# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1ype # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/1ype_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_1ype_0 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 36 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 0 190 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 1 0 0 0 0 1 0 0 0 0 0 -0.8066 2 1 0 1 0 0 0 0 0 1 1 1 38.015 0 0 0 0 0 4 78 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 5 4 2 0 0 0 2 1 0 0 0 0 -1.7066 16 11 2 3 0 0 0 2 0 2.5 4 7 381.238 0.666 0.666 0 0.666 2 24 536 0 0 0 0 0 0 6 1 0 0 0 0 0 2 0 0 0 6 1 0 0 0 2 6 7 1 8 2 0 6 0 0 0 0 0 8 0 7 1 0 0 0 15 1 0 0 4 4 6 2 0 0 1 2 2 0 0 0 0 -2.1989 21 14 3 4 0 0 0 2 1 3 7 11 515.437 0.666 0.666 0 0.666 -2 36 411 0 0 0 1 0 0 2 6 0 0 0 0 0 5 0 1 0 5 1 0 0 0 5 3 7 6 10 8 0 3 0 0 0 0 1 14 0 5 1 0 0 0 20 1 0 0 3 6 2 3 0 0 0 3 1 0 1 0 0 -1.9839 19 11 3 4 1 0 0.5 3 0 3.5 2 11 459.252 0.666 0.666 0 0.666 -3 21 416 1 0 0 2 3 0 0 1 0 0 0 4 0 3 0 3 0 0 2 0 0 0 4 6 8 1 4 9 4 2 0 0 0 0 2 7 0 3 7 0 0 0 12 7 0 0 # 14.03 -12.491 25.807 # GLY 248 Env_1ype_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 12 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 2 0 0 0 0 0 0 0 0 0 0 -0.4076 3 3 0 0 0 0 0 0 0 0 2 0 86.552 0 0 0 0 3 12 80 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 2 0 0 0 0 1 0 2 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 4 4 1 0 0 1 3 0 0 0 0 0 -2.3965 14 9 2 3 0 0 0 1 1 3 5 7 330.948 0 0 0 0 -1 23 243 0 0 0 0 2 0 0 2 0 1 0 0 0 3 0 0 0 5 1 0 0 0 4 0 8 2 9 5 0 0 0 0 0 0 0 12 0 0 2 0 0 0 12 2 0 0 6 9 2 4 0 0 0 3 1 2 3 0 0 -2.5189 30 17 4 6 3 0 3 4 0 3.5 2 16 768.794 0.333 0.333 0 0.333 -6 27 382 0 0 0 0 8 0 1 2 0 1 0 0 2 3 0 1 3 4 5 0 0 0 6 1 21 2 10 19 0 1 0 0 5 0 0 15 1 1 8 0 0 5 17 8 0 0 5 17 3 9 0 0 0 4 1 0 0 0 0 -4.6568 39 25 9 5 0 0 0 9 0 4.5 3 25 985.256 0.666 0.666 0 0.666 -3 33 1012 1 0 0 0 2 0 3 3 0 8 0 2 5 2 0 2 2 3 6 0 0 0 16 5 15 3 19 15 2 3 0 0 3 0 0 16 2 7 11 0 0 3 25 11 0 0 # 15.7463 -9.52067 31.1483 # PHE 259 Env_1ype_2 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 10 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 40 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 25 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 6 2 3 0 0 0 2 0 0 0 0 0 -0.8214 17 12 3 2 0 0 0 3 0 2 2 14 453.541 0 0 0 0 -2 8 98 1 0 0 1 0 0 0 7 0 2 0 0 0 0 0 4 0 0 2 0 0 0 3 1 6 7 3 13 0 1 0 0 0 0 0 5 6 0 6 0 0 0 11 6 0 0 3 9 2 3 0 0 0 5 0 2 0 0 0 -3.5438 24 14 3 7 0 0 2 3 0 5 3 13 570.484 0 0 0 0 -5 27 171 1 0 0 2 0 0 0 1 1 3 0 0 0 1 4 6 0 1 3 1 0 0 10 2 11 1 11 10 1 2 0 1 0 0 0 16 4 0 3 0 0 1 20 3 0 0 7 13 2 9 0 0 2 5 2 1 0 0 0 -6.2887 41 22 11 8 0 0 1 10 1 6 4 25 975.161 0.999 0.999 0 1.999 -10 36 237 3 0 0 4 2 0 0 6 2 2 0 0 0 5 1 1 3 3 6 3 0 0 14 4 17 6 17 18 2 4 0 2 0 0 0 28 1 0 10 0 0 2 29 10 0 0 # 12.968 -4.595 21.362 # VAL 245 Env_1ype_3 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 84 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 28 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 2 0 1 1 0 0 1 0 0 0 0 0 -0.953 6 3 2 1 0 0 0 1 1 1 0 4 146.74 0 0 0 0 -2 5 277 0 2 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 1 0 1 2 3 0 0 0 0 0 0 0 3 3 0 0 0 3 3 0 0 3 9 1 3 1 0 0 3 0 0 0 0 0 -1.3936 20 13 4 3 0 0 0 3.5 0.5 3 0 11 524.021 