# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3ny8 # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/3ny8_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_3ny8_0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 132 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 1 1 0 0 0 0 0 0 0 0 0 0 -0.0224 2 2 0 0 0 0 0 0 0 0 1 0 54.089 0 0 0 0 2 3 22 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 0 2 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 1 0 0 0 0 3 8 1 0 0 0 1 0 0 0 0 0 -2.5725 13 11 1 1 0 0 0 1 0 1 8 3 338.329 0 0 0 0 8 33 101 0 0 0 0 0 0 0 0 0 0 0 0 0 10 0 0 0 2 0 1 0 0 11 0 2 0 13 0 0 0 0 0 7 0 0 0 6 0 0 0 0 7 6 0 0 0 3 8 5 2 0 0 0 3 0 1 0 0 0 -1.4951 22 16 2 4 0 0 1 2 0 3 5 11 563.302 0 0 0 0 3 24 302 0 0 1 0 0 0 0 0 0 1 0 0 0 9 0 4 0 6 0 1 0 0 11 0 11 0 17 5 0 0 0 0 20 0 0 0 2 0 0 0 0 20 2 0 0 0 8 8 12 6 0 0 0 4 0 1 0 0 0 -3.6298 39 28 6 5 0 0 1 6 0 4 13 20 974.913 0 0 0 0 1 67 1007 0 0 3 0 0 0 0 0 0 1 5 0 0 7 0 7 0 5 8 3 0 0 16 0 23 0 21 18 0 0 0 0 37 0 0 0 2 0 0 0 0 37 2 0 0 0 # 5.39267 0.832833 47.859 # PHE 387 Env_3ny8_1 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 9 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.3819 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 18 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 1 0 0 0 3 0 0 0 0 0 -0.9249 6 2 1 3 0 0 0 1 0 3 0 6 115.639 0 0 0 0 -4 0 247 2 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 3 0 3 0 3 3 0 0 0 0 5 0 0 0 0 0 1 0 0 5 0 1 0 0 2 6 0 3 0 0 0 1 0 1 0 0 0 -2.2296 13 8 3 2 0 0 1 3 0 1 0 8 349.434 0 0 0 0 -2 10 747 0 0 2 0 0 4 0 0 0 2 0 0 0 0 0 0 1 0 3 1 0 0 3 0 10 0 3 10 0 0 0 0 10 0 0 0 1 0 2 0 0 10 1 2 0 0 5 10 3 3 0 0 0 4 0 1 0 0 0 -1.3884 26 18 3 5 0 0 1 3 0 4 3 12 668.884 0 0 0 0 2 29 1141 5 0 6 0 0 1 0 0 0 3 0 0 0 0 0 1 4 0 4 2 0 0 10 0 16 0 10 16 0 0 0 0 18 0 0 0 2 0 6 0 0 18 2 6 0 0 6 16 2 6 0 0 0 4 0 0 0 0 0 -2.9435 34 24 6 4 0 0 0 6 0 4 3 17 892.559 0 0 0 0 -1 38 1409 4 0 6 0 0 2 0 0 0 8 0 0 0 1 0 7 2 0 2 2 0 0 15 0 19 0 15 19 0 0 0 0 25 0 0 0 2 0 7 0 0 25 2 7 0 0 # 2.661 -3.464 56.659 # ALA 169 Env_3ny8_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 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 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 36 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 4 0 0 0 4 0 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0.2109 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 26 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 2 0 0 2 0 2 0 2 2 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 2 8 0 0 0 0 3 0 0 0 0 0 -1.8994 14 11 0 3 0 0 0 0 0 3 8 6 335.296 0 0 0 0 4 37 149 0 0 0 1 2 0 0 0 0 0 0 0 0 2 0 0 1 6 0 2 0 0 4 1 9 0 10 3 0 1 0 0 14 0 0 0 0 0 0 0 0 14 0 0 0 0 3 6 7 6 0 0 1 2 1 2 0 0 0 -5.4904 28 16 7 5 0 0 2 6 1 2.5 8 12 658.135 0.333 0.333 0 0.333 -4 44 292 1 0 0 2 2 0 0 0 0 1 3 0 1 5 0 3 4 3 0 3 0 0 14 2 12 0 17 9 0 2 0 0 27 0 0 0 1 0 0 0 0 27 1 0 0 0 4 15 7 0 0 0 0 