# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3kl6 # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/3kl6_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_3kl6_0 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 1 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 5 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 11 0 0 0 0 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 1 0 0 3 0 0 1 3 1 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 5 0 1 0 0 0 7 0 1 0 0 0 -3.9164 16 7 1 8 0 0 1 1 0 7 0 13 346.322 0 0 0 0 -8 5 40 0 0 0 1 0 0 0 4 0 0 0 0 0 0 0 0 8 0 0 3 0 0 3 1 8 4 3 12 0 1 0 0 0 0 0 13 1 0 2 0 0 0 14 2 0 0 5 18 1 6 0 0 0 0 0 0 0 0 0 -0.6097 30 24 6 0 0 0 0 6 0 0 1 18 882.073 0 0 0 0 5 22 31 3 0 0 1 0 0 0 7 0 3 3 0 0 0 0 3 3 0 4 3 0 0 12 1 10 7 12 17 0 1 0 1 0 0 0 16 3 0 10 0 0 1 19 10 0 0 9 16 2 8 0 0 0 6 2 3 0 0 0 -5.2111 46 27 8 11 0 0 3 8 0 7 2 28 1133.72 0.999 0.999 0 0.999 -9 35 202 4 0 0 5 0 0 0 0 4 5 4 3 0 0 3 3 6 0 4 5 0 0 21 8 17 0 21 13 7 5 0 4 0 0 0 31 1 0 10 0 0 4 32 10 0 0 # 13.221 -5.806 -7.8 # ILE 202 Env_3kl6_1 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 32 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 0 191 0 0 0 0 0 0 1 3 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 3 1 3 0 1 0 0 0 0 0 1 0 1 3 0 0 0 2 3 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 43 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 5 4 3 0 0 0 3 0 0 0 0 0 -2.8606 16 10 3 3 0 0 0 3 0 3 4 9 372.153 0 0 0 0 1 18 603 0 0 0 0 0 0 4 2 0 2 0 0 0 0 0 0 0 7 1 0 0 0 2 4 8 2 9 3 0 4 0 0 0 0 0 9 0 6 1 0 0 0 15 1 0 0 4 6 4 2 0 0 0 1 1 0 0 0 0 -0.2431 18 14 2 2 0 0 0 2 0 1.5 4 10 489.147 0.333 0.333 0 0.333 1 27 367 0 0 0 1 1 0 1 5 0 4 0 0 0 0 0 1 0 4 1 0 0 0 4 2 7 5 8 8 0 2 0 0 0 0 1 12 0 4 1 0 0 0 17 1 0 0 5 9 0 3 0 0 1 3 2 0 1 0 0 -2.1484 24 14 4 5 1 0 0.5 3 1 4 1 13 595.545 1.332 1.332 0 1.332 -6 27 585 2 0 0 2 4 0 2 1 0 2 0 5 0 0 0 3 0 1 2 0 0 0 4 9 10 1 5 10 5 4 0 0 0 0 2 7 0 7 8 0 0 0 16 8 0 0 # 1.765 -5.015 -13.676 # GLY 206 Env_3kl6_2 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 17 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 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 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 34 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 0 0 0 0 0 0 2 0 0 0 0 2 0 0 2 2 1 3 0 0 0 0 1 0 0 0 0 -0.825 9 5 3 1 0 0 0 3 0 0.5 1 5 204.178 0.666 0.666 0 0.666 -2 11 765 0 0 0 0 0 0 2 0 0 0 0 0 0 4 0 3 0 0 0 0 0 0 4 2 3 0 4 3 0 2 0 0 0 0 0 0 0 7 2 0 0 0 7 2 0 0 3 3 4 0 0 1 0 3 1 0 0 0 0 -1.6623 15 10 1 4 0 0 0 0 1 3.5 4 7 383.331 1.333 0.333 1 1.333 3 31 1058 0 0 0 0 0 0 2 0 0 1 0 1 0 4 0 5 0 2 0 0 0 0 5 3 7 0 7 5 1 2 0 0 0 0 0 2 2 8 3 0 0 0 12 3 0 0 0 7 5 1 0 0 0 2 0 2 0 0 0 -3.4342 17 12 1 4 0 0 2 1 0 2 5 4 438.614 0 0 0 0 2 37 1308 0 0 0 0 0 0 1 0 0 2 0 3 0 3 0 6 0 2 0 0 0 0 5 4 8 0 7 6 3 1 0 0 1 0 0 2 3 7 4 0 0 1 12 4 0 0 4 7 2 3 0 0 0 3 0 0 0 0 0 -0.3031 19 13 3 3 0 0 0 3 0 3 2 13 486.661 0 0 0 0 -1 15 1149 0 0 0 0 1 0 2 1 0 8 2 2 0 0 0 1 0 2 0 0 0 0 10 4 4 1 12 3 2 2 0 0 4 0 0 4 1 2 8 0 0 4 7 8 0 0 # -4.251 -3.718 -8.932 # SER 160 Env_3kl6_3 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 17 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 0 0 0 0 1 0 0 0 0 0 1 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 34 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 0 0 0 0 2 0 0 0 0 0 2 0 0 0 1 0 1 1 0 0 1 0 0 0 0 0 0 0.0655 4 2 2 0 0 0 0 1.5 0.5 0 2 2 94.747 0 0 0 0.5 -2 8 56 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 4 0 0 2 2 0 0 2 0 0 0 0 2 0 0 0 0 2 2 0 0 0 2 2 1 3 0 0 1 4 0 0 1 0 0 -3.6795 14 5 4 4 1 0 0.5 3.5 0.5 4 2 10 289.606 0 0 0 0.5 -8 10 189 0 0 0 2 2 1 0 2 2 0 0 0 0 0 0 3 0 0 0 2 0 0 2 2 8 2 2 8 2 2 0 2 0 0 0 5 4 0 3 0 0 2 9 3 0 0 4 12 1 3 0 0 0 4 0 0 1 0 0 -1.0527 25 17 3 4 1 0 0.5 3 0 4 1 18 671.647 0 0 0 0 -4 10 743 0 0 0 3 4 5 0 4 1 0 0 0 0 1 0 2 0 2 0 3 0 0 4 3 14 4 6 15 1 3 0 2 0 0 0 10 9 0 4 0 0 2 19 4 0 0 8 9 1 8 0 0 0 1 2 2 0 0 0 -2.6923 31 18 8 5 0 0 2 8 0 2 1 14 754.868 0.999 0.999 0 0.999 -7 43 893 1 0 0 3 7 5 0 4 2 0 0 0 0 1 0 2 0 2 2 2 0 0 4 3 20 