# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3cjo # POINT_FILE ../DUDE/pocket_res_ptf_dude_crys/3cjo_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_3cjo_0 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 17 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 1 0 0 0 0 0 0 0 0 1 0 0 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 68 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 4 0 0 0 0 0 0 0 0 4 0 0 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.3635 6 3 1 2 0 0 0 1 0 2 0 6 137.655 0 0 0 0 -3 0 95 0 1 0 0 0 0 0 0 0 3 0 0 0 0 2 0 0 0 0 0 0 0 5 1 0 0 5 0 1 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 2 4 0 2 0 0 0 3 0 0 0 0 0 -2.2202 11 6 2 3 0 0 0 2 0 3 0 8 263.816 0 0 0 0 -2 6 161 0 1 0 0 0 0 1 3 0 5 1 0 0 0 0 0 0 0 0 0 0 0 6 2 0 3 6 3 1 1 0 0 7 0 0 0 1 0 3 0 0 7 1 3 0 0 4 16 2 4 0 0 0 2 0 0 0 0 0 -1.6199 28 22 4 2 0 0 0 4 0 2 2 15 802.778 0 0 0 0 7 29 557 3 4 0 0 0 0 4 1 0 3 6 0 2 0 0 0 2 2 0 1 0 0 15 8 4 1 17 3 4 4 0 0 18 0 3 0 6 0 1 0 0 18 9 1 0 0 2 14 3 3 1 0 0 2 0 1 0 0 0 -2.7083 26 19 4 3 0 0 1 3 1 2 3 11 712.916 0 0 0 0 4 38 411 2 2 0 0 0 0 1 2 3 3 4 0 1 1 0 0 3 3 0 1 0 0 12 3 9 2 15 5 5 1 0 0 16 0 4 2 4 0 0 0 0 16 10 0 0 0 # 22.4608 11.3056 111.725 # PRO 120 Env_3cjo_1 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 11 207 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 69 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 -0.3913 4 3 1 0 0 0 0 0 1 0 0 0 134.04 1 0 1 1 2 13 216 0 0 0 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 3 1 0 3 0 0 0 0 1 0 0 0 0 3 1 0 0 0 0 2 5 1 0 0 2 0 0 0 0 0 0 -1.4111 10 7 3 0 0 0 0 1.5 1.5 0 7 2 243.036 0 0 0 0.5 1 31 391 0 0 0 0 0 0 2 0 2 0 0 1 0 0 0 0 0 5 0 0 0 0 0 3 7 0 5 0 3 2 0 1 2 0 0 0 7 0 0 0 0 3 7 0 0 0 4 3 6 2 0 0 1 2 1 0 0 0 0 -1.0593 19 13 3 3 0 0 0 2.5 0.5 2.5 7 7 448.417 0.666 0.666 0 1.166 -1 32 1025 0 0 0 2 0 0 3 0 3 0 0 3 0 0 0 0 2 6 0 0 0 0 0 8 11 0 6 2 6 5 0 5 3 0 0 0 9 0 2 0 0 8 9 2 0 0 2 11 0 1 0 0 0 2 4 1 0 0 0 -4.4425 21 13 1 7 0 0 1 1 0 4 0 10 533.529 1.665 1.665 0 1.665 -3 26 1687 0 0 0 4 0 0 7 0 2 0 0 1 0 0 0 0 4 3 0 0 0 0 0 12 9 0 3 4 3 11 0 5 4 0 0 0 8 0 4 0 0 9 8 4 0 0 # 22.0283 15.128 122.233 # GLU 111 Env_3cjo_2 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 11 138 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 46 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 1 1 0 2 0 0 0 0 0 0 0 0 -0.8616 4 2 2 0 0 0 0 1 1 0 0 0 102.947 0.999 0 0.999 0.999 -1 18 208 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 3 1 0 0 3 0 0 0 1 0 0 0 0 3 1 0 0 0 0 2 0 1 1 0 0 1 1 0 0 0 0 -2.6191 6 2 2 2 0 0 0 1 1 1.5 0 3 127.367 