# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3bz3 # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/3bz3_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_3bz3_0 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 1 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 1 3 0 1 0 0 0 0 0 0 0 0 0 -0.5442 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 4 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 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 0 1 0 0 0 2 0 0 0 0 0 -1.3662 5 2 1 2 0 0 0 1 0 2 0 4 104.145 0 0 0 0 -2 3 64 1 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 1 0 0 4 0 1 0 4 1 0 0 0 2 1 0 0 2 0 0 0 0 0 3 2 0 0 0 2 7 0 1 0 0 0 4 0 0 0 0 0 -1.9624 14 9 1 4 0 0 0 1 0 4 0 10 361.703 0 0 0 0 -1 9 199 3 0 3 0 0 0 0 0 0 0 6 2 0 0 0 0 0 0 0 0 0 0 9 2 3 0 9 3 2 0 0 5 4 0 0 4 0 1 0 0 0 9 5 0 0 0 5 14 0 6 0 0 0 1 0 0 0 1 0 -1.6981 27 19 6 1 1 0 0.5 6 0 1 0 16 759.527 0 0 0 0 2 20 508 3 4 1 0 1 0 0 1 0 0 11 2 0 0 0 0 0 0 0 4 0 0 18 6 2 1 18 3 6 0 0 7 5 0 0 13 0 1 1 0 0 12 14 1 0 0 3 17 0 3 0 0 0 4 0 0 0 0 0 -2.944 27 20 3 4 0 0 0 3 0 4 0 14 745.656 0 0 0 0 4 24 582 2 3 1 0 1 0 2 2 0 2 8 1 0 0 0 0 0 0 0 5 0 0 17 6 2 2 17 4 4 2 0 2 8 0 0 14 0 2 1 0 0 10 16 1 0 0 # 10.002 -2.166 14.376 # VAL 552 Env_3bz3_1 0 0 0 0 0 1 0 0 0 0 0 0 0 -0.3853 1 0 1 0 0 0 0 0 1 0 0 0 33.51 1 0 1 1 1 5 5 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 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 -0.8634 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 -1 10 20 0 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 1 0 0 0 0 0 2 0 0 1 0 0 0 2 1 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 -0.8208 3 1 0 2 0 0 0 0 0 1 0 0 48.853 0.999 0.999 0 0.999 -2 9 46 0 0 0 2 0 0 1 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 1 0 0 0 0 0 2 0 0 1 0 2 0 0 3 10 0 2 0 0 0 0 0 0 0 0 0 0.5945 15 13 2 0 0 0 0 2 0 0 0 5 450.973 0.333 0.333 0 0.333 7 21 377 0 0 0 1 0 0 4 3 0 1 4 2 0 0 0 0 0 0 0 0 0 0 5 7 0 3 5 3 2 5 0 0 11 0 0 3 0 0 1 0 0 11 3 1 0 0 2 11 3 3 0 0 0 3 1 0 1 0 0 -3.9467 24 16 3 4 1 0 0 3 0 3.5 3 13 632.744 0.333 0.333 0 0.333 3 29 314 2 0 0 2 0 0 4 1 0 3 2 1 3 6 0 0 0 0 0 0 0 0 16 7 0 1 16 1 1 6 0 0 16 0 0 6 0 0 2 0 0 16 6 2 0 0 7 11 6 5 0 0 0 6 0 0 1 0 0 -2.6963 36 24 5 6 1 0 0 5 0 6 6 19 903.661 0 0 0 0 4 40 845 2 0 0 2 0 3 0 0 0 4 2 4 4 13 0 1 0 0 0 1 0 0 26 6 4 0 26 4 4 2 0 0 18 0 0 10 0 6 2 0 0 18 16 2 0 0 # 8.228 12.467 9.166 # LYS 454 Env_3bz3_2 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 76 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 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.1143 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 2 228 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 2 2 0 1 0 0 0 2 0 0 0 0 0 -1.181 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 6 422 0 0 0 0 0 0 0 1 0 0 4 0 0 0 0 0 1 0 0 1 0 0 5 0 1 1 5 2 0 0 0 0 0 0 0 2 5 0 0 0 0 0 7 0 0 0 2 8 2 2 0 0 0 2 0 0 0 0 0 -1.2193 16 12 2 2 0 0 0 2 0 2 2 10 439.404 0 0 0 0 1 13 504 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 5 3 0 0 5 0 0 7 0 8 1 7 9 0 0 0 0 2 0 0 11 3 0 0 0 0 2 14 0 0 0 3 3 4 3 0 0 0 3 0 0 0 0 0 -1.8528 16 10 3 3 0 0 0 3 0 3 4 10 378.095 0 0 0 0 0 17 551 0 0 1 0 2 0 0 2 0 0 0 0 0 5 0 3 2 0 0 1 0 0 6 0 8 2 6 10 0 0 0 0 5 0 0 6 3 0 2 0 0 5 9 2 0 0 2 9 0 1 0 0 0 3 0 3 0 0 0 -2.9683 18 11 1 6 0 0 3 1 0 3 0 11 468.7 0 0 0 0 -6 10 1034 0 0 2 0 3 0 4 0 0 0 3 0 0 1 0 4 1 0 0 0 0 0 4 4 10 0 4 10 0 4 0 0 1 0 0 12 3 0 2 0 0 1 15 2 0 0 # 17.065 -4.837 6.204 # LEU 504 Env_3bz3_3 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 59 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 1 0 0 0 0 0 0 1 0 0 0 1 3 0 1 0 0 0 0 0 0 0 0 0 -0.2414 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 4 295 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 5 0 0 0 0 0 0 5 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.4522 4 2 1 1 0 0 0 1 0 1 0 3 92.651 0 0 0 0 -1 3 198 0 0 0 0 1 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 2 0 1 1 2 2 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 4 0 1 0 0 0 3 0 0 0 0 0 -1.0119 10 6 1 3 0 0 0 1 0 3 0 9 249.679 0 0 0 0 -3 1 472 0 1 0 0 2 2 0 1 2 0 0 0 0 0 0 0 0 0 0 2 0 0 2 1 6 1 2 5 3 0 0 0 0 0 0 10 0 0 0 0 0 0 10 0 0 0 3 8 1 2 1 0 0 3 0 0 0 1 0 -1.5877 19 12 3 3 1 0 0.5 2.5 0.5 3 0 8 489.964 0.666 0 0.666 0.666 -2 31 1172 0 4 0 0 3 4 0 2 2 0 1 0 0 0 0 0 0 0 0 3 0 0 4 4 9 2 4 9 6 0 0 0 0 0 0 18 0 0 1 0 0 0 18 1 0 0 2 10 1 4 2 0 1 1 1 0 0 0 0 -4.3026 22 13 7 2 0 0 0 5 2 1.5 2 8 561.384 0.999 0.666 0.333 1.499 -3 38 1826 2 6 0 0 0 3 4 1 3 0 1 0 0 0 0 0 0 0 0 2 0 0 5 10 6 1 5 4 9 4 0 0 0 0 0 21 0 0 1 0 0 0 