# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3nxo # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/3nxo_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_3nxo_0 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 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 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 4 0 0 0 0 0 0 4 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 3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 2 0 0 3 0 1 0 3 1 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 3 4 3 1 2 0 0 4 1 0 0 0 0 -3.1024 18 10 3 5 0 0 0 1.5 1.5 4.5 2 10 427.449 0.999 0.333 0.666 0.999 -4 29 304 0 3 0 0 0 0 4 0 0 0 2 0 0 3 0 0 2 0 2 2 0 0 7 7 4 0 7 4 3 4 0 0 0 0 0 18 0 0 0 0 0 0 18 0 0 0 3 14 3 4 1 0 0 1 0 2 0 0 0 -3.1283 28 20 5 3 0 0 2 4.5 0.5 1 4 11 744.214 0.666 0.333 0.333 0.666 2 49 477 0 5 0 0 0 0 4 0 0 1 2 0 0 3 0 0 3 0 3 7 0 0 13 9 6 0 13 6 5 4 0 0 0 0 0 25 0 0 3 0 0 0 25 3 0 0 5 17 7 4 0 0 0 5 1 0 0 0 0 -4.3853 39 29 4 6 0 0 0 4 0 5.5 7 19 1039.14 0.333 0.333 0 0.333 9 48 539 3 2 0 0 1 0 1 0 0 3 5 1 0 8 0 0 1 0 5 9 0 0 28 4 7 0 28 7 3 1 0 0 0 0 0 34 0 0 5 0 0 0 34 5 0 0 # 25.545 8.294 7.264 # VAL 135 Env_3nxo_1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 -0.0518 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 6 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 0 2 1 1 0 0 0 0 0 0 0 0 0 -0.6475 4 3 1 0 0 0 0 1 0 0 1 2 107.678 0 0 0 0 1 5 3 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 3 0 0 0 0 1 0 3 0 4 0 0 0 0 0 3 0 0 1 0 0 0 0 0 3 1 0 0 0 3 8 3 1 0 0 0 3 0 0 0 0 0 -1.1963 18 14 1 3 0 0 0 1 0 3 3 8 484.908 0 0 0 0 5 23 187 0 0 0 0 0 0 0 1 0 2 0 0 4 0 0 0 4 5 0 2 0 0 8 0 9 1 13 5 0 0 0 0 9 0 0 6 0 2 1 0 0 9 8 1 0 0 5 13 3 5 0 0 0 6 0 1 0 0 0 -3.3108 33 21 5 7 0 0 1 5 0 6 3 18 820.676 0 0 0 0 -2 34 277 0 0 3 0 0 0 0 4 0 4 5 0 0 1 0 0 3 4 0 9 0 0 19 0 10 4 23 10 0 0 0 0 8 0 0 20 0 1 4 0 0 8 21 4 0 0 6 15 1 9 0 0 1 4 0 1 0 0 1 -6.0938 38 22 10 6 0 0 1 9 1 4 2 26 962.962 0 0 0 0 -8 26 1058 1 1 4 0 0 0 0 3 0 4 5 6 0 1 0 2 0 2 0 8 0 1 19 7 8 4 21 9 7 0 1 0 11 0 0 10 0 3 14 0 0 11 13 14 0 0 # 15.247 10.155 -7.777 # MET 52 Env_3nxo_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 7 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 21 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 1 1 2 0 0 2 0 0 0 0 0 -1.7306 10 5 3 2 0 0 0 1.5 1.5 2 0 4 236.752 0.666 0 0.666 0.666 -3 24 254 0 3 1 0 0 0 0 0 0 0 4 1 0 0 1 0 0 0 0 0 0 0 5 4 1 0 5 1 4 0 0 0 0 0 0 1 1 4 4 0 0 0 6 4 0 0 1 5 0 2 1 0 0 3 0 0 0 0 0 -4.279 12 6 3 3 0 0 0 2.5 0.5 3 0 5 295.898 0.333 0 0.333 0.333 -4 21 528 0 3 3 0 0 1 0 0 0 0 0 2 0 0 2 0 0 0 0 1 0 0 3 5 4 0 3 4 5 0 0 0 1 0 0 3 2 6 0 0 0 1 11 0 0 0 4 10 2 3 0 0 0 2 0 0 0 0 0 -0.582 21 16 3 2 0 0 0 3 0 2 2 9 574.65 0 0 0 0 5 31 752 0 6 2 0 0 2 0 1 0 1 0 2 1 2 2 0 0 0 0 2 0 0 8 8 4 1 8 5 8 0 0 0 4 0 0 4 3 9 1 0 0 4 16 1 0 0 3 15 6 5 0 0 0 1 0 2 1 0 0 -4.3298 33 24 5 3 1 0 2 5 0 1 6 12 915.612 0 0 0 0 8 55 952 0 3 4 0 0 1 0 2 0 6 0 1 1 3 2 0 3 3 0 4 0 0 16 4 11 2 19 10 4 0 0 0 10 0 0 8 3 7 5 0 0 10 18 5 0 0 # 10.21 12.095 -3.508 # LEU 67 Env_3nxo_3 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 55 