0.333 0.333 0 0.333 -3 9 284 0 1 0 1 0 0 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 4 2 0 0 2 1 3 0 0 3 0 0 1 2 0 0 0 0 3 3 0 0 0 4 7 0 1 0 0 0 2 0 2 0 0 0 -0.0766 16 11 1 4 0 0 2 1 0 2 0 8 427.118 0.333 0.333 0 0.333 -2 15 451 0 1 0 2 0 0 2 1 0 1 0 0 4 0 0 1 4 0 0 0 0 0 5 5 5 1 5 6 1 4 0 0 10 0 1 3 2 0 0 0 0 10 6 0 0 0 2 14 1 3 0 0 0 2 2 0 0 0 1 -4.0395 25 17 3 4 0 1 0 3 0 3 1 10 676.933 0.666 0.666 0 0.666 1 31 429 0 1 0 2 0 0 1 3 0 3 3 2 2 4 1 1 1 0 0 0 0 1 13 6 2 4 13 5 3 3 1 0 13 0 3 8 0 0 1 0 0 13 11 1 0 0 # 20.0297 12.5133 104.007 # GLU 99 Env_3cjo_3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 27 192 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 6 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 0 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 96 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 3 0 0 0 0 0 3 0 0 0 2 11 2 2 0 0 0 2 1 0 0 0 0 -1.5345 20 15 2 3 0 0 0 2 0 2.5 2 7 535.198 0.666 0.666 0 0.666 4 26 927 0 0 0 0 0 0 6 0 3 0 0 3 0 0 0 0 0 4 2 2 0 0 2 9 9 0 6 2 6 6 0 3 7 0 0 0 10 0 0 0 0 10 10 0 0 0 4 9 2 3 0 0 2 1 1 0 0 0 0 -1.9601 22 15 5 2 0 0 0 4 1 1.5 4 13 585.488 0.333 0.333 0 1.333 -3 24 782 0 0 0 0 0 0 2 0 4 0 0 4 0 0 4 0 0 1 3 4 0 0 8 6 8 0 9 3 8 2 0 4 15 0 0 0 3 0 0 0 0 19 3 0 0 0 7 8 4 5 0 1 0 6 0 0 0 0 0 -2.8922 31 19 6 6 0 0 0 5 1 6 5 20 768.962 1 0 1 1 -3 34 1719 0 2 0 3 0 1 4 0 3 0 6 1 0 0 1 0 3 0 6 1 0 0 8 10 13 0 8 10 6 7 0 6 20 0 0 0 2 0 3 0 0 26 2 3 0 0 # 22.2808 15.0528 117.529 # TRP 110 Env_3cjo_4 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 5 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 1 0 0 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 15 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 3 0 0 0 0 0 0 3 0 0 0 2 4 0 1 0 0 0 2 0 0 0 0 0 -1.2399 9 6 1 2 0 0 0 1 0 2 0 5 238.185 0 0 0 0 1 11 47 0 0 0 0 0 0 0 0 0 0 7 0 0 0 0 2 0 0 0 0 0 0 7 0 2 0 7 2 0 0 0 0 0 0 0 7 0 2 0 0 0 0 9 0 0 0 1 7 3 2 0 0 0 1 0 0 0 0 0 -1.8492 14 11 2 1 0 0 0 2 0 1 3 8 381.469 0 0 0 0 3 14 39 0 0 0 0 0 0 0 0 0 0 8 0 0 4 0 1 0 0 0 1 0 0 13 0 1 0 13 1 0 0 0 0 0 0 0 7 0 7 0 0 0 0 14 0 0 0 6 8 2 5 1 0 0 2 2 1 0 0 0 -2.9454 27 16 6 5 0 0 1 5.5 0.5 3 2 14 672.784 1.332 0.999 0.333 1.332 -4 36 155 0 1 0 3 0 0 4 0 0 0 7 0 0 5 0 4 0 0 0 3 0 0 15 8 4 0 15 4 1 7 0 0 1 0 0 22 0 4 0 0 0 1 26 0 0 0 5 18 2 3 1 0 0 7 1 1 0 0 0 -4.4922 38 25 4 9 0 0 1 3 1 7.5 1 20 979.641 0.999 0.666 0.333 0.999 -1 44 397 0 2 1 4 0 0 4 4 0 2 5 0 0 4 0 6 0 0 0 6 0 0 17 10 7 4 17 11 2 8 0 0 7 0 0 26 0 2 3 0 0 7 28 3 0 0 # 27.229 17.668 102.569 # LEU 143 Env_3cjo_5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 24 