4 6 20 2 3 0 5 0 0 0 10 6 0 10 0 0 5 16 10 0 0 # 8.509 -10.003 -14.548 # SER 185 Env_3kl6_4 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 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 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 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 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 0 1 1 0 0 0 3 0 0 0 0 0 -1.1658 7 3 1 3 0 0 0 1 0 3 1 6 142.16 0 0 0 0 -3 4 43 2 0 0 0 2 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 3 0 3 1 3 4 0 0 0 0 0 0 0 6 0 1 0 0 0 0 7 0 0 0 3 5 4 1 0 0 1 2 0 1 0 0 0 -1.5907 17 12 2 3 0 0 1 1.5 0.5 2 6 8 436.094 0 0 0 0.5 0 31 162 0 0 0 0 1 0 0 2 2 0 0 0 0 2 1 0 0 0 5 4 0 0 7 0 8 2 7 8 2 0 0 0 0 0 2 14 0 1 0 0 0 0 17 0 0 0 4 11 11 5 0 0 1 3 0 0 0 0 0 -3.2184 35 26 6 3 0 0 0 5.5 0.5 3 12 16 889.917 0 0 0 0.5 5 46 588 0 0 0 0 2 0 0 5 3 0 0 0 0 4 3 0 0 0 11 7 0 0 14 0 16 5 14 18 3 0 0 0 0 0 7 22 0 2 4 0 0 0 31 4 0 0 7 14 5 4 0 0 0 3 1 1 1 0 0 -2.2446 36 26 4 5 1 0 1.5 4 0 3.5 6 19 966.287 0.333 0.333 0 0.333 3 43 956 0 0 0 1 1 0 1 4 1 3 0 1 0 4 2 0 2 0 11 5 0 0 14 3 15 4 14 18 2 2 0 0 0 0 4 22 0 1 9 0 0 0 27 9 0 0 # 7.886 3.842 -11.658 # ALA 171 Env_3kl6_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 11 339 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 3 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 2 113 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 1 0 0 0 0 0 1 0 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 1 113 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 1 0 0 0 0 0 1 0 0 0 1 2 1 0 2 0 0 0 0 0 0 0 0 0.0581 6 4 2 0 0 0 0 0.5 1.5 0 0 2 166.117 0.666 0 0.666 0.666 -2 18 550 0 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 2 0 0 2 4 0 0 0 0 0 4 0 2 0 0 0 0 0 6 0 0 0 0 2 0 2 1 0 0 1 0 0 0 0 0 -2.2479 6 2 3 1 0 0 0 2.5 0.5 1 0 4 131.217 0.333 0 0.333 0.333 -3 8 394 0 2 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 2 2 0 4 2 0 0 0 0 0 2 0 4 0 0 0 0 0 6 0 0 0 1 1 0 2 0 0 0 2 0 1 2 0 0 -3.291 9 2 2 3 2 0 2 2 0 2 0 3 209.065 0 0 0 0 -6 15 357 0 1 0 0 4 2 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 1 1 7 0 1 7 1 0 0 0 0 0 2 1 2 1 3 0 0 0 6 3 0 0 # 5.06167 -13.397 -19.8257 # GLN 182 Env_3kl6_6 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 75 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 3 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 25 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 1 0 0 0 0 0 1 0 0 0 1 2 2 2 0 0 0 0 0 1 0 0 0 -1.9756 8 5 2 1 0 0 1 2 0 0 2 3 209.295 0 0 0 0 0 14 157 0 0 1 2 0 0 0 0 0 0 0 0 0 3 0 0 2 0 0 0 0 0 3 2 3 0 3 3 0 2 0 0 0 0 0 0 6 0 2 0 0 0 6 2 0 0 1 4 2 1 0 0 0 1 0 0 0 0 0 -0.3752 9 7 1 1 0 0 0 1 0 1 2 3 227.35 0 0 0 0 2 15 176 0 0 2 2 0 0 0 0 0 0 0 0 1 3 0 0 1 0 0 0 0 0 4 2 3 0 4 3 0 2 0 0 0 0 0 1 7 0 1 0 0 0 8 1 0 0 5 5 2 4 0 0 0 4 0 1 1 0 0 -2.4569 22 12 4 5 1 0 1 4 0 4 2 13 544.636 0 0 0 0 -4 23 1096 0 1 4 0 0 2 0 0 0 0 0 0 2 4 0 0 7 0 2 0 0 0 6 1 15 0 6 15 1 0 0 0 0 0 0 2 15 0 5 0 0 0 17 5 0 0 4 10 4 4 3 0 0 5 0 0 0 0 0 -4.5178 30 18 7 5 0 0 0 5 2 5 3 16 739.806 0.999 0 0.999 0.999 -4 48 2396 0 6 1 1 0 5 0 0 0 3 0 0 3 6 0 0 3 0 2 0 0 0 12 7 11 0 12 11 6 1 0 3 0 0 0 3 15 0 9 0 0 3 18 9 0 0 # 4.081 -7.32433 0.92 # ASP 86 Env_3kl6_7 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 2 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 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 -0.6146 3 2 0 1 0 0 0 0 0 0.5 0 1 81.157 0.333 0.333 0 0.333 -1 4 5 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 1 2 0 0 2 0 1 0 0 0 0 0 2 0 0 1 0 0 0 2 1 0 0 2 1 1 2 0 0 0 1 0 0 0 0 0 -0.1967 7 4 2 1 0 0 0 2 0 1 1 4 153.888 0.333 0.333 0 0.333 -2 6 94 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 3 0 2 0 0 0 0 0 2 5 0 2 3 0 2 0 0 0 0 0 5 0 0 2 0 0 0 5 2 0 0 1 3 4 1 0 0 2 4 1 1 0 0 0 -4.6695 17 8 3 6 0 0 1 1.5 1.5 4.5 6 7 354.363 0.333 0.333 0 0.833 -4 25 506 0 0 0 1 0 0 0 0 2 2 0 0 0 0 0 0 2 4 4 2 0 0 4 1 12 0 8 6 2 1 0 2 0 0 0 10 0 0 5 0 0 2 10 5 0 0 6 13 5 2 0 0 1 3 0 0 1 0 0 -0.0886 31 24 3 3 1 0 0 2.5 0.5 3 6 17 861.325 0 0 0 0.5 4 37 490 1 0 0 4 0 0 0 0 2 5 0 0 3 1 0 0 3 4 7 1 0 0 11 4 16 0 