# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1li4 # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/1li4_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_1li4_0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 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 2 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 2 0 1 0 0 0 0 2 0 0 0 0 -0.6509 7 4 1 2 0 0 0 1 0 1 0 2 163.52 0.999 0.999 0 0.999 -1 12 47 0 0 0 3 0 0 1 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 5 2 0 0 2 1 4 0 0 6 0 0 0 0 0 1 0 0 6 0 1 0 0 4 8 0 1 0 0 0 4 1 0 1 0 0 -1.7195 19 12 1 5 1 0 0 1 0 4.5 0 11 489.96 0.666 0.666 0 0.666 -2 22 187 0 0 3 2 0 0 1 0 0 0 0 4 5 1 0 1 0 0 0 2 0 0 8 7 4 0 8 4 4 3 0 0 18 0 0 0 0 0 1 0 0 18 0 1 0 0 5 9 3 8 0 1 1 3 1 0 0 0 0 -5.4248 31 17 10 4 0 0 0 8.5 1.5 3.5 4 17 772.707 1.333 0.333 1 1.833 -3 37 287 0 0 5 2 0 0 2 0 1 0 0 4 3 5 0 3 2 0 0 4 0 0 12 8 11 0 12 10 5 4 0 0 27 0 0 0 1 1 2 0 0 27 2 2 0 0 5 12 5 7 0 0 0 6 0 0 0 0 0 -4.3377 35 22 7 6 0 0 0 7 0 6 5 18 835.755 0 0 0 0 -3 39 474 0 0 8 1 0 2 3 0 3 0 0 0 0 10 0 3 2 0 0 3 0 0 13 4 18 0 13 15 3 4 0 0 23 0 0 0 4 3 5 0 0 23 7 5 0 0 # 51.476 -15.355 104.514 # SER 361 Env_1li4_1 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 15 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 30 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 1 2 0 2 0 0 0 0 0 0 0 0 0 -0.1644 5 3 2 0 0 0 0 2 0 0 0 3 128.804 0 0 0 0 0 3 217 0 0 0 0 0 0 2 0 0 0 0 0 0 1 0 2 0 0 0 0 0 0 1 2 2 0 1 2 0 2 0 0 3 0 0 0 2 0 0 0 0 3 2 0 0 0 4 6 0 0 0 0 0 4 2 0 0 0 0 -1.5375 16 10 0 6 0 0 0 0 0 5 0 11 396.419 0.999 0.999 0 0.999 -4 14 616 4 0 0 0 0 0 6 0 0 0 0 0 1 1 3 1 0 0 0 0 0 0 9 6 1 0 9 1 0 6 0 0 7 0 0 0 5 0 4 0 0 7 5 4 0 0 3 6 0 5 0 0 0 1 1 0 1 0 0 -2.0104 17 9 5 2 1 0 0 5 0 1.5 0 9 411.496 0.666 0.666 0 0.666 -1 19 643 1 0 0 0 0 0 5 0 0 2 0 0 5 2 1 0 0 0 0 1 0 0 12 5 0 0 12 0 0 5 0 0 9 0 0 0 2 0 6 0 0 9 2 6 0 0 3 17 2 5 0 0 0 5 1 0 0 0 0 -4.3383 33 22 5 6 0 0 0 5 0 5.5 2 19 859.592 0.333 0.333 0 0.333 0 25 1507 1 0 4 0 0 0 7 0 2 3 0 0 4 3 3 2 0 0 0 4 0 0 18 7 8 0 18 6 2 7 0 0 24 0 0 0 4 2 3 0 0 24 6 3 0 0 # 57.327 -20.272 95.88 # SER 355 Env_1li4_2 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1102 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 16 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.1143 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 2 48 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 2 3 0 1 0 0 0 1 0 0 0 0 0 -0.4014 7 5 1 1 0 0 0 1 0 1 0 4 193.181 0 0 0 0 0 7 73 0 0 1 0 0 0 0 1 0 0 4 0 0 0 0 1 0 0 0 0 0 0 4 0 2 1 4 3 0 0 0 0 6 0 0 0 0 0 1 0 0 6 0 1 0 0 1 7 0 2 0 0 1 3 0 1 0 0 0 -4.0552 15 8 3 4 0 0 1 2.5 0.5 3 1 8 359.491 0 0 0 0.5 -4 18 94 0 0 4 0 0 0 0 3 1 0 4 0 0 0 0 3 0 0 0 0 0 0 4 0 8 3 4 10 1 0 0 0 5 0 0 0 0 0 10 0 0 5 0 10 0 0 8 7 3 4 0 0 1 5 0 0 0 0 1 -0.6276 29 18 6 5 0 0 0 4.5 0.5 5 4 19 725.005 0 0 0 0.5 -7 21 389 2 0 3 0 1 0 0 2 5 0 3 0 3 2 0 2 1 0 0 4 0 1 14 0 12 3 14 9 5 0 1 0 8 0 0 0 2 4 15 0 0 8 6 15 0 0 4 10 0 7 0 1 0 5 0 0 0 0 2 -4.1497 29 15 8 6 0 0 0 7 1 5 0 16 688.513 1 0 1 1 -7.5 26 456 3 2 4 0 2 3 0 2 2 0 1 1 1 3 0 0 3 0 0 0 0 2 8 3 14 4 8 14 5 0 2 0 1 0 0 0 4 13 11 0 0 1 17 11 0 0 # 43.53 -23.757 98.596 # LEU 347 Env_1li4_3 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 6 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 0 1 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 18 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 0 3 0 0 0 0 3 0 0 0 1 1 0 4 0 0 0 1 1 1 0 0 0 -2.8633 9 2 4 3 0 0 1 4 0 1.5 0 6 166.356 0.333 0.333 0 0.333 -7 7 69 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 6 0 0 1 0 0 1 2 6 0 1 6 0 2 0 0 6 0 0 0 0 3 0 0 0 6 3 0 0 0 6 6 0 1 0 0 0 3 0 0 0 0 0 1.103 16 12 1 3 0 0 0 1 0 3 0 10 435.169 0.333 0.333 0 0.333 -2 17 185 0 0 0 0 0 3 5 0 2 0 0 0 3 0 0 0 1 0 0 2 0 0 5 5 6 0 5 4 2 5 0 0 8 0 0 0 0 0 8 0 0 8 0 8 0 0 1 11 2 2 0 0 0 4 1 0 0 0 0 -5.0735 21 14 2 5 0 0 0 2 0 4.5 2 8 543.549 0.333 0.333 0 0.333 5 33 207 2 0 0 0 0 2 2 0 2 0 2 0 3 2 0 1 2 0 0 3 0 0 12 2 7 0 12 5 2 2 0 0 12 0 0 0 0 1 8 0 0 12 1 8 0 0 5 15 4 5 0 0 0 4 0 0 2 0 0 -2.2513 35 24 5 4 2 0 0 5 0 4 4 18 940.045 0 0 0 0 5 39 325 3 0 0 0 0 3 0 2 5 0 5 0 8 2 0 2 3 0 0 2 0 0 20 0 13 2 20 10 5 0 0 0 14 0 