# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1qw6 # POINT_FILE ../DUDE/pocket_res_ptf_tian/1qw6_3AR_A_902.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_1qw6_0 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.2429 3 2 1 0 0 0 0 1 0 0 0 1 81.157 0 0 0 0 1 3 51 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 0 3 0 0 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 0 0 0 0 0 0.5823 3 3 0 0 0 0 0 0 0 0 0 2 100.53 0 0 0 0 0 1 51 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 0 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 1 1 0 1 0 0 0 2 0 0 0 0 0 -1.0129 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 23 1 0 0 0 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 1 0 0 4 0 0 0 1 4 0 0 4 4 5 3 0 0 0 2 0 1 0 0 0 -1.4271 19 13 3 3 0 0 1 3 0 2 6 10 464.368 0 0 0 0 1 30 282 1 0 0 0 0 0 0 4 0 0 3 0 0 0 0 0 0 3 8 0 0 0 4 0 11 4 7 12 0 0 0 0 0 0 0 9 0 2 8 0 0 0 11 8 0 0 3 11 2 3 0 0 0 2 0 0 0 0 0 -3.1186 21 16 3 2 0 0 0 3 0 2 3 10 584.942 0 0 0 0 3 29 298 2 0 0 0 0 1 0 3 0 0 3 0 0 0 0 3 0 2 6 1 0 0 6 0 12 3 8 13 0 0 0 0 0 0 1 12 0 1 7 0 0 0 14 7 0 0 5 7 4 3 0 0 1 6 2 2 0 0 0 -5.1195 30 16 4 10 0 0 2 3 1 7 5 11 665 0.999 0.999 0 0.999 -4 53 662 1 0 0 0 0 4 3 1 0 3 1 0 1 2 0 3 0 3 7 1 0 0 9 3 17 1 12 15 0 3 0 0 3 0 4 17 0 4 2 0 0 3 25 2 0 0 # 0.294 -2.822 62.702 # PRO Env_1qw6_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 300 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 0 0 0 0 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 50 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 1 0 0 0 0 0 0 1 0 0 0 2 5 3 3 0 0 0 3 0 0 0 0 0 -2.5887 16 10 3 3 0 0 0 3 0 3 3 10 391.026 0 0 0 0 0 17 584 0 0 0 0 1 0 0 0 0 0 0 0 0 7 0 1 0 0 0 7 0 0 14 0 2 0 14 2 0 0 0 0 0 0 0 15 0 0 1 0 0 0 15 1 0 0 3 8 3 1 0 0 0 2 0 0 1 1 0 -0.672 19 14 1 2 2 0 0.5 1 0 2 3 8 532.398 0 0 0 0 6 24 204 2 0 0 0 2 0 0 0 0 3 0 0 3 4 3 2 0 0 0 0 0 0 15 0 4 0 15 4 0 0 0 0 0 0 0 10 0 0 9 0 0 0 10 9 0 0 4 12 2 4 0 0 0 4 0 0 0 0 0 -2.0492 26 18 4 4 0 0 0 4 0 4 2 18 685.784 0 0 0 0 -3 15 398 3 0 1 0 2 0 0 1 0 2 0 0 5 1 3 5 0 3 0 0 0 0 14 0 11 1 17 9 0 0 0 0 3 0 0 9 0 1 13 0 0 3 10 13 0 0 # -0.426667 6.66667 63.5267 # PHE Env_1qw6_2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 420 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 0 2 0 0 0 1 0 0 0 0 0 0 -0.647 3 2 1 0 0 0 0 0 1 0 3 0 67.679 0 0 0 0 0 9 210 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 1 4 0 1 0 0 0 2 0 1 0 0 0 -1.892 9 5 1 3 0 0 1 1 0 2 0 3 208.901 0 0 0 0 -1 14 435 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 1 1 3 0 0 0 0 1 0 8 0 4 5 0 0 0 3 0 0 0 0 0 0 6 0 0 3 0 6 0 0 4 7 0 3 0 0 0 2 0 1 0 0 0 -0.8678 17 11 3 3 0 0 1 3 0 2 0 11 461.458 0 0 0 0 -4 10 677 0 3 0 0 0 2 0 3 0 0 3 0 0 0 0 2 2 