0.666 0 0.666 0.666 -1 23 1047 0 7 0 3 2 0 2 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 12 2 3 3 5 7 5 0 0 0 0 5 0 0 5 10 0 0 0 10 10 0 0 4 5 0 2 1 0 0 2 2 0 0 0 0 -2.1821 16 9 3 4 0 0 0 2.5 0.5 3 0 10 379.693 1.665 1.332 0.333 1.665 -6 20 1173 0 6 0 3 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 13 0 0 3 0 6 7 0 0 0 0 6 0 0 4 6 0 0 0 10 6 0 0 4 5 0 3 0 0 0 4 3 0 0 0 0 -3.4434 19 9 3 7 0 0 0 3 0 5.5 0 12 419.457 1.332 1.332 0 1.332 -8 16 1392 0 2 0 7 3 0 3 0 0 0 1 2 0 0 0 0 0 0 0 1 0 0 2 14 3 0 2 3 4 10 0 0 0 0 4 0 4 7 4 0 0 0 15 4 0 0 # 2.137 -13.0257 26.023 # ASP 252 Env_1ype_4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 390 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 6 0 0 0 0 0 6 0 0 0 0 2 2 0 0 0 1 0 0 0 0 0 0 -0.5892 5 4 1 0 0 0 0 0 1 0 3 0 134.699 0 0 0 0 2 13 446 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 3 0 0 0 0 1 1 3 0 4 0 1 0 0 1 0 0 0 0 4 0 0 0 0 1 4 0 0 0 1 8 1 1 3 0 0 1 0 0 0 0 0 -1.9824 15 10 4 1 0 0 0 2 2 1 0 5 417.237 0.999 0 0.999 0.999 -2 29 2038 0 8 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 4 0 0 0 0 3 8 4 0 7 0 8 0 0 3 0 0 0 0 12 0 0 0 0 3 12 0 0 0 4 2 0 3 0 0 0 0 0 0 0 0 0 1.5853 9 6 3 0 0 0 0 3 0 0 0 8 243.471 0 0 0 0 -2 2 652 0 1 1 0 0 0 0 0 0 0 0 0 0 0 5 0 0 1 1 0 0 0 5 1 3 0 6 2 1 0 0 5 0 0 1 1 2 0 0 0 0 5 4 0 0 0 3 7 5 2 0 0 0 7 0 1 0 0 0 -5.3431 25 15 2 8 0 0 1 2 0 7 6 13 574.721 0 0 0 0 -1 39 1188 0 1 3 0 0 0 1 0 0 0 5 0 0 0 3 0 0 0 12 0 0 0 8 2 15 0 8 15 1 1 0 3 0 0 3 11 2 0 6 0 0 3 16 6 0 0 # 31.1772 -12.137 19.9828 # TRP 119 Env_1ype_5 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 3 0 2 0 0 0 0 0 1 0 0 0 -1.2468 7 4 2 1 0 0 1 2 0 0 0 3 189.763 0 0 0 0 -2 8 102 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 4 0 0 4 1 2 0 0 0 0 2 0 2 0 3 0 0 0 4 3 0 0 1 6 1 2 3 0 0 2 0 0 0 0 0 -3.7788 15 8 5 2 0 0 0 3 2 2 0 3 373.209 0.999 0 0.999 0.999 -3 40 383 0 8 4 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 10 4 0 1 4 8 2 0 0 0 0 2 1 12 0 0 0 0 0 15 0 0 0 6 4 1 5 2 0 0 3 0 0 1 0 0 -1.8991 22 11 7 3 1 0 0 6 1 3 0 12 520.655 0.999 0 0.999 0.999 -7 33 996 0 5 9 1 0 0 0 0 0 0 2 0 2 0 0 0 3 0 0 0 0 0 4 6 12 0 4 12 5 1 0 0 0 0 4 2 8 0 8 0 0 0 14 8 0 0 6 11 0 5 2 0 0 8 1 0 0 0 0 -6.3461 33 17 7 9 0 0 0 5.5 1.5 8.5 0 24 791.452 0.666 0.333 0.333 0.666 -11 26 1416 0 6 10 3 0 0 1 0 0 2 4 0 3 0 0 0 1 0 3 0 0 0 9 10 14 0 9 14 6 4 0 3 0 0 4 3 12 0 11 0 0 3 19 11 0 0 # 26.422 -4.761 30.0263 # ASP 124 Env_1ype_6 0 0 0 0 0 1 0 0 0 0 0 0 0 -0.3853 1 0 1 0 0 0 0 0 1 0 0 0 33.51 1 0 1 1 1 5 49 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 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 98 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 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 -0.5679 1 0 0 1 0 0 0 0 0 1 0 1 11.494 0 0 0 0 -1 0 20 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 2 3 2 1 0 0 0 1 0 0 0 0 0 -0.1279 9 7 1 1 0 0 0 1 0 1 2 5 246.223 0 0 0 0 1 10 174 0 0 0 0 4 0 0 0 2 0 0 2 0 1 0 0 0 0 0 0 0 0 1 2 6 0 1 4 4 0 0 6 0 0 0 2 0 0 1 0 0 6 2 1 0 0 2 7 7 3 0 0 1 1 0 0 2 0 0 -2.2417 23 16 4 1 2 0 1 3.5 0.5 1 8 10 602.879 0 0 0 0.5 1 35 941 0 0 0 0 3 0 0 0 4 0 6 1 0 2 0 0 0 2 5 0 0 0 8 1 14 0 10 8 5 0 0 8 0 0 0 10 3 0 2 0 0 8 13 2 0 0 4 10 8 3 0 0 1 5 0 1 0 0 0 -3.9293 32 22 4 6 0 0 1 3.5 0.5 5 9 14 794.657 0 0 