2 0 0 1 1 0 -0.3382 30 26 0 2 2 0 0.5 0 0 2 7 10 873.552 0.333 0.333 0 0.333 14 40 283 3 0 0 3 1 0 0 0 0 4 1 0 1 8 0 5 1 1 0 2 0 0 19 3 8 0 20 7 0 3 0 0 27 0 0 0 3 0 0 0 0 27 3 0 0 0 # 1.659 4.897 45.23 # VAL 86 Env_3ny8_3 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6546 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 4 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 8 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 0 0 1 0 0 0 1 0 0 0 0 0 -0.3863 3 1 1 1 0 0 0 1 0 1 0 3 59.141 0 0 0 0 -2 0 17 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 1 0 2 0 1 2 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 2 2 4 2 0 0 0 3 0 0 0 0 0 -2.6731 13 8 2 3 0 0 0 2 0 3 4 6 313.172 0 0 0 0 1 22 448 1 0 1 0 0 0 0 0 0 4 0 0 0 3 0 2 0 0 2 0 0 0 8 0 5 0 8 5 0 0 0 0 13 0 0 0 0 0 0 0 0 13 0 0 0 0 6 13 2 4 0 0 0 4 0 2 0 0 0 -2.0889 31 21 4 6 0 0 2 4 0 4 3 19 794.766 0 0 0 0 -3 28 1089 5 0 5 0 0 0 0 0 0 7 0 0 0 6 0 5 0 0 3 0 0 0 18 0 13 0 18 13 0 0 0 0 30 0 0 0 1 0 0 0 0 30 1 0 0 0 4 11 10 8 0 0 0 3 0 1 0 0 0 -4.8837 37 25 8 4 0 0 1 8 0 3 10 17 920.711 0 0 0 0 5 49 1250 2 0 2 0 0 0 0 0 0 9 0 0 0 12 0 5 0 0 6 1 0 0 24 0 13 0 24 13 0 0 0 0 31 0 0 0 6 0 0 0 0 31 6 0 0 0 # 3.886 -2.853 51.103 # SER 173 Env_3ny8_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 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 -0.1597 2 2 0 0 0 0 0 0 0 0 1 0 60.031 0 0 0 0 2 4 22 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 0 2 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 1 0 0 0 1 6 5 1 0 0 0 1 0 0 0 0 0 -1.1583 14 12 1 1 0 0 0 1 0 1 5 4 386.864 0 0 0 0 8 26 221 0 0 0 0 0 0 0 0 0 0 3 0 0 9 0 0 0 1 1 0 0 0 12 0 2 0 13 1 0 0 0 0 11 0 0 0 3 0 0 0 0 11 3 0 0 0 4 15 9 3 0 0 0 3 0 0 0 0 0 -3.5797 34 28 3 3 0 0 0 3 0 3 10 14 927.457 0 0 0 0 13 55 792 0 0 0 0 0 0 0 0 0 4 8 0 0 5 0 3 0 4 9 1 0 0 18 0 16 0 22 12 0 0 0 0 33 0 0 0 1 0 0 0 0 33 1 0 0 0 7 11 6 6 0 0 0 6 0 3 0 0 0 -3.9086 39 24 6 9 0 0 3 6 0 6 6 23 955.679 0 0 0 0 -6 40 777 0 0 0 0 0 0 0 0 0 2 4 0 0 8 4 5 7 4 2 3 0 0 21 0 18 0 25 14 0 0 0 0 39 0 0 0 0 0 0 0 0 39 0 0 0 0 # 6.13983 -0.833 44.404 # PHE 177 Env_3ny8_5 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 19 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 57 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 0 2 1 0 0 0 1 0 0 0 0 0 -0.8222 5 3 1 1 0 0 0 1 0 1 2 3 112.183 0 0 0 0 0 9 101 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 2 0 0 0 0 0 0 5 0 2 3 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 2 2 3 1 0 0 0 3 0 0 2 0 0 -1.3017 13 7 1 3 2 0 1 1 0 3 3 7 309.322 0 0 0 0 -2 17 319 0 0 0 0 3 0 1 0 0 0 0 0 0 1 0 1 1 6 0 0 0 0 1 1 11 0 7 5 0 1 0 0 11 0 0 0 0 0 2 0 0 11 0 2 0 0 2 8 7 3 0 0 0 2 0 0 0 0 0 -2.1968 22 17 3 2 0 0 0 3 0 2 7 11 568.32 0 0 0 0 3 31 896 0 0 0 1 3 0 3 0 0 1 0 0 0 7 0 1 0 6 0 0 0 0 8 4 10 0 14 4 0 4 0 0 16 0 0 0 0 0 6 0 0 16 0 6 0 0 8 12 6 6 0 0 1 2 2 3 0 0 0 -4.3098 40 26 7 7 0 0 3 6 1 3 8 18 1011.6 0.999 0.999 0 0.999 -2 70 