15 10 2 4 0 2 0 0 0 20 0 0 9 0 0 2 20 9 0 0 5 14 8 11 0 0 0 4 0 2 0 0 0 -6.9973 44 27 11 6 0 0 2 11 0 4 9 24 1065.78 0 0 0 0 -2 54 880 3 0 1 4 0 0 0 2 4 7 0 0 2 4 0 2 3 2 7 3 0 0 19 4 19 2 21 15 4 4 0 5 0 0 0 17 11 0 11 0 0 5 28 11 0 0 # 6.84 -7.544 -7.98 # SER 204 Env_3kl6_8 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 8 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 16 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 1 1 0 0 0 0 -0.6512 5 2 1 2 0 0 0 1 0 1.5 0 4 106.788 0.333 0.333 0 0.333 -3 3 34 2 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 2 1 0 2 1 0 2 0 0 0 0 1 0 0 0 4 0 0 0 1 4 0 0 2 8 0 0 0 0 0 2 1 1 0 0 0 -2.2026 14 10 0 4 0 0 1 0 0 2.5 0 4 363.52 0.999 0.999 0 0.999 2 25 71 0 0 0 6 2 0 0 0 0 1 0 0 0 0 0 0 0 0 1 4 0 0 5 6 3 0 5 3 0 6 0 0 0 0 4 5 0 0 5 0 0 0 9 5 0 0 3 11 2 5 0 0 0 1 2 0 0 0 0 -3.447 24 16 5 3 0 0 0 5 0 2 3 12 619.704 0.666 0.666 0 0.666 0 29 105 0 0 0 8 2 0 0 1 0 4 1 0 0 0 0 1 0 0 3 4 0 0 9 8 6 1 9 7 0 8 0 0 0 0 4 8 1 0 11 0 0 0 13 11 0 0 6 12 3 8 0 0 0 6 0 0 2 0 0 -4.5531 37 21 8 6 2 0 1 8 0 6 3 25 911.903 0 0 0 0 -7 23 550 1 1 0 0 3 2 1 3 0 4 2 0 0 0 0 6 0 1 3 10 0 0 17 2 15 3 18 17 1 1 0 0 0 0 4 24 3 2 4 0 0 0 33 4 0 0 # 8.874 -2.864 -17.044 # ALA 180 Env_3kl6_9 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 5 111 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 16 333 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 1 2 0 0 0 0 0 0 2 0 0 0 0 -0.8087 5 3 0 2 0 0 0 0 0 1 0 1 115.873 0.999 0.999 0 0.999 -2 14 315 0 1 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 1 0 1 1 3 0 0 0 0 0 0 3 1 1 0 0 0 4 1 0 0 2 2 0 1 0 0 0 1 0 0 0 0 0 0.1746 6 4 1 1 0 0 0 1 0 1 0 4 159.671 0 0 0 0 0 3 380 0 2 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 2 0 2 2 2 0 0 0 0 0 0 0 4 2 0 0 0 4 2 0 0 0 4 0 1 0 0 0 1 0 0 0 0 0 -0.8182 6 4 1 1 0 0 0 1 0 1 0 3 159.671 0 0 0 0 1 4 265 0 0 0 0 1 0 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 1 1 0 2 0 4 0 0 0 0 0 0 2 4 0 0 0 0 6 0 0 0 4 9 0 2 0 0 0 2 1 0 0 0 0 -0.4381 18 13 2 3 0 0 0 2 0 2.5 0 9 488.098 0.666 0.666 0 0.666 -3 24 1047 0 3 0 0 4 0 4 2 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 12 4 2 0 6 8 4 0 0 0 0 0 0 1 8 9 0 0 0 9 9 0 0 # -4.146 -6.158 -19.449 # ARG 211 Env_3kl6_10 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 4 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 16 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 1 1 0 0 1 2 0 0 0 0 0 -0.6268 8 4 2 2 0 0 0 1 1 2 2 5 178.813 0 0 0 0 -3 11 147 0 0 0 0 0 0 0 1 0 3 0 0 0 0 0 0 0 3 1 0 0 0 3 0 4 1 6 2 0 0 0 0 0 0 0 8 0 0 0 0 0 0 8 0 0 0 1 4 7 1 0 0 0 2 0 0 0 0 0 -2.0032 15 12 1 2 0 0 0 1 0 2 7 7 378.438 0 0 0 0 4 29 500 0 0 0 0 0 0 0 2 0 0 0 0 0 1 0 0 0 11 1 0 0 0 1 0 12 2 12 3 0 0 0 0 0 0 0 15 0 0 0 0 0 0 15 0 0 0 4 13 2 6 0 0 0 2 0 1 2 0 0 -2.7775 30 19 6 3 2 0 1.5 6 0 2 2 17 794.779 0 0 0 0 -1 25 280 0 0 0 0 4 0 0 3 0 3 0 0 4 3 0 5 1 0 7 0 0 0 10 0 17 3 10 20 0 0 0 0 0 0 0 23 0 0 7 0 0 0 23 7 0 0 5 6 2 3 0 0 0 5 0 0 1 0 0 -2.0463 22 13 3 5 1 0 0.5 3 0 5 3 15 535.123 0 0 0 0 -4 20 289 2 0 0 0 2 0 1 2 0 3 0 0 3 0 0 1 1 0 6 1 0 0 9 1 10 2 9 12 0 1 0 0 1 0 0 13 0 1 7 0 0 1 14 7 0 0 # 3.821 -3.071 -9.109 # ILE 217 Env_3kl6_11 0 0 0 0 0 0 0 0 0 0 1 0 0 -0.108 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 10 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 1 0 0 -0.187 2 1 0 0 1 0 0.5 0 0 0 0 0 60.031 0 0 0 0 -1 3 26 0 0 0 0 2 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 1 1 0 0 0 1 1 0 0 1 3 0 1 0 0 0 0 0 0 0 0 0 0.1448 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 0 2 230 0 1 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 0 0 4 1 0 0 0 0 0 1 0 1 1 2 0 0 0 3 2 0 0 3 10 0 3 0 0 0 5 0 0 0 0 0 -2.7016 21 13 3 5 0 0 0 3 0 5 0 16 535.511 0 0 0 0 -4 9 1295 2 5 0 0 4 3 3 0 3 0 0 0 0 0 0 0 0 0 0 1 0 0 3 8 10 0 3 7 8 3 0 0 0 0 6 0 6 5 4 0 0 0 17 4 0 0 6 5 0 7 1 0 0 2 1 0 0 0 0 -1.4754 22 11 8 3 0 0 0 7 1 2.5 0 17 525.273 0.333 0.333 0 0.333 -8 12 1038 2 2 0 1 2 2 2 4 1 1 0 1 0 0 0 0 3 0 0 1 0 0 4 6 8 4 4 11 4 3 0 0 0 0 3 0 5 9 5 0 0 0 17 5 0 0 8 14 2 5 1 0 1 7 3 0 0 0 0 -4.7152 41 24 7 10 0 0 0 6 1 