# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1b9v # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/1b9v_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_1b9v_0 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 49 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 1 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 98 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 2 0 0 0 0 0 2 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.7081 5 2 2 1 0 0 0 2 0 1 0 4 117.08 0 0 0 0 -3 3 236 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 3 0 2 3 0 0 0 0 0 0 0 0 3 1 1 0 0 0 4 1 0 0 1 3 0 0 0 0 0 1 0 1 0 0 0 -0.7634 6 4 0 2 0 0 1 0 0 1 0 3 149.76 0 0 0 0 -1 5 276 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 0 0 0 0 0 2 2 2 0 0 0 4 2 0 0 3 2 2 2 1 0 1 3 2 2 0 0 0 -3.2546 18 7 4 7 0 0 2 3 1 4 2 6 372.071 1.665 0.999 0.666 2.165 -11 39 438 0 2 2 0 0 0 3 3 2 0 0 0 0 0 0 6 0 0 0 0 0 0 0 5 10 3 0 11 4 3 0 0 0 0 3 5 2 5 3 0 0 0 15 3 0 0 1 8 2 3 3 0 1 2 0 1 0 0 0 -5.817 21 11 7 3 0 0 1 4.5 2.5 2 3 8 525.112 0.666 0 0.666 1.166 -8 40 454 0 4 4 0 0 0 0 2 3 1 1 0 0 0 0 6 0 0 0 0 0 0 2 4 13 2 2 12 7 0 0 0 0 0 4 4 1 10 2 0 0 0 19 2 0 0 # 24.38 -10.901 65.265 # ALA 245 Env_1b9v_1 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 36 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 12 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 3 0 2 0 0 0 1 0 1 0 0 0 -2.0836 7 3 2 2 0 0 1 2 0 1 0 5 157.455 0 0 0 0 -3 3 42 0 0 0 0 0 0 3 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 3 2 2 0 4 0 3 0 0 0 0 0 2 0 5 0 0 0 0 7 0 0 0 5 7 0 1 0 0 0 2 0 0 0 0 0 0.9712 15 12 1 2 0 0 0 1 0 2 0 10 439.245 0 0 0 0 1 9 58 0 0 0 0 0 4 3 2 0 0 1 0 0 0 0 2 3 0 0 0 0 0 1 3 9 2 1 11 0 3 0 0 0 0 0 6 0 5 4 0 0 0 11 4 0 0 2 7 1 4 0 0 0 4 2 1 0 0 0 -4.7643 21 10 4 7 0 0 1 4 0 5 1 12 463.135 0.999 0.999 0 0.999 -7 24 138 0 0 0 0 0 1 6 0 0 0 2 0 0 1 0 5 4 2 0 0 0 0 3 6 12 0 5 10 0 6 0 0 0 0 0 10 0 10 1 0 0 0 20 1 0 0 4 16 6 1 0 1 0 4 1 1 0 0 0 -3.5313 34 26 2 6 0 0 1 1 1 4.5 7 11 922.439 1.666 0.666 1 1.666 8 66 371 0 5 0 0 0 1 7 0 0 1 2 3 0 3 0 4 0 2 4 2 0 0 8 15 11 0 10 9 8 7 0 0 0 0 0 17 0 8 9 0 0 0 25 9 0 0 # 35.9093 -8.05867 58.3423 # GLU 226 Env_1b9v_2 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.2047 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 3 0 5 0 0 0 0 0 0 0 4 0 1 0 0 0 0 5 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.3795 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 2 6 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 0 0 0 0 0 1 0 2 0 1 2 0 0 0 0 0 0 0 2 0 1 0 0 0 0 3 0 0 0 3 8 0 3 0 0 0 1 2 1 0 0 0 -2.2172 18 11 3 4 0 0 1 3 0 2 0 9 455.015 0.999 0.999 0 0.999 -5 22 52 0 0 0 0 0 0 3 2 0 1 2 0 0 0 0 8 1 0 0 1 0 0 4 3 9 2 4 11 0 3 0 0 0 0 0 11 0 7 0 0 0 0 18 0 0 0 4 16 2 5 0 0 0 1 0 2 0 0 0 -2.7244 30 22 5 3 0 0 2 5 0 1 2 14 839.735 0 0 0 0 6 34 91 2 0 0 0 0 1 5 2 0 4 5 0 0 2 0 1 4 1 0 3 0 0 16 5 7 2 17 8 0 5 0 0 0 0 0 22 0 6 2 0 0 0 28 2 0 0 5 13 2 2 0 0 0 9 0 0 1 0 0 -4.4711 32 20 2 9 1 0 0 2 0 9 2 22 814.463 0 0 0 0 -1 21 166 6 1 0 0 0 4 3 0 0 1 3 0 1 2 0 3 1 3 1 3 0 0 16 4 12 0 19 9 1 3 0 0 0 0 0 16 0 9 7 0 0 0 25 7 0 0 # 37.265 -4.99 55.938 # GLY 179 Env_1b9v_3 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 60 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 20 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 1 0 2 0 0 0 0 1 0 0 0 -1.8054 6 3 2 1 0 0 1 0.5 1.5 0 2 0 142.775 0.333 0 0.333 0.333 -1 26 120 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 3 0 0 3 2 1 0 0 0 0 0 3 0 0 3 0 0 0 3 3 0 0 0 5 3 2 1 0 0 0 1 0 0 0 0 -2.3048 12 8 3 1 0 0 0 2.5 0.5 0.5 2 4 308.011 0.999 0.333 0.666 0.999 0 28 161 0 3 0 0 0 0 3 0 0 0 0 4 0 0 0 0 0 0 2 0 0 0 0 10 2 0 0 2 7 3 0 0 0 0 0 6 0 0 6 0 0 0 6 6 0 0 5 8 2 1 0 0 0 5 0 0 0 0 0 -0.1949 21 15 1 5 0 0 0 1 0 5 2 11 541.406 0.333 0.333 0 0.333 3 20 224 0 2 0 0 0 1 9 0 0 4 0 2 0 0 0 0 1 0 2 0 0 0 4 13 4 0 4 4 4 9 0 0 0 0 0 10 0 2 9 0 0 0 12 9 0 0 5 10 0 5 2 1 0 4 3 0 0 0 0 -5.5212 30 15 8 7 0 0 0 5.5 2.5 5.5 0 16 727.309 2.665 1.332 1.333 2.665 -10 46 388 0 7 1 0 1 2 9 3 0 2 0 3 0 0 0 0 1 0 1 0 0 0 2 19 6 3 2 9 10 9 0 0 0 0 0 11 0 8 11 0 0 0 19 11 0 0 # 32.2877 -13.311 60.7263 # GLU 276 Env_1b9v_4 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 23 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 69 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 3 0 1 0 0 0 0 1 0 0 0 0 -0.6093 6 4 1 1 0 0 0 1 0 0.5 0 3 162.314 0.333 0.333 0 0.333 -1 9 76 0 2 0 0 0 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 2 3 0 1 2 1 2 1 0 0 0 0 0 3 0 0 3 0 0 0 3 3 0 0 4 2 0 2 0 0 0 3 1 1 0 0 0 -1.4567 13 6 2 5 0 0 1 2 0 3.5 1 6 256.317 0.666 0.666 0 0.666 -6 24 162 0 1 2 0 0 0 2 3 0 2 0 1 0 0 0 0 0 0 2 0 0 0 2 4 4 3 2 7 2 2 0 0 0 0 0 3 0 2 8 0 0 0 5 8 0 0 3 12 4 2 2 0 0 1 3 0 0 0 0 -4.6585 27 19 4 4 0 0 0 3 1 2.5 3 8 731.19 2.331 1.332 0.999 2.331 3 57 521 0 5 4 1 0 0 6 3 0 3 0 2 0 0 0 0 0 0 3 0 0 0 3 14 7 3 3 10 7 7 0 0 0 0 0 8 0 8 11 0 0 0 16 11 0 0 5 5 2 4 2 0 1 6 1 0 0 0 0 -4.6488 26 12 7 7 0 0 0 5 2 6.5 3 16 574.505 0.999 0.666 0.333 1.499 -9 30 294 0 4 2 6 0 0 5 1 1 1 0 3 0 0 0 0 1 0 2 0 0 0 1 18 6 1 1 6 8 11 0 0 0 0 1 7 0 6 12 0 0 0 14 12 0 0 # 30.317 -15.338 63.205 # ARG 292 Env_1b9v_5 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 3 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 1 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 6 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 2 0 0 0 0 2 0 0 0 1 1 0 3 0 0 0 1 1 0 0 0 0 -2.2799 7 2 3 2 0 0 0 3 0 1.5 0 5 135.062 0.333 0.333 0 0.333 -4 6 27 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 3 2 0 0 0 0 0 0 1 5 1 0 6 0 1 0 0 0 0 0 3 0 4 0 0 0 0 7 0 0 0 4 9 2 0 0 0 0 3 1 0 0 0 0 -0.5138 19 15 0 4 0 0 0 0 0 3.5 2 9 524.36 0.666 0.666 0 0.666 3 25 195 0 3 0 0 0 0 3 2 0 0 0 0 0 0 0 0 4 4 0 3 0 0 3 6 8 2 7 6 3 3 0 0 0 0 0 12 0 7 0 0 0 0 19 0 0 0 5 8 2 5 0 0 0 3 0 1 0 0 0 -1.8619 24 15 5 4 0 0 1 5 0 3 2 17 605.054 0 0 0 0 -4 20 219 0 4 0 0 0 3 3 2 0 0 3 0 0 0 0 0 1 4 0 4 0 0 7 7 8 2 11 6 4 3 0 0 0 0 0 12 0 7 5 0 0 0 19 5 0 0 2 13 3 3 1 0 0 4 1 0 0 0 0 -5.1026 27 18 4 5 0 0 0 3 1 4.5 3 13 693.432 0.333 0.333 0 0.333 1 34 217 3 1 0 1 0 2 1 3 0 5 3 0 0 0 0 3 0 4 0 1 0 0 12 3 9 3 16 8 1 2 0 0 0 0 0 15 0 4 8 0 0 0 19 8 0 0 # 33.441 -5.51 58.002 # SER 178 Env_1b9v_6 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 1 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 4 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 1 1 1 0 0 2 0 0 0 0 0 -1.8546 8 4 2 2 0 0 0 1.5 0.5 2 0 4 182.663 0.666 0 0.666 0.666 -2 17 34 1 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 1 0 0 0 0 0 4 3 1 0 4 1 3 0 0 0 0 0 0 5 0 0 3 0 0 0 5 3 0 0 1 4 0 1 2 0 0 4 1 0 0 0 0 -3.9969 13 5 3 5 0 0 0 1.5 1.5 4.5 0 8 286.808 0.666 0.333 0.333 0.666 -7 18 122 3 