0 0.5 3 46 1664 2 0 1 0 1 0 0 0 3 0 10 3 0 2 0 2 0 4 4 0 0 0 14 3 15 0 18 8 6 0 0 9 0 0 0 17 4 0 2 0 0 9 21 2 0 0 # 20.248 -10.339 13.919 # LYS 79 Env_1ype_7 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 64 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 1 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 4 320 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 5 0 0 0 0 5 0 0 0 1 1 0 1 0 0 0 1 0 1 0 0 0 -0.9238 5 2 1 2 0 0 1 1 0 1 0 3 109.808 0 0 0 0 -2 5 522 0 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 2 2 1 0 2 1 2 0 0 0 0 0 0 0 0 3 2 0 0 0 3 2 0 0 1 4 3 1 0 0 0 2 0 0 0 0 0 -1.7689 11 8 1 2 0 0 0 1 0 2 3 6 284.238 0 0 0 0 1 19 1282 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 3 0 0 0 0 0 6 5 0 3 2 6 0 0 0 0 0 0 3 0 3 5 0 0 0 6 5 0 0 2 7 3 1 0 0 1 3 1 0 0 0 0 -2.4775 18 12 2 4 0 0 0 1 1 3.5 4 8 439.673 0.666 0.666 0 0.666 0 27 813 0 2 3 0 0 0 3 0 0 3 0 0 0 0 0 0 3 4 0 0 0 0 3 5 10 0 7 6 2 3 0 0 0 0 0 4 4 3 7 0 0 0 11 7 0 0 4 6 8 3 0 0 0 1 2 0 1 0 0 -2.6734 25 18 3 3 1 0 0 3 0 2 8 6 641.445 0.666 0.666 0 0.666 8 55 926 0 2 4 0 0 0 4 0 0 3 0 1 2 6 0 0 1 2 0 0 0 0 11 7 7 0 13 5 3 4 0 0 1 0 0 10 6 3 5 0 0 1 19 5 0 0 # 20.717 -14.062 30.988 # ILE 199 Env_1ype_8 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 12 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 -0.3661 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 178 0 0 0 1 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 3 0 3 0 2 0 0 0 0 0 0 4 0 1 0 0 0 4 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 -0.6071 2 1 0 1 0 0 0 0 0 1 0 2 45.004 0 0 0 0 -1 0 142 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 1 0 1 0 0 0 0 0 0 1 0 1 0 0 0 1 1 0 0 3 7 0 4 0 0 0 2 0 0 0 0 0 -1.1098 16 10 4 2 0 0 0 4 0 2 0 11 414.636 0 0 0 0 -1 9 749 0 0 1 3 2 0 4 2 0 0 3 0 0 0 0 1 0 0 0 0 0 0 3 7 4 2 3 6 0 7 0 0 0 0 0 3 5 0 8 0 0 0 8 8 0 0 8 8 0 3 0 0 0 6 3 1 1 0 0 -2.9301 30 16 3 10 1 0 1.5 3 0 7.5 0 17 694.831 1.665 1.665 0 1.665 -12 30 689 0 0 2 4 6 0 2 2 0 0 5 0 0 0 0 5 0 4 0 0 0 0 5 6 17 2 9 15 0 6 0 0 0 0 0 11 7 4 8 0 0 0 22 8 0 0 2 8 0 5 0 0 0 2 1 0 0 0 0 -3.7692 18 10 5 3 0 0 0 5 0 2.5 0 13 453.202 0.333 0.333 0 0.333 -6 10 429 0 0 5 0 3 0 1 4 0 1 3 0 0 0 0 0 0 1 0 0 0 0 4 1 9 4 5 12 0 1 0 0 0 0 0 7 2 1 8 0 0 0 10 8 0 0 # 11.222 -8.89 14.247 # GLY 223 Env_1ype_9 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 25 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 0 135 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 22 539 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 1 5 0 0 0 1 5 0 0 1 7 0 1 1 0 0 1 1 0 1 0 0 -2.1157 13 8 2 2 1 0 0.5 1.5 0.5 1.5 0 5 358.798 0.666 0.333 0.333 0.666 -2 21 710 0 3 0 0 5 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 8 5 0 0 5 3 5 0 0 0 0 0 0 0 8 5 0 0 0 8 5 0 0 1 5 0 2 0 0 0 1 1 0 0 0 0 -1.5528 10 6 2 2 0 0 0 2 0 1.5 0 6 254.965 0.333 0.333 0 0.333 -1 7 572 0 2 0 2 0 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 7 0 3 0 3 2 5 0 0 0 0 1 0 0 2 7 0 0 0 3 7 0 0 4 5 0 2 0 0 0 2 1 0 1 0 0 -0.626 15 9 2 3 1 0 0.5 2 0 2.5 0 8 367.648 0.999 0.999 0 0.999 -4 15 699 1 1 0 3 2 0 5 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 1 11 2 1 1 3 3 8 0 0 0 0 1 0 0 4 10 0 0 0 5 10 0 0 # 10.552 -17.108 23.813 # GLY 250 Env_1ype_10 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 