0 0 0 5 16 0 0 14 5 16 0 0 # 50.934 -25.319 100.893 # THR 57 Env_1li4_4 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 3 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.062 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 0 7 6 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 2 0 0 0 0 0 0 0 0 2 0 0 0 0 1 0 0 2 0 0 0 2 1 0 0 0 0 -3.1015 6 1 2 3 0 0 0 2 0 2.5 0 1 106.562 0.333 0.333 0 0.333 -5 14 34 0 0 4 1 0 0 1 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 4 0 0 0 1 0 1 0 0 4 1 1 0 0 5 9 0 2 0 0 0 2 2 1 0 0 3 -0.775 24 17 2 5 0 0 1 2 0 3 0 7 627.57 1.332 1.332 0 1.332 0.5 28 183 0 0 7 3 0 0 4 0 0 0 0 3 0 0 0 0 4 0 0 0 0 3 0 10 11 3 0 11 3 7 3 0 8 0 0 0 5 4 7 0 0 8 9 7 0 0 5 10 0 4 0 0 0 2 1 2 0 0 3 -2.1203 27 16 5 6 0 0 2 4 0 2.5 0 17 689.778 0.333 0.333 0 0.333 -8.5 13 305 0 0 3 3 0 0 3 0 0 0 0 2 0 0 0 6 5 0 0 2 0 3 2 8 14 3 2 14 2 6 3 0 15 0 0 0 2 2 8 0 0 15 4 8 0 0 4 9 1 5 0 0 2 5 3 1 1 0 8 -6.819 39 18 7 12 1 1 1 6 1 6.5 3 16 895.432 1.332 1.332 0 2.332 -11 39 641 0 0 2 7 0 0 3 0 3 0 1 2 2 1 0 3 3 0 0 4 0 8 8 12 11 8 8 8 5 10 8 0 13 0 0 2 5 7 12 0 0 13 14 12 0 0 # 46.453 -14.217 106.038 # LYS 186 Env_1li4_5 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 57 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 0 0 0 3 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 38 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 0 0 0 2 0 0 0 0 2 0 0 0 0 1 0 0 0 0 0 1 1 0 0 0 1 -1.3907 4 1 0 3 0 0 0 0 0 1.5 0 1 70.635 0.333 0.333 0 0.333 -2 4 45 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 2 1 1 0 0 1 2 1 0 2 0 0 0 0 1 1 0 0 2 1 1 0 0 3 4 0 3 0 0 0 2 1 1 1 1 3 -2.5402 19 10 3 4 2 0 1.5 3 0 2.5 0 10 471.904 0.666 0.666 0 0.666 -5.5 15 137 0 0 1 4 3 0 0 4 2 0 0 0 1 0 0 1 0 0 0 0 0 3 1 4 7 7 1 9 2 4 3 0 14 0 0 0 0 2 3 0 0 14 2 3 0 0 6 10 0 3 0 0 0 4 0 0 0 0 2 -0.2677 25 17 4 4 0 0 0 3 0 4 0 14 659.263 0 0 0 0 -2.5 15 450 0 0 6 2 2 0 0 3 2 0 0 0 2 1 2 1 0 0 1 1 0 2 6 2 12 5 6 13 2 2 2 0 15 0 0 0 1 2 7 0 0 15 3 7 0 0 6 17 0 10 0 1 0 5 0 1 0 0 3 -6.2793 43 25 12 6 0 0 1 10 1 5 0 24 1109.05 1 0 1 1 -6 38 1109 0 1 4 0 1 0 1 1 0 2 7 2 3 1 4 4 0 0 3 6 0 3 23 4 12 4 23 13 3 1 3 0 32 0 0 0 1 0 10 0 0 32 1 10 0 0 # 47.124 -16.246 99.334 # HIS 353 Env_1li4_6 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 2 1 3 0 0 1 2 0 0 0 0 0 -1.9756 11 5 4 2 0 0 0 3.5 0.5 2 2 7 246.539 0 0 0 0.5 -5 11 101 0 0 2 0 0 0 0 2 4 0 1 0 0 0 0 2 0 0 0 0 0 0 1 0 8 2 1 6 4 0 0 0 6 0 0 0 0 4 1 0 0 6 4 1 0 0 4 6 2 1 0 0 0 4 0 0 0 0 0 0.0186 17 12 1 4 0 0 0 1 0 4 2 13 429.382 0 0 0 0 -4 9 330 0 0 2 0 4 0 2 4 3 0 1 0 0 0 0 1 0 0 0 0 0 0 1 2 10 4 1 11 3 2 0 0 12 0 0 0 0 3 2 0 0 12 3 2 0 0 4 7 0 8 0 0 1 2 0 0 0 1 2 -3.38 25 12 9 3 1 0 0.5 8.5 0.5 2 1 14 600.648 0 0 0 0.5 -8.5 16 793 0 2 4 1 2 0 3 2 3 1 3 0 0 0 2 0 0 0 0 0 0 2 6 6 9 4 6 8 5 4 2 0 16 0 0 0 0 3 6 0 0 16 3 6 0 0 5 15 0 4 0 0 0 6 1 0 0 0 3 -3.8446 34 22 5 7 0 0 0 4 0 6.5 0 19 878.075 0.666 0.666 0 0.666 -1 25 1278 1 2 0 6 0 0 1 1 0 2 6 0 4 0 3 0 0 0 2 3 0 3 19 9 2 4 19 3 2 7 3 0 22 0 0 0 0 1 11 0 0 22 1 11 0 0 # 45.877 -17.367 95.434 # SER 198 Env_1li4_7 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 66 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 0 0 0 1 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0518 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 6 132 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 0 0 0 2 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.0105 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 1 1 132 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 0 0 0 2 0 0 0 0 2 0 0 3 1 0 2 1 0 0 2 0 0 0 0 0 -1.5702 9 4 3 2 0 0 0 2.5 0.5 2 0 4 207.092 0.333 0 0.333 0.333 -4 19 329 2 1 0 0 0 4 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 4 1 4 0 4 4 1 0 0 0 1 0 0 0 0 2 6 0 0 1 2 6 0 0 0 4 2 2 2 0 1 1 0 0 0 0 0 -2.2551 12 6 5 1 0 0 0 3 2 1 2 5 286.495 0.666 0 0.666 1.166 -4 25 519 3 3 0 0 0 2 0 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 4 3 4 1 4 3 5 0 0 0 5 0 0 0 0 3 4 0 0 5 3 4 0 0 4 5 4 2 0 1 1 6 1 0 0 0 0 -3.9317 24 13 4 7 0 0 0 2.5 1.5 6.5 5 13 560.754 1.333 0.333 1 1.833 -7 37 799 0 1 1 1 2 2 0 2 3 0 2 2 0 0 0 1 3 2 0 2 0 0 4 4 14 2 6 11 6 1 0 0 12 0 0 0 2 3 7 0 0 12 5 7 0 0 # 48.731 -27.191 92.791 # MET 351 Env_1li4_8 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 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 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 2 1 1 0 0 1 0 0 1 0 0 0 -0.8896 7 4 2 1 0 0 1 1.5 0.5 0 2 3 172.482 0 0 0 0.5 -4 13 72 0 0 1 2 0 0 0 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0 0 3 4 0 0 2 3 2 0 0 5 0 0 0 0 2 0 0 0 5 2 0 0 0 1 5 1 2 0 1 1 2 1 0 1 0 2 -3.3207 17 9 4 3 1 0 0 2.5 1.5 2.5 2 4 432.029 1.333 0.333 1 1.833 0 33 134 0 0 3 2 0 0 1 0 2 0 0 4 2 0 0 1 0 0 0 0 0 2 2 7 6 2 2 4 6 3 2 0 12 0 0 0 0 2 3 0 0 12 2 3 0 0 5 11 1 1 0 0 0 3 0 0 0 0 3 -0.1916 24 19 1 4 0 0 0 1 0 3 1 11 676.883 0.333 0.333 0 0.333 3 20 301 0 0 3 0 0 0 2 1 2 0 0 3 2 2 0 2 0 0 0 4 0 3 8 5 7 4 8 6 5 2 3 0 15 0 0 0 2 2 5 0 0 15 4 5 0 0 6 7 1 9 0 0 0 5 1 1 0 1 3 -5.3583 34 16 10 7 1 0 1.5 9 0 5.5 1 23 796.118 0.333 0.333 0 0.333 -13 18 492 0 0 3 0 2 0 3 2 2 0 1 1 4 4 0 5 2 0 0 2 0 3 11 4 14 5 11 14 3 3 3 0 21 0 0 0 4 3 6 0 0 21 7 6 0 0 # 48.4287 -15.135 102.831 # ASP 190 Env_1li4_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 44 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 1 0 0 0 0 0 0 0 0 1 0 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 3 132 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 3 0 0 0 0 0 0 0 0 3 0 0 0 0 2 0 0 2 0 0 0 2 0 0 0 0 3 -1.2107 9 2 2 4 0 1 0 2 0 2 0 2 167.361 0 0 0 0 -6 11 96 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 3 0 0 6 3 0 6 0 0 3 0 3 0 0 0 3 0 3 0 0 3 3 3 0 0 2 2 0 1 0 0 0 2 0 1 0 0 6 -1.1602 14 8 1 5 0 0 1 1 0 2 0 5 332.419 0 0 0 0 -3 5 183 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 6 0 0 8 6 0 8 0 0 6 0 3 0 0 0 1 4 6 0 0 3 5 6 0 0 1 6 1 2 0 1 0 2 2 1 0 0 10 -4.8142 26 11 4 10 0 1 1 2 1 3 1 6 602.453 1.666 0.666 1 1.666 -7.5 26 395 0 0 5 2 0 0 1 0 1 0 0 1 0 0 0 0 5 0 0 1 0 10 1 4 11 10 1 10 2 3 10 0 8 0 0 0 4 3 11 0 0 8 7 11 0 0 4 13 2 8 0 0 2 2 1 0 0 0 5 -3.2295 37 23 10 4 0 0 0 9 1 2.5 4 15 921.379 0.999 0.999 0 1.999 -7 38 1069 0 0 3 7 0 0 1 1 5 0 0 2 0 0 0 4 2 0 0 7 0 5 7 10 14 6 7 10 7 8 5 0 25 0 0 1 5 0 6 0 0 25 6 6 0 0 # 41.898 -12.185 107.472 # THR 158 Env_1li4_10 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 3 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 1 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 1 0 1 0 0 0 2 0 1 0 0 0 -1.6413 6 2 1 3 0 0 1 1 0 2 0 4 121.302 0 0 0 0 -4 5 96 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 6 0 0 6 0 0 0 0 3 0 0 0 3 0 0 0 0 3 3 0 0 0 4 9 0 4 0 1 0 2 1 1 0 0 1 -2.4263 23 13 5 5 0 0 1 4 1 2.5 0 11 575.894 1.666 0.666 1 1.666 -7 28 547 0 0 3 4 0 0 2 0 0 0 0 3 0 0 0 2 8 0 0 0 0 1 0 9 13 1 0 13 3 6 1 0 10 0 0 0 5 5 3 0 0 10 10 3 0 0 6 9 0 2 0 0 0 3 2 1 0 0 3 -1.4858 26 17 2 6 0 1 1 2 0 4 0 9 693.656 0.666 0.666 0 0.666 1 26 446 0 0 3 4 0 0 0 0 0 0 0 3 0 0 0 3 5 0 0 5 0 3 5 7 11 3 5 11 3 4 3 0 14 0 0 2 3 2 5 0 0 14 7 5 0 0 4 11 0 8 0 0 0 6 1 0 0 0 8 -5.7681 38 18 9 11 0 0 0 8 0 6.5 0 21 843.92 0.999 0.999 0 0.999 -13.5 17 321 0 0 5 5 0 0 6 1 0 0 0 3 0 0 0 3 1 0 0 6 0 8 6 14 9 9 6 10 3 11 8 0 13 0 0 5 2 2 16 0 0 13 9 16 0 0 # 44.75 -12.0507 108.623 # ASN 181 Env_1li4_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 27 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 9 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 3 0 0 0 0 0 1 0 0 0 0 0 0.0623 5 4 0 1 0 0 0 0 0 1 0 3 145.534 0 0 0 0 1 3 37 0 0 0 3 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 5 0 0 0 0 0 0 0 3 2 0 0 0 3 2 0 0 1 7 3 3 0 0 2 1 1 0 0 1 0 -3.3908 19 11 5 2 1 0 0.5 4 1 1.5 5 5 463.991 0.666 0.666 0 1.666 -3 39 176 0 0 0 2 1 0 3 1 5 0 4 0 0 0 0 0 3 0 0 0 0 0 4 5 9 1 4 5 5 5 0 0 0 0 0 2 0 12 5 0 0 0 14 5 0 0 5 5 2 3 0 0 2 2 2 1 0 0 0 -2.4333 22 12 5 5 0 0 1 4 1 3 4 12 508.873 0.999 0.999 0 1.999 -9 26 167 0 0 0 1 3 0 6 1 6 0 3 0 0 0 0 0 2 0 0 0 0 0 3 7 11 1 3 6 6 7 0 0 0 0 0 4 0 9 9 0 0 0 13 9 0 0 4 10 2 4 0 1 0 4 2 0 0 0 5 -5.0628 32 19 6 7 0 0 0 4 1 5 2 15 812.651 1.666 0.666 1 1.666 -4.5 37 195 0 0 0 4 4 1 3 2 4 0 3 2 0 1 0 0 3 0 0 0 0 5 4 9 12 7 4 10 6 7 5 0 6 0 0 7 0 12 7 0 0 6 19 7 0 0 # 44.9337 -20.9467 107.327 # ASP 131 Env_1li4_12 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 6 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 0 103 