5 0 0 0 0 2 0 1 0 0 0 0 0 0 0 2 0 0 0 0 0 3 7 3 0 3 2 6 2 0 0 0 0 0 5 0 2 6 0 0 0 7 6 0 0 8 16 0 8 0 0 1 2 1 0 0 0 0 -1.6324 36 24 9 3 0 0 0 8.5 0.5 2.5 1 25 955.667 0.666 0.666 0 1.166 -5 22 382 3 6 0 0 0 0 7 1 5 3 3 0 0 0 0 2 2 4 0 0 0 0 9 13 13 1 13 5 11 7 0 0 0 0 0 11 0 13 12 0 0 0 24 12 0 0 4 16 3 4 0 0 1 6 2 1 0 0 0 -5.4447 37 23 5 9 0 0 1 4.5 0.5 7 4 17 922.412 0.999 0.999 0 1.499 -3 45 300 3 2 0 1 0 0 3 1 5 5 3 0 0 3 3 3 2 1 0 2 0 0 19 6 11 1 20 6 7 4 0 0 0 0 0 12 0 8 17 0 0 0 20 17 0 0 # 40.502 -5.049 62.112 # LEU 132 Env_1b9v_7 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 20 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 60 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 2 2 0 0 0 0 0 1 0 0 0 0 -1.1671 5 4 0 1 0 0 0 0 0 0.5 2 0 134.199 0.333 0.333 0 0.333 2 18 109 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 3 2 0 2 0 2 1 0 0 0 0 0 0 0 1 4 0 0 0 1 4 0 0 2 2 2 0 1 0 1 0 2 0 0 0 0 -1.4775 10 6 2 2 0 0 0 1 1 1 3 0 228.56 1.665 1.332 0.333 2.165 0 36 156 0 2 0 0 0 0 4 0 1 0 0 0 0 0 0 0 0 2 0 1 0 0 1 6 3 0 3 0 3 4 0 0 0 0 0 5 0 2 3 0 0 0 7 3 0 0 2 8 11 1 0 0 0 0 2 1 0 0 0 -2.1673 25 21 1 3 0 0 1 1 0 1 11 4 649.7 0.999 0.666 0.333 0.999 9 66 485 0 3 0 1 0 0 6 0 2 0 0 0 0 0 0 0 0 4 7 2 0 0 2 10 13 0 6 7 5 7 0 0 0 0 0 5 0 7 13 0 0 0 12 13 0 0 4 8 2 3 4 0 2 3 1 0 0 0 0 -5.445 27 14 9 4 0 0 0 5 4 3.5 4 12 655.901 1.665 0.666 0.999 2.165 -9 44 670 1 7 0 3 0 0 2 0 2 2 0 0 0 0 1 0 0 4 3 2 0 0 6 12 9 0 10 3 9 5 0 0 0 0 0 6 1 6 14 0 0 0 13 14 0 0 # 37.852 -12.218 66.983 # ARG 116 Env_1b9v_8 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 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 -0.0338 2 2 0 0 0 0 0 0 0 0 2 0 47.1 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 2 0 0 0 0 2 0 1 0 0 0 1 1 1 0 0 0 -2.2525 6 2 1 3 0 0 1 1 0 1.5 0 2 123.945 0.333 0.333 0 0.333 -3 8 83 1 0 1 0 0 0 1 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 1 1 4 0 1 3 1 1 0 0 0 0 3 1 1 1 0 0 0 0 6 0 0 0 7 7 0 4 1 0 0 3 1 1 0 0 0 -1.5442 24 14 5 5 0 0 1 4.5 0.5 3.5 0 18 602.962 0.999 0.666 0.333 0.999 -8 17 344 2 1 3 3 0 0 2 3 3 0 0 0 0 0 0 6 1 0 0 0 0 0 2 6 13 3 2 13 4 5 0 0 0 0 5 3 2 8 6 0 0 0 18 6 0 0 8 9 2 7 0 0 0 7 2 0 0 0 0 -4.6304 35 19 7 9 0 0 0 7 0 8 2 24 814.833 0.999 0.999 0 0.999 -11 25 1038 2 2 3 5 0 0 5 1 1 4 0 0 0 0 0 7 3 0 2 0 0 0 6 12 16 1 6 16 3 10 0 0 0 0 3 5 5 10 12 0 0 0 23 12 0 0 3 15 2 3 3 0 0 4 0 4 0 0 0 -5.4031 34 20 6 8 0 0 4 4 2 4 2 13 857.859 0.999 0 0.999 0.999 -7 57 1188 0 8 1 0 0 0 3 3 0 1 0 1 0 0 0 8 4 0 5 0 0 0 1 12 18 3 1 21 9 3 0 0 0 0 0 10 2 14 8 0 0 0 26 8 0 0 # 22.745 -13.908 60.4835 # HIS 273 Env_1b9v_9 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 3 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 1 0 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.3328 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 0 3 10 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 4 0 0 4 0 0 0 0 0 0 0 3 0 0 1 0 0 0 3 1 0 0 1 2 0 1 0 0 0 1 0 0 0 0 0 -0.8627 5 3 1 1 0 0 0 1 0 1 0 3 126.161 0 0 0 0 0 5 7 0 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 2 0 0 0 0 0 2 0 3 0 2 3 0 0 0 0 0 0 0 4 0 0 1 0 0 0 4 1 0 0 5 8 0 1 0 0 0 3 0 1 0 0 0 -0.2294 18 13 1 4 0 0 1 1 0 3 0 10 488.475 0 0 0 0 0 16 77 0 2 0 0 0 4 1 2 0 3 2 0 1 0 0 2 1 0 0 0 0 0 6 3 7 2 6 9 2 1 0 0 0 0 0 13 0 1 4 0 0 0 14 4 0 0 4 13 0 5 0 0 0 4 1 1 1 0 0 -4.9116 29 17 5 6 1 0 1 5 0 4.5 0 16 