2 0 0 0 0 3 3 8 3 5 9 3 0 0 2 0 0 0 0 0 0 15 0 0 2 0 15 0 0 3 9 2 5 0 0 0 7 0 0 0 0 0 -4.8884 26 14 5 7 0 0 0 5 0 7 2 18 606.305 0 0 0 0 -5 23 894 0 2 2 0 0 1 0 2 0 4 3 0 0 0 0 2 3 2 2 3 0 0 10 2 12 2 12 12 2 0 0 1 2 0 0 10 1 2 10 0 0 3 13 10 0 0 # -9.10833 -2.87333 62.1333 # TRP Env_1qw6_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 11 252 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 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 84 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 1 0 0 0 0 0 0 0 0 1 0 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 84 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 4 3 2 0 0 0 1 0 0 0 0 0 -1.8764 10 7 2 1 0 0 0 2 0 1 3 6 247.429 0 0 0 0 1 10 248 0 0 0 0 0 0 2 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 4 2 4 0 4 4 0 2 0 0 2 0 0 8 0 0 0 0 0 2 8 0 0 0 6 5 1 2 0 0 0 3 0 1 0 0 0 -0.1046 18 12 2 4 0 0 1 2 0 3 2 10 462.113 0 0 0 0 0 24 415 0 0 0 0 0 0 2 0 0 1 0 0 3 0 2 0 1 2 7 0 0 0 6 2 10 0 8 8 0 2 0 0 4 0 0 10 0 0 4 0 0 4 10 4 0 0 2 10 1 2 0 0 0 2 2 1 1 0 0 -3.5782 21 13 2 5 1 0 1 2 0 3 1 10 538.924 0.999 0.999 0 0.999 -2 26 199 0 0 0 3 0 0 0 4 0 3 0 0 1 0 2 0 5 1 1 1 0 0 7 3 7 4 8 10 0 3 0 0 15 0 0 2 1 0 3 0 0 15 3 3 0 0 # 0 -1.87333 56.19 # GLU Env_1qw6_4 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 6 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 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 12 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 2 0 0 0 0 0 0 2 0 0 0 1 1 1 1 0 0 1 1 0 0 0 0 0 -1.0689 6 3 2 1 0 0 0 1.5 0.5 1 2 3 139.751 0 0 0 0.5 -2 8 18 1 0 0 0 0 0 0 0 2 0 0 0 0 0 0 3 0 0 0 0 0 0 1 0 5 0 1 3 2 0 0 0 3 0 0 3 0 0 0 0 0 3 3 0 0 0 2 9 2 2 0 0 1 5 0 0 0 0 0 -3.4937 21 13 3 5 0 0 0 2.5 0.5 5 3 13 515.591 0 0 0 0.5 -3 19 317 7 1 0 0 0 0 0 3 3 0 3 0 0 3 1 0 0 0 0 0 0 0 14 1 3 3 14 3 4 0 0 0 4 0 0 9 0 0 8 0 0 4 9 8 0 0 6 8 0 6 0 0 0 4 0 0 0 0 0 -1.7618 24 14 6 4 0 0 0 6 0 4 0 20 599.938 0 0 0 0 -6 6 276 5 1 0 0 0 0 0 1 3 2 2 0 0 2 2 4 1 0 0 1 0 0 14 1 8 1 14 6 4 0 0 0 8 0 0 6 0 1 9 0 0 8 7 9 0 0 6 20 4 6 0 0 0 3 0 2 0 0 0 -2.6502 41 30 6 5 0 0 2 6 0 3 4 21 1125.02 0 0 0 0 5 38 801 2 3 0 0 0 0 0 0 1 2 9 0 0 3 7 2 3 1 2 6 0 0 29 3 9 0 30 7 4 0 0 0 10 0 0 9 0 2 20 0 0 10 11 20 0 0 # -2.38 0.54 67.95 # SER Env_1qw6_5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 # 0 0 0 # TYR Env_1qw6_6 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 11 105 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 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 -0.0644 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 35 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 1 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 -0.5614 2 1 0 1 0 0 1 0 0 0 0 0 50.667 0 0 0 0 0 7 36 