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 -0.3054 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 416 0 0 1 1 0 0 0 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 1 0 4 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 2 -0.5679 3 1 0 2 0 0 0 0 0 1 0 1 56.498 0 0 0 0 -1.5 0 133 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 1 2 0 1 0 0 2 0 0 0 0 0 1 0 2 0 0 0 1 2 0 0 2 4 0 1 0 0 0 2 0 0 0 0 3 -0.0826 12 8 1 3 0 0 0 1 0 2 0 7 316.699 0 0 0 0 -2 2 911 0 0 2 4 0 0 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 3 0 6 3 3 0 3 2 4 3 0 1 0 6 0 2 0 3 0 0 1 8 3 0 0 2 4 0 2 0 0 0 1 1 1 0 0 3 -1.9063 14 8 2 4 0 0 1 2 0 1.5 0 7 337.705 0.666 0.666 0 0.666 -4 8 846 0 0 1 2 0 0 0 2 0 0 1 3 0 0 0 2 0 0 0 0 0 3 1 5 3 5 1 5 3 2 3 0 3 0 3 2 1 1 4 0 0 3 7 4 0 0 5 6 0 3 0 0 0 4 3 1 0 0 3 -4.4568 25 11 4 10 0 0 1 3 0 5.5 0 10 538.12 1.332 1.332 0 1.332 -10 29 2184 0 0 3 4 0 0 0 2 0 0 2 5 0 2 0 3 1 0 0 0 0 3 4 9 7 5 4 9 5 4 3 0 9 0 3 3 3 2 5 0 0 9 11 5 0 0 # 17.817 -1.933 -7.841 # GLY 20 Env_3nxo_4 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 8 156 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.204 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 52 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0142 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 52 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 2 5 1 3 1 0 0 2 0 0 0 0 0 -1.6611 14 8 4 2 0 0 0 3 1 2 1 7 347.069 0 0 0 0 -2 19 1444 0 5 3 0 0 0 0 0 0 1 0 0 0 1 4 0 0 0 0 0 0 0 6 5 3 0 6 3 5 0 0 0 1 0 0 0 0 8 5 0 0 1 8 5 0 0 2 8 3 1 1 0 0 2 0 0 0 0 0 -1.6575 17 13 2 2 0 0 0 1.5 0.5 2 2 8 470.275 0.666 0 0.666 0.666 2 29 1807 0 7 0 0 0 1 0 0 0 3 1 0 0 2 3 0 0 0 0 0 0 0 9 7 1 0 9 1 7 0 0 0 3 0 0 0 0 9 5 0 0 3 9 5 0 0 4 7 3 3 1 0 0 3 0 0 0 0 0 -1.3482 21 14 4 3 0 0 0 3.5 0.5 3 3 11 530.622 0.333 0 0.333 0.333 1 27 1357 0 4 0 0 0 1 4 0 0 4 3 0 0 3 2 0 0 0 0 0 0 0 12 8 1 0 12 1 4 4 0 0 4 0 0 0 0 11 6 0 0 4 11 6 0 0 # 6.65867 5.34333 -2.922 # ASN 64 Env_3nxo_5 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 11 135 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 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 -0.0644 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 45 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 1 0 2 0 0 0 0 0 0 0 0 -1.8389 5 3 2 0 0 0 0 1 1 0 1 1 142.399 0.666 0 0.666 0.666 0 18 198 0 2 0 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 2 2 0 1 2 2 0 0 0 3 0 0 0 0 2 0 0 0 3 2 0 0 0 1 1 5 1 0 0 0 2 0 0 0 0 0 -1.195 10 7 1 2 0 0 0 1 0 2 4 4 230.808 0.333 0 0.333 0.333 2 23 497 0 1 0 0 0 3 0 0 0 0 1 0 0 5 0 0 0 0 0 0 0 0 6 1 3 0 6 3 1 0 0 0 8 0 0 0 0 1 1 0 0 8 1 1 0 0 3 7 5 3 1 0 0 2 0 2 0 0 0 -3.4056 23 15 4 4 0 0 2 3 1 2 5 9 586.405 0 0 0 0 1 36 1161 0 3 1 0 0 0 0 0 0 0 5 2 0 10 0 0 2 0 0 0 0 0 15 5 3 0 15 3 5 0 0 0 13 0 0 0 2 3 5 0 0 13 5 5 0 0 4 13 2 4 0 0 0 3 0 0 0 0 0 -1.3887 26 19 4 3 0 0 0 4 0 3 2 15 700.811 0 0 0 0 1 21 2016 0 6 2 0 0 0 0 0 0 0 2 4 0 5 0 0 6 0 1 0 0 0 7 10 9 0 7 9 10 0 0 0 17 0 0 0 4 3 2 0 0 17 7 2 0 0 # 9.105 10.0283 1.34933 # GLN 35 Env_3nxo_6 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 45 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 15 