8.5 2 23 958.774 2.664 1.998 0.666 3.164 -11 48 1492 4 2 0 8 0 2 4 9 3 3 0 2 0 0 0 0 1 0 0 3 0 0 10 16 6 9 10 12 7 12 0 0 0 0 10 0 10 8 13 0 0 0 28 13 0 0 # 4.879 -6.62 -21.473 # CYS 181 Env_3kl6_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 11 363 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 2 121 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 4 0 1 0 1 0 0 0 0 0 0 0 -0.8015 6 4 2 0 0 0 0 1 1 0 0 2 181.687 1 0 1 1 1 12 822 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 3 3 0 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 3 4 0 1 0 0 0 1 0 1 0 0 0 0.3227 10 7 1 2 0 0 1 1 0 1 0 6 277.358 0 0 0 0 -1 7 1186 0 0 0 0 0 0 1 0 0 0 0 6 0 0 0 0 3 0 0 0 0 0 0 7 3 0 0 3 6 1 0 0 0 0 0 0 7 0 3 0 0 0 7 3 0 0 0 2 0 1 0 0 0 2 0 0 0 0 0 -1.8479 5 2 1 2 0 0 0 1 0 2 0 4 104.145 0 0 0 0 -2 2 337 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 1 4 0 0 4 0 1 0 0 0 0 0 0 2 0 3 0 0 0 2 3 0 0 0 3 0 2 0 0 0 1 0 1 0 0 0 -1.9924 7 3 2 2 0 0 1 2 0 1 0 4 157.455 0 0 0 0 -3 5 415 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 5 0 1 0 0 0 1 0 6 0 1 6 0 0 0 0 0 0 0 0 4 0 3 0 0 0 4 3 0 0 # -0.790333 -17.7857 -2.74233 # GLU 83 Env_3kl6_13 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 24 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 3 0 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 8 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 1 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.4089 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 32 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 2 0 0 2 0 0 2 0 0 0 0 2 0 0 0 2 0 0 0 2 2 0 0 4 5 0 3 0 0 0 3 0 0 0 0 0 -0.8486 15 9 3 3 0 0 0 3 0 3 0 14 378.483 0 0 0 0 -5 1 240 5 0 0 2 2 0 2 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 5 4 4 2 5 6 0 4 0 0 0 0 2 2 0 4 7 0 0 0 8 7 0 0 4 7 0 4 0 0 0 4 0 1 1 0 0 -2.5527 21 11 4 5 1 0 1.5 4 0 4 0 16 514.812 0 0 0 0 -8 12 496 3 1 0 0 6 0 1 4 0 0 0 2 0 0 0 0 0 0 3 1 0 0 4 4 9 4 4 13 3 1 0 0 0 0 1 3 0 9 8 0 0 0 13 8 0 0 6 13 1 7 0 0 0 8 0 0 1 0 0 -6.4788 36 20 7 8 1 0 0.5 7 0 8 2 24 867.712 0 0 0 0 -7 25 1068 2 2 0 0 3 0 4 6 0 1 1 3 0 0 0 0 0 2 5 7 0 0 11 9 10 6 13 14 5 4 0 0 0 0 5 10 0 6 15 0 0 0 21 15 0 0 # 4.47067 -0.761333 -17.479 # ASP 179 Env_3kl6_14 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 27 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 1 0 0 0 0 1 0 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 0 149 0 0 0 0 1 0 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 0 0 5 0 0 0 0 5 0 0 0 1 0 1 0 2 0 0 1 1 0 0 0 0 -1.1797 6 2 2 2 0 0 0 0.5 1.5 1.5 0 1 111.797 1.332 0.666 0.666 1.332 -4 22 503 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 3 3 0 0 0 0 0 0 2 1 3 0 0 0 3 3 0 0 2 7 0 1 1 0 0 2 1 0 1 0 0 -2.0864 15 9 2 3 1 0 0.5 1.5 0.5 2.5 0 7 403.802 0.666 0.333 0.333 0.666 -3 21 751 0 3 0 0 5 0 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 8 5 2 0 7 3 5 0 0 0 0 0 0 2 8 5 0 0 0 10 5 0 0 0 5 0 2 0 0 0 0 0 0 0 0 0 -0.68 7 5 2 0 0 0 0 2 0 0 0 4 195.824 0 0 0 0 1 4 436 1 2 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 5 0 1 1 1 2 3 0 0 0 0 0 0 2 2 3 0 0 0 4 3 0 0 3 5 0 2 0 0 0 1 1 0 1 0 0 -0.648 13 8 2 2 1 0 0.5 2 0 1.5 0 8 335.575 0.666 0.666 0 0.666 -3 11 475 3 1 0 1 2 0 3 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 3 7 2 1 3 3 3 4 0 0 0 0 1 0 2 3 7 0 0 0 6 7 0 0 # -0.672 -6.314 -18.499 # GLY 208 Env_3kl6_15 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 5 153 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 1 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 -0.8807 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 -1 11 427 0 0 0 0 0 0 1 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 0 3 0 0 0 0 0 3 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0.824 2 2 0 0 0 0 0 0 0 0 0 0 54.089 0.333 0.333 0 0.333 1 5 274 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 0 2 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 -0.8144 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 1 7 395 0 0 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 2 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 