21 1 0 0 # 10.913 2.786 0.833 # ILE 428 Env_3bz3_4 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 11 123 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 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 41 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 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 -0.3293 2 1 1 0 0 0 0 0 1 0 0 0 67.02 1 0 1 1 2 6 66 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 1 1 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 7 0 1 0 0 0 3 0 1 0 0 0 -1.7262 14 9 1 4 0 0 1 1 0 3 0 8 367.366 0 0 0 0 -2 13 360 0 0 0 0 0 0 3 0 0 1 1 4 0 0 0 1 0 0 0 4 0 0 6 7 1 0 6 1 4 3 0 0 0 0 1 6 0 0 7 0 0 0 7 7 0 0 3 8 0 4 0 0 0 3 0 0 0 1 0 -1.9236 19 11 4 3 1 0 0.5 4 0 3 0 13 486.161 0 0 0 0 -6 12 594 0 0 0 0 3 0 1 0 0 1 3 7 0 0 1 1 0 0 0 2 0 0 7 8 4 0 7 4 7 1 0 0 0 0 1 4 1 0 13 0 0 0 6 13 0 0 4 11 0 3 0 1 0 4 0 0 0 0 0 -2.6407 23 15 4 4 0 0 0 3 1 4 0 16 624.547 1 0 1 1 -1 17 655 1 0 0 0 2 0 0 0 4 4 3 3 2 0 2 1 0 0 0 1 0 0 13 3 7 0 13 3 7 0 0 0 0 0 2 9 5 0 7 0 0 0 16 7 0 0 # 19.7407 5.28567 11.5887 # GLU 500 Env_3bz3_5 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 11 114 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 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0644 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 38 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 1 0 0 0 0 0 0 1 0 0 0 0 1 1 0 2 0 0 0 0 0 0 0 0 -0.588 4 2 2 0 0 0 0 0.5 1.5 0 0 0 99.097 0.666 0 0.666 0.666 -1 16 545 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 1 3 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 5 0 1 1 0 0 0 0 0 0 0 0 -1.3289 8 6 2 0 0 0 0 1.5 0.5 0 0 3 239.626 0.333 0 0.333 0.333 1 16 705 0 3 0 0 0 3 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 2 3 3 0 2 3 3 0 0 0 0 0 0 7 0 0 1 0 0 0 7 1 0 0 3 9 0 2 0 0 0 3 0 0 0 0 0 -0.9124 17 12 2 3 0 0 0 2 0 3 0 11 464.876 0 0 0 0 1 12 1311 0 5 0 0 0 1 0 4 1 3 2 0 0 0 0 0 1 0 0 0 0 0 5 5 3 4 5 6 6 0 0 0 0 0 0 14 1 0 2 0 0 0 15 2 0 0 3 6 0 3 0 0 0 5 0 0 0 0 0 -2.784 17 9 3 5 0 0 0 3 0 5 0 15 401.471 0 0 0 0 -6 3 785 0 0 0 0 4 0 0 4 2 2 1 0 0 0 0 0 3 0 0 1 0 0 4 0 9 4 4 11 2 0 0 0 0 0 0 13 3 0 1 0 0 0 16 1 0 0 # 15.929 1.874 -1.501 # GLN 438 Env_3bz3_6 0 0 0 0 0 1 0 0 0 0 0 0 0 -0.3853 1 0 1 0 0 0 0 0 1 0 0 0 33.51 1 0 1 1 1 5 55 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 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.062 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 0 7 110 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 2 1 0 1 0 0 0 1 1 0 0 0 0 -0.411 6 3 1 2 0 0 0 1 0 1.5 0 4 127.367 0.666 0.666 0 0.666 -3 5 526 0 0 0 4 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 2 0 0 0 2 4 0 0 0 0 0 0 0 0 6 0 0 0 0 6 0 0 2 4 0 2 0 0 0 3 1 0 0 0 0 -2.1748 12 6 2 4 0 0 0 2 0 3.5 0 8 277.953 0.333 0.333 0 0.333 -3 7 756 0 0 0 4 0 0 0 0 2 1 0 2 0 2 1 0 0 0 0 0 0 0 4 6 2 0 4 0 4 4 0 0 0 0 1 0 1 0 10 0 0 0 2 10 0 0 3 5 0 1 0 0 0 1 1 0 0 0 0 -0.2121 11 8 1 2 0 0 0 1 0 1.5 0 7 307.848 0.333 0.333 0 0.333 -1 7 532 0 0 0 0 0 0 1 0 1 1 0 2 0 0 4 0 0 0 0 2 0 0 7 3 1 0 7 0 3 1 0 0 0 0 1 1 4 0 5 0 0 0 6 5 0 0 3 9 2 5 0 1 1 4 0 1 0 0 0 -4.5133 26 14 7 5 0 0 1 5.5 1.5 4 4 13 604.823 1.333 0.333 1 1.833 -3 39 659 0 0 0 0 0 0 1 0 3 6 2 3 1 3 2 0 0 0 3 2 0 0 16 4 6 0 16 3 6 1 0 0 4 0 6 4 3 0 9 0 0 4 13 9 0 0 # 20.856 9.055 17.437 # LYS 485 Env_3bz3_7 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 3 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 0 0 1 0 0 0 0 1 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.3054 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 23 0 0 0 1 0 0 0 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 3 1 3 0 1 0 0 0 0 0 1 0 0 4 0 0 0 1 4 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.5478 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 3 66 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 0 1 0 2 1 0 0 0 1 0 0 0 2 0 0 0 0 0 1 2 0 0 0 3 8 0 1 0 0 0 2 0 1 0 0 0 -0.5147 15 11 1 3 0 0 1 1 0 2 0 8 422.892 0 0 0 0 2 11 187 0 0 1 4 0 0 0 0 0 0 4 2 0 0 0 1 0 0 0 3 0 0 7 6 2 0 7 2 2 4 0 1 1 0 0 6 0 0 7 0 0 2 6 7 0 0 2 13 2 4 0 0 0 0 0 0 0 0 0 -1.5991 21 17 4 0 0 0 0 4 0 0 2 11 599.309 0.333 0.333 0 0.333 4 21 366 0 0 2 1 0 0 0 0 0 0 6 2 0 4 0 1 0 0 0 5 0 0 15 3 3 0 15 3 2 1 0 2 5 0 0 11 0 0 3 0 0 7 11 3 0 0 7 16 2 5 0 0 1 6 2 0 1 1 0 -5.6094 41 25 6 8 2 0 0.5 5.5 0.5 7 3 18 1056.73 0.666 0.666 0 1.166 0 57 863 0 2 4 2 2 0 0 0 2 4 9 1 3 4 0 2 0 0 0 6 0 0 26 5 10 0 26 8 5 2 0 6 14 0 4 9 1 0 7 0 0 20 14 7 0 0 # 10.753 4.259 12.851 # GLY 563 Env_3bz3_8 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 23 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 -0.3054 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 293 0 0 0 0 0 0 1 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 3 1 3 0 1 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 -0.5679 1 0 0 1 0 0 0 0 0 1 0 1 11.494 0 0 0 0 -1 0 59 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 1 0 0 0 0 0 0 1 0 0 0 2 7 0 2 0 0 0 1 1 0 0 1 0 -0.9605 14 9 2 2 1 0 0.5 2 0 1.5 0 7 382.016 0.333 0.333 0 0.333 0 13 1211 0 0 0 0 2 0 5 0 0 4 0 0 0 0 0 0 0 0 0 3 0 0 7 5 2 0 7 2 0 5 0 0 0 0 0 14 0 0 0 0 0 0 14 0 0 0 3 7 0 1 0 0 0 2 1 0 0 0 0 -1.5548 14 10 1 3 0 0 0 1 0 2.5 0 8 373.431 0.666 0.666 0 0.666 -1 14 843 0 0 0 2 3 0 3 1 0 1 0 0 0 0 0 0 0 0 0 4 0 0 5 5 3 1 5 4 0 5 0 0 0 0 0 13 0 0 1 0 0 0 13 1 0 0 3 4 0 3 0 0 0 2 2 0 0 0 0 -2.095 14 7 3 4 0 0 0 3 0 3 0 8 302.381 1.332 1.332 0 1.332 -5 16 761 0 0 0 5 1 0 2 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 7 3 3 1 4 2 7 0 0 0 0 0 11 0 2 1 0 0 0 13 1 0 0 # 6.183 3.754 1.345 # GLY 429 Env_3bz3_9 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 58 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 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.1143 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 2 174 0 0 0 0 0 0 0 0 0 0 3 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 0 3 0 0 0 0 2 2 0 1 0 0 0 1 1 0 0 0 0 -1.4145 7 4 1 2 0 0 0 1 0 1.5 0 4 173.808 0.333 0.333 0 0.333 -1 9 254 0 0 0 1 0 0 0 1 0 0 4 0 0 0 0 1 0 0 0 0 0 0 4 1 1 1 4 2 0 1 0 0 6 0 0 0 0 0 1 0 0 6 0 1 0 0 2 4 0 0 0 0 0 3 0 0 0 0 0 -0.4649 9 6 0 3 0 0 0 0 0 3 0 6 222.611 0.333 0.333 0 0.333 -2 7 168 0 0 0 5 0 1 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 5 2 2 0 4 0 5 0 0 3 0 0 0 0 1 5 0 0 3 1 5 0 0 4 7 0 5 0 1 0 2 2 1 0 0 0 -4.1488 22 11 6 5 0 0 1 5 1 3 0 10 538.585 1.666 0.666 1 1.666 -7 36 573 0 1 1 2 0 2 1 3 0 0 0 4 0 4 0 3 0 0 0 1 0 0 5 8 6 3 5 9 5 3 0 1 9 0 0 5 0 2 5 0 0 10 7 5 0 0 5 9 0 2 0 0 0 4 1 0 0 0 0 -0.9925 21 14 2 5 0 0 0 2 0 4.5 0 11 531.665 0.666 0.666 0 0.666 0 18 1480 0 4 1 0 0 3 4 4 0 0 0 1 0 1 0 1 0 0 0 2 0 0 3 9 5 4 3 9 5 4 0 1 4 0 0 5 0 3 8 0 0 5 8 8 0 0 # 6.355 7.622 9.188 # LEU 567 Env_3bz3_10 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 5 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 0 0 0 1 0 0 0 0 0 0 1 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 10 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 0 0 0 2 0 0 0 0 0 0 2 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 -0.4533 4 4 0 0 0 0 0 0 0 0 0 2 134.04 0 0 0 0 2 4 42 0 0 0 0 0 0 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 4 5 0 4 0 0 0 2 1 0 0 0 0 -1.2376 16 9 4 3 0 0 0 4 0 2.5 0 10 395.263 0.333 0.333 0 0.333 -2 11 287 0 0 0 1 0 0 1 0 0 4 4 2 4 0 0 0 0 0 0 0 0 0 12 4 0 0 12 0 2 2 0 0 2 0 0 11 0 0 3 0 0 2 11 3 0 0 3 15 0 3 0 1 0 7 1 0 0 0 0 -5.3049 30 18 4 8 0 0 0 3 1 7.5 0 18 760.765 1.666 0.666 1 1.666 -1 28 366 3 0 0 3 0 0 2 2 0 7 2 5 2 0 0 0 0 0 0 4 0 0 18 10 0 2 18 2 5 5 0 0 3 0 0 18 0 0 9 0 0 3 18 9 0 0 8 20 0 8 0 0 0 3 0 0 1 0 0 -1.807 40 28 8 3 1 0 0 8 0 3 0 24 1112.38 0 0 0 0 3 31 695 7 1 0 3 0 0 4 2 0 9 0 5 5 1 0 0 0 0 0 3 0 0 25 13 0 2 25 2 6 7 0 0 12 0 0 21 0 0 7 0 0 12 21 7 0 0 # 14.181 11.902 9.947 # MET 499 Env_3bz3_11 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6546 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 5 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 0 2 0 0 0 0 0 0 0 0 0 0 0 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 10 0 0 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 2 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.5452 6 3 1 2 0 0 0 1 0 2 0 3 124.724 0 0 0 0 -2 6 76 0 0 3 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 2 4 0 0 4 0 2 0 3 1 0 0 0 0 0 2 0 0 4 0 2 0 0 5 4 2 5 0 0 1 5 0 0 0 0 0 -2.6848 22 11 6 5 0 0 0 5.5 0.5 5 3 18 513.658 0 0 0 0.5 -10 14 511 0 1 4 2 0 0 0 4 2 0 2 0 0 5 0 2 0 0 0 0 0 0 7 3 8 4 7 10 3 2 0 4 9 0 0 0 0 0 9 0 0 13 0 9 0 0 4 7 3 4 0 0 1 2 0 0 0 0 0 -1.75 21 14 5 2 0 0 0 4.5 0.5 2 4 12 522.973 0.333 0.333 0 0.833 -1 18 559 0 1 1 5 0 0 0 4 2 0 4 0 0 3 0 0 0 0 0 1 0 0 8 6 3 4 8 5 3 5 0 1 10 0 0 2 0 0 8 0 0 11 2 8 0 0 3 12 4 4 1 0 0 4 4 0 0 0 0 -6.0728 32 19 5 8 0 0 0 4 1 6 4 14 769.512 1.665 1.665 0 1.665 -2 48 1448 2 8 0 7 0 0 0 0 1 2 7 0 0 3 0 0 0 0 1 1 0 0 15 15 2 0 15 1 9 7 0 4 5 0 0 6 0 2 15 0 0 9 8 15 0 0 # 6.354 5.295 13.976 # SER 568 Env_3bz3_12 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 25 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 1 2 0 1 0 0 0 0 0 0 0 0 0 0.4829 4 3 1 0 0 0 0 1 0 0 0 3 114.667 0 0 0 0 0 2 100 0 0 0 0 0 0 0 0 0 0 4 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 3 3 0 2 