1219 0 0 0 10 4 0 2 0 0 4 0 0 0 6 0 3 0 5 4 2 0 0 12 12 16 0 17 11 0 12 0 0 23 0 0 0 3 0 14 0 0 23 3 14 0 0 # -2.276 9.394 55.623 # THR 79 Env_3ny8_6 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 33 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 0 1 0 0 0 0 1 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0.68 4 4 0 0 0 0 0 0 0 0 0 2 134.04 0 0 0 0 1 3 132 0 0 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 4 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 1 0 0 2 0 0 0 2 0 0 0 0 0 -1.3698 5 1 2 2 0 0 0 2 0 2 0 5 84.772 0 0 0 0 -4 0 174 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 5 0 0 5 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 1 4 3 2 0 0 0 3 0 0 0 0 0 -2.5382 13 8 2 3 0 0 0 2 0 3 3 7 303.927 0 0 0 0 0 14 397 3 0 2 0 0 1 0 0 0 0 0 0 0 2 0 0 0 0 5 0 0 0 5 0 8 0 5 8 0 0 0 0 8 0 0 0 1 0 4 0 0 8 1 4 0 0 7 6 7 4 0 0 0 2 0 0 0 0 0 -0.9532 26 20 4 2 0 0 0 4 0 2 8 13 689.593 0 0 0 0 3 39 1184 1 0 4 0 0 2 0 0 0 0 0 0 0 9 0 0 0 0 10 0 0 0 10 0 16 0 10 16 0 0 0 0 10 0 0 0 4 0 12 0 0 10 4 12 0 0 4 9 4 5 0 0 0 5 0 2 0 0 0 -4.7786 29 17 5 7 0 0 2 5 0 5 4 13 672.379 0 0 0 0 -2 45 1539 6 4 2 0 0 5 0 0 0 1 0 0 0 4 0 0 0 0 6 1 0 0 12 4 13 0 12 13 4 0 0 0 14 0 0 0 4 0 11 0 0 14 4 11 0 0 # 0.944 -0.567 58.893 # THR 164 Env_3ny8_7 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 84 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 28 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 0 0 0 0 1 0 1 0 0 0 -0.5144 4 2 0 2 0 0 1 0 0 1 0 3 95.671 0 0 0 0 -2 6 142 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 4 0 0 4 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 0 3 2 0 0 0 0 0 0 0 0 0 -1.02 6 4 2 0 0 0 0 2 0 0 4 2 128.416 0 0 0 0 1 18 218 0 0 1 0 0 0 0 0 0 1 0 0 0 2 0 0 0 0 2 0 0 0 3 0 3 0 3 3 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 3 5 9 0 0 0 0 4 0 1 0 0 0 -2.6082 22 17 0 5 0 0 1 0 0 4 9 10 563.96 0 0 0 0 6 33 656 3 0 0 0 0 0 0 0 1 1 0 0 0 12 0 1 0 0 2 2 0 0 18 0 4 0 18 3 1 0 0 0 19 0 0 0 1 0 2 0 0 19 1 2 0 0 3 13 10 8 0 0 0 2 0 1 0 0 0 -4.1924 37 26 8 3 0 0 1 8 0 2 10 16 930.843 0 0 0 0 5 47 1597 2 0 0 0 0 0 0 0 4 7 0 0 0 11 0 1 3 0 2 7 0 0 27 0 10 0 27 6 4 0 0 0 25 0 0 0 6 0 6 0 0 25 6 6 0 0 # 5.83 0.582667 54.68 # ASN 390 Env_3ny8_8 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 29 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 58 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 0 0 2 0 0 0 1 0 1 0 0 0 -1.4565 5 1 2 2 0 0 1 2 0 1 0 4 90.435 0 0 0 0 -4 2 103 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 5 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 2 3 1 0 0 0 0 1 0 1 0 0 0 -0.5724 8 6 0 2 0 0 1 0 0 1 2 3 209.791 0 0 0 0 0 18 184 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 4 1 0 0 2 0 6 0 2 6 0 0 0 0 8 0 0 0 0 0 0 0 0 8 0 0 0 0 3 3 4 2 0 0 0 4 0 2 0 0 0 -3.0374 18 10 2 6 0 0 2 2 0 4 4 11 409.766 0 0 0 0 -4 17 417 4 0 0 0 0 0 0 0 0 1 0 0 0 0 0 6 2 0 5 0 0 0 5 0 13 0 5 13 0 0 0 0 