0 0 0 0 0 0 0 3 1 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 1 3 1 3 1 0 0 0 0 0 0 0 0 1 4 0 0 0 1 4 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.5478 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 3 90 0 0 1 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 2 0 1 0 2 1 0 0 0 0 2 0 0 0 0 0 1 0 0 2 0 1 0 0 4 11 1 2 0 0 0 2 0 1 0 0 0 -0.6169 21 16 2 3 0 0 1 2 0 2 1 10 584.659 0 0 0 0 1 20 423 1 0 5 0 0 0 0 0 5 0 5 0 3 0 0 2 0 0 0 0 0 0 9 0 12 0 9 7 5 0 0 0 12 0 0 0 0 6 3 0 0 12 6 3 0 0 2 6 1 3 0 0 2 4 1 0 0 0 1 -4.5583 20 9 5 6 0 0 0 4 1 4.5 3 9 447.685 0.333 0.333 0 1.333 -8 26 348 3 0 2 0 0 1 1 0 3 0 2 0 1 0 2 3 1 0 0 0 0 1 8 1 10 1 8 7 3 1 1 0 8 0 0 0 0 7 5 0 0 8 7 5 0 0 5 8 1 5 0 0 0 4 2 1 2 0 2 -3.8037 30 15 6 7 2 0 1 5 0 5 1 11 696.431 1.332 1.332 0 1.332 -4.5 42 679 1 0 0 3 0 3 3 2 1 0 1 0 3 0 5 2 2 0 0 2 0 2 12 6 8 4 12 9 1 6 2 0 14 0 0 0 0 4 12 0 0 14 4 12 0 0 # 47.036 -21.441 96.531 # GLY 352 Env_1li4_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 9 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 27 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 2 0 0 0 0 0 -1.0442 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 6 80 0 1 0 0 0 0 0 1 0 0 4 0 0 0 0 0 0 0 0 1 0 0 5 1 0 1 5 1 1 0 0 0 1 0 0 0 0 2 4 0 0 1 2 4 0 0 3 4 0 5 0 0 0 4 0 0 0 0 1 -4.04 17 7 6 4 0 0 0 5 0 4 0 13 385.952 0 0 0 0 -9 8 180 0 2 5 0 0 0 0 2 1 5 0 0 0 0 0 0 0 0 0 1 0 1 6 2 6 3 6 7 3 0 1 0 3 0 0 3 0 5 6 0 0 3 8 6 0 0 6 14 1 5 0 0 0 3 0 0 0 0 4 -0.829 33 24 5 4 0 0 0 5 0 3 1 12 885.411 0 0 0 0 2.5 35 307 0 2 10 0 0 0 0 3 4 2 5 0 0 0 0 0 0 0 0 3 0 4 10 2 14 7 10 13 6 0 4 1 14 0 0 3 0 8 7 0 0 15 11 7 0 0 3 12 2 3 0 0 3 5 0 0 0 0 3 -4.9903 31 18 7 6 0 0 0 4.5 1.5 5 5 14 757.625 0 0 0 1.5 -5.5 31 592 1 1 5 2 0 0 0 2 6 1 3 0 0 4 0 1 0 0 0 2 0 3 11 3 12 5 11 8 7 2 3 2 7 0 0 2 2 10 8 0 0 9 14 8 0 0 # 39.187 -21.127 100.037 # LEU 344 Env_1li4_14 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 42 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 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 14 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 4 0 1 0 0 0 0 0 0 0 0 0 -0.1461 5 4 1 0 0 0 0 1 0 0 0 2 148.177 0 0 0 0 1 6 100 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 0 0 1 0 0 2 0 3 0 2 3 0 0 0 0 1 0 0 0 0 2 2 0 0 1 2 2 0 0 2 8 1 2 0 0 0 1 1 1 1 0 0 -2.1524 17 11 2 3 1 0 1 2 0 1.5 1 8 459.204 0.333 0.333 0 0.333 1 21 502 0 0 0 0 0 2 1 0 1 0 0 0 6 0 0 0 4 0 0 3 0 0 9 1 7 0 9 6 1 1 0 0 5 0 0 0 0 4 8 0 0 5 4 8 0 0 5 3 0 3 0 0 2 6 1 0 0 0 0 -4.1158 20 8 5 7 0 0 0 4 1 6.5 2 13 415.377 0.666 0.666 0 1.666 -9 20 226 2 0 0 0 0 2 3 1 2 0 1 0 3 0 0 1 3 0 0 2 0 0 8 3 8 1 8 7 2 3 0 0 9 0 0 0 0 2 9 0 0 9 2 9 0 0 4 10 2 6 0 0 0 5 0 0 0 0 0 -2.7471 27 16 6 5 0 0 0 6 0 5 2 22 658.532 0 0 0 0 -8 10 261 3 0 0 1 0 0 3 3 6 0 3 0 2 0 0 2 3 0 0 1 0 0 9 4 11 3 9 8 6 4 0 0 14 0 0 0 0 2 11 0 0 14 2 11 0 0 # 50.095 -27.1153 96.721 # GLN 85 Env_1li4_15 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 9 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 -0.2047 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 52 0 0 0 0 0 0 0 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 3 1 3 1 0 0 0 0 0 0 0 0 4 1 0 0 0 4 1 0 0 0 0 0 0 0 0 0 2 1 0 0 0 2 -1.9797 5 0 0 5 0 0 0 0 0 2.5 0 1 60.113 0.333 0.333 0 0.333 -5 7 13 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 1 1 0 1 2 0 0 0 0 1 0 1 3 0 0 0 2 3 0 0 4 6 0 4 0 0 0 2 0 0 0 0 6 -0.9429 22 15 5 2 0 0 0 4 0 2 0 10 580.753 0.333 0.333 0 0.333 -1.5 12 281 0 0 3 0 0 0 1 1 3 4 0 0 0 2 0 0 2 0 0 0 0 6 6 1 8 7 6 6 3 1 6 0 0 0 0 4 0 7 11 0 0 0 11 11 0 0 4 10 0 2 0 0 0 3 1 2 0 0 4 -2.6797 26 16 3 7 0 0 2 2 0 3.5 0 13 672.998 0.333 0.333 0 0.333 -4 17 449 0 0 3 0 0 0 2 1 1 1 2 0 0 2 0 0 9 0 0 1 0 4 6 2 13 5 6 13 1 2 4 0 2 0 0 5 0 8 11 0 0 2 13 11 0 0 3 16 2 8 0 0 1 3 0 2 0 0 6 -5.2729 41 25 9 7 0 0 2 8.5 0.5 3 3 17 1036.85 0 0 0 0.5 -4 35 911 0 1 1 2 1 0 2 3 3 1 5 0 0 1 0 0 10 0 0 5 0 6 12 5 15 9 12 15 4 4 6 1 4 0 0 4 4 13 15 0 0 5 21 15 0 0 # 36.85 -16.806 102.178 # GLY 300 Env_1li4_16 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 24 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 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 