0 0 0 2 0 0 0 0 0 -1.1475 10 6 2 2 0 0 0 2 0 2 0 8 252.322 0 0 0 0 -2 6 203 2 0 0 0 1 0 1 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 8 1 1 0 8 1 0 1 0 0 0 0 0 6 0 0 4 0 0 0 6 4 0 0 1 6 0 2 0 0 0 2 0 0 0 0 0 -1.6205 11 7 2 2 0 0 0 2 0 2 0 9 285.832 0 0 0 0 -2 2 304 5 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 6 2 3 0 6 3 0 2 0 0 0 0 0 8 1 0 2 0 0 0 9 2 0 0 2 10 0 3 0 0 0 3 0 1 0 0 0 -2.6063 19 12 3 4 0 0 1 3 0 3 0 10 496.17 0 0 0 0 -1 13 562 2 0 0 0 2 2 3 2 0 0 0 0 2 0 0 0 3 0 0 3 0 0 7 3 7 2 7 9 0 3 0 0 0 0 0 14 3 0 2 0 0 0 17 2 0 0 6 8 0 3 0 0 0 5 1 0 0 1 0 -1.8158 24 14 3 6 1 0 0.5 3 0 5.5 0 13 583.817 0.666 0.666 0 0.666 -4 29 1235 1 0 0 0 1 5 2 2 1 2 5 0 2 0 0 0 3 0 0 0 0 0 10 2 10 2 10 11 1 2 0 0 0 0 0 15 4 0 5 0 0 0 19 5 0 0 # 18.302 4.623 4.692 # LEU 501 Env_3bz3_13 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 12 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 1 0 0 0 0 0 0 1 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 24 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 2 0 0 0 0 0 0 2 0 0 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0.2109 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 24 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 9 0 2 0 0 0 4 0 0 0 0 0 -3.0788 17 11 2 4 0 0 0 2 0 4 0 12 442.86 0 0 0 0 -1 10 311 0 0 0 0 0 0 2 0 1 2 4 0 5 0 0 0 0 0 0 3 0 0 14 2 1 0 14 0 1 2 0 0 0 0 0 13 0 0 4 0 0 0 13 4 0 0 5 15 0 6 0 0 0 2 0 0 0 0 0 -0.4838 28 20 6 2 0 0 0 6 0 2 0 16 778.01 0 0 0 0 4 22 503 0 0 0 0 1 4 2 0 3 8 3 2 1 0 0 0 0 0 0 4 0 0 16 4 8 0 16 5 5 2 0 0 0 0 0 24 0 0 4 0 0 0 24 4 0 0 3 22 0 2 0 0 0 6 0 0 1 0 0 -5.7063 34 25 2 6 1 0 0 2 0 6 0 16 961.509 0 0 0 0 10 37 624 2 0 0 0 1 2 2 3 1 9 3 3 2 0 0 0 0 0 0 6 0 0 22 5 4 3 22 6 4 2 0 0 1 0 0 30 0 0 3 0 0 1 30 3 0 0 # 14.332 7.41 4.762 # ALA 452 Env_3bz3_14 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 4 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 2 0 1 0 0 0 0 0 0 0 0 0 0.4829 4 3 1 0 0 0 0 1 0 0 0 3 114.667 0 0 0 0 0 2 16 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 2 0 1 0 0 0 2 0 0 0 0 0 -1.6414 6 3 1 2 0 0 0 1 0 2 0 4 137.655 0 0 0 0 -1 6 67 0 0 0 0 0 0 0 1 1 0 3 1 0 0 0 0 0 0 0 0 0 0 3 1 1 1 3 1 2 0 0 0 0 0 0 4 1 0 1 0 0 0 5 1 0 0 2 6 1 0 0 0 0 3 0 0 0 0 0 -1.2588 12 9 0 3 0 0 0 0 0 3 1 8 329.083 0 0 0 0 1 9 127 0 0 1 0 0 0 0 3 1 4 0 2 0 1 0 0 0 0 0 0 0 0 5 2 2 3 5 4 3 0 0 1 1 0 4 2 1 0 3 0 0 2 7 3 0 0 2 9 3 4 0 0 1 0 0 0 0 0 0 -3.0993 19 14 5 0 0 0 0 4.5 0.5 0 4 8 525.3 0 0 0 0.5 4 30 192 1 0 1 1 0 0 0 0 3 3 2 2 0 2 0 0 0 0 0 4 0 0 12 3 4 0 12 1 5 1 0 1 5 0 3 4 1 0 5 0 0 6 8 5 0 0 6 19 5 5 0 0 1 6 0 1 0 0 0 -3.3243 43 30 6 7 0 0 1 5.5 0.5 6 6 22 1129.41 0 0 0 0.5 4 47 363 3 0 2 3 0 0 0 0 5 1 11 1 1 4 0 1 0 0 0 11 0 0 31 4 8 0 31 3 6 3 0 2 19 0 1 8 2 0 11 0 0 21 11 11 0 0 # 11.729 3.393 17.258 # LEU 562 Env_3bz3_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 0 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 1 0 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 0 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 4 0 0 0 0 0 0 4 0 0 0 2 1 0 1 0 0 0 1 0 0 0 0 0 0.2127 5 3 1 1 0 0 0 1 0 1 0 4 126.161 0 0 0 0 -1 3 17 1 0 0 0 0 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 4 1 0 0 4 0 1 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 2 7 0 1 0 0 0 4 0 0 0 0 0 -2.3707 14 9 1 4 0 0 0 1 0 4 0 10 361.703 0 0 0 0 -1 9 280 2 0 0 0 0 0 0 0 5 2 1 3 0 0 0 0 1 0 0 0 0 0 5 3 6 0 5 1 8 0 0 0 0 0 0 13 0 0 1 0 0 0 13 1 0 0 4 18 7 7 0 0 2 2 0 0 0 0 0 -4.2419 40 29 9 2 0 0 0 7.5 1.5 2 9 18 1055.76 0 0 0 0.5 5 51 794 2 0 0 0 0 4 0 1 2 8 3 1 1 0 0 0 3 9 0 6 0 0 20 1 18 1 29 8 3 0 0 0 0 0 0 37 0 0 3 0 0 0 37 3 0 0 6 14 4 4 0 0 0 5 0 1 0 0 0 -1.6246 34 24 4 6 0 0 1 4 0 5 4 20 907.459 0 0 0 0 1 33 965 0 0 0 2 0 1 2 3 2 6 3 1 3 0 0 0 1 5 0 5 0 0 17 5 9 3 22 5 3 4 0 0 0 0 0 33 0 0 1 0 0 0 33 1 0 0 # 13.813 11.608 0.873 # ILE 453 Env_3bz3_16 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 11 297 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 3 0 0 0 0 3 0 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 99 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 1 0 0 0 0 1 0 0 0 0 2 0 1 0 0 0 1 0 0 0 0 0 -0.9901 4 2 1 1 0 0 0 1 0 1 0 3 92.651 0 0 0 0 -1 1 304 0 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 4 0 0 0 0 1 0 0 0 0 3 0 0 0 1 3 0 0 0 3 4 0 2 0 0 0 2 0 0 0 0 0 -0.6187 11 7 2 2 0 0 0 2 0 2 0 9 285.832 0 0 0 0 -2 4 852 0 3 0 0 0 0 0 3 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 3 0 3 5 3 3 0 0 0 6 0 0 0 0 0 5 0 0 6 0 5 0 0 4 6 2 4 0 0 0 3 2 0 0 0 0 -2.6114 21 12 4 5 0 0 0 4 0 4 2 13 494.515 0.999 0.999 0 0.999 -4 23 1430 0 