1 3 0 2 0 0 0 0 0 0 0 0 0 -0.2744 6 4 2 0 0 0 0 2 0 0 0 5 162.314 0 0 0 0 -1 1 822 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 3 3 0 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 1 2 0 0 0 0 0 1 0 1 0 0 0 -0.3417 5 3 0 2 0 0 1 0 0 1 0 3 129.181 0 0 0 0 -2 3 349 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 4 0 0 0 0 0 0 1 4 0 0 4 1 0 0 0 0 0 0 0 1 0 4 0 0 0 1 4 0 0 # -0.269 -20.457 -4.544 # LYS 82 Env_3kl6_16 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 1 0 0 0 -0.347 5 2 1 2 0 0 1 1 0 1 0 4 109.808 0 0 0 0 -3 6 34 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 1 2 0 0 3 0 2 0 3 2 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 2 7 2 0 0 0 0 3 0 0 0 0 0 -2.1074 14 11 0 3 0 0 0 0 0 3 3 7 376.183 0 0 0 0 2 20 79 0 0 0 0 0 0 0 0 3 3 1 0 0 0 2 1 0 0 2 2 0 0 8 0 6 0 8 3 3 0 0 0 0 0 0 13 0 0 1 0 0 0 13 1 0 0 4 13 3 5 0 0 1 2 0 1 0 0 0 -2.11 29 20 6 3 0 0 1 5.5 0.5 2 4 13 774.7 0 0 0 0.5 3 32 184 3 0 0 0 0 0 0 2 4 4 6 0 0 0 0 4 0 0 2 4 0 0 17 0 10 2 17 8 4 0 0 0 0 0 0 25 0 0 4 0 0 0 25 4 0 0 6 20 3 5 0 0 1 7 3 0 0 0 0 -6.7509 45 29 6 10 0 0 0 5.5 0.5 8.5 4 26 1139.64 1.332 1.332 0 1.832 -4 40 674 2 0 0 8 0 0 4 5 3 3 1 1 4 0 5 0 0 0 2 7 0 0 22 13 5 5 22 7 4 12 0 0 0 0 4 32 0 0 9 0 0 0 36 9 0 0 # 12.614 0.231 -15.717 # VAL 127 Env_3kl6_17 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 5 174 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 1 0 0 0 0 0 1 0 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 7 348 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 2 0 0 0 0 0 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 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.0093 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 3 348 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 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 -0.8187 1 0 0 1 0 0 0 0 0 0.5 0 0 14.137 0.333 0.333 0 0.333 -1 4 59 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 3 3 0 1 1 0 0 1 1 0 0 0 0 -0.7055 10 6 2 2 0 0 0 1.5 0.5 1.5 0 5 252.326 0.999 0.666 0.333 0.999 -2 16 987 0 1 0 0 0 0 6 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 10 0 0 0 0 4 6 0 0 0 0 0 0 9 0 1 0 0 0 9 1 0 0 # -4.67 -10.046 -26.567 # LYS 136 Env_3kl6_18 0 0 0 0 0 0 0 0 0 0 1 0 0 -0.108 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 16 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 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 -0.187 2 1 0 0 1 0 0.5 0 0 0 0 0 60.031 0 0 0 0 -1 3 26 0 0 0 0 2 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 1 1 0 0 0 1 1 0 0 1 3 0 1 0 0 0 1 0 0 0 0 0 -0.3797 6 4 1 1 0 0 0 1 0 1 0 5 159.671 0 0 0 0 -2 1 106 0 0 0 0 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 2 0 6 0 0 0 0 0 0 0 0 0 4 2 0 0 0 4 2 0 0 4 4 0 3 0 0 0 3 0 0 0 0 0 -0.5783 14 8 3 3 0 0 0 3 0 3 0 12 344.973 0 0 0 0 -4 3 640 2 0 0 0 4 1 4 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 2 4 7 1 2 6 2 4 0 0 0 0 0 0 5 5 4 0 0 0 10 4 0 0 3 6 0 3 0 0 0 2 2 0 0 0 0 -2.1512 16 9 3 4 0 0 0 3 0 3 0 8 369.401 1.332 1.332 0 1.332 -4 19 995 1 3 0 2 1 2 3 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 2 9 4 1 2 4 5 5 0 0 0 0 6 0 6 3 1 0 0 0 15 1 0 0 8 15 0 10 3 0 0 6 3 0 0 0 0 -7.8967 45 23 13 9 0 0 0 10.5 2.5 7.5 0 28 1076.13 1.332 0.999 0.333 1.332 -13 44 2420 6 9 0 6 0 5 5 6 2 0 0 1 0 0 0 0 2 0 0 3 0 0 9 21 9 6 9 13 12 11 0 0 0 0 13 0 9 10 13 0 0 0 32 13 0 0 # 3.461 -6.106 -20.33 # CYS 209 Env_3kl6_19 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 9 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 36 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 -0.371 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 21 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 2 0 0 3 1 1 0 3 1 0 1 0 0 0 0 0 4 0 0 1 0 0 0 4 1 0 0 4 8 2 3 0 0 0 2 0 0 0 0 0 -0.9503 19 14 3 2 0 0 0 3 0 2 2 15 520.561 0 0 0 0 -1 10 57 0 0 0 3 0 0 0 7 0 2 0 0 0 0 0 4 0 0 2 1 0 0 3 3 6 7 3 13 0 3 0 0 0 0 0 6 6 0 7 0 0 0 12 7 0 0 4 8 1 5 0 0 0 6 0 2 0 0 0 -4.0153 26 13 5 8 0 0 2 5 0 6 2 15 570.8 0.333 0.333 0 0.333 -8 24 123 1 0 0 2 0 0 0 1 1 4 0 0 0 0 4 7 0 1 4 1 0 0 10 2 13 