27 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 54 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 94 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 1 1 2 1 0 0 1 3 0 0 2 0 0 -2.695 11 4 2 3 2 0 1 1.5 0.5 3 3 5 229.918 0 0 0 0.5 -6 14 118 0 0 0 1 2 0 0 1 3 0 0 0 0 0 0 2 0 0 0 2 0 0 2 1 7 1 2 5 3 1 0 4 0 0 0 4 2 0 1 0 0 4 6 1 0 0 5 11 0 5 0 0 0 3 0 0 0 0 0 -1.1774 24 16 5 3 0 0 0 5 0 3 0 20 641.327 0 0 0 0 -5 4 642 1 0 0 4 3 0 3 4 0 0 1 0 0 0 0 3 0 2 0 3 0 0 5 7 8 4 7 10 0 7 0 0 0 0 0 10 7 0 7 0 0 0 17 7 0 0 6 13 0 7 0 1 0 3 1 1 0 0 0 -2.8906 32 19 8 5 0 0 1 7 1 3.5 0 20 822.004 1.666 0.666 1 1.666 -5 22 792 2 0 0 2 8 0 3 5 4 0 1 1 0 0 0 2 0 2 0 2 0 0 5 6 16 5 7 15 5 5 0 7 0 0 0 12 5 0 8 0 0 7 17 8 0 0 # 15.404 -8.525 18.292 # SER 225 Env_1ype_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 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 4 0 0 0 1 0 0 0 0 0 -2.427 9 4 4 1 0 0 0 4 0 1 0 7 202.082 0 0 0 0 -3 5 24 0 0 0 2 2 0 0 2 0 3 0 0 0 0 0 0 0 0 0 0 0 0 3 2 2 2 3 4 0 2 0 0 0 0 0 0 0 0 9 0 0 0 0 9 0 0 7 6 0 3 0 0 0 4 0 0 0 0 0 0.5267 20 13 3 4 0 0 0 3 0 4 0 18 524.017 0 0 0 0 -5 2 114 3 0 1 2 2 0 0 8 0 2 0 0 0 0 0 0 0 2 0 0 0 0 5 2 5 8 7 11 0 2 0 0 0 0 0 4 2 2 12 0 0 0 8 12 0 0 5 8 0 5 0 0 0 7 0 0 0 0 0 -4.3538 25 13 5 7 0 0 0 5 0 7 0 21 586.773 0 0 0 0 -9 7 795 2 0 3 2 1 0 4 2 0 3 0 0 0 0 0 1 2 2 0 3 0 0 8 6 9 2 10 9 0 6 0 0 0 0 3 4 7 2 9 0 0 0 16 9 0 0 3 16 0 3 0 0 0 3 0 0 1 0 0 -1.8648 26 19 3 3 1 0 0.5 3 0 3 0 13 740.104 0 0 0 0 4 20 493 0 0 1 0 1 6 1 0 0 0 2 0 0 0 1 4 2 1 0 7 0 0 10 1 15 0 11 14 0 1 0 0 0 0 2 14 5 2 3 0 0 0 23 3 0 0 # 7.81067 -7.02167 17.6827 # ASP 224 Env_1ype_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 11 129 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 43 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 0 0 0 0 1 0 0 0 -0.6201 2 1 0 1 0 0 1 0 0 0 0 0 50.667 0 0 0 0 0 3 60 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 0 0 1 0 1 0 0 0 0 0 0 0 1 1 0 0 0 1 1 0 0 1 6 3 1 0 1 0 1 0 0 0 0 0 -1.0987 13 10 2 1 0 0 0 1 1 1 3 5 373.274 1 0 1 1 3 30 561 0 0 0 0 0 0 2 1 0 0 0 4 0 0 0 1 2 3 0 0 0 0 0 6 6 1 3 4 4 2 0 0 0 0 0 3 1 2 7 0 0 0 6 7 0 0 3 7 5 5 0 0 0 3 0 1 0 0 0 -3.4095 24 15 5 4 0 0 1 5 0 3 5 13 584.087 0 0 0 0 0 29 978 0 1 0 0 0 0 2 3 0 3 0 2 0 3 0 3 3 2 2 0 0 0 6 5 10 3 8 11 3 2 0 0 0 0 0 5 3 6 10 0 0 0 14 10 0 0 4 7 4 3 1 0 0 4 0 0 0 0 0 -2.5493 23 15 4 4 0 0 0 3.5 0.5 4 4 15 569.684 0.333 0 0.333 0.333 -2 24 1496 0 4 0 0 1 0 0 2 0 3 0 2 0 2 0 2 1 4 2 0 0 0 5 6 10 2 9 8 6 0 0 0 1 0 0 6 3 7 6 0 0 1 16 6 0 0 # 14.9567 -15.592 29.7453 # GLU 249 Env_1ype_13 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 11 276 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 92 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 1 0 0 1 0 0 0 0 0 0 0 0 -0.4735 2 1 1 0 0 0 0 0 1 0 0 0 54.089 0 0 0 0 0 5 216 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 1 1 0 0 0 0 0 0 1 0 1 0 0 0 1 1 0 0 2 5 1 3 1 0 0 2 0 0 0 0 0 -2.3116 14 8 4 2 0 0 0 3.5 0.5 2 0 4 352.63 0.666 0 0.666 0.666 -3 29 964 0 5 6 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 8 6 0 0 6 5 3 0 0 0 0 1 0 8 0 5 0 0 0 9 5 0 0 2 2 0 2 1 0 0 2 0 0 0 0 0 -1.7118 9 4 3 2 0 0 0 2.5 0.5 2 0 6 196.8 0.333 0 0.333 0.333 -5 11 803 0 5 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 