3 0 0 0 2 4 3 0 0 2 0 0 3 0 3 0 0 1 0 0 0 5 7 6 3 5 9 3 4 0 0 9 0 0 1 0 5 6 0 0 9 6 6 0 0 3 7 2 1 0 1 0 4 1 0 0 0 0 -2.4562 19 12 2 5 0 0 0 1 1 4.5 2 10 489.96 1.333 0.333 1 1.333 -2 27 1138 0 1 0 2 0 0 1 1 0 0 1 2 0 6 0 2 0 0 3 0 0 0 7 6 5 1 7 6 3 3 0 0 6 0 0 3 0 4 6 0 0 6 7 6 0 0 # 1.70367 9.42767 8.84967 # GLN 432 Env_3bz3_17 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 45 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 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.1143 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 2 135 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 2 3 0 1 0 0 0 2 0 0 0 1 0 -1.6158 9 5 1 2 1 0 0.5 1 0 2 0 5 231.196 0 0 0 0 -2 9 227 0 0 0 0 2 0 0 1 0 0 4 0 0 0 0 0 0 0 0 2 0 0 6 0 2 1 6 3 0 0 0 0 0 0 0 7 0 0 2 0 0 0 7 2 0 0 2 2 0 0 0 0 0 2 0 0 0 0 0 -0.1376 6 4 0 2 0 0 0 0 0 2 0 6 157.028 0 0 0 0 -2 0 55 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 4 0 0 4 1 0 1 4 1 1 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 5 11 0 9 0 0 0 4 0 0 0 0 0 -3.5822 29 16 9 4 0 0 0 9 0 4 0 23 709.369 0 0 0 0 -7 9 612 0 0 2 0 4 0 3 4 0 0 4 4 0 0 0 1 0 0 0 7 0 0 11 7 7 4 11 11 4 3 0 2 1 0 0 19 0 0 7 0 0 3 19 7 0 0 5 18 0 4 0 0 0 6 0 1 0 0 0 -3.5291 34 23 4 7 0 0 1 4 0 6 0 21 913.399 0 0 0 0 0 22 1106 1 2 2 1 1 0 3 1 0 0 8 2 0 0 0 3 1 0 0 9 0 0 18 8 7 1 18 8 4 4 0 5 2 0 0 17 5 0 5 0 0 7 22 5 0 0 # 12.835 0.333 10.183 # LEU 553 Env_3bz3_18 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 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -1.1414 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0.2109 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 71 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 2 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 4 8 5 2 0 0 0 5 0 0 0 0 0 -2.5127 24 17 2 5 0 0 0 2 0 5 5 14 614.527 0 0 0 0 3 25 955 0 0 0 0 1 0 0 3 0 0 8 0 0 6 0 5 0 0 0 1 0 0 15 0 6 3 15 9 0 0 0 0 6 0 0 12 6 0 0 0 0 6 18 0 0 0 3 13 1 6 0 0 0 3 0 0 0 0 0 -3.4808 26 17 6 3 0 0 0 6 0 3 1 18 681.985 0 0 0 0 -3 16 1044 0 0 2 0 4 0 4 1 0 0 8 0 0 1 0 3 0 0 0 3 0 0 12 4 9 1 12 10 0 4 0 0 5 0 0 14 4 0 3 0 0 5 18 3 0 0 7 14 5 5 0 0 0 5 0 3 0 1 0 -4.9093 40 26 5 8 1 0 3.5 5 0 5 6 20 1023.59 0 0 0 0 -1 51 1217 0 0 3 1 5 0 1 0 0 0 6 2 0 3 0 3 4 0 7 5 0 0 14 4 22 0 14 22 2 2 0 0 14 0 0 16 8 0 2 0 0 14 24 2 0 0 # 15.39 -4.596 9.568 # VAL 554 Env_3bz3_19 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6761 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 90 0 0 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0.0828 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 1 3 270 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0.1816 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 180 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 2 4 0 1 0 0 0 4 0 0 0 0 0 -1.713 11 6 1 4 0 0 0 1 0 4 0 8 261.173 0 0 0 0 -2 6 358 1 0 0 0 3 0 0 0 0 0 5 0 0 0 0 1 1 0 0 0 0 0 6 0 5 0 6 5 0 0 0 0 0 0 0 2 2 0 7 0 0 0 4 7 0 0 1 7 0 1 0 0 0 1 0 0 0 0 0 -1.0959 10 8 1 1 0 0 0 1 0 1 0 6 293.711 0 0 0 0 2 9 364 0 0 0 0 1 0 0 0 0 0 6 0 0 0 0 2 0 0 0 1 0 0 7 0 3 0 7 3 0 0 0 0 0 0 0 3 3 0 4 0 0 0 6 4 0 0 3 7 0 6 0 0 0 2 0 1 0 0 0 -2.7461 19 10 6 3 0 0 1 6 0 2 0 12 460.067 0 0 0 0 -7 13 694 4 0 0 0 1 1 0 1 0 0 4 0 0 0 0 6 0 0 0 2 0 0 10 0 8 1 10 9 0 0 0 0 0 0 0 14 3 0 2 0 0 0 17 2 0 0 # 20.753 0.069 4.485 # THR 503 Env_3bz3_20 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 12 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 0 3 0 1 0 0 0 0 0 0 0 0 0 -1.1414 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 48 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 0 0 1 0 0 0 2 0 0 0 0 0 -0.4177 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 133 0 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 2 0 0 2 1 1 1 2 1 1 1 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 3 7 0 2 0 0 0 3 0 0 0 0 0 -1.4111 15 10 2 3 0 0 0 2 0 3 0 12 397.856 0 0 0 0 -2 7 432 0 0 0 2 0 0 0 3 2 4 1 3 0 0 0 0 0 0 0 0 0 0 5 5 2 3 5 3 5 2 0 0 1 0 0 14 0 0 0 0 0 1 14 0 0 0 4 12 1 7 0 0 1 2 0 0 0 1 0 -2.7786 28 17 8 2 1 0 0.5 7.5 0.5 2 2 17 719.344 0 0 0 0.5 -3 20 1328 1 0 0 2 1 1 3 4 4 7 2 2 0 0 0 0 1 0 0 0 0 0 10 7 7 4 10 7 6 5 0 0 2 0 0 21 0 2 3 0 0 2 23 3 0 0 5 16 2 0 0 0 0 6 1 1 0 0 0 -2.4373 31 23 0 8 0 0 1 0 0 6.5 2 15 844.079 0.666 0.666 0 0.666 -1 34 1364 3 1 0 2 4 1 3 2 2 3 1 3 0 0 0 0 6 0 0 0 0 0 7 9 13 2 7 13 6 5 0 0 1 0 0 22 0 1 7 0 0 1 23 7 0 0 # 8.711 7.537 2.609 # VAL 436 Env_3bz3_21 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 51 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 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 