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 2 0 0 0 0 0 0 0 0 0 0 0 -0.3545 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 3 11 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 1 0 0 1 0 0 0 0 0 1 1 0 0 0 1 9 0 1 0 0 0 2 0 0 0 0 0 -2.1919 13 10 1 2 0 0 0 1 0 2 0 5 372.225 0 0 0 0 5 18 104 0 0 0 0 0 0 0 0 0 3 3 0 0 3 0 2 0 0 0 2 0 0 11 0 2 0 11 2 0 0 0 0 5 0 0 8 0 0 0 0 0 5 8 0 0 0 5 14 0 4 0 0 0 3 0 0 0 0 0 -1.6469 26 19 4 3 0 0 0 4 0 3 0 17 727.72 0 0 0 0 2 21 176 0 0 0 0 0 0 0 0 0 3 10 0 0 1 0 6 0 0 0 6 0 0 20 0 6 0 20 6 0 0 0 0 6 0 0 19 0 1 0 0 0 6 20 0 0 0 1 19 0 5 1 0 0 2 1 1 0 0 0 -5.6057 30 20 6 4 0 0 1 5.5 0.5 2.5 0 12 819.596 0.666 0.333 0.333 0.666 2 36 410 0 1 0 0 0 0 1 0 0 3 13 0 0 0 2 3 0 0 0 7 0 0 25 2 3 0 25 3 1 1 0 0 11 0 0 16 1 2 0 0 0 11 19 0 0 0 # 27.3108 14.5162 106.66 # PHE 222 Env_3cjo_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 11 339 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 2 113 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 1 1 0 0 0 0 0 0 0 0 0 1 -0.0695 3 2 0 1 0 0 0 0 0 0 1 0 71.525 0 0 0 0 1 4 172 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 0 1 1 0 0 1 1 0 1 0 0 0 0 0 2 0 0 1 0 2 0 0 1 1 2 1 0 0 0 1 0 0 0 0 3 -0.6058 9 6 1 2 0 0 0 1 0 1 2 4 218.265 0 0 0 0 0 6 368 0 0 0 0 0 0 2 2 0 0 0 0 0 2 0 0 0 0 0 0 0 3 2 2 0 5 2 2 0 2 3 0 2 0 2 0 0 0 5 0 0 2 2 5 0 0 1 4 3 1 0 0 0 1 0 0 0 0 7 -1.2774 17 11 3 3 0 0 0 1 0 1 3 5 424.536 0 0 0 0 0.5 16 666 0 2 0 0 0 0 1 1 0 0 1 0 0 5 0 0 0 0 0 0 0 7 6 3 0 8 6 1 2 1 7 0 5 0 1 0 1 0 10 0 0 5 2 10 0 0 4 5 0 3 0 0 0 4 0 0 0 0 9 -2.0164 25 13 5 6 0 1 0 3 0 4 0 12 614.301 0 0 0 0 -6 10 931 0 2 0 0 0 1 1 1 0 0 6 0 0 3 0 0 2 0 0 0 0 9 9 3 3 10 9 4 2 1 9 0 6 0 1 0 6 0 12 0 0 6 7 12 0 0 # 11.1233 8.682 107.089 # GLU 101 Env_3cjo_7 0 1 0 0 0 0 0 0 0 0 0 0 0 0.1303 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 10 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.423 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 4 30 0 0 0 0 0 0 0 0 0 3 0 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 1 0 2 0 0 0 3 0 0 0 0 0 -1.4204 8 3 2 3 0 0 0 2 0 3 0 7 163.286 0 0 0 0 -4 3 222 0 0 0 0 0 1 1 0 0 4 1 0 0 0 0 0 0 0 0 1 0 0 6 1 1 0 6 1 0 1 0 1 7 0 0 0 0 0 0 0 0 8 0 0 0 0 2 3 0 0 0 0 0 1 0 0 0 0 0 0.4235 6 5 0 1 0 0 0 0 0 1 0 6 179.044 0 0 0 0 -1 0 287 0 0 0 0 0 2 1 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 3 1 2 0 3 2 0 1 0 1 5 0 0 0 0 0 0 0 0 6 0 0 0 0 2 21 1 5 0 1 0 1 0 0 0 0 0 -4.3161 31 24 6 1 0 0 0 5 1 1 1 10 912.94 1 0 1 1 13 50 1435 0 0 0 0 0 3 2 0 0 3 8 4 0 1 0 0 0 0 4 6 0 0 18 6 7 0 18 7 4 2 0 1 20 0 0 5 0 3 2 0 0 21 8 2 0 0 5 19 2 4 0 0 0 4 0 0 0 