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 8 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 0 2 0 0 0 0 0 0 0 0 3 -0.2198 7 3 3 1 0 0 0 2 0 0 0 4 154.435 0 0 0 0 -3.5 0 40 0 0 3 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 3 1 0 3 3 1 3 0 0 3 0 4 0 0 0 0 0 3 0 0 4 0 3 0 0 1 11 1 0 0 0 1 1 0 1 0 0 0 -1.4378 16 13 1 2 0 0 1 0.5 0.5 1 2 4 477.871 0 0 0 0.5 5 27 169 0 0 1 0 0 0 0 1 2 2 7 0 0 0 0 2 0 0 0 1 0 0 10 0 5 1 10 4 2 0 0 0 8 0 0 0 0 2 6 0 0 8 2 6 0 0 5 11 2 5 0 0 0 5 0 0 0 1 2 -2.8619 31 20 5 5 1 0 0.5 5 0 5 2 21 804.956 0 0 0 0 -5 18 205 0 0 0 0 2 0 0 4 3 4 8 0 0 0 0 3 0 0 0 5 0 2 17 0 8 6 17 9 3 0 2 0 15 0 0 0 0 3 13 0 0 15 3 13 0 0 6 10 1 9 0 0 2 7 0 0 0 0 2 -6.3749 37 18 12 7 0 0 0 10 1 7 3 25 852.735 0 0 0 1 -12.5 22 417 4 0 2 0 5 0 0 6 5 2 6 0 3 0 0 1 0 0 0 1 0 2 16 0 13 8 16 14 5 0 2 0 16 0 0 2 0 9 10 0 0 16 11 10 0 0 # 43.0547 -19.4303 97.5783 # ASN 346 Env_1li4_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 12 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 48 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 47 0 0 2 0 0 0 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 3 0 2 1 3 3 0 0 0 0 0 0 0 2 0 1 3 0 0 0 3 3 0 0 0 6 0 2 0 0 0 1 0 0 0 0 1 -3.2831 10 6 3 1 0 0 0 2 0 1 0 4 265.257 0 0 0 0 0 12 49 0 0 2 0 0 0 0 1 0 0 1 0 0 0 0 0 1 0 0 4 0 1 5 0 3 2 5 4 0 0 1 0 5 0 0 3 0 1 1 0 0 5 4 1 0 0 7 16 0 5 0 0 0 3 0 0 0 3 4 -0.4559 38 26 5 4 3 0 1.5 5 0 3 0 15 1051.91 0 0 0 0 -1.5 32 200 0 0 10 0 5 0 0 2 0 0 6 0 0 0 0 0 6 0 0 5 0 4 11 0 21 6 11 23 0 0 4 0 15 0 0 10 0 2 11 0 0 15 12 11 0 0 6 14 0 4 0 0 0 9 1 2 0 0 5 -6.7262 41 23 5 13 0 0 2 4 0 9.5 0 24 1004.81 0.333 0.333 0 0.333 -10.5 25 327 0 2 1 0 6 0 1 0 1 0 9 0 0 0 0 0 6 0 0 10 0 5 19 3 14 5 19 13 3 1 5 0 15 0 0 10 0 4 12 0 0 15 14 12 0 0 # 38.572 -16.6 97.638 # ILE 299 Env_1li4_18 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 19 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0518 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 6 38 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 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 1 0 0 1 0 1 0 0 0 0 -1.7497 5 2 2 1 0 0 0 1.5 0.5 0.5 1 2 109.431 0.333 0.333 0 0.833 -2 7 89 0 0 0 1 0 0 0 0 1 0 0 0 3 0 0 0 0 0 0 0 0 0 3 1 1 0 3 0 1 1 0 0 4 0 0 0 0 1 0 0 0 4 1 0 0 0 3 4 3 0 0 0 0 3 1 1 0 0 0 -1.075 15 10 0 5 0 0 1 0 0 3.5 3 5 361.036 0.666 0.666 0 0.666 -1 23 235 0 0 0 3 0 0 0 0 3 0 0 0 2 1 1 2 0 0 0 3 0 0 7 3 5 0 7 2 3 3 0 0 11 0 0 0 0 3 1 0 0 11 3 1 0 0 2 8 6 5 0 0 1 2 1 0 0 0 0 -3.8481 25 16 6 3 0 0 0 5.5 0.5 2.5 7 13 616.673 0.333 0.333 0 0.833 0 33 362 0 0 0 1 0 0 3 0 6 0 0 0 0 5 2 4 0 0 0 4 0 0 11 4 10 0 11 4 6 4 0 0 16 0 0 0 0 6 3 0 0 16 6 3 0 0 10 13 0 6 0 1 0 3 3 2 0 0 2 -2.8091 40 24 7 9 0 0 2 6 1 4.5 0 24 1019.41 2.665 1.665 1 2.665 -10.5 42 499 0 0 3 3 0 0 8 4 0 0 1 2 1 6 2 6 2 0 0 0 0 2 10 13 11 6 10 15 2 11 2 0 27 0 0 0 0 2 11 0 0 27 2 11 0 0 # 50.836 -18.13 101.493 # MET 358 Env_1li4_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 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 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 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.4206 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 1 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 3 0 0 0 0 0 0 0 0 3 0 0 0 0 3 6 0 2 0 0 0 3 0 1 0 0 0 -1.0437 15 9 2 4 0 0 1 2 0 3 0 10 381.503 0 0 0 0 -4 7 265 0 0 0 0 0 0 1 0 1 0 0 0 1 0 1 3 2 0 0 6 0 0 8 1 6 0 8 5 1 1 0 0 10 0 0 0 0 3 2 0 0 10 3 2 0 0 5 8 0 3 0 0 0 5 0 1 1 0 0 -3.1846 23 13 3 6 1 0 1 3 0 5 0 12 576.55 0 0 0 0 -2 28 432 1 0 0 0 0 3 1 0 1 0 0 0 5 0 3 3 5 0 0 1 0 0 10 1 12 0 10 11 1 1 0 0 9 0 0 0 0 5 9 0 0 9 5 9 0 0 2 19 3 6 0 0 0 2 0 1 1 0 0 -4.5335 34 24 6 3 1 0 1 6 0 2 3 16 934.761 0 0 0 0 6 43 574 3 0 0 0 0 1 0 4 3 0 2 0 8 4 2 0 5 0 0 2 0 0 21 0 9 4 21 10 3 0 0 0 19 0 0 0 0 4 11 0 0 19 4 11 0 0 # 53.3113 -23.282 97.8827 # GLU 59 Env_1li4_20 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 1 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 1 0 0 0 0 0 0 0 0 1 0 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 3 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 3 0 0 0 0 0 0 0 0 3 0 0 0 0 1 1 2 1 0 0 0 1 0 1 0 0 0 -1.7518 7 4 1 2 0 0 1 1 0 1 2 3 162.85 0 0 0 0 