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 17 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 0 1 0 0 0 1 0 1 0 0 0 -1.4371 6 3 1 2 0 0 1 1 0 1 0 4 143.318 0 0 0 0 -3 3 54 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 6 0 0 6 0 0 0 2 4 0 0 0 0 0 0 0 0 6 0 0 0 0 3 4 1 1 1 0 0 5 0 0 0 0 0 -1.2608 15 8 2 5 0 0 0 1 1 5 0 10 347.335 0.333 0 0.333 0.333 -5 15 682 1 8 2 1 0 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 2 9 4 0 2 4 8 1 0 10 3 0 0 0 0 1 1 0 0 13 1 1 0 0 6 4 1 5 2 0 0 1 1 0 0 0 0 -1.3041 20 11 7 2 0 0 0 6 1 1.5 1 13 493.864 1.332 0.666 0.666 1.332 -7 23 575 5 4 0 6 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 1 0 0 9 10 1 0 9 0 5 6 0 4 1 0 0 1 0 4 10 0 0 5 5 10 0 0 5 11 1 6 0 0 2 6 1 0 0 0 0 -5.7787 32 17 8 7 0 0 0 7 1 6.5 3 25 765.32 0.333 0.333 0 1.333 -11 17 1500 3 3 0 4 0 0 0 4 2 2 3 0 0 3 0 0 0 0 4 4 0 0 15 7 6 4 15 8 5 4 0 3 6 0 0 4 0 0 19 0 0 9 4 19 0 0 # 4.28567 2.61533 13.4823 # ASN 551 Env_3bz3_22 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 18 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 0 0 1 0 0 0 0 1 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.2654 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 318 0 0 0 0 0 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 3 0 4 0 1 0 0 0 0 0 1 0 1 3 0 0 0 2 3 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 3 233 0 0 0 0 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 0 1 0 0 1 0 0 1 0 1 0 0 0 1 2 0 0 0 3 6 0 3 0 0 0 1 0 0 0 0 0 -0.3219 13 9 3 1 0 0 0 3 0 1 0 8 342.564 0 0 0 0 -1 11 1077 0 0 0 0 0 5 3 3 0 0 0 0 0 1 0 0 0 0 0 1 0 0 2 3 5 3 2 8 0 3 0 0 0 0 0 4 0 9 0 0 0 0 13 0 0 0 3 10 0 3 0 0 0 3 0 0 0 0 0 -1.831 19 13 3 3 0 0 0 3 0 3 0 11 522.815 0 0 0 0 1 16 1111 0 0 0 4 0 3 1 2 0 0 4 0 0 3 0 0 0 0 0 2 0 0 9 5 3 2 9 5 0 5 0 0 4 0 0 9 0 6 0 0 0 4 15 0 0 0 4 9 3 2 0 0 0 4 1 0 0 0 0 -2.3459 23 16 2 5 0 0 0 2 0 4.5 3 12 584.707 0.666 0.666 0 0.666 0 28 702 0 0 0 2 0 0 1 3 0 0 3 5 0 4 0 0 3 0 0 2 0 0 9 8 3 3 9 6 5 3 0 0 6 0 0 11 0 3 3 0 0 6 14 3 0 0 # 3.389 8.909 4.483 # GLY 431 Env_3bz3_23 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 5 173 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 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 19 692 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 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.039 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 173 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 1 0 0 0 0 0 0 0 0 0 0 0 -0.0006 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 173 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 1 0 0 0 0 0 0 1 0 0 0 0 -1.0651 2 1 0 1 0 0 0 0 0 0.5 0 1 47.647 0.333 0.333 0 0.333 -1 3 191 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 3 4 1 2 2 0 0 4 1 0 0 0 0 -2.2675 17 8 4 5 0 0 0 2.5 1.5 4.5 0 9 375.613 1.332 0.666 0.666 1.332 -7 27 1428 0 9 0 1 0 0 1 2 1 0 0 0 0 2 0 0 0 0 1 0 0 0 2 11 2 2 2 3 10 2 0 0 5 0 0 0 0 6 6 0 0 5 6 6 0 0 # -0.129 12.562 16.837 # ARG 569 Env_3bz3_24 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 6 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 0 1 0 0 0 0 1 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -1.1414 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 24 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 0 0 1 0 0 0 1 0 0 0 0 0 0.2786 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 69 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 2 0 0 3 1 0 0 3 0 1 0 0 0 0 0 1 0 0 0 3 0 0 0 1 3 0 0 4 5 0 1 0 0 0 4 1 0 0 1 0 -1.5423 16 9 1 5 1 0 0.5 1 0 4.5 0 11 389.43 0.666 0.666 0 0.666 -5 14 371 0 0 0 1 1 0 4 2 0 2 2 3 1 0 0 0 0 0 0 0 0 0 5 8 1 2 5 3 3 5 0 0 0 0 2 7 0 0 7 0 0 0 9 7 0 0 2 15 0 4 0 0 0 1 1 0 1 0 0 -2.9477 24 17 4 2 1 0 0 4 0 1.5 0 10 678.37 0.333 0.333 0 0.333 7 30 454 0 0 0 2 0 0 5 2 0 3 3 4 5 0 0 0 0 0 0 0 0 0 11 11 0 2 11 2 4 7 0 0 1 0 3 15 0 0 5 0 0 1 18 5 0 0 5 16 2 4 0 1 0 6 1 1 1 0 0 -4.6527 37 23 5 8 1 0 1 4 1 6.5 2 19 960.658 1.666 0.666 1 1.666 -2 45 740 0 0 0 4 3 0 0 0 3 1 9 8 5 3 0 1 0 0 0 0 0 0 18 12 7 0 18 4 11 4 0 0 6 0 1 13 2 0 15 0 0 6 16 15 0 0 # 15.053 6.411 12.278 # VAL 484 Env_3bz3_25 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 11 333 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 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 111 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 1 0 0 0 0 0 0 1 0 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 1 111 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 1 0 0 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4766 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 222 