18 0 0 0 0 0 0 0 0 18 0 0 0 0 5 22 3 6 0 0 0 4 0 2 0 0 0 -3.702 42 30 6 6 0 0 2 6 0 4 3 23 1149.44 0 0 0 0 2 37 1719 4 0 0 0 0 0 0 0 0 6 0 0 0 5 2 7 6 0 2 10 0 0 27 0 15 0 27 15 0 0 0 0 39 0 0 0 2 0 1 0 0 39 2 1 0 0 # -1.717 -1.586 50.617 # SER 172 Env_3ny8_9 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 8 216 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 72 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 1 0 1 0 0 0 0 0 0 0 0 0 -0.4782 2 1 1 0 0 0 0 1 0 0 0 2 47.647 0 0 0 0 -1 0 144 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 2 0 2 1 0 0 0 2 0 0 2 0 0 -0.6546 9 4 1 2 2 0 1 1 0 2 2 5 210.229 0 0 0 0 -4 12 285 0 0 0 2 5 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 2 6 0 1 5 1 2 0 0 2 0 0 0 0 0 7 0 0 2 0 7 0 0 1 4 2 1 0 1 2 0 0 0 0 0 0 -1.3314 11 7 4 0 0 0 0 2 2 0 4 4 302.955 1 0 1 2 0 22 482 0 0 0 0 5 0 0 0 2 0 0 1 0 3 0 0 0 0 0 0 0 0 3 1 7 0 3 5 3 0 0 0 4 0 0 0 0 0 7 0 0 4 0 7 0 0 2 7 5 2 0 0 0 3 0 0 1 0 0 -1.9039 20 14 2 3 1 0 0.5 2 0 3 5 9 511.588 0 0 0 0 -1 27 1275 0 0 0 0 5 0 0 0 2 0 0 4 0 7 0 0 2 0 0 0 0 0 7 4 9 0 7 7 6 0 0 0 6 0 0 0 3 0 11 0 0 6 3 11 0 0 # 3.95967 10.825 63.401 # ASP 161 Env_3ny8_10 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 21 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 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 84 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 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 2 0 1 0 0 0 3 0 0 0 0 0 -2.3461 7 3 1 3 0 0 0 1 0 3 0 5 149.149 0 0 0 0 -2 6 104 0 0 0 0 1 0 0 0 0 1 3 0 0 0 0 1 0 0 0 1 0 0 5 0 2 0 5 2 0 0 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 2 4 2 2 0 0 0 1 0 1 0 0 0 -1.0693 12 8 2 2 0 0 1 2 0 1 2 8 311.027 0 0 0 0 -2 10 213 0 0 0 0 1 0 0 0 0 3 0 0 0 2 0 3 0 0 0 3 0 0 8 0 4 0 8 4 0 0 0 0 12 0 0 0 0 0 0 0 0 12 0 0 0 0 5 14 4 6 0 0 0 3 0 0 0 1 0 -2.1622 33 23 6 3 1 0 0.5 6 0 3 4 18 888.599 0 0 0 0 0 35 557 2 0 0 4 3 0 0 4 0 3 0 0 0 2 0 7 2 3 0 3 0 0 10 4 15 4 13 16 0 4 0 0 33 0 0 0 0 0 0 0 0 33 0 0 0 0 3 11 5 3 0 0 0 5 0 2 0 0 0 -5.1775 29 19 3 7 0 0 2 3 0 5 5 16 724.056 0 0 0 0 1 32 781 1 0 0 1 1 0 0 0 0 1 1 0 0 6 0 5 6 3 0 4 0 0 13 1 15 0 16 12 0 1 0 0 29 0 0 0 0 0 0 0 0 29 0 0 0 0 # -5.724 6.827 45.8 # LEU 84 Env_3ny8_11 0 1 0 0 0 0 0 0 0 0 0 0 0 0.2985 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -1.1414 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 2 0 0 1 0 0 0 2 0 0 0 0 0 -0.357 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 0 0 1 0 0 0 0 0 0 3 0 0 5 0 0 0 5 0 0 0 0 0 3 0 0 0 2 0 0 0 0 3 2 0 0 0 3 9 1 2 0 0 1 2 1 0 1 0 0 -1.9614 20 13 3 3 1 0 0 2 1 2.5 2 10 528.209 0.666 0.666 0 0.666 0 25 325 3 0 0 4 0 0 0 0 0 1 0 0 7 0 0 0 0 2 0 3 0 0 14 4 2 0 16 0 0 4 0 0 20 0 0 0 0 0 0 0 0 20 0 0 0 0 6 7 7 4 0 0 0 3 1 1 0 1 0 -2.925 30 20 4 5 1 0 1.5 4 0 3.5 8 13 739.365 0.333 0.333 0 0.333 1 49 622 1 0 0 3 1 0 0 3 0 3 2 0 0 0 2 0 0 5 5 5 0 0 13 3 11 3 18 9 0 3 0 0 30 0 0 0 0 0 0 0 0 30 0 0 0 0 3 16 7 5 0 0 0 6 0 0 0 0 