741.507 0.666 0.666 0 0.666 -3 30 77 0 1 0 0 0 3 3 2 0 5 4 0 4 0 0 5 0 0 0 2 0 0 15 4 8 2 15 10 1 3 0 0 0 0 0 20 0 6 3 0 0 0 26 3 0 0 5 17 0 6 0 0 0 5 1 0 0 0 0 -2.935 34 22 6 6 0 0 0 6 0 5.5 0 21 893.649 0.333 0.333 0 0.333 -2 25 149 1 2 0 0 2 0 5 3 0 6 1 0 2 0 0 8 1 0 0 3 0 0 13 7 11 3 13 14 2 5 0 0 0 0 0 23 0 10 1 0 0 0 33 1 0 0 # 33.257 -7.063 53.004 # THR 224 Env_1b9v_10 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 93 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 1 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 7 186 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 2 0 0 0 0 2 0 0 0 0 0 1 0 2 0 0 0 0 0 0 0 0 -0.9176 3 1 2 0 0 0 0 1 1 0 0 0 69.437 0.999 0 0.999 0.999 -2 17 177 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 3 8 0 2 1 0 0 1 1 0 0 0 0 -1.1627 16 11 3 2 0 0 0 2 1 1.5 0 8 430.163 0.666 0.666 0 0.666 0 16 1140 0 6 0 6 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 16 0 0 0 0 10 6 0 0 0 0 0 0 0 10 6 0 0 0 10 6 0 0 1 1 0 0 0 0 0 2 2 0 0 0 0 -1.9915 6 2 0 4 0 0 0 0 0 3 0 3 118.282 0.666 0.666 0 0.666 -4 9 421 0 2 0 3 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 3 3 0 0 0 0 0 0 1 3 2 0 0 0 4 2 0 0 2 1 0 2 0 0 0 1 1 0 0 0 0 -0.6868 7 3 2 2 0 0 0 2 0 1.5 0 4 141.504 0.666 0.666 0 0.666 -3 8 488 0 2 1 2 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 5 1 0 1 1 3 2 0 0 0 0 0 0 4 1 2 0 0 0 5 2 0 0 # 30.778 -4.201 69.353 # LYS 148 Env_1b9v_11 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 8 207 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 69 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 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4782 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 138 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 0 0 0 2 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 2 1 0 0 0 1 0 3 0 0 0 0 0 -1.1152 7 3 1 3 0 0 0 0 1 3 0 6 168.522 1 0 1 1 -2 5 593 0 1 0 2 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 7 0 0 0 0 5 2 0 0 0 0 0 0 1 6 0 0 0 0 7 0 0 0 1 5 1 2 3 0 0 0 1 0 0 0 0 -2.5744 13 7 5 1 0 0 0 3.5 1.5 0.5 0 3 337.337 1.665 0.333 1.332 1.665 -3 39 780 0 7 0 0 0 0 1 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 13 0 0 0 0 12 1 0 0 0 0 0 0 1 6 6 0 0 0 7 6 0 0 2 8 3 1 5 0 1 2 1 1 0 0 0 -3.8381 24 13 7 4 0 0 1 3 4 2.5 2 6 593.291 2.331 0.666 1.665 2.831 -8 70 833 0 16 0 0 0 0 3 0 2 0 0 0 0 0 0 0 1 1 1 0 0 0 0 19 5 0 1 2 18 3 0 0 0 0 0 0 4 4 16 0 0 0 8 16 0 0 # 33.765 -7.84067 68.2027 # ASP 149 Env_1b9v_12 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 29 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 87 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 0 3 0 0 0 0 0 1 0 0 0 0 0 -0.7241 4 3 0 1 0 0 0 0 0 1 0 1 112.024 0 0 0 0 1 7 63 0 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 2 1 1 0 2 2 0 0 0 0 0 0 3 0 1 0 0 0 0 4 0 0 0 4 6 0 2 0 0 0 3 2 2 0 0 0 -2.7984 19 10 2 7 0 0 2 2 0 4 0 10 447.513 0.999 0.999 0 0.999 -7 20 202 0 1 1 3 0 0 3 3 0 2 0 0 0 0 0 2 4 0 0 0 0 0 2 7 7 3 2 10 1 6 0 0 0 0 2 8 0 4 5 0 0 0 14 5 0 0 4 13 1 5 0 0 1 2 0 0 0 0 0 -1.409 26 18 6 2 0 0 0 5.5 0.5 2 2 18 710.443 0 0 0 0.5 -2 18 655 3 2 1 1 0 0 2 0 2 6 3 0 0 0 0 5 1 0 0 0 0 0 12 5 9 0 12 7 4 3 0 0 0 0 3 5 3 1 14 0 0 0 12 14 0 0 9 7 2 6 0 0 1 7 1 0 0 0 0 -2.8386 33 18 7 8 0 0 0 6.5 0.5 7.5 3 20 761.244 0.666 0.666 0 1.166 -11 30 726 2 2 5 3 0 0 5 0 3 3 1 0 1 0 0 4 4 0 0 0 0 0 7 