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 2 0 1 0 0 0 3 0 0 0 0 0 -1.2213 8 4 1 3 0 0 0 1 0 3 0 6 182.659 0 0 0 0 -3 4 479 0 1 0 0 0 0 2 1 0 1 2 0 0 0 0 1 0 0 0 0 0 0 3 3 1 1 3 2 1 2 0 1 2 0 0 5 0 0 0 0 0 3 5 0 0 0 4 11 0 3 0 0 0 2 0 1 0 0 0 -0.5391 21 15 3 3 0 0 1 3 0 2 0 16 585.206 0 0 0 0 -2 7 916 0 7 0 0 0 0 0 4 0 3 3 0 0 0 0 3 0 0 0 1 0 0 7 7 3 4 7 7 7 0 0 3 9 0 0 9 0 0 0 0 0 12 9 0 0 0 # 6.83 -1.77967 5.01333 # GLU 506 Env_3bz3_26 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 28 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 -0.3054 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 271 0 0 0 0 0 0 1 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 3 1 3 0 1 0 0 0 0 0 4 1 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 -0.5679 1 0 0 1 0 0 0 0 0 1 0 1 11.494 0 0 0 0 -1 0 76 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 3 6 0 2 0 0 0 4 0 0 0 0 0 -1.8506 15 9 2 4 0 0 0 2 0 4 0 11 375.84 0 0 0 0 -2 7 1026 0 0 0 0 2 0 5 0 0 0 4 0 0 0 0 0 2 0 0 2 0 0 6 5 4 0 6 4 0 5 0 0 0 0 0 8 5 0 2 0 0 0 13 2 0 0 3 10 0 2 0 0 0 0 0 0 0 0 0 1.4641 15 13 2 0 0 0 0 2 0 0 0 8 450.973 0.333 0.333 0 0.333 3 12 565 0 0 0 0 2 0 1 0 0 0 6 0 0 0 0 0 2 0 0 4 0 0 10 1 4 0 10 4 0 1 0 0 1 0 0 9 3 0 2 0 0 1 12 2 0 0 2 16 2 4 0 0 0 4 2 1 0 1 0 -7.1478 32 20 4 7 1 0 1.5 4 0 5 2 12 824.756 0.666 0.666 0 0.666 1 48 1295 0 0 0 0 2 1 2 0 0 4 9 0 0 5 0 4 2 0 0 3 0 0 21 2 9 0 21 9 0 2 0 0 9 0 0 15 4 0 4 0 0 9 19 4 0 0 # 13.163 -2.137 5.467 # GLY 505 Env_3bz3_27 0 0 0 0 0 0 0 0 0 0 0 1 0 -0.3118 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 57 0 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 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.123 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 0 1 57 0 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 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 1 0 2 0 0 0 2 0 0 0 0 0 -1.3486 6 2 2 2 0 0 0 2 0 2 0 6 118.282 0 0 0 0 -4 0 231 0 0 0 0 2 0 0 2 0 1 0 0 0 0 0 0 0 0 0 1 0 0 2 0 2 2 2 4 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 4 4 1 2 0 0 1 1 2 0 0 0 0 -0.8679 15 9 3 3 0 0 0 2.5 0.5 2 2 9 363.849 0.999 0.999 0 1.499 -5 16 633 0 0 0 5 2 0 0 2 2 2 0 0 0 0 0 0 0 0 0 2 0 0 4 5 4 2 4 4 2 5 0 0 0 0 0 15 0 0 0 0 0 0 15 0 0 0 3 9 2 3 0 0 1 3 1 0 0 0 0 -1.9012 22 14 4 4 0 0 0 3.5 0.5 3.5 3 11 547.898 0.666 0.666 0 1.166 -2 24 1886 0 2 0 3 0 0 6 0 6 3 0 0 0 0 0 0 0 0 0 2 0 0 5 11 6 0 5 0 8 9 0 0 0 0 0 22 0 0 0 0 0 0 22 0 0 0 3 6 0 2 0 1 0 2 1 0 0 0 0 -2.6241 15 9 3 3 0 0 0 2 1 2.5 0 8 400.499 1.333 0.333 1 1.333 1 18 1172 0 3 0 0 0 1 2 4 1 1 0 1 0 0 0 0 0 0 0 2 0 0 3 6 2 4 3 5 5 2 0 0 0 0 0 11 1 2 1 0 0 0 14 1 0 0 # 6.867 5.307 -2.636 # CYS 427 Env_3bz3_28 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 70 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 1 0 0 0 0 0 0 0 0 0 1 0 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 16 210 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 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.095 3 3 0 0 0 0 0 0 0 0 0 0 100.53 0 0 0 0 2 6 142 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 0 0 1 0 2 0 0 2 0 0 0 0 0 1 0 0 0 2 1 0 0 0 0 2 8 1 0 0 0 0 1 0 0 0 0 -2.6996 12 10 1 1 0 0 0 1 0 0.5 8 0 305.87 0.333 0.333 0 0.333 7 42 553 0 1 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 6 2 0 0 0 1 2 9 0 7 3 1 1 0 8 0 0 0 0 0 0 4 0 0 8 0 4 0 0 7 11 4 3 0 0 1 5 0 0 0 0 0 -1.0327 31 22 4 5 0 0 0 3 1 5 6 16 779.047 0.333 0.333 0 0.333 -1 33 1306 4 3 4 5 0 0 0 0 0 2 0 0 0 0 3 1 0 4 5 0 0 0 9 8 14 0 13 10 3 5 0 11 1 0 0 0 0 4 15 0 0 12 4 15 0 0 5 6 1 6 0 0 0 4 3 1 0 0 0 -5.0092 26 12 6 8 0 0 1 6 0 5.5 1 20 585.497 0.999 0.999 0 0.999 -12 25 1320 3 4 1 2 0 0 2 0 0 2 0 0 1 0 3 2 0 2 4 0 0 0 9 8 9 0 11 7 4 4 0 7 5 0 0 0 0 1 13 0 0 12 1 13 0 0 # -0.023 0.322 14.118 # ARG 550 Env_3bz3_29 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 7 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 1 0 0 0 0 0 0 0 0 1 0 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 95 0 0 0 0 0 0 0 3 0 0 1 0 0 1 0 0 0 0 0 0 0 0 2 0 0 3 2 3 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 1 0 0 0 0 0 0 1 3 0 0 0 0 -2.2013 5 1 0 4 0 0 0 0 0 2.5 0 1 74.484 1.332 1.332 0 1.332 -4 14 104 0 0 0 1 0 0 3 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 4 0 0 1 0 0 4 0 0 4 0 0 0 0 0 1 0 0 4 0 1 0 0 3 8 0 3 0 1 0 1 1 0 0 0 0 -1.1053 17 11 4 2 0 0 0 3 1 1.5 0 8 457.231 1.666 0.666 1 1.666 2 18 843 0 3 0 4 0 0 2 0 0 0 3 1 0 3 0 1 0 0 0 0 0 0 6 10 1 0 6 1 4 6 0 0 9 0 0 1 0 0 7 0 0 9 1 7 0 0 3 10 1 1 0 0 0 3 0 1 0 0 0 -1.567 19 14 1 4 0 0 1 1 0 3 1 8 519.346 0 0 0 0 -2 29 956 0 2 0 2 0 3 3 0 0 0 3 1 0 1 0 4 0 0 0 0 0 0 4 8 