0 -5.1254 37 26 5 6 0 0 0 5 0 6 7 21 950.102 0 0 0 0 4 38 1142 1 0 0 2 1 0 0 3 0 4 3 0 0 7 3 0 0 5 3 5 0 0 23 2 9 3 28 7 0 2 0 0 37 0 0 0 0 0 0 0 0 37 0 0 0 0 # -0.16 13.797 48.073 # VAL 55 Env_3ny8_12 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 1 2 0 2 0 0 0 1 0 1 0 0 0 -1.849 7 3 2 2 0 0 1 2 0 1 0 5 157.455 0 0 0 0 -3 4 102 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 1 0 0 2 0 0 4 0 3 0 4 3 0 0 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 4 7 0 2 0 0 0 6 0 1 0 0 0 -2.7403 20 11 2 7 0 0 1 2 0 6 0 14 483.005 0 0 0 0 -5 10 436 0 0 0 0 0 0 0 2 0 0 4 0 0 1 0 5 5 0 0 3 0 0 8 0 10 2 8 12 0 0 0 0 20 0 0 0 0 0 0 0 0 20 0 0 0 0 4 9 1 7 0 0 0 2 0 2 0 0 0 -2.6101 25 14 7 4 0 0 2 7 0 2 1 18 618.412 0 0 0 0 -8 13 770 1 0 0 0 1 0 0 2 0 0 4 0 0 2 0 6 6 0 0 3 0 0 10 0 13 2 10 15 0 0 0 0 25 0 0 0 0 0 0 0 0 25 0 0 0 0 6 14 2 5 0 0 0 5 0 3 0 0 0 -4.1999 35 22 5 8 0 0 3 5 0 5 2 22 896.926 0 0 0 0 -6 29 836 2 0 0 3 2 0 0 0 0 5 3 0 0 4 1 6 3 1 1 4 0 0 19 3 13 0 20 12 0 3 0 0 35 0 0 0 0 0 0 0 0 35 0 0 0 0 # -5.343 2.89 47.282 # SER 134 Env_3ny8_13 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 24 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 96 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 1 0 0 0 1 0 0 0 0 0 0.1502 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 90 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 3 1 0 0 3 0 0 1 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 2 6 0 1 0 0 0 4 0 2 0 0 0 -2.8559 15 8 1 6 0 0 2 1 0 4 0 11 362.507 0 0 0 0 -6 8 133 0 0 0 3 0 0 0 0 0 1 1 0 0 0 0 7 3 0 0 0 0 0 2 3 10 0 2 10 0 3 0 0 15 0 0 0 0 0 0 0 0 15 0 0 0 0 4 8 0 6 0 0 0 2 1 1 0 0 0 -2.3465 22 12 6 4 0 0 1 6 0 2.5 0 13 528.293 0.666 0.666 0 0.666 -6 19 268 0 0 0 3 1 0 0 0 0 5 3 0 0 0 0 4 4 0 1 1 0 0 9 3 10 0 9 10 0 3 0 0 22 0 0 0 0 0 0 0 0 22 0 0 0 0 4 15 6 2 0 0 0 3 1 3 0 0 0 -4.2624 34 25 2 7 0 0 3 2 0 3.5 7 12 911.249 0.333 0.333 0 0.333 5 55 819 0 0 0 1 3 0 0 0 0 2 2 0 0 6 0 5 6 1 3 5 0 0 15 1 18 0 16 17 0 1 0 0 31 0 0 0 0 0 3 0 0 31 0 3 0 0 # -2.76 4.534 49.651 # VAL 83 Env_3ny8_14 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 102 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 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 17 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 3 3 1 3 0 0 0 2 0 1 0 0 0 -2.2626 13 7 3 3 0 0 1 3 0 2 2 6 294.567 0 0 0 0 -4 24 403 0 0 6 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 3 0 0 0 4 0 9 0 4 9 0 0 0 0 13 0 0 0 0 0 0 0 0 13 0 0 0 0 4 5 12 3 0 0 0 5 0 0 0 0 0 -4.1858 29 21 3 5 0 0 0 3 0 5 12 11 705.2 0 0 0 0 7 53 830 0 0 8 0 0 0 0 0 0 0 3 0 0 10 0 0 0 3 5 0 0 0 13 0 16 0 16 13 0 0 0 0 29 0 0 0 0 0 0 0 0 29 0 0 0 0 5 11 5 6 0 0 0 5 0 0 0 0 0 -2.907 32 21 6 5 0 0 0 6 0 5 5 21 793.231 0 0 0 0 -1 30 893 0 0 1 0 1 0 0 2 0 3 5 0 0 1 2 0 0 9 3 5 0 0 16 0 14 2 25 7 0 0 0 0 32 0 0 0 0 0 0 0 0 32 0 0 0 0 # 7.56417 4.355 51.3642 # PHE 386 Env_3ny8_15 0 0 0 0 0 0 0 0 0 0 1 0 0 -0.108 1 0 0 0 1 0 0.5 