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 1 1 0 0 0 0 0 0 2 0 0 0 1 3 2 2 1 0 0 1 0 1 0 0 0 -1.5059 11 6 3 2 0 0 1 2 1 1 2 4 245.713 0.333 0 0.333 0.333 -3 29 216 1 4 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 3 0 0 0 2 4 5 0 2 5 4 0 0 0 0 0 2 4 0 1 4 0 0 0 7 4 0 0 6 9 3 4 2 0 0 3 0 1 0 0 0 -3.1962 28 18 6 4 0 0 1 5 1 3 4 16 726.327 0.666 0 0.666 0.666 -3 36 591 3 5 0 0 0 2 0 0 0 2 1 0 0 0 3 4 0 0 4 4 0 0 13 5 10 0 13 10 5 0 0 0 0 0 2 11 0 7 8 0 0 0 20 8 0 0 5 8 6 3 1 0 1 3 3 0 0 0 0 -4.3307 30 19 5 6 0 0 0 3.5 1.5 4.5 7 12 734.253 1.665 1.332 0.333 1.665 -2 53 425 1 2 1 3 0 0 1 0 0 2 4 0 0 0 4 3 0 3 4 2 0 0 13 6 11 0 16 8 2 4 0 1 4 0 0 10 1 6 8 0 0 5 17 8 0 0 # 5.86667 -0.58 61.3433 # GLN Env_1qw6_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 5 115 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 3 0 0 0 0 0 0 0 0 -2.2062 4 1 3 0 0 0 0 1 2 0 0 0 102.947 0.666 0 0.666 0.666 -3 19 460 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 -0.763 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 1 6 272 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 1 0 0 2 0 0 0 0 0 1 0 0 2 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 -0.2658 3 2 0 1 0 0 0 0 0 0.5 0 1 68.226 0.666 0.666 0 0.666 -1 5 199 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 2 0 0 1 0 0 0 0 0 2 0 0 1 0 2 0 0 1 3 0 1 0 0 0 1 0 0 0 0 0 -0.2217 6 4 1 1 0 0 0 1 0 1 0 3 159.671 0 0 0 0 1 4 515 0 3 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 2 4 0 0 2 0 3 1 0 0 3 0 0 0 0 2 1 0 0 3 2 1 0 0 1 9 0 3 1 0 0 3 1 0 0 0 0 -3.8964 18 10 4 4 0 0 0 3.5 0.5 3.5 0 11 450.559 0.666 0.333 0.333 0.666 -5 18 620 0 3 0 5 0 0 2 0 0 0 0 0 0 0 3 0 1 0 0 4 0 0 7 10 1 0 7 1 3 7 0 0 6 0 0 0 7 3 2 0 0 6 10 2 0 0 # 6.72 -0.58 49.48 # ARG Env_1qw6_8 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 31 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 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 19 124 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 4 0 0 0 0 0 4 0 0 0 0 1 0 0 0 0 0 0 3 0 0 0 0 -2.3652 4 1 0 3 0 0 0 0 0 1.5 0 0 75.921 0.999 0.999 0 0.999 -2 11 47 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 1 3 0 0 1 0 0 0 1 0 2 0 0 1 1 2 0 0 3 5 0 1 1 0 0 2 0 0 0 0 0 -0.854 12 8 2 2 0 0 0 1.5 0.5 2 0 6 303.772 0.999 0.666 0.333 0.999 -1 13 349 1 4 0 7 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 11 0 0 1 0 4 7 0 1 7 0 0 0 2 0 2 0 0 8 2 2 0 0 2 4 5 4 2 0 0 1 2 0 0 0 0 -3.7073 20 11 6 3 0 0 0 4.5 1.5 2 4 8 469.047 1.332 0.666 0.666 1.332 -2 42 762 2 7 0 4 0 0 0 0 0 0 0 0 0 0 0 1 0 2 4 0 0 0 2 11 7 0 4 5 7 4 0 2 4 0 0 2 6 0 6 0 0 6 8 6 0 0 7 11 3 4 1 0 0 7 1 1 0 0 0 -4.4894 35 21 5 9 0 0 1 4.5 0.5 7.5 4 18 835.087 0.999 0.666 0.333 0.999 -9 53 1198 2 4 4 8 0 1 1 0 0 0 0 0 