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 1 2 0 0 0 0 0 1 0 0 0 0 0 0.0503 4 3 0 1 0 0 0 0 0 1 0 3 112.024 0 0 0 0 0 1 60 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 5 2 2 0 0 0 0 0 1 0 0 0 -2.0663 10 7 2 1 0 0 1 2 0 0 2 3 266.023 0 0 0 0 2 14 277 1 0 0 0 0 0 1 0 0 0 0 0 0 4 0 0 3 0 1 0 0 0 5 1 4 0 5 4 0 1 0 0 5 0 0 5 0 0 0 0 0 5 5 0 0 0 5 9 7 3 0 0 0 4 0 0 0 0 0 -2.3336 28 21 3 4 0 0 0 3 0 4 8 15 718.359 0 0 0 0 5 37 703 2 0 2 0 0 0 0 0 0 1 3 0 0 8 0 0 1 0 9 2 0 0 16 0 12 0 16 12 0 0 0 0 14 0 0 11 0 0 3 0 0 14 11 3 0 0 8 10 14 7 0 0 1 4 1 1 0 0 1 -4.3502 47 32 9 6 0 0 1 7 1 4.5 16 22 1148.72 0.333 0.333 0 0.333 3 77 1566 2 5 2 0 0 1 1 0 0 3 5 0 0 7 0 0 3 4 9 4 0 1 21 6 19 1 25 15 5 1 1 0 17 0 0 20 0 4 6 0 0 17 24 6 0 0 # 16.4923 4.981 6.637 # GLU 30 Env_3nxo_7 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 8 354 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 1 118 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 1 0 0 0 0 0 0 0 0 0 0.159 3 2 1 0 0 0 0 1 0 0 0 3 81.157 0 0 0 0 -1 0 325 0 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 2 0 0 1 0 0 2 0 0 0 0 2 0 0 0 1 0 0 0 2 1 0 0 1 1 0 1 0 0 0 3 0 0 0 0 0 -1.6886 6 2 1 3 0 0 0 1 0 3 0 6 115.639 0 0 0 0 -4 0 524 0 0 0 2 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 2 0 2 2 2 0 2 0 0 0 0 2 0 2 0 2 0 0 0 4 2 0 0 1 4 0 0 0 0 0 2 0 0 0 0 1 -0.7543 8 5 0 3 0 0 0 0 0 2 0 4 202.032 0 0 0 0 0 6 602 0 0 1 0 0 0 0 1 0 0 4 1 0 0 0 0 0 0 0 0 0 1 4 1 1 2 4 2 1 0 1 0 0 0 1 0 2 0 5 0 0 0 3 5 0 0 3 9 0 3 0 0 0 2 0 0 0 0 0 -0.6361 17 12 3 2 0 0 0 3 0 2 0 11 467.519 0 0 0 0 -1 9 1210 0 0 3 0 0 0 0 1 0 0 1 2 0 0 5 4 0 1 0 0 0 0 6 2 8 1 7 8 2 0 0 0 4 0 2 0 4 3 4 0 0 4 9 4 0 0 # 13.7143 -3.53233 -3.525 # ASP 21 Env_3nxo_8 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 3 0 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 0 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 3 0 0 0 0 0 0 3 0 0 0 1 0 2 1 0 0 0 0 1 0 0 0 0 -0.9329 5 3 1 1 0 0 0 1 0 0.5 2 2 114.826 0.333 0.333 0 0.333 0 11 53 0 0 0 0 0 0 1 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 2 1 2 0 2 2 0 1 0 0 1 0 0 4 0 0 0 0 0 1 4 0 0 0 3 5 3 1 0 0 0 4 1 0 0 0 0 -2.0975 17 11 1 5 0 0 0 1 0 4.5 3 10 403.02 0.666 0.666 0 0.666 -1 19 272 2 1 0 0 0 0 3 0 0 0 0 1 0 2 0 0 1 0 2 5 0 0 9 5 3 0 9 3 2 3 0 0 5 0 0 12 0 0 0 0 0 5 12 0 0 0 5 8 8 6 0 0 0 2 0 1 0 0 0 -2.8616 30 21 6 3 0 0 1 6 0 2 9 14 753.892 0 0 0 0 5 48 397 2 1 0 0 0 0 3 0 0 2 0 1 0 8 0 0 0 0 8 5 0 0 17 5 8 0 17 8 2 3 0 0 8 0 0 22 0 0 0 0 0 8 22 0 0 0 7 21 2 3 0 0 0 4 0 0 0 0 0 -0.9861 37 30 3 4 0 0 0 3 0 4 3 21 1060.84 0 0 0 0 8 31 646 1 4 0 0 0 0 5 0 0 6 0 2 0 6 0 0 0 0 8 5 0 0 18 11 8 0 18 8 6 5 0 0 7 0 0 30 0 0 0 0 0 7 30 0 0 0 # 19.722 6.514 8.246 # THR 136 Env_3nxo_9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 6 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 1 2 0 0 0 1 0 0 0 0 0 0 -0.8295 4 3 1 0 0 0 0 0 1 0 3 0 101.189 0 0 0 0 1 10 19 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 0 3 0 4 0 0 0 0 0 3 0 0 0 0 0 1 0 0 3 0 1 0 0 1 8 0 1 0 0 0 2 0 0 0 0 0 -1.2116 12 9 1 2 0 0 0 1 0 2 0 7 338.715 0 0 0 0 1 9 403 2 3 0 0 0 1 0 1 0 0 0 0 0 0 1 0 0 3 0 1 0 0 4 3 4 1 7 2 3 0 0 0 3 0 0 1 