10 16 0 7 13 5 8 0 0 0 0 6 11 2 5 9 0 0 0 24 9 0 0 # 25.718 -8.429 59.978 # ARG 223 Env_1b9v_13 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1102 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 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 0 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 0 0 3 0 0 0 0 3 0 0 2 2 0 1 0 0 0 1 0 0 0 0 0 -0.5454 6 4 1 1 0 0 0 1 0 1 0 4 159.671 0 0 0 0 0 6 59 0 1 0 0 0 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 5 1 0 0 5 0 1 0 0 0 0 0 0 1 0 0 5 0 0 0 1 5 0 0 2 8 0 2 0 0 0 3 2 1 0 0 0 -4.0522 18 10 2 6 0 0 1 2 0 4 0 11 430.356 0.999 0.999 0 0.999 -6 14 195 4 1 0 3 0 0 0 0 0 2 2 0 0 0 0 4 1 0 0 1 0 0 9 4 5 0 9 5 1 3 0 0 0 0 0 5 0 0 13 0 0 0 5 13 0 0 7 12 3 5 0 0 0 5 0 0 0 0 0 -1.6844 32 22 5 5 0 0 0 5 0 5 3 20 844.408 0 0 0 0 2 29 972 1 4 2 4 0 0 0 0 3 3 2 0 0 0 0 1 1 3 2 6 0 0 12 8 12 0 15 6 7 4 0 0 0 0 0 17 1 6 8 0 0 0 24 8 0 0 7 18 7 9 1 0 0 5 0 1 0 0 0 -6.2309 48 32 10 6 0 0 1 9.5 0.5 5 8 27 1224.87 0.333 0 0.333 0.333 0 62 1881 1 2 2 8 0 0 0 1 5 7 2 0 0 0 1 1 4 2 9 3 0 0 14 10 23 1 16 17 7 8 0 0 0 0 0 24 5 15 4 0 0 0 44 4 0 0 # 26.973 -1.636 56.538 # LEU 222 Env_1b9v_14 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 90 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 0 0 6 0 0 0 0 6 0 0 0 0 1 2 0 0 0 1 1 0 0 0 0 0 -1.5341 5 3 1 1 0 0 0 0 1 1 3 1 112.683 0 0 0 0 0 11 45 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 2 0 0 2 0 3 0 5 0 0 0 0 0 0 0 0 2 0 3 0 0 0 0 5 0 0 0 3 9 0 3 1 0 0 2 0 0 0 0 0 -0.9483 18 12 4 2 0 0 0 3 1 2 0 11 488.098 0 0 0 0 -2 13 381 1 3 0 3 0 0 0 0 0 0 1 0 0 0 0 2 0 5 0 3 0 0 5 6 7 0 10 2 3 3 0 0 0 0 0 6 0 7 5 0 0 0 13 5 0 0 4 13 1 4 0 0 0 3 1 1 0 0 0 -2.768 27 18 4 5 0 0 1 4 0 3.5 0 18 712.573 0.666 0.333 0.333 0.666 -3 18 696 2 6 0 3 0 0 0 4 0 4 3 0 0 0 0 3 0 0 0 2 0 0 11 9 3 4 11 7 6 3 0 0 0 0 0 7 1 7 12 0 0 0 15 12 0 0 11 12 0 8 2 0 0 7 2 0 0 0 0 -3.4149 42 23 10 9 0 0 0 9 1 8 0 28 1015.55 1.998 1.332 0.666 1.998 -12 37 1711 5 7 2 11 0 0 0 1 0 4 6 0 0 0 4 1 1 0 0 0 0 0 19 18 4 1 19 5 7 11 0 0 0 0 0 12 6 3 21 0 0 0 21 21 0 0 # 31.5367 -1.229 61.1602 # TRP 177 Env_1b9v_15 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 66 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 22 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 1 2 0 0 1 0 0 1 0 0 0 0 0 -0.8443 5 3 1 1 0 0 0 0.5 0.5 1 0 4 136.453 0.333 0 0.333 0.333 -2 6 106 0 1 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 4 1 0 0 0 0 0 0 1 0 3 1 0 0 0 4 1 0 0 2 3 1 4 0 0 0 2 1 0 0 0 0 -1.7152 13 6 4 3 0 0 0 4 0 2.5 0 9 281.802 0.666 0.333 0.333 0.666 -6 13 331 4 2 1 0 0 0 1 4 0 0 0 0 0 0 0 1 0 0 0 0 0 0 4 3 2 4 4 6 2 1 0 0 0 0 0 3 4 2 4 0 0 0 9 4 0 0 4 8 2 1 2 0 1 3 1 0 0 0 0 -2.0795 22 14 4 4 0 0 0 2 2 3.5 3 11 570.574 0.999 0.666 0.333 1.499 -5 36 748 0 3 0 2 0 0 2 3 3 0 5 0 0 0 0 4 0 0 0 0 0 0 5 7 7 3 5 7 6 4 0 0 0 0 3 5 2 2 10 0 0 0 12 10 0 0 4 7 1 6 0 0 1 3 3 2 0 0 0 -6.2 27 12 7 8 0 0 2 6.5 0.5 4.5 2 15 599.355 0.999 0.999 0 1.499 -11 27 919 1 3 0 4 0 0 2 1 2 2 3 0 0 0 0 7 0 1 1 0 0 0 6 9 11 1 7 9 5 6 0 0 0 0 2 5 4 5 11 0 0 0 16 11 0 0 # 26.0743 -15.0627 64.869 # ASN 294 Env_1b9v_16 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 59 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 16 177 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 4 0 0 0 1 0 0 0 0 0 0 0 -0.3643 5 4 1 0 0 0 0 0 1 0 0 0 167.55 1 0 1 1 4 14 300 0 3 