1 11 12 1 2 0 0 0 0 0 19 4 0 3 0 0 0 23 3 0 0 8 13 3 6 0 0 1 5 2 1 0 0 0 -4.1571 39 24 7 8 0 0 1 6.5 0.5 6 4 25 991.575 0.666 0.666 0 1.166 -7 34 198 4 0 0 2 3 0 0 9 4 3 0 0 0 0 1 3 1 2 5 2 0 0 10 2 18 9 12 21 4 2 0 2 0 0 0 25 2 0 10 0 0 2 27 10 0 0 # 11.158 -5.254 -13.174 # VAL 203 Env_3kl6_20 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 81 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 1 0 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 16 243 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 3 0 0 0 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 -1.089 4 2 0 2 0 0 0 0 0 2 0 1 90.008 0 0 0 0 -1 9 276 0 2 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 2 2 0 0 0 0 0 2 0 1 0 1 0 0 0 3 1 0 0 3 1 0 0 0 0 0 1 0 0 0 0 0 1.4364 5 4 0 1 0 0 0 0 0 1 0 3 132.603 0 0 0 0 0 4 543 0 1 0 0 0 1 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 3 1 1 0 2 3 0 0 0 0 0 1 0 3 0 1 0 0 0 4 1 0 0 1 7 0 5 0 0 0 2 0 0 0 0 0 -3.7942 15 8 5 2 0 0 0 5 0 2 0 11 372.045 0 0 0 0 -4 9 1771 0 4 0 0 0 6 0 2 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 6 7 2 0 8 7 0 0 0 0 0 3 0 6 1 5 0 0 0 10 5 0 0 6 8 0 4 0 0 0 3 0 0 1 0 0 -0.1726 22 14 4 3 1 0 0.5 4 0 3 0 13 584.052 0 0 0 0 -3 20 2176 0 5 0 0 1 8 3 2 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 10 10 2 0 11 8 3 0 0 0 0 7 0 9 1 5 0 0 0 17 5 0 0 # 5.175 -12.864 -24.277 # ARG 132 Env_3kl6_21 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 0 0 1 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.3819 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 0 0 2 0 0 0 0 2 0 0 0 2 0 0 1 0 0 0 2 0 0 0 0 0 -0.2893 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 167 2 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 2 2 1 0 0 0 0 0 0 0 0 4 1 0 0 0 4 1 0 0 3 12 0 3 0 0 0 3 1 0 0 0 0 -3.244 22 15 3 4 0 0 0 3 0 3.5 0 12 591.041 0.666 0.666 0 0.666 -1 19 1108 0 1 0 5 2 6 4 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 3 11 8 0 3 8 2 9 0 0 0 0 8 0 0 9 5 0 0 0 17 5 0 0 5 4 0 2 0 0 0 4 1 0 0 0 0 -0.6358 16 9 2 5 0 0 0 2 0 4.5 0 11 377.046 0.333 0.333 0 0.333 -4 10 884 1 4 0 3 1 2 1 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 4 9 3 0 4 3 5 4 0 0 0 0 6 0 0 4 6 0 0 0 10 6 0 0 4 8 0 6 0 0 0 6 1 0 2 0 0 -4.8157 27 12 6 7 2 0 1 6 0 6.5 0 19 623.085 0.333 0.333 0 0.333 -12 17 1510 3 0 0 0 3 1 5 3 3 0 0 4 0 0 0 0 3 0 1 1 0 0 4 9 11 3 4 11 7 5 0 0 0 0 1 0 5 13 8 0 0 0 19 8 0 0 # 2.203 0.102 -21.94 # ALA 210 Env_3kl6_22 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 33 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 3 0 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 22 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 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 -0.5753 2 1 0 1 0 0 0 0 0 1 0 1 45.004 0 0 0 0 0 1 13 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 1 1 0 0 0 4 5 2 2 0 0 0 2 2 2 1 0 0 -3.0095 20 11 2 6 1 0 2.5 2 0 3 3 9 469.141 0.999 0.999 0 0.999 -6 32 378 1 0 0 3 3 0 0 0 4 0 0 0 0 0 0 4 0 0 4 1 0 0 2 3 15 0 2 11 4 3 0 7 0 0 0 3 2 0 8 0 0 7 5 8 0 0 6 9 4 4 0 0 0 4 0 1 1 0 0 -1.5793 29 19 4 5 1 0 1.5 4 0 4 4 16 736.063 0 0 0 0 -3 32 687 6 0 0 1 3 3 0 2 0 0 0 0 0 2 0 6 0 3 2 1 0 0 9 1 17 2 12 16 0 1 0 5 0 0 0 8 8 0 8 0 0 5 16 8 0 0 2 9 5 4 0 0 0 2 0 1 0 0 0 -4.3651 23 16 4 3 0 0 1 4 0 2 5 10 602.258 0 0 0 0 2 29 447 3 0 0 4 2 1 0 0 0 1 1 0 0 2 0 1 1 2 2 3 0 0 10 4 9 0 12 7 0 4 0 4 0 0 0 8 2 0 9 0 0 4 10 9 0 0 # 8.1475 -11.7485 -10.9895 # HIS 42 Env_3kl6_23 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 11 177 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 59 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 1 0 2 0 0 0 0 0 0 0 0 -0.5537 5 3 2 0 0 0 0 0.5 1.5 0 0 1 132.607 0.666 0 0.666 0.666 -1 16 419 0 3 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 1 0 1 3 1 0 0 0 0 0 0 1 1 3 0 0 0 2 3 0 0 2 3 0 2 1 0 0 1 0 0 0 0 0 -1.0008 9 5 3 1 0 0 0 2.5 0.5 1 0 6 231.747 0.333 0 0.333 0.333 -3 11 537 0 3 0 0 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 2 2 0 4 3 2 0 0 0 0 0 0 2 4 3 0 0 0 6 3 0 0 2 6 0 2 0 0 0 3 0 0 1 0 0 -1.6504 14 8 2 3 1 0 0.5 2 0 3 0 8 357.357 0 