2 1 5 0 0 3 4 5 0 0 7 15 0 7 1 0 0 5 0 0 1 0 0 -2.4616 36 22 8 5 1 0 0 7 1 5 0 20 927.818 0 0 0 0 -2 33 991 1 4 4 0 0 1 0 3 1 1 1 0 3 1 12 0 0 2 0 2 0 0 21 4 8 3 23 8 5 0 0 0 3 0 0 9 4 6 14 0 0 3 19 14 0 0 4 10 7 6 2 0 0 9 0 0 0 0 0 -7.2682 38 21 8 9 0 0 0 7 1 9 6 23 890.321 0.999 0 0.999 0.999 -6 49 1631 1 4 5 0 0 2 0 1 0 4 5 1 1 8 2 0 2 0 0 2 0 0 23 5 9 1 23 10 5 0 0 0 10 0 0 13 2 6 7 0 0 10 21 7 0 0 # 11.3562 10.468 -11.0452 # TRP 57 Env_3nxo_10 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 7 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 -2.2547 3 0 3 0 0 0 0 1 2 0 0 0 69.437 0.666 0 0.666 0.666 -3 16 21 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 2 0 1 0 0 0 1 0 1 0 0 0 -2.2677 5 2 1 2 0 0 1 1 0 1 0 1 120.1 0 0 0 0 -2 10 275 0 1 0 0 0 1 0 0 0 0 1 1 0 0 0 0 1 0 0 0 0 0 1 2 2 0 1 2 2 0 0 0 2 0 0 0 1 1 1 0 0 2 2 1 0 0 3 11 0 2 0 0 0 3 0 1 0 0 0 -1.8022 20 14 2 4 0 0 1 2 0 3 0 10 536.122 0 0 0 0 0 23 932 0 2 0 0 0 4 0 0 0 0 6 3 0 0 0 0 5 0 0 0 0 0 6 5 9 0 6 9 5 0 0 0 9 0 0 0 3 2 6 0 0 9 5 6 0 0 3 9 3 4 0 0 0 3 0 0 0 0 0 -2.5122 22 15 4 3 0 0 0 4 0 3 3 13 572.713 0 0 0 0 1 21 633 0 2 0 0 0 4 0 4 0 0 1 1 0 4 0 0 5 0 0 1 0 0 6 3 9 4 6 13 3 0 0 0 13 0 0 1 5 2 1 0 0 13 8 1 0 0 6 4 5 5 0 0 0 5 0 0 0 0 0 -2.269 25 15 5 5 0 0 0 5 0 5 5 14 587.279 0 0 0 0 -2 31 1135 0 5 4 0 0 0 0 0 0 1 0 1 0 6 2 0 4 0 0 2 0 0 11 6 8 0 11 8 6 0 0 0 12 0 0 6 1 5 1 0 0 12 12 1 0 0 # 9.816 13.332 -0.334 # ARG 70 Env_3nxo_11 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.8386 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 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 4 0 0 0 0 0 0 4 0 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 19 0 0 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 1 0 1 0 0 4 0 2 0 5 1 0 0 0 0 0 0 0 5 0 0 1 0 0 0 5 1 0 0 1 7 2 2 0 0 0 2 0 0 0 1 0 -2.6941 15 10 2 2 1 0 0.5 2 0 2 2 8 398.905 0 0 0 0 0 14 55 1 0 1 0 4 0 0 1 0 2 0 0 0 0 0 0 0 2 2 2 0 0 5 0 9 1 7 8 0 0 0 0 4 0 0 9 0 0 2 0 0 4 9 2 0 0 6 14 1 5 0 0 0 3 0 1 0 0 0 -2.4035 30 21 5 4 0 0 1 5 0 3 2 17 800.172 0 0 0 0 2 33 176 0 0 2 0 1 0 0 2 0 7 2 0 0 0 0 0 0 2 5 9 0 0 18 0 10 2 20 10 0 0 0 0 9 0 0 16 0 0 5 0 0 9 16 5 0 0 6 20 4 3 0 0 0 6 0 0 0 0 0 -3.8442 39 30 3 6 0 0 0 3 0 6 4 21 1082.78 0 0 0 0 9 40 275 3 0 1 0 1 0 0 3 0 5 8 0 3 0 0 0 0 2 5 8 0 0 27 0 9 3 29 10 0 0 0 0 12 0 0 22 0 0 5 0 0 12 22 5 0 0 # 22.786 14.211 -3.266 # ILE 114 Env_3nxo_12 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 29 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 87 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 1 0 2 0 0 0 1 0 0 0 0 3 -0.2299 9 5 2 2 0 0 0 2 0 1 0 6 218.812 0 0 0 0 -3 0 96 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 2 0 0 0 0 3 0 0 2 7 0 6 0 0 3 0 2 0 0 0 0 0 7 0 0 2 0 7 0 0 2 4 0 3 0 0 0 4 0 0 0 0 11 -2.4647 24 10 4 8 0 2 0 3 0 4 0 12 541.06 0 0 0 0 -9 1 612 0 0 0 0 0 0 0 6 0 0 0 3 1 0 0 0 1 1 0 1 0 11 2 3 2 17 3 7 3 0 11 0 5 0 0 5 0 0 14 0 0 5 5 14 0 0 4 5 0 3 0 0 0 2 0 1 1 0 8 -0.5182 24 13 3 7 1 0 1 3 0 2 0 11 590.683 0 0 0 0 -5 9 734 0 0 0 0 0 0 0 2 0 0 0 5 4 0 0 3 0 1 0 1 0 8 5 5 4 10 6 5 5 0 8 0 9 0 0 4 0 0 11 0 0 9 4 11 0 0 2 13 2 4 0 1 0 3 0 1 0 0 4 -4.3755 30 19 5 6 0 0 1 4 