3 0 0 3 5 1 0 0 0 0 2 0 2 0 5 0 0 0 4 5 0 0 3 7 0 3 0 0 0 3 0 0 0 0 0 -2.2665 16 10 3 3 0 0 0 3 0 3 0 11 411.993 0 0 0 0 -1 7 1159 0 4 4 2 0 0 0 0 0 4 1 0 0 0 0 0 1 0 0 0 0 0 5 6 5 0 5 5 4 2 0 0 0 0 4 0 6 3 3 0 0 0 13 3 0 0 # 28.29 -12.3313 31.245 # GLU 121 Env_1ype_14 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 5 201 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 -2.2547 3 0 3 0 0 0 0 1 2 0 0 0 69.437 0.666 0 0.666 0.666 -3 16 603 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 -0.0258 3 3 0 0 0 0 0 0 0 0 1 0 93.541 0 0 0 0 2 11 467 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 1 0 1 0 2 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 1 3 0 0 0 0 0 0 0 0 0 0 -0.32 4 4 0 0 0 0 0 0 0 0 3 0 107.131 0 0 0 0 3 15 396 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 1 3 0 3 0 1 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 0 1 2 1 0 0 1 0 0 0 0 0 0 -1.0678 5 3 2 0 0 0 0 1 1 0 3 2 115.326 0 0 0 0 0 11 597 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 2 3 0 3 0 2 0 0 0 0 0 0 0 5 0 0 0 0 0 5 0 0 0 2 1 2 0 0 0 0 1 0 0 0 0 0 0.4555 6 5 0 1 0 0 0 0 0 1 2 3 159.124 0 0 0 0 1 7 647 0 2 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 3 0 0 0 0 1 2 3 0 4 0 2 0 0 1 0 0 0 0 5 0 0 0 0 1 5 0 0 0 # 34.588 -14.05 21.729 # ARG 120 Env_1ype_15 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 60 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 40 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 1 0 0 0 -1.2299 3 1 0 2 0 0 1 0 0 1 0 1 62.161 0 0 0 0 -1 3 52 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 3 0 0 2 1 0 0 1 0 0 0 1 1 0 0 0 0 1 2 0 0 0 3 6 0 2 0 0 0 2 2 0 1 0 0 -1.72 16 9 2 4 1 0 0.5 2 0 3 0 10 394.716 0.999 0.999 0 0.999 -6 12 163 1 0 0 3 3 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 0 0 2 3 11 0 2 7 4 3 0 7 0 0 0 3 2 0 4 0 0 7 5 4 0 0 5 7 0 6 0 1 0 3 0 1 1 0 0 -2.6877 24 12 7 4 1 0 1.5 6 1 3 0 17 598.612 1 0 1 1 -8 15 269 7 0 0 1 3 0 0 2 0 0 1 1 0 0 0 6 0 2 0 1 0 0 9 2 11 2 11 11 1 1 0 5 0 0 0 8 5 0 6 0 0 5 13 6 0 0 6 15 5 1 0 0 0 3 0 2 0 0 0 -1.7801 32 26 1 5 0 0 2 1 0 3 6 12 894.433 0 0 0 0 7 49 607 2 0 0 4 2 0 0 1 0 1 5 2 0 0 0 0 2 4 6 3 0 0 11 6 14 1 15 11 2 4 0 3 0 0 0 17 2 0 10 0 0 3 19 10 0 0 # 18.777 -7.775 19.1055 # HIS 70 Env_1ype_16 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6546 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 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 10 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 93 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 6 1 1 0 0 2 3 1 1 0 0 0 -4.1893 16 8 3 5 0 0 1 1.5 1.5 3.5 3 7 369.778 0.333 0.333 0 0.833 -3 21 310 0 0 0 2 0 0 0 0 1 0 4 0 0 1 0 0 2 4 0 2 0 0 7 2 7 0 11 2 1 2 0 1 0 0 0 9 0 0 6 0 0 1 9 6 0 0 6 10 4 2 0 0 0 5 0 0 0 0 0 -0.3393 27 20 2 5 0 0 0 2 0 5 4 18 710.162 0 0 0 0 -2 21 312 1 0 1 3 0 0 0 0 2 2 3 0 0 3 0 0 3 4 4 1 0 0 10 3 14 0 14 8 2 3 0 2 0 0 0 17 1 0 7 0 0 2 18 7 0 0 5 15 8 10 0 0 1 4 0 1 1 0 0 -6.4845 45 28 11 5 1 0 1 10.5 0.5 4 9 25 1122.09 0 0 0 0.5 1 50 576 3 4 2 4 0 0 0 1 5 5 1 0 5 3 0 1 2 2 4 3 0 0 20 8 16 1 22 10 9 4 0 6 0 0 4 21 7 0 7 0 0 6 32 7 0 0 # 19.144 -6.469 24.455 # SER 246 Env_1ype_17 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 8 129 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 