 7 0 0 0 6 0 6 3 18 775.611 0.999 0.999 0 0.999 -6.5 30 794 6 0 1 2 0 0 2 0 2 5 3 1 0 3 0 0 3 0 2 1 0 2 18 5 8 2 18 6 3 4 2 4 3 0 0 0 3 5 18 0 0 7 8 18 0 0 # 36.045 26.284 28.067 # ASN 284 Env_1c8k_11 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.7992 3 1 1 1 0 0 0 1 0 1 0 0 56.502 0 0 0 0 -2 8 75 0 0 3 0 0 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 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 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 25 0 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 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4014 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 50 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 4 7 2 1 0 0 0 3 1 0 0 0 0 -0.6802 18 13 1 4 0 0 0 1 0 3.5 2 8 471.477 0.666 0.666 0 0.666 2 20 884 1 0 2 0 0 0 4 0 0 0 0 0 0 3 5 0 0 0 3 0 0 0 9 4 5 0 9 5 0 4 0 0 0 0 0 0 0 0 18 0 0 0 0 18 0 0 2 7 4 4 0 0 0 1 1 0 0 0 1 -2.3488 20 13 4 3 0 0 0 4 0 1.5 4 11 489.463 0.333 0.333 0 0.333 -1 20 1063 1 0 0 1 0 0 3 0 0 0 0 0 0 7 3 0 0 0 4 0 0 1 11 4 4 1 11 4 0 4 1 0 0 0 0 0 1 1 18 0 0 0 2 18 0 0 6 5 4 6 1 0 0 5 0 0 0 0 0 -3.8829 27 15 7 5 0 0 0 6.5 0.5 5 5 16 625.845 0.333 0 0.333 0.333 -6 37 1056 3 1 5 4 0 0 2 2 0 0 0 0 0 5 2 0 0 0 3 0 0 0 10 7 8 2 10 10 1 6 0 0 0 0 0 0 4 6 17 0 0 0 10 17 0 0 # 36.5797 32.5887 36.831 # ASN 282 Env_1c8k_12 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 11 120 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 3 0 0 0 0 0 3 0 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 40 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 1 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 1 0 0 0 -0.5002 3 2 0 1 0 0 1 0 0 0 0 0 84.177 0 0 0 0 1 9 129 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 1 1 1 0 1 1 0 1 0 0 1 0 0 0 1 0 1 0 0 1 1 1 0 0 1 3 2 1 0 0 0 0 0 0 0 0 0 -0.5776 7 6 1 0 0 0 0 1 0 0 3 2 188.288 0 0 0 0 3 18 257 0 0 0 0 0 0 2 0 0 0 0 0 2 1 0 0 0 0 2 0 0 0 3 2 2 0 3 2 0 2 0 0 2 0 0 0 3 0 2 0 0 2 3 2 0 0 3 4 4 3 0 0 0 1 0 0 2 0 0 -1.3067 17 11 3 1 2 0 0 3 0 1 4 8 447.601 0 0 0 0 5 30 419 1 0 0 0 0 0 2 0 0 1 0 0 7 2 0 0 0 0 3 0 0 1 11 2 3 1 11 3 0 2 1 0 9 0 0 0 5 0 3 0 0 9 5 3 0 0 0 12 5 2 1 0 0 3 1 0 0 0 0 -5.2435 24 17 3 4 0 0 0 2.5 0.5 3.5 5 9 624.163 0.666 0.333 0.333 0.666 5 37 1095 2 5 0 2 0 0 0 0 1 1 1 0 2 5 0 0 0 0 3 0 0 2 11 7 4 2 11 3 6 2 2 0 6 0 0 0 11 0 7 0 0 6 11 7 0 0 # 36.8493 39.0153 23.922 # GLU 572 Env_1c8k_13 0 0 0 1 0 0 0 0 0 0 0 0 0 -0.2547 1 0 1 0 0 0 0 1 0 0 0 1 14.137 0 0 0 0 -1 0 41 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 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0.0045 4 4 0 0 0 0 0 0 0 0 0 1 134.04 0 0 0 0 2 4 164 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 -0.3378 6 3 1 2 0 0 0 1 0 2 0 6 137.655 0 0 0 0 -3 0 189 3 0 0 0 0 0 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 5 0 0 1 5 1 0 0 0 0 0 0 0 0 3 0 3 0 0 0 3 3 0 0 2 6 3 2 0 1 0 1 2 0 0 0 0 -3.1436 17 11 3 3 0 0 0 2 1 2 3 4 446.556 1.999 0.999 1 1.999 2 42 574 4 0 0 0 0 1 4 1 0 0 0 2 0 3 2 0 0 0 0 0 0 0 9 6 1 1 9 2 2 4 0 0 2 0 0 5 1 0 9 0 0 2 6 9 0 0 3 5 3 1 0 0 0 2 0 0 0 0 0 0.049 14 11 1 2 0 0 0 1 0 2 3 6 365.895 0 0 0 0 2 20 448 1 0 1 0 0 1 1 1 0 0 0 1 0 3 4 0 0 0 1 0 0 0 8 2 3 1 8 4 1 1 0 0 1 0 0 2 1 0 10 0 0 1 3 10 0 0 2 8 0 4 1 0 0 3 0 0 0 0 0 -3.1242 18 10 5 3 0 0 0 4.5 0.5 3 0 10 437.628 0.333 0 0.333 0.333 -3 19 644 2 1 3 0 0 2 2 1 0 0 0 1 0 1 1 0 0 0 4 0 0 0 4 4 9 1 4 10 2 2 