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 1 4 0 0 1 0 4 0 0 0 0 0 0 0 0 1 4 0 0 0 1 4 0 0 1 4 0 1 0 0 0 0 2 0 0 0 0 -1.7926 8 5 1 2 0 0 0 1 0 1 0 2 197.03 0.999 0.999 0 0.999 -2 16 487 0 2 0 3 0 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 2 6 0 0 2 0 3 3 0 0 0 0 0 0 3 1 4 0 0 0 4 4 0 0 3 7 3 1 0 0 0 2 1 0 0 0 0 -0.6923 17 13 1 3 0 0 0 1 0 2.5 3 8 447.052 0.666 0.666 0 0.666 3 23 943 0 2 0 9 0 0 0 0 0 2 0 1 0 0 0 0 0 3 0 0 0 0 2 12 3 0 5 0 3 9 0 0 0 0 0 0 2 11 4 0 0 0 13 4 0 0 3 2 5 3 0 0 1 2 1 0 0 0 0 -2.2858 17 10 4 3 0 0 0 3 1 2.5 6 8 388.386 0.333 0.333 0 0.333 -2 30 664 0 0 1 3 0 0 0 0 0 3 0 2 0 0 0 0 0 8 0 0 0 0 3 5 9 0 11 1 2 3 0 0 0 0 0 0 2 11 4 0 0 0 13 4 0 0 # 29.259 -3.692 66.308 # ARG 150 Env_1b9v_17 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 3 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 1 3 0 1 0 0 0 0 0 0 0 0 0 -0.2414 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 4 15 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 1 1 0 1 0 0 0 2 0 0 0 0 0 -0.9524 5 2 1 2 0 0 0 1 0 2 0 4 104.145 0 0 0 0 -2 3 15 0 0 0 0 0 0 0 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 2 1 0 2 2 2 1 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 1 4 2 1 3 0 0 2 1 0 0 0 0 -3.1726 14 7 4 3 0 0 0 2 2 2.5 1 6 335.349 1.332 0.333 0.999 1.332 -6 32 281 0 5 0 1 0 0 0 1 0 0 0 3 0 0 0 0 3 0 1 0 0 0 0 9 4 1 0 5 8 1 0 0 0 0 0 0 0 8 6 0 0 0 8 6 0 0 5 11 4 3 5 0 0 1 1 1 0 0 0 -3.4377 31 20 8 3 0 0 1 5 3 1.5 3 12 802.05 2.664 0.666 1.998 2.664 -4 68 491 0 10 0 3 0 0 1 3 0 0 0 1 0 0 0 0 5 3 5 0 0 0 0 15 13 3 3 13 11 4 0 0 0 0 0 7 0 9 15 0 0 0 16 15 0 0 5 9 2 5 1 0 0 5 1 3 0 0 0 -5.2585 31 16 6 9 0 0 3 5 1 5.5 2 14 723.593 0.666 0.666 0 0.666 -7 39 452 0 4 1 4 0 0 1 4 0 0 2 1 0 0 2 2 3 2 5 0 0 0 4 10 13 4 6 15 5 5 0 0 0 0 0 4 0 9 18 0 0 0 13 18 0 0 # 33.299 -19.45 63.775 # ILE 348 Env_1b9v_18 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 30 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 4 120 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 2 0 0 0 0 0 -0.4229 6 3 1 2 0 0 0 1 0 2 0 5 137.655 0 0 0 0 -2 3 202 0 0 2 0 0 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 4 0 2 0 4 2 0 0 0 0 0 0 0 0 0 2 4 0 0 0 2 4 0 0 1 5 0 0 2 0 0 3 0 0 0 0 0 -2.5191 11 6 2 3 0 0 0 0.5 1.5 3 0 6 280.55 0.333 0 0.333 0.333 -4 17 445 0 3 2 3 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 3 6 2 0 3 2 3 3 0 0 0 0 0 2 3 2 4 0 0 0 7 4 0 0 4 7 5 5 4 0 0 1 3 0 0 0 0 -5.6868 29 16 9 4 0 0 0 6.5 2.5 2.5 3 8 692.217 2.997 1.332 1.665 2.997 -5 73 1085 1 11 4 6 0 0 0 3 0 0 1 0 0 0 0 0 0 3 0 0 0 0 2 17 7 3 5 7 11 6 0 0 0 0 0 7 5 10 7 0 0 0 22 7 0 0 7 10 3 5 0 0 0 3 1 1 0 0 0 -1.036 30 20 5 5 0 0 1 5 0 3.5 3 19 760.879 0.666 0.666 0 0.666 -3 27 909 3 2 2 6 0 0 0 1 2 0 1 0 0 0 2 4 3 3 0 1 0 0 7 8 14 1 10 10 4 6 0 0 0 0 0 5 3 6 16 0 0 0 14 16 0 0 # 26.275 -3.94 62.163 # ILE 221 Env_1b9v_19 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 39 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 13 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 1 3 0 1 1 0 0 0 0 0 0 0 0 -0.5498 6 4 2 0 0 0 0 1.5 0.5 0 0 3 172.606 0.333 0 0.333 0.333 0 8 81 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 0 3 3 0 0 0 3 3 0 0 1 4 2 0 3 0 0 1 1 0 0 0 0 -2.0992 12 7 3 2 0 0 0 1 2 1.5 0 3 303.776 1.665 0.333 1.332 1.665 -3 38 158 0 9 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 11 0 0 