0 14 26 0 0 0 0 0 0 0 0 1 0 1 0 0 2 0 0 3 0 0 0 0 0 3 0 4 0 3 3 1 0 0 0 4 0 0 0 0 2 1 0 0 4 2 1 0 0 5 8 2 3 0 0 0 4 0 0 0 0 0 -0.4531 22 15 3 4 0 0 0 3 0 4 2 16 577.059 0 0 0 0 -2 13 154 1 0 0 0 0 0 4 0 2 0 3 0 3 2 0 0 7 0 0 0 0 0 9 4 9 0 9 7 2 4 0 0 8 0 0 0 0 9 5 0 0 8 9 5 0 0 1 11 6 3 0 0 1 2 1 0 1 0 0 -4.3227 26 18 4 3 1 0 0 3 1 2.5 7 8 670.056 0.333 0.333 0 0.333 6 50 133 1 0 0 0 0 0 2 0 3 0 6 0 5 2 0 0 0 4 0 3 0 0 17 2 7 0 21 0 3 2 0 0 12 0 0 4 0 3 7 0 0 12 7 7 0 0 3 13 5 4 0 0 1 0 1 0 1 0 0 -2.9363 28 21 5 1 1 0 0 4.5 0.5 0.5 6 8 755.293 0.666 0.666 0 1.166 10 52 160 2 0 0 1 0 0 2 0 2 4 6 0 4 1 0 0 0 4 0 2 0 0 19 3 6 0 23 0 2 3 0 0 19 0 0 4 0 2 3 0 0 19 6 3 0 0 # 51.122 -24.945 104.152 # THR 60 Env_1li4_21 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 39 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 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 -0.0338 2 2 0 0 0 0 0 0 0 0 2 0 47.1 0 0 0 0 0 5 26 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 0 0 0 0 2 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 1 0 -0.7312 3 2 0 0 1 0 0.5 0 0 0 0 0 93.541 0 0 0 0 1 6 32 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 2 0 1 1 1 0 0 0 1 0 0 0 0 1 1 0 0 1 1 1 0 0 2 7 0 2 0 0 0 0 1 1 0 0 0 -1.535 13 9 2 2 0 0 1 2 0 0.5 0 4 348.227 0.666 0.666 0 0.666 0 18 117 0 0 2 2 2 0 0 0 2 0 3 0 0 0 0 2 0 0 0 0 0 0 3 2 8 0 3 6 2 2 0 0 2 0 0 0 0 6 5 0 0 2 6 5 0 0 3 11 1 3 0 0 1 4 1 1 0 0 0 -4.3741 25 15 4 6 0 0 1 3.5 0.5 4.5 2 12 626.84 0.333 0.333 0 0.833 -3 30 180 0 0 3 3 3 0 0 0 4 0 9 0 1 0 0 2 0 0 0 0 0 0 10 3 12 0 10 8 4 3 0 0 1 0 0 0 0 17 7 0 0 1 17 7 0 0 7 9 2 6 0 0 1 6 0 1 0 0 4 -3.9576 36 20 8 8 0 0 1 6.5 0.5 6 3 21 877.725 0 0 0 0.5 -11 25 244 0 0 4 2 2 0 0 0 7 1 6 0 0 0 0 7 3 0 0 0 0 4 7 2 23 4 7 16 7 2 4 0 5 0 0 2 1 15 13 0 0 5 18 13 0 0 # 43.7655 -23.7055 103.701 # HIS 55 Env_1li4_22 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 3 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 1 0 0 0 0 1 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 -0.1143 3 2 1 0 0 0 0 1 0 0 0 2 81.157 0 0 0 0 0 2 9 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 3 0 0 0 0 3 0 0 0 2 2 0 1 0 0 0 2 0 0 0 0 0 -1.181 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 6 25 0 0 0 0 2 0 0 0 1 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 3 0 4 2 1 0 0 0 0 0 0 2 0 4 1 0 0 0 6 1 0 0 1 5 2 2 0 0 1 2 1 0 0 1 0 -3.5685 15 8 3 3 1 0 0.5 2 1 2.5 3 6 347.728 0.666 0.666 0 0.666 -3 26 66 0 0 0 4 3 0 0 0 2 0 1 0 0 0 0 1 1 3 0 0 0 0 1 4 10 0 4 5 2 4 0 0 1 0 0 7 0 5 2 0 0 1 12 2 0 0 7 12 9 3 0 0 1 4 1 1 0 0 0 -1.9914 38 28 4 6 0 0 1 3.5 0.5 4.5 10 19 997.813 0.333 0.333 0 0.833 0 52 121 0 0 0 8 4 0 1 3 5 0 4 0 1 2 0 3 2 5 0 0 0 0 7 9 19 3 12 12 5 9 0 0 5 0 0 17 0 7 9 0 0 5 24 9 0 0 3 12 4 5 0 0 1 2 3 1 0 1 0 -5.5513 32 19 6 6 1 0 1.5 5.5 0.5 3.5 5 12 776.771 1.665 1.665 0 2.165 -4 53 68 0 0 0 3 2 1 6 2 2 0 4 0 1 2 0 6 1 2 0 0 0 0 7 9 14 2 9 12 2 9 0 0 5 0 0 12 0 2 13 0 0 5 14 13 0 0 # 48.023 -24.687 108.166 # LEU 54 Env_1li4_23 0 0 0 1 0 0 0 0 0 0 0 0 0 -0.2547 1 0 1 0 0 0 0 1 0 0 0 1 14.137 0 0 0 0 -1 0 55 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 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0.0045 4 4 0 0 0 0 0 0 0 0 0 1 134.04 0 0 0 0 2 4 220 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 -0.4296 6 3 1 2 0 0 0 1 0 2 0 6 137.655 0 0 0 0 -3 0 182 0 0 0 0 0 0 0 0 3 0 0 0 0 0 2 1 0 0 0 0 0 0 2 0 4 0 2 1 3 0 0 0 1 0 0 0 0 3 2 0 0 1 3 2 0 0 0 3 0 1 0 0 0 1 1 0 0 0 0 -2.1537 6 3 1 2 0 0 0 1 0 1.5 0 3 140.298 0.333 0.333 0 0.333 -1 7 185 0 0 0 0 0 0 1 1 2 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 3 1 1 2 2 1 0 0 3 0 0 0 0 2 1 0 0 3 2 1 0 0 3 7 2 4 0 0 0 1 1 2 0 0 0 -1.7252 20 12 4 4 0 0 2 4 0 1.5 2 9 485.762 0.666 0.666 0 0.666 -5 22 464 0 0 0 0 0 0 3 3 2 0 0 0 2 1 0 6 0 0 0 3 0 0 6 3 8 3 6 9 2 3 0 0 17 0 0 0 0 2 1 0 0 17 2 1 0 0 7 10 0 3 0 0 2 4 4 0 1 0 0 -3.9875 31 17 5 8 1 0 0 4 1 6 2 18 762.911 1.665 1.665 0 2.665 -7 36 1457 0 0 0 1 0 0 10 4 2 0 0 0 5 3 0 2 0 0 2 2 0 0 10 11 6 4 10 8 2 11 0 0 24 0 0 0 1 2 4 0 0 24 3 4 0 0 # 52.024 -17.6828 94.6516 # PRO 354 Env_1li4_24 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 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 -0.204 