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 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 43 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 1 0 0 0 0 0 0 0 1 0 0 0 1 2 0 0 0 0 0 1 0 0 0 0 0 0.0995 4 3 0 1 0 0 0 0 0 1 0 3 112.024 0 0 0 0 0 1 221 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 0 0 3 0 1 0 0 0 0 3 0 1 0 0 0 0 0 4 0 0 0 4 4 0 5 0 0 0 1 1 0 0 0 0 -0.945 15 8 5 2 0 0 0 5 0 1.5 0 9 338.534 0.666 0.666 0 0.666 -5 15 1479 0 4 4 0 0 0 6 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 10 5 0 1 4 4 6 0 0 0 0 1 0 14 0 0 0 0 0 15 0 0 0 5 8 0 3 2 0 0 6 2 0 0 0 0 -5.66 26 13 5 8 0 0 0 4 1 7 0 16 621.498 1.665 0.999 0.666 1.665 -10 31 1492 0 6 4 6 0 0 2 0 0 0 3 0 0 0 0 0 0 3 2 0 0 0 3 14 9 0 6 6 6 8 0 0 0 0 6 0 14 0 6 0 0 0 20 6 0 0 2 2 7 1 2 0 0 2 1 0 0 0 0 -1.1377 17 11 3 3 0 0 0 1 2 2.5 5 6 388.339 0.999 0.333 0.666 0.999 -1 37 1020 0 5 1 2 0 0 0 0 0 0 1 0 0 0 0 0 0 4 4 0 0 0 1 7 9 0 5 5 5 2 0 0 0 0 2 0 8 0 7 0 0 0 10 7 0 0 # 29.7113 -9.56733 27.2527 # ASN 118 Env_1ype_18 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 15 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 3 0 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 5 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 1 0 0 0 0 0 1 0 0 0 1 2 0 2 0 0 0 1 0 0 0 0 0 -0.9187 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 1 36 0 0 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 4 0 0 4 0 2 0 0 0 0 2 0 4 0 0 0 0 0 6 0 0 0 6 8 1 2 2 0 0 3 2 0 0 0 0 -1.5159 24 15 4 5 0 0 0 2.5 1.5 4 0 10 597.256 1.998 1.332 0.666 1.998 -4 43 1642 0 5 4 2 0 0 8 0 0 0 3 0 1 0 0 0 1 0 0 0 0 0 4 15 5 0 4 5 5 10 0 0 0 0 6 1 8 0 9 0 0 0 15 9 0 0 3 9 0 4 1 0 0 3 2 1 1 0 0 -5.41 24 12 5 6 1 0 1 4.5 0.5 4 0 12 589.531 0.999 0.666 0.333 0.999 -6 30 1192 0 6 3 4 0 0 1 0 0 4 2 0 1 0 0 0 3 0 0 0 0 0 7 11 6 0 7 6 6 5 0 0 0 0 7 1 1 1 14 0 0 0 10 14 0 0 2 8 0 4 1 0 1 1 0 0 0 0 0 -1.9291 17 10 6 1 0 0 0 4.5 1.5 1 1 9 448.15 0.333 0 0.333 0.333 -1 22 984 0 4 1 0 0 0 0 0 0 6 2 0 1 0 0 0 1 2 0 0 0 0 9 4 4 0 11 2 4 0 0 0 0 0 1 2 5 4 5 0 0 0 12 5 0 0 # 25.7413 -9.59967 29.7437 # ASN 122 Env_1ype_19 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 5 116 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 16 348 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 3 0 0 0 0 0 0 2 0 0 0 0 -0.7697 6 4 0 2 0 0 0 0 0 1 0 1 149.383 0.999 0.999 0 0.999 -1 16 479 0 2 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 1 0 1 2 3 0 0 0 0 0 0 0 1 5 0 0 0 1 5 0 0 2 1 0 1 0 0 0 1 0 0 0 0 0 0.1356 5 3 1 1 0 0 0 1 0 1 0 4 126.161 0 0 0 0 -1 1 252 0 1 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 2 0 2 1 2 0 0 0 0 0 0 0 4 1 0 0 0 4 1 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 4 276 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 0 4 2 0 0 0 4 2 0 0 3 8 0 2 0 0 0 2 0 0 0 0 0 -0.4106 15 11 2 2 0 0 0 2 0 2 0 9 419.872 0 0 0 0 -1 13 850 0 3 0 0 4 0 2 2 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 9 4 2 0 6 7 2 0 0 0 0 0 0 0 6 9 0 0 0 6 9 0 0 # 10.206 -20.209 25.253 # ARG 253 Env_1ype_20 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 27 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 1 2 0 1 0 0 0 0 0 0 0 0 0 0.4829 4 3 1 0 0 0 0 1 0 0 0 3 114.667 0 0 0 0 0 2 108 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 1 2 0 1 0 0 0 