1 0 9 2 0 0 0 0 0 2 0 1 9 0 0 0 3 9 0 0 5 6 2 2 2 0 0 3 3 1 0 0 0 -3.5202 24 13 4 7 0 0 1 2.5 1.5 4.5 3 7 537.26 2.331 1.998 0.333 2.331 -5 54 471 0 3 0 4 0 0 6 0 0 1 3 0 0 0 2 0 0 1 4 0 0 0 6 13 5 0 7 4 3 10 0 0 0 0 0 5 0 9 10 0 0 0 14 10 0 0 4 11 4 2 0 0 1 3 3 0 0 0 0 -4.3594 28 19 3 6 0 0 0 2.5 0.5 4.5 5 13 722.096 0.999 0.999 0 1.499 0 41 570 1 1 0 4 0 0 4 0 2 2 4 1 0 0 2 1 0 1 4 1 0 0 10 10 8 0 11 5 4 8 0 0 0 0 0 8 0 9 11 0 0 0 17 11 0 0 # 38.0743 -9.08933 64.1653 # GLU 117 Env_1b9v_20 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 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 64 0 0 0 1 0 0 0 3 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 3 0 4 0 1 0 0 0 0 0 0 0 3 2 0 0 0 3 2 0 0 0 0 0 0 0 0 0 2 0 1 0 0 0 -1.8044 3 0 0 3 0 0 1 0 0 2 0 2 40.145 0 0 0 0 -3 2 81 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 1 1 1 0 1 1 0 1 0 0 0 0 1 0 0 0 2 0 0 0 1 2 0 0 5 9 1 3 2 0 0 2 1 0 0 0 0 -1.3928 23 15 5 3 0 0 0 4 1 2.5 0 11 602.543 1.665 0.666 0.999 1.665 -5 32 745 1 3 6 5 0 0 0 0 0 1 0 0 0 0 0 7 0 0 0 0 0 0 2 8 13 0 2 13 3 5 0 0 0 0 3 3 0 7 10 0 0 0 13 10 0 0 5 4 0 5 1 0 0 5 1 2 0 0 0 -4.69 23 9 6 8 0 0 2 5 1 5.5 0 16 498.775 0.333 0.333 0 0.333 -12 17 913 4 1 2 1 0 0 0 0 1 6 0 1 0 0 0 3 4 0 0 0 0 0 10 3 10 0 10 9 3 1 0 0 0 0 2 5 1 6 9 0 0 0 14 9 0 0 4 15 3 4 0 0 2 3 1 1 0 0 0 -4.2031 33 22 6 5 0 0 1 5 1 3.5 6 17 860.362 0.333 0.333 0 1.333 -3 49 1354 3 2 0 0 0 0 1 4 6 6 2 3 0 0 0 0 2 0 4 0 0 0 11 6 12 4 11 10 11 1 0 0 0 0 3 5 2 12 11 0 0 0 22 11 0 0 # 21.185 -7.024 59.533 # GLY 243 Env_1b9v_21 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 2 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 6 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 2 1 0 0 0 1 1 1 0 0 0 0 -1.8281 6 3 1 2 0 0 0 0.5 0.5 1.5 2 1 133.309 0.333 0.333 0 0.833 -2 15 45 0 1 0 0 0 0 1 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 2 2 2 0 2 0 3 1 0 0 0 0 0 2 0 1 3 0 0 0 3 3 0 0 3 6 2 2 0 0 1 3 0 0 0 0 0 -0.889 17 11 3 3 0 0 0 2.5 0.5 3 3 8 419.094 0.333 0.333 0 0.833 -1 21 192 0 5 0 1 0 0 1 0 3 0 4 0 0 0 0 0 3 0 0 0 0 0 4 7 6 0 4 3 8 2 0 0 0 0 0 7 0 2 8 0 0 0 9 8 0 0 5 14 0 5 0 0 0 5 2 0 0 0 0 -4.5131 31 19 5 7 0 0 0 5 0 6 0 22 793.119 0.666 0.666 0 0.666 -5 18 844 1 5 0 5 0 0 4 0 3 3 2 2 0 0 0 0 2 4 0 0 0 0 6 16 9 0 10 2 10 9 0 0 0 0 0 3 1 15 12 0 0 0 19 12 0 0 11 13 1 8 1 0 0 8 0 1 0 0 0 -3.2424 43 25 9 9 0 0 1 8 1 8 1 29 1052.03 0.333 0.333 0 0.333 -12 31 1134 3 9 4 1 0 0 3 1 5 6 0 1 0 0 0 2 5 2 1 0 0 0 9 14 19 1 11 13 15 4 0 0 0 0 0 9 4 10 20 0 0 0 23 20 0 0 # 39.268 -5.011 65.369 # ARG 154 Env_1b9v_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 4 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 -0.2047 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 32 0 0 0 0 0 0 0 4 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 4 1 4 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 0 0 0 0 0 0 0 2 1 0 0 0 0 -1.9372 3 0 0 3 0 0 0 0 0 2.5 0 2 37.125 0.333 0.333 0 0.333 -3 3 19 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 1 0 2 0 1 0 0 0 0 0 0 0 2 1 0 0 0 2 1 0 0 3 8 1 3 2 0 0 3 1 0 0 0 0 -2.428 21 12 5 4 0 0 0 3.5 1.5 3.5 0 10 512.296 1.332 0.666 0.666 1.332 -6 32 254 0 5 1 3 0 0 0 2 0 5 0 0 0 0 2 0 3 0 0 0 0 0 7 8 4 2 7 6 5 3 0 0 0 0 0 5 0 8 8 0 0 0 13 8 0 0 5 9 0 3 4 0 0 4 0 0 0 0 0 -3.8964 25 14 7 4 0 0 0 5 2 4 0 14 642.312 1.332 0 1.332 1.332 -6 34 641 0 5 6 5 0 0 0 0 0 