0 0 0 0 0 26.521 0 0 0 0 -1 2 10 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 -0.187 2 1 0 0 1 0 0.5 0 0 0 0 0 60.031 0 0 0 0 -1 3 27 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 1 0 0 0 0 0 1 0 0 1 0 1 0 0 1 3 0 0 0 0 0 1 0 0 0 0 0 0.0359 5 4 0 1 0 0 0 0 0 1 0 4 145.534 0 0 0 0 -1 1 64 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 5 0 0 0 0 2 0 0 0 0 0 3 0 0 2 0 3 0 0 2 0 10 2 0 0 2 2 0 1 0 0 0 -3.4589 19 12 4 3 0 0 1 2.5 1.5 2 12 6 423.981 0 0 0 0.5 1 51 297 0 0 0 1 5 0 0 0 1 0 0 0 0 0 0 0 1 11 0 0 0 0 0 1 18 0 11 6 1 1 0 0 6 0 0 0 0 0 13 0 0 6 0 13 0 0 2 5 5 2 0 0 0 3 0 0 0 0 0 -1.2702 17 12 2 3 0 0 0 2 0 3 5 9 418.047 0 0 0 0 0 21 635 0 0 0 3 1 0 2 1 2 0 0 0 0 0 0 0 1 7 0 0 0 0 0 5 11 1 7 3 2 5 0 0 12 0 0 0 0 0 5 0 0 12 0 5 0 0 7 14 5 5 0 0 1 5 1 0 1 0 0 -2.7176 39 26 6 6 1 0 0.5 5.5 0.5 5.5 6 22 994.45 0.666 0.666 0 1.166 -5 39 1594 0 0 4 3 4 0 5 1 3 0 0 0 0 4 0 0 5 10 0 0 0 0 4 8 26 1 14 14 3 8 0 0 22 0 0 0 3 0 14 0 0 22 3 14 0 0 # -2.071 12.24 59.347 # CYS 160 Env_3ny8_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 78 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 26 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 1 0 0 0 0 1 0 0 0 0 0 -0.1268 4 3 0 1 0 0 0 0 0 1 1 3 105.035 0 0 0 0 0 4 95 0 0 3 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 3 0 1 3 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 0 8 2 0 0 0 0 0 1 0 0 0 -2.3133 12 9 2 1 0 0 1 2 0 0 9 2 272.236 0 0 0 0 5 41 176 0 0 1 0 0 0 0 0 0 0 0 0 0 4 0 0 0 2 5 0 0 0 4 0 8 0 6 6 0 0 0 0 12 0 0 0 0 0 0 0 0 12 0 0 0 0 6 5 9 2 0 0 0 3 2 1 0 0 0 -2.735 28 20 2 6 0 0 1 2 0 4 10 12 677.74 0.999 0.999 0 0.999 2 51 894 0 0 0 3 0 0 0 2 0 3 2 0 0 2 0 0 0 7 9 0 0 0 7 3 16 2 14 11 0 3 0 0 28 0 0 0 0 0 0 0 0 28 0 0 0 0 3 11 8 4 0 0 1 2 0 0 0 0 0 -2.2975 29 22 5 2 0 0 0 4 1 2 9 13 751.713 0 0 0 0 6 45 1219 0 0 0 0 0 0 0 1 0 6 6 0 1 1 0 0 0 7 6 1 0 0 15 0 13 1 22 7 0 0 0 0 29 0 0 0 0 0 0 0 0 29 0 0 0 0 # 6.567 8.51167 51.3953 # ASN 409 Env_3ny8_17 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 12 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 1 0 0 0 0 0 -0.3811 3 2 0 1 0 0 0 0 0 1 0 2 78.514 0 0 0 0 -1 1 53 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 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 2 1 0 1 0 0 0 0 0 1 0 0 0 0.0993 5 3 1 1 0 0 1 1 0 0 0 4 131.824 0 0 0 0 -2 2 111 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 5 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 2 5 0 3 0 0 0 3 0 1 0 0 0 -2.278 14 7 3 4 0 0 1 3 0 3 0 10 328.62 0 0 0 0 -5 6 512 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 6 2 0 0 5 0 0 6 0 8 0 6 8 0 0 0 0 13 0 0 0 1 0 0 0 0 13 1 0 0 0 2 8 0 2 0 0 0 3 0 2 0 0 0 -2.9736 17 10 2 5 0 0 2 2 0 3 0 9 432.17 0 0 0 0 -3 13 750 2 0 0 0 0 0 0 0 0 3 0 0 0 2 0 2 5 0 0 3 0 0 10 0 7 0 10 7 0 0 0 0 15 0 0 0 2 0 0 0 0 15 2 0 0 0 5 11 5 3 0 0 1 6 0 2 0 0 0 -3.9428 33 21 4 8 0 0 2 3 1 6 7 17 816.16 0 0 0 0 -4 44 915 2 0 0 0 0 0 0 0 0 4 