0 0 -2.69 34 26 4 4 0 0 0 4 0 4 2 17 957.167 0 0 0 0 7 37 1321 0 0 0 0 0 2 6 2 0 4 5 4 0 2 0 0 2 0 1 6 0 0 17 10 5 2 17 7 4 6 0 3 15 0 0 10 0 3 3 0 0 18 13 3 0 0 # 26.158 20.775 110.471 # ILE 196 Env_3cjo_8 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 1 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 2 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 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 2 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 4 10 0 3 0 0 0 3 0 0 0 0 0 -1.5843 20 14 3 3 0 0 0 3 0 3 0 11 546.033 0 0 0 0 3 17 49 2 0 0 0 0 0 0 0 0 6 5 0 3 0 0 0 1 0 0 3 0 0 19 0 1 0 19 1 0 0 0 0 8 0 0 12 0 0 0 0 0 8 12 0 0 0 3 16 0 6 0 0 0 4 0 0 0 0 0 -3.8037 29 19 6 4 0 0 0 6 0 4 0 20 767.488 0 0 0 0 -2 19 169 1 0 0 3 0 0 1 0 0 11 3 1 0 4 0 0 4 0 0 1 0 0 20 5 4 0 20 4 1 4 0 0 11 0 0 17 1 0 0 0 0 11 18 0 0 0 8 16 0 4 0 0 0 5 2 1 0 0 0 -2.4832 36 24 4 8 0 0 1 4 0 6 0 20 950.758 0.999 0.999 0 0.999 0 28 613 2 0 2 4 0 0 3 1 0 8 1 3 0 2 0 1 6 0 0 3 0 0 16 10 9 1 16 10 3 7 0 0 14 0 0 17 3 0 2 0 0 14 20 2 0 0 # 24.386 5.782 104.336 # MET 98 Env_3cjo_9 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 50 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 0 100 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 -0.9389 6 2 1 3 0 0 0 1 0 3 0 6 115.639 0 0 0 0 -4 0 305 3 0 0 0 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 4 1 0 1 4 1 0 1 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 2 3 0 2 0 0 0 1 0 0 0 0 0 -0.3179 8 5 2 1 0 0 0 2 0 1 0 8 207.318 0 0 0 0 -3 0 417 1 0 0 0 0 0 3 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 2 3 0 3 2 3 0 3 0 0 8 0 0 0 0 0 0 0 0 8 0 0 0 0 2 8 0 3 0 0 0 2 0 1 0 0 0 -1.9873 16 10 3 3 0 0 1 3 0 2 0 9 417.656 0 0 0 0 -1 11 1002 3 4 0 0 0 0 1 0 0 0 2 5 0 0 0 0 1 0 0 0 0 0 5 10 1 0 5 1 9 1 0 0 16 0 0 0 0 0 0 0 0 16 0 0 0 0 4 7 1 2 2 0 0 2 2 0 0 0 0 -1.5004 20 12 4 4 0 0 0 2.5 1.5 3 0 10 500.802 1.665 0.999 0.666 1.665 -5 31 1193 0 5 0 0 0 0 4 0 0 2 1 4 0 0 0 0 3 0 1 0 0 0 3 13 4 0 3 4 9 4 0 0 19 0 0 0 1 0 0 0 0 19 1 0 0 0 # 17.737 19.645 105.858 # ALA 201 Env_3cjo_10 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 78 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 7 156 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 0 2 0 0 0 0 0 0 0 0 0 0 0 0.0093 2 2 0 0 0 0 0 0 0 0 0 0 67.02 0 0 0 0 2 3 156 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 0 3 0 0 0 0 0 2 0 0 0 0 0 -1.1048 5 3 0 2 0 0 0 0 0 2 0 2 123.518 0 0 0 0 0 4 347 0 0 0 0 0 1 0 0 0 0 1 0 0 0 3 0 0 0 0 0 0 0 4 0 1 0 4 1 0 0 0 0 1 0 0 0 0 4 0 0 0 1 4 0 0 0 4 9 0 3 0 0 0 1 0 0 0 0 0 -0.0093 17 13 3 1 0 0 0 3 0 1 0 11 