0 0 6 1 0 2 6 0 0 0 8 13 14 0 10 12 4 9 0 12 4 0 1 3 6 0 9 0 0 16 10 9 0 0 # 10.37 -3.37 55.56 # ARG Env_1qw6_9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 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 6 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 -0.647 3 2 1 0 0 0 0 0 1 0 3 0 67.679 0 0 0 0 0 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 2 4 6 0 0 0 0 1 1 1 0 0 0 -2.5266 15 12 0 3 0 0 1 0 0 1.5 7 2 377.112 0.666 0.666 0 0.666 6 42 123 0 0 0 3 0 0 0 0 0 1 0 1 0 0 0 0 0 2 8 0 0 0 1 4 10 0 3 8 1 3 0 0 5 0 2 7 1 0 0 0 0 5 10 0 0 0 7 6 10 3 1 0 0 2 2 4 0 0 0 -5.2892 35 23 4 8 0 0 4 3.5 0.5 3 14 10 818.02 0.999 0.666 0.333 0.999 2 93 263 0 1 0 5 0 0 0 0 0 5 0 1 0 2 0 0 0 2 19 0 0 0 7 7 21 0 9 19 2 5 0 0 15 0 4 9 4 2 1 0 0 15 19 1 0 0 5 10 12 5 3 0 0 4 1 0 0 0 0 -5.3865 40 27 8 5 0 0 0 5.5 2.5 4.5 11 18 986.53 1.332 0.666 0.666 1.332 3 67 674 0 7 0 4 0 0 2 1 0 3 0 2 0 2 0 0 0 1 18 0 0 0 5 15 19 1 6 19 9 6 0 0 9 0 4 10 7 3 7 0 0 9 24 7 0 0 # 7.59 -8.035 59.12 # TRP Env_1qw6_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 17 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 34 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 3 0 0 0 0 0 0 0 0 0 0 0 -0.2064 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 2 36 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 2 0 1 0 2 0 1 0 0 0 2 0 0 1 0 0 0 0 0 2 1 0 0 0 3 4 0 1 0 0 0 2 0 1 0 0 0 -0.8272 11 7 1 3 0 0 1 1 0 2 0 8 288.852 0 0 0 0 -2 5 182 1 0 0 2 0 0 0 0 4 0 0 0 2 0 0 0 1 0 0 1 0 0 4 2 5 0 4 1 4 2 0 0 6 0 0 2 1 0 2 0 0 6 3 2 0 0 2 16 1 7 0 0 1 4 1 0 0 0 0 -5.7663 32 19 8 5 0 0 0 7.5 0.5 4.5 2 17 796.968 0.333 0.333 0 0.833 -3 28 655 3 0 0 2 0 0 2 1 3 1 0 0 2 0 4 0 7 0 0 7 0 0 17 4 10 1 17 8 3 4 0 0 17 0 0 7 2 0 6 0 0 17 9 6 0 0 10 9 2 7 0 0 0 2 1 1 0 0 0 0.9885 32 21 7 4 0 0 1 7 0 2.5 2 23 830.042 0.666 0.666 0 0.666 -9 20 1134 0 0 0 1 0 0 5 3 4 1 0 0 0 0 4 2 3 0 2 7 0 0 12 6 11 3 12 10 4 6 0 0 17 0 0 4 5 3 3 0 0 17 12 3 0 0 # -4.71 -3.11 51.82 # MET Env_1qw6_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 42 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 3 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 -0.0303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 14 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 1 0 0 0 1 0 0 0 0 0 -1.3202 4 2 1 1 0 0 0 1 0 1 1 3 85.662 0 0 0 0 -1 5 112 0 0 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 1 0 1 0 0 3 0 0 3 0 0 1 0 0 0 0 0 3 1 0 0 0 4 5 3 2 2 0 1 2 0 0 0 0 0 -0.7449 19 12 5 2 0 0 0 3 2 2 3 10 489.968 0.999 0 0.999 0.999 -3 35 519 0 5 0 2 0 0 2 0 0 6 0 0 0 0 0 0 0 3 1 0 0 0 6 9 4 0 9 1 5 4 0 0 13 0 0 3 3 0 0 0 0 13 6 0 0 0 1 4 7 3 2 0 0 2 1 2 0 0 0 -6.954 22 12 5 5 0 0 2 3.5 1.5 2.5 8 6 487.24 0.666 0.333 0.333 0.666 -1 