0 0 0 4 1 6 6 2 5 3 0 0 14 0 19 0 16 17 0 0 0 0 31 0 0 0 2 0 0 0 0 31 2 0 0 0 # -1.984 -2.089 47.656 # SER 176 Env_3ny8_18 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 63 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 21 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 1 1 0 0 0 0 1 0 1 0 0 0 -0.7992 5 3 0 2 0 0 1 0 0 1 1 3 122.192 0 0 0 0 -1 10 79 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 3 2 0 0 2 0 3 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 1 4 1 2 0 0 0 1 0 0 1 0 0 -2.0347 10 6 2 1 1 0 0 2 0 1 2 3 247.429 0 0 0 0 3 20 84 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 0 1 0 2 4 0 0 6 1 3 0 6 3 0 1 0 0 7 0 0 0 3 0 0 0 0 7 3 0 0 0 5 6 8 1 0 0 1 3 0 0 0 0 0 -1.413 24 19 2 3 0 0 0 1 1 3 9 9 635.453 0 0 0 0 5 52 425 0 0 3 0 0 0 0 0 0 2 0 0 0 0 0 0 2 8 3 6 0 0 8 0 16 0 16 8 0 0 0 0 23 0 0 0 1 0 0 0 0 23 1 0 0 0 3 13 7 8 0 0 0 3 0 1 0 1 0 -5.7193 36 23 8 4 1 0 1.5 8 0 3 7 18 901.179 0 0 0 0 0 43 405 0 0 0 0 5 0 0 0 0 4 1 0 1 0 0 3 4 8 1 9 0 0 15 0 21 0 23 13 0 0 0 0 33 0 0 0 3 0 0 0 0 33 3 0 0 0 # 1.11367 9.40567 49.9877 # ASP 82 Env_3ny8_19 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 5 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 15 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 0 1 0 0 0 1 0 1 0 0 0 -0.8292 5 2 1 2 0 0 1 1 0 1 0 3 109.808 0 0 0 0 -3 3 47 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 2 0 0 1 0 0 1 0 4 0 1 4 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 3 5 0 2 0 0 0 4 0 1 0 0 0 -2.1506 15 8 2 5 0 0 1 2 0 4 0 12 359.487 0 0 0 0 -5 5 230 1 0 0 0 0 0 0 0 0 0 3 0 0 0 0 4 1 0 0 6 0 0 10 0 5 0 10 5 0 0 0 0 15 0 0 0 0 0 0 0 0 15 0 0 0 0 3 10 1 5 0 0 0 1 0 3 0 0 0 -3.3437 23 14 5 4 0 0 3 5 0 1 1 13 595.801 0 0 0 0 -5 18 309 1 0 0 0 2 0 0 0 0 1 1 0 0 1 0 10 1 1 0 5 0 0 9 0 14 0 10 13 0 0 0 0 22 0 0 0 1 0 0 0 0 22 1 0 0 0 6 14 3 6 0 0 1 8 0 0 0 0 0 -4.5552 38 23 7 8 0 0 0 6 1 8 4 23 941.174 0 0 0 0 -3 31 1206 2 0 0 2 2 0 0 1 0 2 3 0 0 4 0 8 5 4 0 5 0 0 16 2 19 1 20 16 0 2 0 0 36 0 0 0 2 0 0 0 0 36 2 0 0 0 # -2.285 1.52 45.718 # THR 87 Env_3ny8_20 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 27 138 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 6 0 0 0 0 0 0 0 0 6 0 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 69 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 3 0 0 0 0 0 0 0 0 3 0 0 0 0 1 3 2 2 0 0 0 1 1 1 0 0 0 -2.6474 11 6 2 3 0 0 1 2 0 1.5 2 6 258.144 0.333 0.333 0 0.333 -2 17 167 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 2 6 0 0 0 0 0 1 8 2 6 4 0 1 0 0 9 0 0 0 0 0 2 0 0 9 0 2 0 0 3 10 6 1 0 0 1 4 0 1 1 0 0 -2.3401 27 19 2 5 1 0 1.5 1.5 0.5 4 7 11 688.369 0.333 0.333 0 0.833 0 43 509 0 0 0 2 4 0 0 0 4 0 0 0 0 4 0 0 2 5 1 5 0 0 9 2 16 0 14 7 4 2 0 0 16 0 0 0 5 0 6 0 0 16 5 6 0 0 8 6 9 7 0 0 3 5 1 0 1 0 0 -4.3169 40 23 10 6 1 0 0.5 7.5 2.5 5.5 13 21 929.454 0.333 0.333 0 0.833 -9 55 984 3 0 0 3 6 0 0 2 3 0 0 0 0 5 0 1 3 7 3 4 0 0 12 3 23 2 19 15 3 3 0 0 34 0 0 