0 0 0 -4 13 1120 0 1 0 0 4 0 4 1 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 9 4 1 0 5 5 4 0 0 0 0 0 0 6 7 1 0 0 0 13 1 0 0 2 5 0 2 0 1 0 1 0 0 1 0 0 -1.0698 12 7 3 1 1 0 0.5 2 1 1 0 9 334.369 1 0 1 1 -2 8 1038 3 2 0 0 1 0 1 0 2 0 0 3 0 0 0 0 0 0 0 0 0 0 3 6 3 0 3 1 7 1 0 0 0 0 0 0 3 6 3 0 0 0 9 3 0 0 # -1.862 -6.56933 -21.888 # GLU 135 Env_3kl6_24 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 1 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 0 122 0 0 0 1 0 1 0 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 0 4 0 1 0 0 0 4 1 0 0 0 0 0 1 0 0 0 2 0 0 0 0 0 -2.0764 3 0 1 2 0 0 0 1 0 2 0 2 47.417 0 0 0 0 -3 4 223 0 0 0 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 2 0 1 2 0 0 0 0 0 0 1 1 1 0 0 0 0 0 3 0 0 0 4 9 0 5 0 0 0 1 0 0 0 0 0 0.0115 19 13 5 1 0 0 0 5 0 1 0 14 504.878 0 0 0 0 -3 8 728 0 1 0 3 4 5 0 2 0 0 0 0 0 2 0 2 0 0 0 0 0 0 2 4 11 2 2 13 1 3 0 0 0 0 2 4 6 0 7 0 0 0 12 7 0 0 7 6 0 2 0 0 0 7 2 1 1 0 0 -2.8669 26 13 2 10 1 0 1.5 2 0 8 0 15 590.452 0.999 0.999 0 0.999 -10 25 554 0 1 0 4 5 3 0 5 0 0 0 0 0 4 0 4 0 0 0 0 0 0 4 5 12 5 4 17 1 4 0 0 0 0 3 9 5 2 7 0 0 0 19 7 0 0 2 13 2 5 1 0 0 2 0 0 2 0 0 -4.4737 27 17 6 2 2 0 1 5 1 2 2 13 727.336 0 0 0 0 -3 33 1020 0 6 0 0 4 4 0 5 0 1 1 0 0 5 0 0 0 0 0 1 0 0 8 6 8 5 8 13 6 0 0 1 0 0 8 8 3 3 4 0 0 1 22 4 0 0 # 10.647 -10.735 -19.129 # GLY 183 Env_3kl6_25 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 1 137 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 4 548 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 1 0 1 0 0 0 1 0 0 0 0 0 0.145 5 3 1 1 0 0 0 1 0 1 0 4 126.161 0 0 0 0 -1 3 550 0 0 0 0 0 0 0 0 0 4 0 0 0 1 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 0 0 1 4 0 0 0 1 4 0 0 1 3 0 0 0 0 0 1 0 0 0 0 0 -0.2765 5 4 0 1 0 0 0 0 0 1 0 4 145.534 0 0 0 0 0 2 292 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 1 0 0 0 0 0 4 0 1 0 4 1 0 0 0 0 0 0 0 0 0 2 3 0 0 0 2 3 0 0 1 4 0 2 0 0 0 2 0 0 0 0 0 -0.9472 9 5 2 2 0 0 0 2 0 2 0 6 218.812 0 0 0 0 -2 3 574 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 2 3 0 0 0 0 0 4 0 5 0 4 5 0 0 0 0 0 0 0 0 0 4 5 0 0 0 4 5 0 0 2 8 3 0 0 0 0 2 0 1 1 0 0 -1.6897 17 13 0 3 1 0 1 0 0 2 3 6 475.387 0 0 0 0 6 29 868 0 0 0 0 0 0 0 0 0 3 0 0 2 2 0 2 7 1 0 0 0 0 7 0 10 0 8 9 0 0 0 0 0 0 0 3 5 3 6 0 0 0 11 6 0 0 # -3.264 -5.299 -1.381 # ILE 163 Env_3kl6_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 5 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 51 0 0 0 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 1 0 0 0 1 0 1 3 1 4 0 0 0 0 0 0 0 4 0 0 1 0 0 0 4 1 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 -1.1358 2 0 0 2 0 0 0 0 0 2 0 2 22.988 0 0 0 0 -2 0 32 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 1 0 0 4 6 2 2 0 0 0 2 2 0 0 0 0 -1.7328 18 12 2 4 0 0 0 2 0 3 3 8 441.816 0.999 0.999 0 0.999 0 27 190 2 0 0 3 0 0 0 0 0 6 0 0 0 0 0 0 0 1 6 0 0 0 8 3 7 0 9 6 0 3 0 0 0 0 3 12 0 0 3 0 0 0 15 3 0 0 3 9 3 4 0 0 0 2 0 1 1 0 0 -2.5616 23 15 4 3 1 0 1.5 4 0 2 3 13 593.013 0 0 0 0 -1 22 305 4 0 0 1 4 0 0 4 0 1 0 2 0 1 0 0 0 1 5 0 0 0 6 3 10 4 7 13 2 1 0 0 0 0 1 13 0 2 7 0 0 0 16 7 0 0 6 10 6 6 0 0 0 4 0 0 0 0 0 -3.0353 32 22 6 4 0 0 0 6 0 4 6 21 814.2 0 0 0 0 1 25 720 4 0 0 2 2 0 1 4 0 0 0 2 0 1 0 2 0 6 6 2 0 0 7 5 16 4 13 14 2 3 0 0 0 0 2 16 0 4 10 0 0 0 22 10 0 0 # 4.478 -0.727 -13.243 # GLY 216 Env_3kl6_27 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 11 156 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 3 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 52 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 1 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 -0.9839 3 1 1 1 0 0 1 0 1 0 0 0 84.177 1 0 1 1 1 8 120 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 2 1 0 0 1 1 1 0 0 0 0 0 0 0 1 2 0 0 0 1 2 0 0 0 5 2 2 0 0 0 1 0 0 0 0 0 -1.6311 10 7 2 1 0 0 0 2 0 1 2 5 260.36 0 0 0 0 -1 15 633 0 0 0 0 0 0 2 0 0 0 0 2 0 2 0 4 0 0 0 0 0 0 2 4 4 0 2 4 2 2 0 0 0 0 0 0 1 5 4 0 0 0 6 4 0 0 4 5 5 2 0 0 0 1 0 0 0 0 0 0.4324 17 14 2 1 0 0 0 2 0 1 5 8 468.021 0 0 0 0 5 27 1171 0 0 0 0 0 0 2 1 0 0 0 2 0 4 0 5 0 3 0 0 0 0 4 4 8 1 7 6 2 2 0 0 0 0 0 3 