59 709 0 6 0 1 0 0 2 1 0 1 0 0 0 0 0 0 1 5 5 0 0 0 1 9 11 1 6 7 6 3 0 0 9 0 0 10 1 0 2 0 0 9 11 2 0 0 8 10 11 3 1 0 0 3 2 0 0 0 0 -1.554 38 29 4 5 0 0 0 3 1 4 11 10 961.399 1.665 1.332 0.333 1.665 7 86 735 0 6 0 2 1 3 3 3 0 1 0 0 0 0 0 0 1 1 14 3 0 0 4 11 20 3 5 22 6 5 0 0 16 0 3 7 8 0 4 0 0 16 18 4 0 0 # 6.33 -4.98 56.0133 # ASP Env_1qw6_12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 # 0 0 0 # TYR Env_1qw6_13 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 20 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 0 136 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 2 3 1 4 0 0 0 0 0 0 0 1 0 0 4 0 0 0 1 4 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 6 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 1 7 3 2 0 0 0 2 0 2 0 0 0 -2.5816 17 11 2 4 0 0 2 2 0 2 3 8 421.335 0 0 0 0 -1 18 588 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 8 0 7 0 0 0 0 2 0 15 0 9 8 0 0 0 0 0 0 0 4 0 0 13 0 0 0 4 13 0 0 4 6 4 4 0 0 0 2 0 0 0 0 0 -0.9783 20 14 4 2 0 0 0 4 0 2 4 10 514.778 0 0 0 0 1 29 736 1 3 0 0 0 0 0 0 0 0 4 0 0 2 4 1 0 4 1 0 0 0 11 3 6 0 15 2 3 0 0 0 0 0 0 4 0 0 16 0 0 0 4 16 0 0 3 17 7 1 0 0 1 5 0 0 0 0 0 -4.2531 34 27 2 5 0 0 0 1 1 5 8 18 942.091 0 0 0 0 7 49 645 10 1 0 0 0 0 0 1 0 0 9 0 0 4 1 1 0 6 1 0 0 0 24 1 8 1 30 3 1 0 0 0 7 0 0 12 0 1 14 0 0 7 13 14 0 0 # -4.66 -0.26 63.63 # GLY Env_1qw6_14 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1825 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 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 1 1 0 1 0 0 0 0 0 0 0 0 0 0.2153 3 2 1 0 0 0 0 1 0 0 0 3 81.157 0 0 0 0 -1 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 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 2 0 1 0 0 0 2 0 0 0 0 0 -1.4909 6 3 1 2 0 0 0 1 0 2 0 4 137.655 0 0 0 0 -1 4 79 1 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 1 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 2 0 2 2 0 0 0 4 2 0 0 2 9 0 4 0 0 0 2 0 1 0 0 0 -2.1942 18 11 4 3 0 0 1 4 0 2 0 12 465.303 0 0 0 0 -3 13 214 0 0 0 0 0 0 0 0 0 1 8 0 0 2 2 4 0 0 0 1 0 0 14 0 4 0 14 4 0 0 0 0 0 0 0 7 0 5 6 0 0 0 12 6 0 0 5 18 2 4 0 0 1 1 0 0 0 0 0 -0.5843 31 25 5 1 0 0 0 4.5 0.5 1 3 13 922.685 0 0 0 0.5 6 37 494 0 0 0 0 0 5 0 1 3 4 4 0 0 2 5 3 0 0 0 4 0 0 19 0 11 1 19 9 3 0 0 0 4 0 5 6 0 5 11 0 0 4 16 11 0 0 3 11 6 2 0 0 1 8 0 1 0 0 0 -6.2334 32 20 3 9 0 0 1 2.5 0.5 8 7 16 754.971 0 0 0 0.5 0 37 503 2 0 0 0 0 3 0 2 2 3 2 0 0 4 3 5 0 0 2 4 0 0 18 0 12 2 18 12 2 0 0 0 5 0 3 10 0 6 8 0 0 5 19 8 0 0 # 2.14 0.37 66.69 # ALA Env_1qw6_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 1 0 0 0 0 0 0 0 0 1 0 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 0 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 5 0 0 0 0 0 0 0 0 5 0 