1 3 3 12 774.466 1 0 1 1 3 40 1003 0 0 0 0 0 0 0 0 0 3 0 4 2 1 0 3 0 3 4 6 0 4 12 4 10 4 15 7 4 0 4 0 17 0 0 4 0 1 8 0 0 17 5 8 0 0 # 19.72 6.065 -7.237 # THR 56 Env_3nxo_13 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 77 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 4 308 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 -0.5319 6 3 1 2 0 0 0 1 0 2 0 6 137.655 0 0 0 0 -3 0 342 0 0 0 0 0 0 1 0 0 3 0 0 0 0 2 0 0 0 0 0 0 0 5 1 0 0 5 0 0 1 0 0 0 0 0 0 0 4 2 0 0 0 4 2 0 0 2 3 0 1 0 0 0 2 0 0 0 0 0 -0.6605 8 5 1 2 0 0 0 1 0 2 0 3 191.744 0 0 0 0 0 9 330 0 0 3 0 0 0 0 0 0 3 0 0 0 0 0 2 0 0 0 0 0 0 3 0 5 0 3 5 0 0 0 0 2 0 0 0 0 6 0 0 0 2 6 0 0 0 3 9 0 4 1 0 0 2 0 0 0 0 0 -2.3173 19 12 5 2 0 0 0 4.5 0.5 2 0 12 516.377 0.333 0 0.333 0.333 -3 18 2300 0 9 4 0 0 0 3 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 2 12 5 0 2 5 9 3 0 0 2 0 0 0 0 15 2 0 0 2 15 2 0 0 1 7 1 1 2 0 0 3 0 1 0 0 0 -2.4595 16 9 3 4 0 0 1 1 2 3 0 6 395.593 0.333 0 0.333 0.333 -3 27 1085 0 7 1 0 0 0 2 0 0 1 0 0 0 1 0 3 0 1 0 0 0 0 2 9 5 0 3 4 7 2 0 0 5 0 0 0 0 5 6 0 0 5 5 6 0 0 # 8.4446 2.2844 -5.8456 # PRO 61 Env_3nxo_14 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 3 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.8386 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 12 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 4 0 0 0 0 0 0 4 0 0 0 2 1 1 1 0 0 0 2 0 0 0 0 0 -0.6616 7 4 1 2 0 0 0 1 0 2 1 5 164.176 0 0 0 0 -1 7 25 0 0 0 0 2 0 0 0 0 3 0 0 0 0 0 0 0 1 0 1 0 0 4 0 3 0 5 2 0 0 0 0 0 0 0 7 0 0 0 0 0 0 7 0 0 0 1 5 5 0 0 0 0 2 0 0 0 0 0 -1.3671 13 11 0 2 0 0 0 0 0 2 5 6 350.711 0 0 0 0 5 24 97 0 0 0 0 1 0 0 0 0 1 0 0 0 6 0 0 1 3 0 1 0 0 8 0 5 0 11 2 0 0 0 0 3 0 0 10 0 0 0 0 0 3 10 0 0 0 3 11 8 4 0 0 0 2 0 1 0 0 0 -2.0681 29 22 4 3 0 0 1 4 0 2 8 11 754.233 0 0 0 0 7 41 262 0 0 3 0 2 0 0 0 0 1 0 0 1 7 0 0 1 4 2 8 0 0 17 0 12 0 21 8 0 0 0 0 7 0 0 18 0 0 4 0 0 7 18 4 0 0 9 12 10 5 0 0 1 7 0 3 0 1 1 -6.4267 49 31 7 10 1 0 3.5 5 1 7 13 25 1193.98 0 0 0 0 -4 75 459 1 0 2 0 1 0 0 0 0 3 3 1 4 9 0 0 5 5 7 7 0 1 27 1 20 1 32 15 1 0 1 0 20 0 0 25 0 0 4 0 0 20 25 4 0 0 # 19.765 11.684 3.028 # ILE 7 Env_3nxo_15 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 12 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 48 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 -0.357 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 46 1 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 5 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 5 0 0 0 2 2 6 0 0 0 0 2 0 1 0 0 2 -1.659 15 11 1 3 0 0 1 0 0 2 7 5 362.085 0 0 0 0 2.5 33 122 3 0 0 0 0 0 0 0 0 1 0 0 0 5 0 0 0 0 4 0 0 2 9 0 4 2 9 4 0 0 2 0 4 0 0 5 0 0 6 0 0 4 5 6 0 0 3 15 5 4 0 0 0 1 0 0 0 0 3 -2.1602 31 25 4 2 0 0 0 4 0 1 5 10 876.399 0 0 0 0 12 35 145 1 0 0 0 3 0 0 0 0 6 0 0 0 4 0 0 1 0 3 10 0 3 21 0 7 3 21 7 0 0 3 0 3 0 0 22 0 0 6 0 0 3 22 6 0 0 4 16 0 3 0 0 0 4 0 1 0 1 2 -2.8357 31 22 3 5 1 0 1.5 3 0 4 0 18 869.285 0 0 0 0 -1 18 160 0 0 0 0 2 0 0 2 0 5 2 0 0 5 1 0 5 0 1 6 0 2 19 0 8 4 19 10 0 0 2 0 1 0 0 20 0 0 10 0 0 1 20 10 0 0 # 23.274 7.223 2.05 # VAL 8 Env_3nxo_16 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 16 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 