7 0 4 7 3 5 0 0 11 0 0 1 0 3 4 0 0 11 4 4 0 0 1 7 5 3 2 0 0 4 0 1 1 0 0 -5.4926 24 13 5 5 1 0 1 3.5 1.5 4 4 8 571.816 0.666 0 0.666 0.666 1 47 1434 1 5 0 1 0 2 1 1 0 0 1 1 2 5 0 1 3 0 0 0 0 0 9 8 6 1 9 7 6 2 0 0 12 0 0 1 0 4 7 0 0 12 5 7 0 0 # 5.399 11.199 12.356 # GLY 566 Env_3bz3_30 0 0 0 0 0 0 0 0 0 0 0 1 0 -0.3118 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 9 0 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 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 -0.123 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 0 1 9 0 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 1 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 1 0 0 0 -1.4784 5 3 1 1 0 0 1 1 0 0 0 2 131.824 0 0 0 0 0 5 95 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 2 0 3 0 2 3 0 0 0 0 0 0 0 2 0 0 3 0 0 0 2 3 0 0 4 9 0 2 0 0 0 4 1 0 0 0 0 -1.1966 20 13 2 5 0 0 0 2 0 4.5 0 12 524.017 0.333 0.333 0 0.333 -1 17 493 0 0 0 0 2 0 1 0 0 0 7 3 0 0 0 3 0 0 0 4 0 0 11 4 5 0 11 5 3 1 0 0 0 0 0 15 0 0 5 0 0 0 15 5 0 0 5 9 0 5 0 1 0 4 1 0 0 0 0 -3.3933 25 14 6 5 0 0 0 5 1 4.5 0 17 620.517 1.666 0.666 1 1.666 -6 24 702 0 0 0 0 0 0 6 1 0 0 5 6 0 0 0 1 1 0 0 5 0 0 10 12 2 1 10 3 6 6 0 0 0 0 0 19 1 0 5 0 0 0 20 5 0 0 8 13 0 8 0 0 0 5 0 0 0 1 0 -1.8044 35 21 8 5 1 0 0.5 8 0 5 0 28 900.797 0 0 0 0 -9 12 810 0 0 0 0 3 0 2 6 0 3 7 1 0 0 0 2 3 0 0 8 0 0 18 3 8 6 18 14 1 2 0 0 0 0 3 20 4 0 8 0 0 0 27 8 0 0 # 16.144 1.998 10.244 # CYS 502 Env_3bz3_31 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 5 169 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 1 0 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 16 507 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 3 0 0 0 0 0 0 3 0 0 0 1 2 0 1 0 0 0 1 0 0 0 0 0 -0.7666 5 3 1 1 0 0 0 1 0 1 0 0 123.522 0 0 0 0 -1 16 452 0 2 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 3 0 0 3 2 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.3853 3 3 0 0 0 0 0 0 0 0 0 0 100.53 0 0 0 0 3 5 266 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 1 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 3 0 1 0 0 0 2 0 0 0 0 0 -0.908 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 2 830 0 4 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 1 2 4 0 0 0 0 0 0 7 0 0 0 0 0 0 7 0 0 0 2 5 0 3 0 0 0 1 0 0 0 0 0 -0.7708 11 7 3 1 0 0 0 3 0 1 0 9 288.475 0 0 0 0 -2 5 605 0 0 0 0 3 2 0 1 0 4 0 0 0 0 0 0 1 0 0 0 0 0 4 0 6 1 4 7 0 0 0 0 0 0 0 10 1 0 0 0 0 0 11 0 0 0 # 14.487 -0.665 -2.882 # ARG 426 Env_3bz3_32 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 11 495 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 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 165 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 1 0 0 0 0 0 0 1 0 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 1 165 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 1 0 0 0 0 0 0 1 0 0 0 1 1 0 1 0 0 0 0 1 0 0 0 0 -0.6808 4 2 1 1 0 0 0 1 0 0.5 0 3 95.294 0.333 0.333 0 0.333 -2 3 406 0 0 0 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 1 0 1 0 3 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 1 0 0 0 0 0 2 0 0 0 1 0 -0.151 6 3 0 2 1 0 0.5 0 0 2 0 4 137.108 0.333 0.333 0 0.333 -3 4 486 0 0 0 1 1 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 2 0 3 0 3 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 1 3 0 4 0 0 0 2 1 0 0 0 0 -3.2183 11 4 4 3 0 0 0 4 0 2.5 0 8 227.713 0.333 0.333 0 0.333 -6 5 360 0 0 0 4 1 0 0 5 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 4 1 5 1 6 0 4 0 0 0 0 0 7 0 2 2 0 0 0 9 2 0 0 # 1.35133 4.49 -1.26867 # GLU 430 Env_3bz3_33 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 30 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 0 3 0 0 0 0 3 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 10 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 0 1 0 0 0 0 1 0 0 1 3 0 2 0 1 0 0 0 0 0 0 0 -0.7039 7 4 3 0 0 0 0 2 1 0 0 4 195.824 1 0 1 1 -1 12 58 0 0 0 2 0 0 0 1 0 0 0 3 0 1 0 0 0 0 0 0 0 0 1 5 0 1 1 1 3 2 0 0 2 0 0 3 0 0 2 0 0 2 3 2 0 0 2 8 0 2 0 0 0 1 1 0 0 0 0 -1.4384 14 10 2 2 0 0 0 2 0 1.5 0 8 389.005 0.333 0.333 0 0.333 1 16 389 0 0 0 2 0 0 1 2 0 0 5 0 2 2 0 0 0 0 0 0 0 0 9 3 0 2 9 2 0 3 0 0 11 0 0 1 0 0 2 0 0 11 1 2 0 0 4 13 0 1 0 0 0 4 0 0 2 0 0 -1.4082 24 17 1 4 2 0 0 1 0 4 0 9 669.894 0.333 0.333 0 0.333 9 32 359 0 0 0 0 0 0 6 3 0 1 2 2 6 2 0 1 0 0 0 1 0 0 12 8 1 3 12 4 2 6 0 0 15 0 0 6 0 0 3 0 0 15 6 3 0 0 0 9 3 3 0 0 0 3 1 1 0 0 0 -4.5673 20 12 3 5 0 0 1 3 0 3.5 3 9 483.398 0.333 0.333 0 0.333 -1 25 297 2 0 0 0 0 1 2 1 0 3 1 0 2 3 0 3 0 0 0 2 0 0 13 2 4 1 13 5 0 2 0 0 13 0 0 3 0 1 3 0 0 13 4 3 0 0 # 9.32833 10.4147 10.8603 # ASP 564