1 2 1 0 0 3 0 1 1 0 0 0 0 6 11 8 0 7 7 6 5 0 0 0 0 0 2 0 14 9 0 0 0 16 9 0 0 4 9 2 4 2 0 0 3 1 1 0 0 0 -3.511 26 15 6 5 0 0 1 4.5 1.5 3.5 0 15 654.412 1.332 0.333 0.999 1.332 -8 38 723 1 8 1 3 0 0 1 0 0 1 2 1 0 0 2 1 4 1 0 0 0 0 6 13 7 0 7 6 9 4 0 0 0 0 0 4 0 13 9 0 0 0 17 9 0 0 # 28.935 -19.299 64.424 # GLY 347 Env_1b9v_23 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 27 168 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 0 0 0 6 0 0 0 0 6 0 0 0 1 2 0 0 0 1 0 0 0 0 0 0 -0.3485 4 3 1 0 0 0 0 0 1 0 3 0 101.189 0 0 0 0 1 10 86 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 1 0 0 1 0 3 0 4 0 0 0 0 0 0 0 0 1 0 0 3 0 0 0 1 3 0 0 0 5 2 0 5 0 1 0 0 0 0 0 0 -2.916 13 7 6 0 0 0 0 2 4 0 1 0 343.732 1.665 0 1.665 2.165 -1 48 421 0 9 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 2 0 0 2 9 2 0 3 0 10 0 0 0 0 0 0 3 0 5 5 0 0 0 8 5 0 0 3 5 2 2 1 0 0 2 2 0 0 0 0 -2.3745 17 10 3 4 0 0 0 2.5 0.5 3 2 7 399.225 1.665 1.332 0.333 1.665 -6 32 491 0 4 0 3 0 0 2 0 2 0 0 0 0 0 0 0 0 2 0 4 0 0 4 9 4 0 6 0 6 5 0 0 0 0 0 11 0 3 3 0 0 0 14 3 0 0 6 10 4 5 2 0 1 4 2 0 0 0 0 -4.3671 34 20 8 6 0 0 0 6.5 1.5 5 4 20 838.29 1.665 0.666 0.999 2.165 -7 46 882 0 7 0 3 0 0 3 4 4 2 0 0 2 0 3 1 0 2 3 0 0 0 7 13 10 4 9 8 11 6 0 0 0 0 0 16 3 3 12 0 0 0 22 12 0 0 # 38.2883 -15.7943 69.5752 # TRP 408 Env_1b9v_24 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 36 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 12 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 2 0 1 0 0 0 0 0 0 -1.6156 4 1 3 0 0 0 0 1 2 0 1 0 99.097 0.333 0 0.333 0.833 -2 15 70 0 2 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 0 3 1 0 0 0 0 1 3 0 0 0 0 0 0 4 0 0 0 1 6 3 1 0 0 0 1 0 0 0 0 0 -0.1161 12 10 1 1 0 0 0 1 0 1 2 4 333.822 0.333 0 0.333 0.333 1 23 182 0 4 1 0 0 0 4 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 8 4 0 0 2 6 4 0 0 0 0 2 9 0 1 0 0 0 0 12 0 0 0 6 13 2 5 4 0 1 5 2 2 0 0 0 -6.9614 40 21 10 9 0 0 2 7 3 6 2 18 961.024 2.331 0.999 1.332 2.831 -14 64 727 4 10 5 3 0 0 7 0 2 0 0 0 0 0 0 3 6 0 0 0 0 0 4 20 16 0 4 14 12 10 0 0 0 0 4 19 4 5 8 0 0 0 32 8 0 0 7 7 0 4 0 0 0 5 0 0 0 0 0 -0.1465 23 14 4 5 0 0 0 4 0 5 0 19 583.158 0 0 0 0 -6 7 291 1 2 2 1 0 0 1 2 4 0 0 0 1 0 0 6 3 0 0 0 0 0 2 4 15 2 2 13 6 2 0 0 0 0 7 6 2 5 3 0 0 0 20 3 0 0 # 26.8297 -12.354 60.2267 # GLU 275 Env_1b9v_25 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 61 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 1 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 16 183 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 3 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.0875 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 1 5 122 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 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 4 5 0 0 0 0 1 0 0 0 0 0 -1.2832 10 9 0 1 0 0 0 0 0 1 5 1 272.197 0 0 0 0 8 26 194 0 1 0 0 0 0 0 1 0 3 0 0 0 0 0 0 0 3 2 0 0 0 3 1 5 1 6 3 1 0 0 0 0 0 0 0 0 1 9 0 0 0 1 9 0 0 3 5 7 3 3 0 1 0 0 1 0 0 0 -2.7511 23 15 7 1 0 0 1 4.5 2.5 0 7 8 570.462 1.665 0 1.665 1.665 -3 66 547 0 7 0 0 0 0 0 1 0 3 0 0 0 0 0 0 0 9 3 0 0 0 3 7 12 1 12 4 7 0 0 0 0 0 0 2 0 2 19 0 0 0 4 19 0 0 5 7 3 3 3 0 0 6 1 0 0 0 0 -5.1553 28 15 6 7 0 0 0 3.5 2.5 6.5 3 16 666.84 0.666 0.333 0.333 0.666 -6 35 450 0 5 1 0 0 0 1 4 0 2 0 2 0 0 0 0 5 2 5 1 0 0 3 8 13 4 5 15 7 1 0 0 0 0 0 4 0 7 17 0 0 0 11 17 0 0 # 34.48 -17.147 67.433 # ARG 374