489.535 0 0 0 0 2 11 747 0 0 0 0 0 2 0 0 0 9 1 3 0 0 2 0 0 0 0 0 0 0 12 3 2 0 12 2 3 0 0 0 12 0 0 2 0 3 0 0 0 12 5 0 0 0 4 11 0 3 0 0 0 4 0 0 0 0 0 -1.4767 22 15 3 4 0 0 0 3 0 4 0 12 578.106 0 0 0 0 1 24 928 0 0 4 0 0 4 2 1 0 3 5 2 0 0 1 0 0 0 0 0 0 0 9 4 8 1 9 9 2 2 0 1 10 0 0 2 0 5 4 0 0 11 7 4 0 0 # 25.674 26.256 108.713 # LYS 199 Env_3cjo_11 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 98 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 -2.2547 3 0 3 0 0 0 0 1 2 0 0 0 69.437 0.666 0 0.666 0.666 -3 16 294 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 1 0 0 0 0 -0.7145 4 3 0 1 0 0 0 0 0 0.5 0 0 114.667 0.333 0.333 0 0.333 1 9 296 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 3 1 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 3 4 1 1 0 0 0 2 0 1 0 0 0 -0.9505 12 8 1 3 0 0 1 1 0 2 2 6 289.511 0.333 0.333 0 0.333 -1 19 686 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 2 3 4 0 0 0 0 3 9 0 3 6 1 2 0 0 3 0 0 0 3 1 5 0 0 3 4 5 0 0 4 4 3 5 0 0 0 3 1 0 0 0 0 -2.7483 20 11 5 4 0 0 0 5 0 3.5 3 15 461.005 0.333 0.333 0 0.333 -5 13 1224 0 2 0 3 0 0 2 0 0 0 0 0 0 0 0 2 2 3 6 0 0 0 0 7 13 0 3 10 2 5 0 0 2 0 0 0 3 4 11 0 0 2 7 11 0 0 4 7 7 4 0 0 0 2 0 1 0 0 0 -1.7822 25 18 4 3 0 0 1 4 0 2 7 13 633.124 0 0 0 0 1 27 1852 2 1 0 2 0 0 8 0 0 0 0 0 0 0 0 4 1 3 4 0 0 0 2 11 12 0 5 9 1 10 0 0 2 0 2 0 9 2 10 0 0 2 13 10 0 0 # 14.379 15.086 115.486 # ARG 102 Env_3cjo_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 3 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 1 0 0 0 0 0 0 0 0 1 0 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.0679 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 137 1 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 0 3 1 3 1 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 -1.5692 3 1 0 2 0 0 0 0 0 2 0 2 56.498 0 0 0 0 -1 3 79 0 0 0 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 2 1 0 0 2 0 1 0 0 0 1 0 0 0 0 2 0 0 0 1 2 0 0 0 4 9 0 3 0 0 0 3 0 0 0 0 0 -0.765 19 13 3 3 0 0 0 3 0 3 0 13 512.523 0 0 0 0 0 9 848 4 0 0 0 0 0 2 0 0 1 6 6 0 0 0 0 0 0 0 0 0 0 11 8 0 0 11 0 6 2 0 0 16 0 0 0 0 3 0 0 0 16 3 0 0 0 3 19 0 4 0 0 0 1 0 0 0 0 0 -1.6773 27 22 4 1 0 0 0 4 0 1 0 14 805.262 0 0 0 0 7 26 950 4 5 0 0 0 0 2 0 0 1 11 4 0 0 0 0 0 0 0 0 0 0 16 11 0 0 16 0 9 2 0 0 18 0 0 2 0 7 0 0 0 18 9 0 0 0 3 12 2 4 3 1 0 4 1 0 0 0 0 -6.1114 30 17 8 5 0 0 0 5 3 4.5 1 12 769.358 2.332 0.333 1.999 2.332 -3 61 1107 1 5 1 0 0 2 2 0 0 4 8 5 0 1 0 0 1 0 0 0 0 0 14 12 4 0 14 4 10 2 0 0 21 0 0 4 0 4 1 0 0 21 8 1 0 0 # 22.228 20.921 104.55 # GLY 200 Env_3cjo_13 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 7 