0 2 0 4 0 0 34 2 4 0 0 # -0.197167 13.1233 54.4177 # TRP 78 Env_3ny8_21 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 2 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 4 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 3 0 0 0 0 0 0 0 0 0 0 0 -0.3087 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 3 4 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 1 0 0 3 0 0 0 3 0 0 0 0 0 2 0 0 0 1 0 0 0 0 2 1 0 0 0 2 4 2 1 0 0 0 3 1 0 0 1 0 -2.3801 14 8 1 4 1 0 0.5 1 0 3.5 2 6 330.448 0.666 0.666 0 0.666 -2 18 113 1 0 0 4 2 0 0 0 0 0 0 0 3 0 0 0 0 0 2 2 0 0 6 4 4 0 6 4 0 4 0 0 12 0 0 0 2 0 0 0 0 12 2 0 0 0 7 10 3 6 0 0 0 4 1 2 0 0 0 -4.245 33 20 6 7 0 0 2 6 0 4.5 4 20 809.609 0.333 0.333 0 0.333 -5 38 331 1 0 0 6 4 0 0 1 0 3 0 0 0 0 0 2 0 2 5 9 0 0 13 6 13 1 15 12 0 6 0 2 28 0 0 0 3 0 0 0 0 30 3 0 0 0 9 16 4 7 0 0 1 4 1 1 0 0 0 -2.0447 43 29 8 6 0 0 1 7 1 4.5 5 27 1121.77 0.666 0.666 0 0.666 -3 38 597 4 0 0 5 0 0 0 4 0 3 4 0 0 0 0 2 0 3 5 13 0 0 24 5 10 4 27 11 0 5 0 1 41 0 0 0 1 0 0 0 0 42 1 0 0 0 # 1.176 11.334 45.533 # MET 51 Env_3ny8_22 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 42 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 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 2 2 0 0 0 1 0 0 0 0 0 0 -0.9914 5 4 1 0 0 0 0 0 1 0 3 1 134.699 0 0 0 0 1 11 30 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 3 0 1 0 0 1 0 3 1 4 1 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 1 5 1 3 0 0 0 2 0 0 0 0 0 -2.5656 12 7 3 2 0 0 0 3 0 2 1 6 303.272 0 0 0 0 0 15 116 0 0 2 0 0 0 0 3 0 0 0 0 1 1 0 0 0 2 1 2 0 0 4 0 5 3 6 6 0 0 0 0 12 0 0 0 0 0 0 0 0 12 0 0 0 0 5 3 10 1 0 0 0 4 1 0 0 0 0 -1.8754 24 18 1 5 0 0 0 1 0 4.5 10 11 588.667 0.333 0.333 0 0.333 4 45 414 0 0 4 1 2 0 0 0 0 2 0 0 0 8 0 0 0 3 3 1 0 0 11 1 12 0 14 9 0 1 0 1 23 0 0 0 0 0 0 0 0 24 0 0 0 0 8 10 13 7 0 0 0 8 0 2 1 0 0 -6.1823 49 31 7 10 1 0 2 7 0 8 14 23 1143.08 0.333 0.333 0 0.333 2 73 796 0 0 7 2 4 0 0 0 0 2 3 0 2 13 0 1 0 4 7 4 0 0 24 2 23 0 28 19 0 2 0 5 41 0 0 0 3 0 0 0 0 46 3 0 0 0 # 5.7915 6.6145 45.8275 # TRP 383 Env_3ny8_23 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 462 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 6 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.2779 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 3 110 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 1 3 1 0 0 0 0 1 0 0 0 0 0 -0.0855 6 5 0 1 0 0 0 0 0 1 1 3 172.055 0 0 0 0 1 7 305 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 2 0 1 0 0 0 3 0 3 0 3 3 0 0 0 0 2 0 0 0 0 0 4 0 0 2 0 4 0 0 3 4 4 3 0 0 0 2 0 4 0 0 0 -4.0194 20 11 3 6 0 0 4 3 0 2 5 9 455.808 0 0 0 0 -4 36 736 0 0 0 2 0 0 0 0 0 0 0 0 0 5 0 0 5 0 7 1 0 0 6 2 12 0 6 12 0 2 0 0 7 0 0 0 3 0 10 0 0 7 3 10 0 0 5 7 5 1 0 0 0 3 0 1 0 0 0 -1.2804 22 17 1 4 0 0 1 1 0 3 7 6 566.058 0 0 0 0 5 50 585 0 0 3 1 0 0 0 0 0 2 0 0 0 2 0 0 4 0 9 1 0 0 5 1 16 0 5 16 0 1 0 0 14 0 0 0 5 0 3 0 0 14 5 3 0 0 # 0.227833 4.4515 56.3758 # PHE 162