1 8 5 0 0 0 12 5 0 0 2 6 4 1 1 0 0 5 0 2 0 0 0 -4.6963 21 12 2 7 0 0 2 1.5 0.5 5 4 12 498.572 0.333 0 0.333 0.333 -5 29 1548 0 2 0 0 0 0 0 4 0 0 0 1 0 5 0 7 0 2 0 0 0 0 5 3 9 4 7 11 3 0 0 0 0 0 0 2 4 9 6 0 0 0 15 6 0 0 # -4.77833 -4.63133 -12.1257 # GLU 207 Env_3kl6_28 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 27 258 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 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 2 0 0 0 1 0 0 0 0 0 0 -0.69 4 3 1 0 0 0 0 0 1 0 3 0 101.189 0 0 0 0 1 11 133 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 0 0 1 0 3 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 8 0 1 0 0 0 1 0 0 0 0 0 -0.7769 11 9 1 1 0 0 0 1 0 1 0 5 327.221 0 0 0 0 4 10 387 0 0 0 0 0 0 0 2 0 4 0 0 0 1 0 0 0 4 0 0 0 0 5 0 4 2 9 2 0 0 0 0 0 0 0 7 0 1 3 0 0 0 8 3 0 0 2 7 4 3 0 0 0 3 1 1 1 0 0 -3.5926 22 13 3 5 1 0 1 3 0 3.5 4 9 523.509 0.666 0.666 0 0.666 1 32 1295 0 0 0 0 0 0 4 2 0 5 0 0 1 5 0 2 1 1 1 0 0 0 11 4 5 2 12 6 0 4 0 0 0 0 0 4 1 9 8 0 0 0 14 8 0 0 7 12 6 4 0 0 0 6 1 1 0 0 0 -3.4571 37 25 4 8 0 0 1 4 0 6.5 6 23 946.68 0.333 0.333 0 0.333 -1 38 1902 0 0 0 0 0 0 3 2 0 8 0 0 3 5 0 6 1 0 9 0 0 0 16 3 16 2 16 18 0 3 0 0 0 0 0 13 1 8 15 0 0 0 22 15 0 0 # 0.683333 -5.54817 -8.8855 # TRP 205 Env_3kl6_29 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 0 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 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 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 4 0 3 0 0 0 1 0 0 0 0 0 -2.0114 8 4 3 1 0 0 0 3 0 1 0 6 187.945 0 0 0 0 -2 5 10 0 0 0 2 1 0 0 2 0 3 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 2 3 3 0 2 0 0 0 0 0 0 0 0 8 0 0 0 0 8 0 0 8 6 0 4 0 0 0 5 0 0 0 0 0 0.2081 23 14 4 5 0 0 0 4 0 5 0 21 583.158 0 0 0 0 -7 2 169 3 1 0 2 3 0 0 8 0 2 0 0 0 2 0 2 0 0 0 0 0 0 7 3 5 8 7 13 1 2 0 0 0 0 1 6 2 2 12 0 0 0 11 12 0 0 3 10 0 5 0 0 0 6 0 0 0 0 0 -5.2686 24 13 5 6 0 0 0 5 0 6 0 19 575.279 0 0 0 0 -7 9 802 2 3 0 1 1 4 0 2 0 3 0 0 0 2 0 2 0 0 0 4 0 0 11 4 7 2 11 9 3 1 0 0 0 0 5 4 7 2 6 0 0 0 18 6 0 0 4 13 0 4 0 0 0 3 0 1 1 0 0 -1.9592 26 17 4 4 1 0 1.5 4 0 3 0 13 714.67 0 0 0 0 -1 20 643 0 1 0 1 1 2 0 0 0 0 0 4 0 1 0 7 2 0 0 7 0 0 8 6 12 0 8 12 5 1 0 0 0 0 5 11 6 3 1 0 0 0 25 1 0 0 # 11.3587 -5.42933 -19.6727 # ASP 184 Env_3kl6_30 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 69 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 3 207 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 1 0 3 0 0 0 2 0 1 0 0 0 -2.5925 8 2 3 3 0 0 1 3 0 2 0 6 149.576 0 0 0 0 -5 3 426 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 5 0 1 0 0 0 0 2 6 0 0 6 0 2 0 0 0 0 0 0 5 0 3 0 0 0 5 3 0 0 5 6 0 2 0 0 0 2 0 0 0 0 0 1.1303 15 11 2 2 0 0 0 2 0 2 0 12 406.941 0.333 0.333 0 0.333 -3 5 971 0 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 5 0 2 0 0 0 0 8 7 0 0 7 0 8 0 0 0 0 0 0 8 0 7 0 0 0 8 7 0 0 3 5 5 2 0 0 0 3 3 0 0 0 0 -3.7341 21 13 2 6 0 0 0 2 0 4.5 5 10 499.91 0.999 0.999 0 0.999 0 31 1632 0 2 0 2 0 0 2 0 0 0 0 4 1 6 0 0 0 0 4 0 0 0 7 10 4 0 7 4 6 4 0 0 0 0 0 1 12 0 8 0 0 0 13 8 0 0 2 7 8 2 0 0 0 2 0 0 1 0 0 -2.4867 22 17 2 2 1 0 0 2 0 2 8 7 566.726 0.333 0.333 0 0.333 10 40 1082 0 1 0 1 0 0 2 0 0 1 0 1 1 12 0 0 1 0 2 0 0 0 14 5 3 0 14 3 2 3 0 0 0 0 0 1 9 0 12 0 0 0 10 12 0 0 # 1.877 -11.481 -1.3 # THR 84 Env_3kl6_31 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 750 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 6 0 0 0 0 6 0 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 1 125 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 1 0 0 0 -1.0726 3 1 1 1 0 0 1 1 0 0 0 2 64.804 0 0 0 0 -2 2 267 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 1 0 0 0 0 0 0 2 0 1 0 2 1 0 0 0 0 0 0 0 0 0 2 1 0 0 0 2 1 0 0 3 4 3 2 0 0 0 2 2 0 0 0 0 -1.7417 16 10 2 4 0 0 0 2 0 3 3 7 380.738 0.999 0.999 0 0.999 -2 30 1376 0 0 0 0 0 0 4 0 0 1 0 0 0 2 0 6 0 3 0 0 0 0 3 4 9 0 6 6 0 4 0 0 0 0 0 3 0 11 2 0 0 0 14 2 0 0 1 4 3 0 0 0 0 3 0 1 0 0 0 -1.7619 12 8 0 4 0 0 1 0 0 3 3 7 286.868 0 0 0 0 -1 15 858 0 0 0 0 0 0 3 0 0 2 0 0 0 0 0 3 1 3 0 0 0 0 2 3 7 0 5 4 0 3 0 0 0 0 0 3 2 3 4 0 0 0 8 4 0 0 # -4.4325 -8.5035 -8.72933 # PHE 162