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.423 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 4 21 0 0 0 0 0 0 0 0 0 3 0 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 1 2 0 2 0 0 0 2 0 0 0 0 0 -1.2556 7 3 2 2 0 0 0 2 0 2 0 5 151.792 0 0 0 0 -3 4 63 0 0 0 0 0 0 0 0 0 4 0 0 1 0 2 0 0 0 0 0 0 0 7 0 0 0 7 0 0 0 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 2 5 3 0 0 0 0 1 0 0 0 0 0 -0.0972 11 10 0 1 0 0 0 0 0 1 3 6 319.685 0 0 0 0 4 14 113 0 0 0 0 0 0 1 0 0 3 1 0 1 3 2 0 0 0 0 0 0 0 10 1 0 0 10 0 0 1 0 0 6 0 0 4 1 0 0 0 0 6 5 0 0 0 4 15 3 4 0 0 0 2 1 0 0 0 0 -1.9639 29 22 4 3 0 0 0 4 0 2.5 3 10 796.995 0.666 0.666 0 0.666 9 43 533 0 1 0 0 0 0 7 2 0 3 6 0 2 4 2 0 2 0 0 0 0 0 17 8 2 2 17 4 1 7 0 0 14 0 0 6 7 0 2 0 0 14 13 2 0 0 4 15 0 5 0 0 0 4 1 1 1 0 0 -5.0752 31 19 5 6 1 0 1 5 0 4.5 0 19 811.166 0.333 0.333 0 0.333 -1 28 310 0 2 0 0 0 0 1 3 0 2 11 0 3 3 1 0 5 0 0 0 0 0 20 3 5 3 20 8 2 1 0 0 19 0 1 8 1 0 2 0 0 19 10 2 0 0 # 24.548 10.885 108.302 # ILE 119 Env_3cjo_14 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 6 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 2 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 2 4 0 1 0 0 0 0 0 1 0 0 0 0.1615 8 6 1 1 0 0 1 1 0 0 0 6 232.354 0 0 0 0 -2 3 276 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 4 4 0 0 4 2 2 0 0 0 0 0 0 0 0 8 0 0 0 0 8 0 0 4 7 3 5 2 0 0 4 0 0 0 0 0 -2.4836 25 14 7 4 0 0 0 5.5 1.5 4 2 14 597.958 0.666 0 0.666 0.666 -5 29 1657 1 7 0 2 0 0 2 0 0 0 5 0 0 0 3 2 0 0 3 0 0 0 9 11 5 0 9 5 7 4 0 0 0 0 1 0 8 3 13 0 0 0 12 13 0 0 3 11 2 3 1 0 0 6 0 0 0 0 0 -5.0079 26 16 4 6 0 0 0 3.5 0.5 6 2 17 657.986 0.333 0 0.333 0.333 -2 25 1884 2 2 0 0 0 0 3 0 0 0 3 0 0 0 5 0 3 2 6 0 0 0 10 5 11 0 12 9 2 3 0 0 0 0 2 0 11 7 6 0 0 0 20 6 0 0 4 10 1 5 1 0 0 2 0 1 0 0 0 -3.0145 24 15 6 3 0 0 1 5.5 0.5 2 2 14 617.989 0.333 0 0.333 0.333 -3 28 2085 2 1 0 0 0 0 11 0 0 0 0 0 0 0 3 0 1 3 3 0 0 0 5 12 7 0 8 4 1 11 0 0 1 0 2 0 7 6 8 0 0 1 15 8 0 0 # 13.1417 10.6197 115.898 # ASP 113 Env_3cjo_15 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 50 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 1 0 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 2 150 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 3 0 0 0 0 0 3 0 0 0 2 2 0 1 0 0 0 2 1 0 0 0 0 -2.004 8 4 1 3 0 0 0 1 0 2.5 0 5 185.302 0.333 0.333 0 0.333 -2 9 386 1 0 0 1 0 0 1 0 0 0 4 0 0 0 1 0 0 0 0 0 0 0 6 2 0 0 6 0 0 2 0 0 0 0 1 0 5 0 2 0 0 0 6 2 0 0 4 7 0 4 0 0 0 2 1 1 0 0 0 -1.7643 19 11 4 4 0 0 1 4 0 2.5 0 14 466.509 0.666 0.666 0 0.666 -6 9 1104 1 4 0 4 0 0 4 0 0 0 0 0 0 0 3 3 0 0 0 0 0 0 4 12 3 0 4 3 4 8 0 0 0 0 1 0 3 0 15 