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 0 2 0 1 0 0 0 0 0 0 1 -1.7306 6 3 3 0 0 0 0 2 1 0 0 3 172.606 1 0 1 1 -0.5 8 28 0 0 3 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 1 4 1 0 4 1 0 1 0 4 0 0 0 1 0 1 0 0 4 1 1 0 0 6 5 0 2 0 0 0 4 1 1 0 0 3 -0.5607 22 13 2 7 0 0 1 2 0 4.5 0 9 526.806 0.666 0.666 0 0.666 -6 22 244 0 0 4 5 0 0 0 0 0 0 1 4 0 0 0 4 1 0 0 0 0 3 1 9 9 3 1 9 4 5 3 0 17 0 0 0 2 0 3 0 0 17 2 3 0 0 4 9 0 4 0 0 0 3 2 2 0 0 5 -4.1285 29 14 5 9 0 1 2 4 0 4 0 14 675.682 0.999 0.999 0 0.999 -9.5 19 556 0 0 4 8 0 0 1 0 0 0 0 4 0 1 0 1 3 0 0 2 0 5 3 13 8 5 3 8 4 9 5 0 16 0 0 0 6 1 6 0 0 16 7 6 0 0 4 11 1 6 0 0 2 3 3 1 0 1 11 -6.3957 43 22 8 12 1 0 1.5 7 1 4.5 3 19 1027.81 0.999 0.999 0 1.999 -14 32 982 0 0 1 5 1 0 2 0 3 0 3 3 0 3 0 2 6 0 0 3 0 11 9 10 13 11 9 10 6 7 11 0 14 0 0 0 8 8 13 0 0 14 16 13 0 0 # 45.3053 -11.8467 104.574 # ASN 191 Env_1li4_25 1 0 0 0 0 0 0 0 2 0 0 0 0 -0.832 3 1 0 2 0 0 0 0 0 1 0 0 48.853 0.999 0.999 0 0.999 -2 11 15 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 0 3 0 0 0 0 3 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 5 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 0 1 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.0957 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 1 1 10 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 3 8 2 1 0 0 0 3 2 1 0 0 0 -3.657 20 13 1 6 0 0 1 1 0 4 2 6 502.771 0.666 0.666 0 0.666 -1 40 67 0 0 0 2 0 3 3 0 0 0 1 2 1 2 0 5 0 0 0 1 0 0 5 7 8 0 5 8 2 5 0 0 14 0 0 0 0 2 4 0 0 14 2 4 0 0 3 8 2 4 0 1 0 2 1 0 1 0 0 -2.6549 22 13 5 3 1 0 0 4 1 2.5 2 8 553.844 1.999 0.999 1 1.999 3 37 126 0 0 1 5 0 2 2 0 0 0 2 2 1 4 0 0 2 0 0 1 0 0 8 9 5 0 8 5 2 7 0 0 10 0 0 3 1 7 1 0 0 10 11 1 0 0 5 17 2 6 0 0 0 3 2 1 0 0 0 -6.7042 36 24 6 6 0 0 1 6 0 4 2 19 975.581 0.666 0.666 0 0.666 -1 37 190 0 0 7 5 0 2 3 0 0 0 3 2 2 4 0 1 3 0 0 4 0 0 13 10 13 0 13 13 2 8 0 0 18 0 0 5 3 6 4 0 0 18 14 4 0 0 # 49.4197 -18.0933 107.566 # GLU 156 Env_1li4_26 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 25 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 0 1 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 75 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 0 3 0 0 0 0 3 0 0 0 1 0 0 2 0 0 0 0 0 0 0 0 4 -0.234 7 3 3 1 0 0 0 2 0 0 0 3 154.435 0 0 0 0 -3 0 94 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 4 0 0 3 4 0 3 0 0 4 0 1 0 0 0 0 2 4 0 0 1 2 4 0 0 3 2 0 2 0 1 0 2 1 1 0 0 6 -2.1741 18 11 3 4 0 0 1 2 1 2.5 0 6 482.037 1.333 0.333 1 1.333 -2 16 258 0 0 2 1 0 0 2 0 0 0 0 1 0 0 0 0 6 0 0 0 0 6 0 4 8 6 0 8 1 3 6 0 6 0 0 0 2 2 8 0 0 6 4 8 0 0 3 10 2 4 0 0 1 3 2 1 0 0 5 -4.3913 31 16 5 10 0 0 1 4.5 0.5 4 3 8 697.244 0.999 0.999 0 1.499 -10.5 43 353 0 0 5 2 0 0 4 2 6 0 0 1 0 0 0 0 6 0 0 0 0 5 0 7 17 7 0 13 7 6 5 0 11 0 0 1 2 9 8 0 0 11 12 8 0 0 9 13 1 3 0 0 2 4 3 0 0 0 6 -1.8123 41 25 6 9 0 1 0 4 1 5.5 3 18 1029.78 1.998 1.998 0 2.998 -6 43 276 0 0 5 7 0 0 7 4 4 1 0 1 0 0 0 0 2 0 0 4 0 6 5 15 11 10 5 11 5 14 6 0 14 0 0 4 3 9 11 0 0 14 16 11 0 0 # 42.843 -16.129 106.912 # THR 157 Env_1li4_27 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 39 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 0 0 0 3 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 26 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 0 0 0 2 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 -0.6145 3 2 0 1 0 0 0 0 0 1 0 2 78.514 0 0 0 0 0 1 24 0 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 1 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 4 2 3 2 0 0 0 2 1 0 0 1 0 -1.2547 15 9 2 3 1 0 0.5 2 0 2.5 3 8 359.612 0.666 0.666 0 0.666 -2 21 365 0 0 0 3 2 0 0 2 3 0 0 0 0 4 0 0 1 0 0 0 0 0 4 3 6 2 4 5 3 3 0 0 0 0 0 0 0 15 0 0 0 0 15 0 0 0 2 10 4 3 0 0 1 1 1 2 0 0 1 -3.2297 25 16 4 5 0 0 2 3.5 0.5 1.5 5 9 636.691 0.333 0.333 0 0.833 -2 34 574 0 0 0 3 3 0 0 4 3 0 1 0 0 5 0 0 5 0 0 0 0 1 6 3 11 5 6 12 3 3 1 0 4 0 0 0 0 17 4 0 0 4 17 4 0 0 7 10 2 7 0 0 1 3 3 1 0 0 6 -4.6849 40 23 9 8 0 0 1 7.5 0.5 4.5 3 18 955.086 1.665 1.665 0 2.165 -10 42 735 0 0 5 6 1 0 2 4 3 0 3 0 0 2 0 0 7 0 1 0 0 6 5 8 17 10 5 18 3 8 6 0 10 0 0 2 0 16 12 0 0 10 18 12 0 0 # 40.0475 -21.381 107.371 # HIS 301 Env_1li4_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 