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 32 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 2 0 1 1 0 0 0 1 0 0 0 0 0 -0.0492 5 3 1 1 0 0 0 1 0 1 1 4 119.172 0 0 0 0 -1 5 56 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 2 0 0 4 0 1 0 5 0 0 0 0 0 0 0 0 4 0 1 0 0 0 0 5 0 0 0 2 8 2 0 0 0 1 2 2 1 0 0 3 -2.5512 21 13 2 6 0 0 1 0 1 3 3 6 517.408 0.999 0.999 0 0.999 -2.5 37 122 0 0 0 0 0 0 4 0 0 2 0 0 0 0 0 0 6 3 0 3 0 3 5 4 9 3 8 6 0 4 3 0 4 0 0 11 0 3 3 0 0 4 14 3 0 0 1 8 4 4 0 0 0 1 0 0 0 0 1 -2.6271 19 14 4 1 0 0 0 4 0 1 4 6 503.284 0 0 0 0 6.5 28 249 0 1 0 0 0 0 1 0 0 2 1 0 0 0 0 0 1 4 0 8 0 1 11 2 5 1 15 1 1 1 1 0 1 0 0 12 0 4 2 0 0 1 16 2 0 0 5 18 2 1 0 0 0 7 0 0 0 0 2 -3.974 35 27 1 7 0 0 0 1 0 7 2 19 979.445 0 0 0 0 7 27 632 0 3 0 0 0 0 3 1 0 10 4 0 0 2 0 2 0 1 2 5 0 2 21 6 5 3 22 5 3 3 2 0 4 0 0 24 0 1 6 0 0 4 25 6 0 0 # 19.806 3.619 4.694 # ALA 9 Env_3nxo_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 57 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 1 114 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 1 0 2 0 0 0 2 0 0 0 0 0 -0.8114 7 3 2 2 0 0 0 2 0 2 0 7 151.792 0 0 0 0 -4 0 278 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 3 0 0 0 0 0 1 0 6 0 1 6 0 0 0 0 6 0 0 0 0 1 0 0 0 6 1 0 0 0 3 4 0 2 0 0 0 3 0 0 0 0 4 -0.609 16 10 2 4 0 0 0 2 0 3 0 9 409.35 0 0 0 0 -2.5 5 637 0 0 0 0 0 0 0 1 0 2 0 2 0 1 0 0 3 3 0 0 0 4 3 2 6 5 6 4 2 0 4 0 9 0 0 0 1 2 4 0 0 9 3 4 0 0 2 7 0 2 0 0 0 2 0 1 0 0 8 -1.7418 22 14 3 5 0 0 1 2 0 2 0 11 574.684 0 0 0 0 -3.5 6 942 0 0 0 2 0 0 0 2 0 4 0 1 0 3 0 0 1 1 0 0 0 8 7 3 2 10 8 3 1 2 8 0 6 0 2 0 2 4 8 0 0 6 8 8 0 0 2 8 0 4 0 0 0 4 1 0 1 0 4 -3.984 24 12 4 7 1 0 0 4 0 4.5 0 10 568.29 0.333 0.333 0 0.333 -2 18 1567 0 0 0 4 0 0 0 2 0 1 3 4 1 1 2 0 0 1 0 1 0 4 9 8 1 6 10 2 4 4 4 0 6 0 4 2 1 1 10 0 0 6 8 10 0 0 # 15.615 3.262 -6.592 # SER 59 Env_3nxo_18 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 89 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 2 267 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 3 0 1 0 0 0 1 0 0 0 0 0 -0.4937 7 5 1 1 0 0 0 1 0 1 0 4 193.181 0 0 0 0 0 7 500 0 0 0 1 0 0 0 0 0 0 4 0 0 0 2 0 0 0 0 0 0 0 6 1 0 0 6 0 0 1 0 0 0 0 1 0 0 2 4 0 0 0 3 4 0 0 1 2 5 1 0 0 1 2 1 0 0 0 0 -2.4029 13 8 2 3 0 0 0 1 1 2.5 6 6 287.15 0.333 0.333 0 0.333 -2 24 475 0 0 0 3 0 0 0 0 0 0 0 0 0 0 1 0 0 9 0 0 0 0 1 3 9 0 10 0 0 3 0 0 0 0 3 0 0 10 0 0 0 0 13 0 0 0 4 6 3 2 0 0 0 3 0 0 0 0 3 -0.538 21 14 2 5 0 0 0 2 0 3 3 10 520.986 0.333 0.333 0 0.333 0.5 22 719 0 0 0 3 0 0 0 1 0 2 0 0 0 0 7 0 0 5 0 0 0 3 9 3 5 4 14 1 0 3 3 0 0 0 3 3 0 9 6 0 0 0 15 6 0 0 3 10 0 4 0 0 0 3 1 0 0 0 7 -2.6705 28 17 6 5 0 0 0 4 0 3.5 0 14 714.605 0.333 0.333 0 0.333 -5 10 1246 2 0 0 1 0 0 0 4 0 1 1 4 0 0 8 0 0 0 0 0 0 7 12 5 0 11 12 4 4 1 7 0 0 0 5 5 2 0 16 0 0 0 12 16 0 0 # 16.772 -1.351 0.256 # LEU 22 Env_3nxo_19 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 72 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 6 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 6 0 0 0 0 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 36 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 2 10 0 4 0 0 0 2 0 0 0 0 0 -2.0288 18 12 4 2 0 0 0 4 0 2 0 9 481.656 0 0 0 0 2 14 217 3 0 0 0 0 0 0 1 0 4 1 0 0 0 3 1 0 3 0 2 0 0 13 0 4 1 16 2 0 0 0 0 0 0 0 11 0 6 1 0 0 0 17 1 0 0 5 14 3 1 0 0 0 4 0 1 0 0 1 -1.643 29 22 1 6 0 0 1 1 0 4 3 17 799.075 0 0 0 0 2 25 778 1 0 0 0 0 0 0 1 0 5 6 0 0 4 4 3 0 2 0 2 0 1 22 0 5 2 24 4 0 0 1 0 0 0 0 12 0 6 11 0 0 0 18 11 0 0 2 11 3 8 0 0 0 6 1 1 0 0 3 -7.7907 35 18 9 8 0 0 1 8 0 6.5 3 19 809.704 0.333 0.333 0 0.333 -6 31 874 1 0 0 0 0 2 1 4 0 6 3 0 0 5 3 3 1 0 0 3 0 3 21 1 6 7 21 10 0 1 3 0 1 0 0 17 1 1 15 0 0 1 19 15 0 0 # 20.2368 -1.1435 3.85333 # TRP 24 Env_3nxo_20 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 16 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 0 0 1 0 0 0 0 1 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.7258 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 4 48 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 3 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 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 50 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 3 0 0 4 0 0 1 4 1 0 0 0 0 0 0 0 1 0 0 4 0 0 0 1 4 0 0 0 4 2 0 0 0 0 4 0 1 0 0 0 -3.4779 11 6 0 5 0 0 1 0 0 4 2 6 250.215 0 0 0 0 -1 18 85 0 0 0 0 0 0 0 1 0 5 0 0 1 2 0 0 0 1 1 0 0 0 8 0 2 1 9 2 0 0 0 0 3 0 0 7 0 0 1 0 0 3 7 1 0 0 6 17 3 4 0 0 0 1 0 0 1 0 2 -1.3387 34 28 4 1 1 0 0 4 0 1 4 15 998.945 0 0 0 0 12 42 142 0 0 0 0 0 0 0 2 0 10 1 0 5 2 0 0 2 3 2 5 0 2 23 0 7 4 26 6 0 0 2 0 6 0 0 23 0 0 5 0 0 6 23 5 0 0 2 9 7 5 0 0 0 2 0 2 0 0 3 -3.1697 30 20 6 4 0 0 2 5 0 2 7 11 745.575 0 0 0 0 3 37 217 0 0 1 0 2 0 0 2 0 4 1 0 1 2 0 0 4 4 2 4 0 3 12 0 13 5 16 11 0 0 3 0 8 0 0 17 0 0 5 0 0 8 17 5 0 0 # 17.919 10.891 -2.51 # VAL 115 Env_3nxo_21 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 564 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 94 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 2 2 1 1 0 0 0 2 0 0 0 0 0 -0.4244 8 5 1 2 0 0 0 1 0 2 1 4 184.755 0 0 0 0 -1 12 608 0 1 0 0 0 3 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 4 1 3 0 4 3 1 0 0 0 8 0 0 0 0 0 0 0 0 8 0 0 0 0 1 4 2 4 0 0 0 1 0 0 0 0 0 -3.2066 12 7 4 1 0 0 0 4 0 1 2 6 303.276 0 0 0 0 -1 15 733 0 2 1 0 0 4 1 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 4 3 5 0 4 5 2 1 0 0 11 0 0 0 0 1 0 0 0 11 1 0 0 0 5 5 3 2 1 0 0 5 1 0 0 0 0 -3.0799 22 13 3 6 0 0 0 2.5 0.5 5.5 3 12 526.042 0.666 0.333 0.333 0.666 -3 33 1341 0 7 2 0 0 1 2 0 0 0 2 0 0 7 0 0 0 0 1 0 0 0 9 9 4 0 9 4 7 2 0 0 17 0 0 0 0 3 2 0 0 17 3 2 0 0 # 9.85033 5.70217 2.141 # PHE 31 Env_3nxo_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 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 18 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 1 0 0 0 0 0 0 0 0 0 0 -0.1475 2 2 0 0 0 0 0 0 0 0 1 0 60.031 0 0 0 0 2 7 5 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 0 1 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 1 6 3 1 0 0 0 2 0 0 0 0 0 -2.0758 13 10 1 2 0 0 0 1 0 2 3 4 351.258 0 0 0 0 5 27 142 0 0 1 0 0 0 0 0 0 0 2 1 1 2 0 0 0 2 1 3 0 0 8 1 4 0 10 2 1 0 0 0 1 0 0 11 0 0 1 0 0 1 11 1 0 0 5 11 7 2 0 0 0 4 0 2 1 0 0 -3.262 32 23 2 6 1 0 2 2 0 4 9 11 800.273 0 0 0 0 7 65 685 0 0 2 0 1 0 1 0 0 2 2 5 3 2 0 0 0 3 8 3 0 0 12 