0 0 0 4 15 0 0 4 10 3 1 1 0 0 2 1 0 0 0 0 -1.458 22 17 2 3 0 0 0 1.5 0.5 2.5 3 6 608.824 0.999 0.666 0.333 0.999 4 43 935 3 2 0 2 0 3 3 2 0 0 0 0 0 3 3 1 0 0 0 0 0 0 9 7 4 2 9 6 2 5 0 0 7 0 5 0 3 0 7 0 0 7 8 7 0 0 1 5 6 4 1 0 0 5 1 0 0 0 0 -5.0703 23 12 5 6 0 0 0 4 1 5.5 5 10 497.036 0.666 0.333 0.333 0.666 -4 40 1177 0 4 0 1 0 2 2 4 0 0 0 0 0 4 2 2 0 0 2 0 0 0 6 7 6 4 6 10 4 3 0 0 7 0 2 0 1 4 9 0 0 7 7 9 0 0 # 12.985 7.859 113.095 # LEU 115 Env_3cjo_16 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 1 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 1 2 0 0 0 0 0 0 0 0 0 0 0 0.8985 3 3 0 0 0 0 0 0 0 0 0 2 100.53 0 0 0 0 1 2 3 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 1 3 0 2 0 0 0 2 0 0 0 0 0 -2.2597 8 4 2 2 0 0 0 2 0 2 0 5 185.302 0 0 0 0 -1 9 57 0 0 1 0 0 0 0 0 0 1 6 0 0 0 0 0 0 0 0 0 0 0 7 0 1 0 7 1 0 0 0 0 0 0 0 1 0 6 1 0 0 0 7 1 0 0 0 4 0 2 0 0 0 0 1 0 0 0 0 -1.8234 7 4 2 1 0 0 0 2 0 0.5 0 4 176.451 0.333 0.333 0 0.333 -1 6 67 0 0 1 1 0 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 5 1 1 0 5 1 0 1 0 0 0 0 0 4 0 2 1 0 0 0 6 1 0 0 7 17 0 3 0 0 0 5 1 0 0 0 0 -1.1055 33 24 3 6 0 0 0 3 0 5.5 0 18 905.327 0.666 0.666 0 0.666 1 29 762 0 0 2 6 0 0 4 2 0 3 6 3 0 0 2 3 0 0 0 2 0 0 13 13 5 2 13 7 3 10 0 0 7 0 0 17 0 3 6 0 0 7 20 6 0 0 6 23 2 5 0 2 0 4 1 0 0 0 0 -3.9346 43 31 7 5 0 0 0 5 2 4.5 2 19 1207.08 2.666 0.666 2 2.666 7 60 1779 0 0 3 0 0 0 7 2 0 7 4 10 0 2 3 2 0 0 0 3 0 0 19 17 5 2 19 7 10 7 0 0 16 0 0 12 0 4 11 0 0 16 16 11 0 0 # 27.77 21.988 104.255 # LEU 155 Env_3cjo_17 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 12 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.3661 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 195 0 0 0 0 0 0 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 3 0 3 0 2 0 0 0 0 3 0 1 0 1 0 0 0 4 1 0 0 0 0 0 2 0 0 0 3 0 0 0 0 0 -3.0739 5 0 2 3 0 0 0 2 0 3 0 4 73.048 0 0 0 0 -5 4 163 0 0 0 0 0 1 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 2 1 1 1 2 2 0 1 0 0 2 0 0 0 2 0 1 0 0 2 2 1 0 0 5 8 3 2 0 0 0 3 0 0 0 0 0 0.3007 21 16 2 3 0 0 0 2 0 3 3 14 559.076 0 0 0 0 1 16 1155 4 0 0 0 0 1 8 1 0 0 1 0 0 5 0 0 1 0 0 0 0 0 10 8 2 1 10 3 0 8 0 0 7 0 4 0 4 0 6 0 0 7 8 6 0 0 5 9 3 5 0 0 0 4 2 0 0 0 0 -3.6419 28 17 5 6 0 0 0 5 0 5 3 15 680.707 0.999 0.999 0 0.999 -2 36 996 1 1 0 0 0 2 4 2 0 1 2 0 4 5 1 0 5 0 0 0 0 0 14 5 7 2 14 9 1 4 0 0 18 0 1 0 3 0 6 0 0 18 4 6 0 0 2 13 0 3 2 0 0 2 1 1 0 0 1 -4.2061 25 15 5 5 0 0 1 3.5 1.5 2.5 0 9 642.914 0.999 0.666 0.333 0.999 -3 35 892 0 3 0 0 0 1 2 0 0 2 4 1 1 0 4 0 6 0 0 0 0 1 11 6 7 1 11 7 4 2 1 0 14 0 0 1 8 0 2 0 0 14 9 2 0 0 # 16.712 8.449 108.862 # GLY 100 