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 6 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 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0877 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 5 20 0 0 0 0 0 0 0 0 0 0 0 0 1 1 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 0 2 0 0 0 0 3 8 0 2 0 0 0 2 0 1 0 0 0 -0.8346 16 11 2 3 0 0 1 2 0 2 0 9 437.029 0 0 0 0 0 11 122 0 0 0 0 0 0 3 0 0 0 3 0 3 2 0 2 3 0 0 0 0 0 8 3 5 0 8 5 0 3 0 0 16 0 0 0 0 0 0 0 0 16 0 0 0 0 3 16 0 4 0 0 0 3 2 1 1 0 0 -5.272 30 19 4 6 1 0 1 4 0 4 0 13 786.741 0.999 0.999 0 0.999 2 44 129 0 0 0 0 0 2 5 0 0 0 7 0 4 2 0 5 5 0 0 0 0 0 13 5 12 0 13 12 0 5 0 0 23 0 0 0 0 3 4 0 0 23 3 4 0 0 7 9 2 7 0 0 0 6 3 1 1 0 0 -5.9571 36 18 7 10 1 0 1 7 0 7.5 2 19 817.352 1.332 1.332 0 1.332 -7 49 196 1 0 3 2 0 4 5 0 1 1 5 0 2 0 0 4 1 2 0 5 0 0 14 7 15 0 16 12 1 7 0 0 26 0 0 3 0 3 4 0 0 26 6 4 0 0 # 53.1387 -21.0157 105.261 # PHE 362 Env_1li4_29 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 2 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 15 0 0 0 1 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 4 0 4 0 1 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 0 0 0 2 0 0 0 1 1 0 0 0 0 0 -0.9186 4 2 1 1 0 0 0 0.5 0.5 1 3 1 85.115 0 0 0 0.5 -2 11 48 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 0 0 0 3 1 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 2 5 2 3 0 0 1 0 3 0 0 0 0 -3.2342 16 9 4 3 0 0 0 3.5 0.5 1.5 3 7 367.698 1.332 1.332 0 1.832 -4 27 197 0 0 0 5 0 0 3 4 2 0 0 0 0 1 0 0 1 0 0 0 0 0 1 8 3 4 1 5 2 8 0 0 3 0 0 3 0 10 0 0 0 3 13 0 0 0 7 11 4 3 0 0 0 5 3 0 0 1 0 -2.4119 34 22 3 8 1 0 0.5 3 0 6.5 4 15 839.284 1.998 1.998 0 1.998 -3 41 791 0 0 0 11 2 0 1 3 1 0 0 0 0 4 0 0 11 0 0 1 0 0 5 12 14 3 5 16 1 12 0 0 13 0 0 7 0 14 0 0 0 13 21 0 0 0 6 8 1 5 0 0 1 4 2 3 0 1 1 -5.6564 32 15 6 10 1 0 3.5 5.5 0.5 5 2 19 755.011 0.666 0.666 0 1.166 -13 30 602 0 0 2 4 5 0 7 0 4 0 1 0 0 2 0 0 5 0 1 0 0 1 3 11 17 1 3 13 4 11 1 0 10 0 0 6 0 10 6 0 0 10 16 6 0 0 # 40.906 -20.876 110.698 # GLY 132 Env_1li4_30 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 8 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 1 0 0 0 0 0 0 0 0 1 0 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 32 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 4 0 0 0 0 0 0 0 0 4 0 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.8304 5 2 2 1 0 0 0 2 0 1 0 4 117.08 0 0 0 0 -3 4 56 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 1 0 0 2 0 0 2 1 2 0 2 2 0 1 0 0 3 0 0 0 0 1 1 0 0 3 1 1 0 0 2 6 0 0 0 0 0 1 2 0 0 0 0 -1.6634 11 8 0 3 0 0 0 0 0 2 0 3 281.986 0.999 0.999 0 0.999 1 20 127 3 0 0 0 0 1 4 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 4 4 3 0 4 3 0 4 0 0 8 0 0 0 0 2 1 0 0 8 2 1 0 0 2 13 2 5 0 0 2 3 0 1 0 0 0 -4.1744 28 17 7 4 0 0 1 6 1 3 4 12 712.732 0 0 0 1 -2 37 278 7 0 0 0 0 3 3 1 4 0 4 0 1 0 0 0 4 0 0 1 0 0 13 3 11 1 13 8 4 3 0 0 21 0 0 0 0 3 4 0 0 21 3 4 0 0 8 14 1 3 0 0 0 6 0 1 1 0 0 -0.5435 34 23 3 7 1 0 1 3 0 6 1 24 912.852 0 0 0 0 -4 20 283 8 0 0 0 0 2 1 2 2 0 3 0 6 0 0 3 4 0 0 3 0 0 20 1 11 2 20 11 2 1 0 0 25 0 0 0 0 1 8 0 0 25 1 8 0 0 # 54.654 -26.891 97.458 # VAL 58 Env_1li4_31 0 0 0 0 0 0 0 0 0 0 0 1 0 -0.3118 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 3 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 0 0 0 -0.123 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 0 1 3 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 1 3 3 2 0 0 2 2 0 0 0 0 0 -2.1378 13 7 4 2 0 0 0 3 1 2 5 7 293.639 0 0 0 1 -5 17 111 0 0 0 2 4 0 0 0 6 0 1 0 0 0 0 0 0 0 0 0 0 0 1 2 10 0 1 4 6 2 0 0 0 0 0 0 0 7 6 0 0 0 7 6 0 0 5 5 1 2 0 0 2 1 2 0 0 0 0 -0.3183 18 11 4 3 0 0 0 3 1 2 3 9 451.448 0.999 0.999 0 1.999 -4 23 136 0 0 1 5 2 0 0 0 5 0 4 0 0 0 0 1 0 0 0 0 0 0 4 5 9 0 4 4 5 5 0 0 0 0 0 2 0 13 3 0 0 0 15 3 0 0 1 9 2 2 0 0 0 3 0 3 0 1 0 -5.2051 21 12 2 6 1 0 3.5 2 0 3 2 10 522.948 0 0 0 0 -6 26 123 0 0 2 1 3 0 0 2 3 0 3 0 0 0 0 6 0 0 1 0 0 0 3 1 15 2 3 14 3 1 0 0 1 0 0 4 0 10 6 0 0 1 14 6 0 0 6 10 1 6 0 0 1 5 2 0 0 0 0 -5.8887 31 17 7 7 0 0 0 6 1 6 3 14 738.256 0.666 0.666 0 0.666 -5 44 342 0 0 5 6 1 0 2 2 3 1 3 0 1 0 0 3 1 1 2 0 0 0 5 8 16 2 6 14 3 8 0 0 5 0 0 7 1 10 8 0 0 5 18 8 0 0 # 43.593 -24.539 106.734 # CYS 79