6 14 0 15 11 5 1 0 0 5 0 0 20 0 0 7 0 0 5 20 7 0 0 6 12 2 6 0 1 1 3 0 0 1 0 0 -3.5628 32 20 8 3 1 0 0 6 2 3 3 18 866.428 1 0 1 1 0 39 387 0 0 3 0 3 0 1 0 0 4 2 3 4 0 0 0 0 1 6 5 0 0 15 4 13 0 16 12 3 1 0 0 5 0 0 23 0 0 4 0 0 5 23 4 0 0 # 21.3777 15.4868 7.63683 # PHE 134 Env_3nxo_23 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 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 39 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 4 1 4 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 5 0 0 1 1 1 0 0 0 0 1 0 1 0 0 1 -1.0624 6 4 0 2 0 0 1 0 0 1 2 2 142.771 0 0 0 0 -0.5 15 60 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 3 1 0 1 1 0 3 2 1 4 0 0 1 0 3 0 0 0 0 0 3 0 0 3 0 3 0 0 2 6 4 2 0 0 0 1 0 1 0 0 2 -1.1859 18 14 2 2 0 0 1 2 0 1 4 6 492.167 0 0 0 0 5 21 255 0 0 0 0 0 0 0 2 0 2 0 0 0 0 0 1 3 0 4 4 0 2 6 0 8 4 6 10 0 0 2 0 9 0 0 2 0 0 7 0 0 9 2 7 0 0 3 14 0 4 0 0 0 3 0 0 0 0 8 -2.7097 32 19 5 7 0 1 0 4 0 3 0 17 816.563 0 0 0 0 -4 12 202 0 0 0 0 0 0 0 2 0 7 0 0 4 0 0 1 1 0 3 6 0 8 17 0 5 10 17 7 0 0 8 0 10 0 0 13 0 0 9 0 0 10 13 9 0 0 5 8 1 4 0 0 0 4 0 0 1 0 10 -1.6918 33 19 5 7 1 1 0 4 0 4 1 14 836.095 0 0 0 0 -1.5 19 481 0 0 0 0 0 0 0 2 0 5 0 0 3 1 0 5 2 0 0 5 0 10 14 0 7 12 14 9 0 0 10 0 8 0 0 13 0 0 12 0 0 8 13 12 0 0 # 21.588 8.428 -4.713 # GLY 116 Env_3nxo_24 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 21 198 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 33 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 1 5 0 2 0 0 0 1 0 1 0 0 0 -2.5233 10 6 2 2 0 0 1 2 0 1 0 4 268.277 0 0 0 0 -1 13 208 0 0 0 0 0 2 0 0 0 1 0 0 0 3 0 0 3 0 0 1 0 0 5 0 5 0 5 5 0 0 0 0 8 0 0 1 0 0 1 0 0 8 1 1 0 0 3 12 3 2 1 0 0 1 0 0 0 0 0 -1.3551 22 18 3 1 0 0 0 2.5 0.5 1 3 7 633.479 0.333 0 0.333 0.333 9 41 709 0 1 0 0 0 5 0 0 0 3 3 0 0 5 0 0 2 0 1 2 0 0 13 1 8 0 13 8 1 0 0 0 13 0 0 3 0 1 5 0 0 13 4 5 0 0 5 10 4 5 2 0 0 6 2 0 0 0 1 -5.2291 35 19 8 8 0 0 0 5.5 1.5 7 3 18 823.918 1.332 0.666 0.666 1.332 -7 46 1037 0 5 0 0 0 2 3 0 0 3 1 0 3 6 0 0 2 1 1 7 0 1 20 8 6 1 21 5 5 3 1 0 18 0 0 7 0 4 6 0 0 18 11 6 0 0 # 14.5442 9.50983 1.16233 # PHE 34 Env_3nxo_25 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 20 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 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 80 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 4 0 0 0 0 4 0 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.262 6 3 1 2 0 0 0 1 0 2 0 5 137.655 0 0 0 0 -2 3 195 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 1 0 1 0 0 0 0 4 0 2 0 5 1 0 0 0 0 2 0 0 0 0 3 1 0 0 2 3 1 0 0 2 8 0 1 0 0 0 4 0 0 0 0 0 -1.9203 15 10 1 4 0 0 0 1 0 4 0 10 395.213 0 0 0 0 -2 8 797 0 4 2 0 0 0 0 0 0 0 0 0 0 0 4 3 1 1 0 0 0 0 4 4 7 0 5 6 4 0 0 0 5 0 0 0 0 2 8 0 0 5 2 8 0 0 4 9 2 5 2 0 0 2 0 1 1 0 0 -3.5131 26 15 7 3 1 0 1 5.5 1.5 2 2 13 662.45 0.333 0 0.333 0.333 -3 36 1538 0 4 4 0 0 0 2 0 0 0 2 0 1 4 2 2 1 4 0 0 0 0 9 6 11 0 13 7 4 2 0 0 11 0 0 1 0 7 7 0 0 11 8 7 0 0 4 9 7 4 0 0 1 6 0 0 0 0 0 -3.6089 31 20 5 6 0 0 0 4 1 6 7 15 749.542 0.333 0 0.333 0.333 -1 52 1428 0 5 3 0 0 0 2 0 0 0 4 1 1 1 4 0 2 8 0 0 0 0 10 8 13 0 18 5 6 2 0 0 12 0 0 2 0 10 7 0 0 12 12 7 0 0 # 11.066 5.824 -6.585 # ILE 60