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.5129 4 2 1 1 0 0 0 1 0 1 0 3 92.651 0 0 0 0 -1 3 84 0 0 0 0 0 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 2 1 0 1 2 1 0 1 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 2 5 4 1 0 0 1 2 1 0 0 0 0 -2.11 16 11 2 3 0 0 0 1 1 2.5 5 6 381.738 0.666 0.666 0 0.666 0 26 296 0 0 0 3 0 0 3 3 0 0 0 0 0 0 0 0 0 5 0 2 0 0 2 6 5 3 7 3 0 6 0 0 11 0 0 5 0 0 0 0 0 11 5 0 0 0 5 9 14 4 0 0 0 2 1 2 0 0 0 -4.6281 37 28 4 5 0 0 2 4 0 2.5 16 12 930.675 0.333 0.333 0 0.333 11 83 221 0 0 0 3 0 0 1 2 0 1 0 0 2 2 0 0 4 3 17 2 0 0 7 4 24 2 10 23 0 4 0 0 22 0 0 14 1 0 0 0 0 22 15 0 0 0 8 13 4 6 0 0 0 5 0 0 0 0 0 -1.7739 36 25 6 5 0 0 0 6 0 5 4 22 936.516 0.333 0.333 0 0.333 -1 39 744 0 4 2 2 0 0 2 2 0 5 0 0 1 2 0 0 1 5 4 6 0 0 14 8 12 2 19 9 4 4 0 0 22 0 0 10 2 0 2 0 0 22 12 2 0 0 # 3.14 -8.69 56.01 # ILE Env_1qw6_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 35 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 19 140 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 0 0 1 0 0 0 0 0 1 0 0 0 -1.5736 2 0 1 1 0 0 1 1 0 0 0 0 41.586 0 0 0 0 -2 5 34 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 1 0 0 0 1 1 0 0 0 2 5 0 0 1 0 0 2 1 0 0 0 0 -1.4545 11 7 1 3 0 0 0 0.5 0.5 2.5 0 0 270.262 0.666 0.333 0.333 0.666 0 28 299 1 3 2 1 0 3 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 4 6 0 1 6 3 1 0 3 0 0 3 0 1 1 3 0 0 3 5 3 0 0 3 6 1 3 2 0 0 1 1 1 0 0 0 -2.738 18 10 5 3 0 0 1 3.5 1.5 1.5 0 9 449.737 1.332 0.666 0.666 1.332 -6 32 466 3 4 3 2 0 3 0 0 0 0 0 0 0 0 0 2 0 0 1 0 0 0 3 6 9 0 3 9 4 2 0 6 0 0 3 1 3 2 3 0 0 6 9 3 0 0 7 4 3 4 0 0 0 6 1 0 0 0 0 -2.6023 25 14 4 7 0 0 0 4 0 6.5 4 15 561.96 0.666 0.666 0 0.666 -6 35 409 1 3 2 4 0 3 0 0 0 2 1 0 0 0 0 2 0 2 5 0 0 0 4 7 14 0 6 12 3 4 0 2 2 0 6 4 1 5 5 0 0 4 16 5 0 0 # 10.23 -0.47 59.83 # ARG Env_1qw6_17 0 1 0 0 0 0 0 0 0 0 0 0 0 0.2985 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 43 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 4 172 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 2 1 0 0 0 1 0 0 0 0 0 -0.0665 6 4 1 1 0 0 0 1 0 1 2 4 145.693 0 0 0 0 0 9 187 1 0 0 0 0 0 0 0 0 0 0 0 0 2 0 1 0 0 0 2 0 0 5 0 1 0 5 1 0 0 0 0 0 0 0 5 0 0 1 0 0 0 5 1 0 0 0 2 4 1 0 0 0 3 0 0 0 0 0 -3.0234 10 6 1 3 0 0 0 1 0 3 4 5 226.073 0 0 0 0 0 15 328 2 0 1 0 0 0 0 0 0 0 0 0 0 5 0 2 0 0 0 0 0 0 7 0 3 0 7 3 0 0 0 0 0 0 0 7 0 2 1 0 0 0 9 1 0 0 6 9 0 5 0 0 0 1 0 1 1 0 0 0.1319 23 15 5 2 1 0 1 5 0 1 0 11 602.645 0 0 0 0 0 23 680 2 0 2 0 0 6 0 0 0 0 0 0 4 4 1 4 0 0 0 0 0 0 11 0 12 0 11 12 0 0 0 0 0 0 6 6 0 3 8 0 0 0 15 8 0 0 3 10 0 4 0 0 0 4 0 0 0 0 0 -2.93 21 13 4 4 0 0 0 4 0 4 0 15 548.446 0 0 0 0 -4 14 423 0 0 4 0 1 2 0 0 0 0 1 0 2 0 7 4 0 0 0 0 0 0 10 0 11 0 10 11 0 0 0 0 0 0 2 2 0 6 11 0 0 0 10 11 0 0 # 2.9 4.63 62.44 # VAL