2 0 0 0 0 0 -1.8789 6 3 1 2 0 0 0 1 0 2 0 4 137.655 0 0 0 0 -1 6 99 0 0 2 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 3 1 2 0 3 2 0 1 0 0 0 0 1 0 2 0 3 0 0 0 3 3 0 0 1 3 3 0 0 0 1 1 1 1 0 0 0 -2.0836 11 7 1 3 0 0 1 0 1 1.5 4 3 258.097 0.666 0.666 0 0.666 -1 21 191 0 0 2 4 0 0 0 0 0 0 0 0 0 0 0 1 0 3 1 0 0 0 0 4 7 0 3 4 0 4 0 0 0 0 2 4 1 0 4 0 0 0 7 4 0 0 6 8 3 4 0 0 1 3 1 1 0 0 0 -2.0439 27 17 5 5 0 0 1 4.5 0.5 3.5 5 12 647.418 0.333 0.333 0 0.833 -3 41 567 0 1 5 6 0 0 1 0 2 0 0 0 1 0 0 3 0 5 3 0 0 0 1 8 18 0 6 11 3 7 0 2 0 0 4 7 8 0 6 0 0 2 19 6 0 0 7 10 10 6 0 0 0 4 0 2 1 0 0 -4.6258 40 27 6 6 1 0 2 6 0 4 11 19 986.128 0.333 0.333 0 0.333 0 63 1584 0 4 5 3 0 0 3 0 5 1 0 0 2 0 0 1 1 7 8 0 0 0 3 10 27 0 10 15 9 6 0 5 0 0 5 12 11 1 6 0 0 5 29 6 0 0 # 22.615 -8.912 24.696 # LEU 123 Env_1ype_21 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 11 426 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 2 142 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 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 1 142 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 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.9247 4 2 1 1 0 0 0 1 0 1 0 3 102.943 0 0 0 0 -2 3 458 0 0 1 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 1 0 3 0 0 0 0 0 0 3 0 1 0 0 0 3 1 0 0 1 2 0 2 0 0 0 1 0 0 0 0 0 -1.0413 6 3 2 1 0 0 0 2 0 1 0 3 127.367 0 0 0 0 -2 6 262 0 0 3 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 5 0 1 0 0 0 0 0 0 3 0 3 0 0 0 3 3 0 0 1 1 0 2 0 0 0 2 0 0 1 0 0 -2.0026 7 2 2 2 1 0 0.5 2 0 2 0 5 155.095 0 0 0 0 -5 6 282 0 0 2 0 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 6 0 0 6 0 1 0 0 0 0 0 0 0 0 7 0 0 0 0 7 0 0 # 12.2683 -14.9553 13.892 # GLU 222 Env_1ype_22 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 0 0 0 0 0 0 0 0 0 0 0.0337 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 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 2 1 0 2 0 0 0 1 0 0 0 0 0 -0.5846 6 3 2 1 0 0 0 2 0 1 0 5 140.298 0 0 0 0 -2 2 59 3 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 4 1 1 0 4 1 0 1 0 0 0 0 1 1 0 0 4 0 0 0 2 4 0 0 2 7 0 0 0 0 0 2 2 1 0 0 0 -2.0671 14 9 0 5 0 0 1 0 0 3 0 4 344.147 1.332 1.332 0 1.332 0 25 98 0 0 0 7 2 0 0 0 0 1 0 0 0 0 0 0 0 0 1 3 0 0 4 7 3 0 4 3 0 7 0 0 0 0 4 4 0 0 6 0 0 0 8 6 0 0 3 9 1 4 0 0 0 1 2 0 0 0 0 -2.9779 20 13 4 3 0 0 0 4 0 2 2 10 512.026 0.666 0.666 0 0.666 -1 23 104 0 0 0 8 2 0 0 0 0 4 0 0 0 0 0 1 0 0 2 3 0 0 7 8 5 0 7 5 0 8 0 0 0 0 3 5 1 0 11 0 0 0 9 11 0 0 10 10 4 8 0 0 0 5 0 1 2 0 0 -3.1761 40 24 8 6 2 0 2 8 0 5 4 27 1011.11 0 0 0 0 -8 29 805 0 0 0 0 3 0 3 5 0 2 1 0 0 2 0 5 3 3 4 9 0 0 14 3 18 5 17 20 0 3 0 0 0 0 2 24 8 2 4 0 0 0 36 4 0 0 # 9.297 -7.325 21.926 # ALA 220 Env_1ype_23 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 39 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 13 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 2 0 0 0 1 0 0 0 0 0 -0.9252 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 70 2 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 3 0 0 2 0 0 3 0 0 0 0 2 0 0 1 2 0 0 0 3 2 0 0 3 6 0 2 0 0 0 2 0 0 0 0 0 -0.4622 13 9 2 2 0 0 0 2 0 2 0 11 352.852 0 0 0 0 -3 2 147 3 0 0 3 3 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 3 3 4 3 7 0 3 0 0 0 0 2 2 0 4 5 0 0 0 8 5 0 0 5 6 0 4 0 0 0 5 1 1 1 0 0 -3.3005 