0 0 1 0 0 4 1 0 12 0 0 1 5 12 0 0 # 31.59 37.3554 37.3966 # PRO 611 Env_1c8k_14 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1825 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 13 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.3819 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 26 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 3 1 0 1 0 0 0 3 0 0 0 0 0 -0.6321 8 4 1 3 0 0 0 1 0 3 0 7 182.659 0 0 0 0 -3 2 220 2 0 2 0 0 0 1 0 0 1 1 0 0 0 0 0 1 0 0 0 0 0 4 1 3 0 4 3 0 1 0 3 0 0 0 0 0 3 2 0 0 3 3 2 0 0 2 9 0 2 0 0 0 2 0 1 0 0 0 -1.2905 16 11 2 3 0 0 1 2 0 2 0 8 424.098 0 0 0 0 -1 15 685 0 0 4 0 0 0 3 0 0 4 1 0 0 2 0 0 2 0 0 0 0 0 7 3 6 0 7 6 0 3 0 3 0 0 0 0 0 5 8 0 0 3 5 8 0 0 5 11 0 6 0 0 0 4 1 0 0 0 0 -3.2502 27 16 6 5 0 0 0 6 0 4.5 0 18 691.387 0.333 0.333 0 0.333 -4 18 1173 0 0 2 0 0 0 3 0 0 2 5 0 0 6 4 0 3 0 0 2 0 0 19 3 5 0 19 5 0 3 0 7 0 0 0 0 0 7 13 0 0 7 7 13 0 0 5 7 3 2 0 0 1 3 2 0 0 0 0 -2.0524 23 15 3 5 0 0 0 2.5 0.5 4 4 10 555.546 1.332 1.332 0 1.832 -1 31 746 0 0 0 5 0 0 4 0 3 1 1 0 0 4 2 0 1 0 0 2 0 0 10 9 4 0 10 1 3 9 0 3 0 0 0 0 1 6 13 0 0 3 7 13 0 0 # 40.775 27.21 29.221 # ALA 383 Env_1c8k_15 0 0 0 0 0 0 0 0 0 0 1 0 0 -0.2736 1 0 0 0 1 0 0 0 0 0 0 0 26.521 0 0 0 0 1 3 29 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 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0518 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 6 58 0 0 0 0 0 0 0 0 0 0 0 0 2 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 0 2 0 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 -0.5574 3 2 0 1 0 0 0 0 0 1 0 2 78.514 0 0 0 0 0 1 87 0 0 0 0 0 0 0 0 0 0 0 0 3 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 2 5 0 3 0 0 0 1 1 0 0 0 0 -1.4502 12 7 3 2 0 0 0 3 0 1.5 0 7 302.612 0.333 0.333 0 0.333 -1 10 230 1 0 0 2 0 0 1 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 9 3 0 0 9 0 0 3 0 0 11 0 0 0 1 0 0 0 0 11 1 0 0 0 4 13 2 2 0 0 1 2 1 0 1 0 0 -1.3648 26 19 3 3 1 0 0 2.5 0.5 2.5 3 10 709.896 0.666 0.666 0 1.166 5 39 832 1 0 0 2 0 0 3 0 5 8 1 0 6 0 0 0 0 0 0 0 0 0 16 5 5 0 16 0 5 5 0 0 23 0 0 0 3 0 0 0 0 23 3 0 0 0 5 10 3 6 0 0 1 3 2 1 1 0 0 -4.9802 32 18 7 6 1 0 1 6.5 0.5 4 5 15 768.186 0.999 0.999 0 1.499 -3 52 1291 3 0 0 4 0 0 1 0 5 1 3 2 7 0 0 0 0 0 5 1 0 0 15 7 10 0 15 5 7 5 0 0 26 0 0 0 1 0 5 0 0 26 1 5 0 0 # 34.297 43.49 24.673 # MET 615 Env_1c8k_16 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 15 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 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 60 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 0 0 4 0 0 0 0 4 0 0 2 2 0 1 0 0 0 1 0 0 0 0 0 0.3251 6 4 1 1 0 0 0 1 0 1 0 4 159.671 0 0 0 0 -1 4 206 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 0 0 0 0 1 0 0 6 0 0 0 6 0 0 0 0 2 0 0 0 0 0 0 4 0 0 2 0 4 0 0 1 4 0 2 0 0 0 1 1 1 0 0 0 -2.472 10 5 2 3 0 0 1 2 0 1.5 0 5 225.681 0.666 0.666 0 0.666 -3 12 424 1 0 0 0 0 0 4 0 0 0 0 0 0 0 1 0 1 0 0 3 0 0 5 4 1 0 5 1 0 4 0 6 0 0 0 0 0 0 4 0 0 6 0 4 0 0 3 10 3 1 1 0 0 4 1 0 0 0 0 -2.9419 23 16 2 5 0 0 0 1.5 0.5 4.5 3 10 613.872 0.666 0.333 0.333 0.666 2 35 920 2 1 2 0 0 0 4 0 0 0 0 0 0 2 4 0 5 0 1 2 0 0 10 5 8 0 10 8 1 4 0 10 0 0 0 0 4 3 6 0 0 10 7 6 0 0 5 8 6 2 2 0 0 3 0 0 0 0 0 -1.9447 26 19 4 3 0 0 0 2.5 1.5 3 6 10 664.774 0.666 0 0.666 0.666 3 48 864 1 3 4 0 0 0 1 1 0 0 2 0 0 1 0 0 6 0 6 1 0 0 5 4 16 1 5 17 3 1 0 2 0 0 0 0 11 10 3 0 0 2 21 3 0 0 # 40.993 28.759 24.495 # ILE 380