23 11 4 7 1 0 1.5 4 0 5.5 0 16 527.512 0.666 0.666 0 0.666 -10 18 505 1 1 0 4 6 0 0 4 0 0 1 1 0 0 0 0 0 0 5 0 0 0 2 6 11 4 2 15 2 4 0 0 0 0 0 4 0 9 10 0 0 0 13 10 0 0 7 13 1 6 0 0 0 6 2 0 1 0 0 -5.1039 36 21 6 8 1 0 0.5 6 0 7 2 24 892.371 0.666 0.666 0 0.666 -7 29 947 1 2 0 3 2 0 3 8 0 0 2 3 0 1 0 0 0 2 3 6 0 0 10 11 7 8 12 13 5 6 0 0 0 0 6 9 0 6 15 0 0 0 21 15 0 0 # 8.013 -10.5137 25.4047 # ASP 219 Env_1ype_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 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 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 29 0 0 0 0 0 0 0 3 0 0 0 0 0 1 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 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 15 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 0 0 1 0 0 0 0 1 0 0 3 4 3 2 0 0 0 3 2 0 0 0 0 -3.0217 17 10 2 5 0 0 0 2 0 4 4 8 379.301 0.999 0.999 0 0.999 -2 25 139 2 0 0 3 0 0 0 0 0 0 0 0 0 5 0 0 0 1 6 0 0 0 7 3 7 0 8 6 0 3 0 0 0 0 3 11 0 0 3 0 0 0 14 3 0 0 4 6 6 5 0 0 0 2 0 1 0 0 0 -2.028 24 16 5 3 0 0 1 5 0 2 6 14 587.23 0 0 0 0 0 26 352 4 0 0 1 3 0 0 3 0 0 0 2 0 4 0 0 0 2 5 0 0 0 8 3 10 3 10 11 2 1 0 0 0 0 1 16 0 0 7 0 0 0 17 7 0 0 5 12 11 4 0 0 0 5 1 0 1 0 0 -5.1471 39 28 4 6 1 0 0.5 4 0 5.5 11 20 998.251 0.333 0.333 0 0.333 5 57 798 4 0 0 3 3 0 2 5 0 0 1 2 0 3 0 2 0 8 5 1 0 0 9 7 18 5 17 15 2 5 0 0 0 0 2 21 0 4 12 0 0 0 27 12 0 0 # 11.236 -8.841 27.788 # GLY 258 Env_1ype_25 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1146 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 6 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 -0.881 4 3 1 0 0 0 0 0 1 0 4 0 94.2 0 0 0 0 1 13 626 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 0 0 0 4 0 3 1 0 0 0 3 0 0 0 1 0 0 0 0 0 3 1 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0.1272 3 3 0 0 0 0 0 0 0 0 2 0 80.61 0 0 0 0 2 9 297 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 0 0 0 0 0 3 0 1 2 0 0 0 1 0 0 0 2 0 0 0 0 0 1 2 0 0 0 0 2 3 1 0 0 0 0 0 1 0 0 0 -1.4416 7 5 1 1 0 0 1 1 0 0 3 2 171.935 0 0 0 0 2 16 647 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 5 0 0 0 0 0 7 0 2 5 0 0 0 2 0 0 0 5 0 0 0 0 0 2 5 0 0 0 3 6 0 0 0 1 0 3 0 0 0 0 0 -0.3309 13 9 1 3 0 0 0 0 1 3 0 7 369.582 1 0 1 1 0 14 1055 0 0 0 0 0 0 0 0 0 0 0 3 0 0 6 0 0 2 2 0 0 0 6 3 4 0 8 2 3 0 0 8 0 0 0 5 0 0 0 0 0 8 5 0 0 0 # 20.4427 -16.2305 16.8395 # TRP 77 Env_1ype_26 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 27 234 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 4 0 0 0 1 0 0 0 0 0 0 -0.7607 5 4 1 0 0 0 0 0 1 0 5 0 114.779 0 0 0 0 2 14 121 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 3 0 0 0 0 2 0 3 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 1 7 4 1 0 0 0 1 1 0 0 0 0 -2.1029 15 12 1 2 0 0 0 1 0 1.5 4 5 413.932 0.333 0.333 0 0.333 6 27 473 0 0 0 0 0 0 1 2 0 3 0 0 0 5 0 0 0 4 0 0 0 0 8 1 4 2 12 2 0 1 0 0 0 0 0 9 0 4 2 0 0 0 13 2 0 0 3 7 0 3 0 0 0 3 1 1 1 0 0 -3.1329 19 10 3 5 1 0 1 3 0 3.5 0 10 456.877 0.666 0.666 0 0.666 -3 22 505 0 0 1 0 0 0 4 2 0 3 0 0 1 3 0 0 3 1 1 0 0 0 7 4 6 2 8 7 0 4 0 0 0 0 0 5 1 6 7 0 0 0 12 7 0 0 6 16 0 5 0 0 0 5 0 2 0 0 0 -2.5478 34 22 5 7 0 0 2 5 0 5 0 22 899.689 0 0 0 0 -3 21 909 0 3 3 0 0 0 2 3 0 6 4 0 3 1 0 6 1 0 2 0 0 0 14 5 12 3 14 15 3 2 0 0 0 0 0 13 4 5 12 0 0 0 22 12 0 0 # 17.7132 -11.4742 28.532 # TRP 247