Env_3cjo_18 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 58 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 1 1 0 1 0 0 0 0 0 0 0 0 0 0.2153 3 2 1 0 0 0 0 1 0 0 0 3 81.157 0 0 0 0 -1 0 174 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 1 0 0 1 0 0 0 3 0 0 0 0 0 -1.4898 5 1 1 3 0 0 0 1 0 3 0 5 82.129 0 0 0 0 -4 0 311 2 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 3 0 0 2 0 2 1 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 2 3 0 2 0 0 0 1 0 0 0 0 0 -0.507 8 5 2 1 0 0 0 2 0 1 0 8 207.318 0 0 0 0 -3 0 509 3 0 0 0 0 0 1 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 3 5 0 0 3 0 4 1 0 0 8 0 0 0 0 0 0 0 0 8 0 0 0 0 2 8 0 3 0 0 0 1 0 1 0 0 0 -0.876 15 10 3 2 0 0 1 3 0 1 0 8 406.162 0 0 0 0 0 10 720 1 1 0 0 0 0 1 4 0 0 0 5 0 0 0 0 3 0 0 0 0 0 1 7 3 4 1 7 6 1 0 0 15 0 0 0 0 0 0 0 0 15 0 0 0 0 3 10 0 2 0 0 0 3 0 1 0 0 0 -1.8837 19 13 2 4 0 0 1 2 0 3 0 10 515.543 0 0 0 0 -1 19 1185 0 3 0 0 0 0 2 0 0 0 3 4 0 0 0 0 7 0 0 0 0 0 3 9 7 0 3 7 7 2 0 0 18 0 0 0 0 1 0 0 0 18 1 0 0 0 # 18.009 24.796 104.758 # ALA 202 Env_3cjo_19 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 41 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 2 123 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 2 0 1 0 0 0 2 0 0 0 0 0 -1.2817 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 6 361 0 0 0 0 0 0 1 0 0 1 4 0 0 0 0 0 0 0 1 0 0 0 5 1 1 0 5 1 0 1 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 2 3 0 0 0 0 0 2 0 0 0 0 0 0.0373 7 5 0 2 0 0 0 0 0 2 0 7 190.538 0 0 0 0 -2 0 295 0 0 0 0 0 0 1 0 0 2 0 0 0 0 0 0 0 0 2 2 0 0 4 1 2 0 4 2 0 1 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 2 11 5 6 0 0 0 1 0 0 0 0 0 -3.323 25 18 6 1 0 0 0 6 0 1 5 12 658.609 0 0 0 0 6 29 1384 2 0 0 0 0 4 3 2 0 3 0 1 0 2 1 0 0 0 5 2 0 0 10 4 9 2 10 11 1 3 0 0 23 0 0 2 0 0 0 0 0 23 2 0 0 0 4 15 3 2 0 0 0 2 1 0 0 0 0 -2.1238 27 22 2 3 0 0 0 2 0 2.5 4 9 755.79 0.666 0.666 0 0.666 9 45 1027 1 0 0 0 0 1 4 1 0 4 3 3 0 2 4 0 0 0 2 2 0 0 16 7 3 1 16 4 3 4 0 1 22 0 0 3 0 1 0 0 0 23 4 0 0 0 # 21.923 17.635 109.812 # LEU 197 Env_3cjo_20 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 3 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 3 0 0 0 0 0 0 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.0136 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 1 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 1 0 0 0 0 0 0 1 0 0 0 0 3 0 0 1 0 0 0 0 1 0 0 0 -0.4666 5 3 1 1 0 0 1 0 1 0 0 0 138.266 0 0 0 0 0 14 69 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 1 0 0 1 0 0 0 1 2 2 0 1 2 1 1 0 0 2 0 0 2 0 1 0 0 0 2 3 0 0 0 1 9 2 1 1 0 0 0 0 1 0 0 0 -2.0281 15 12 2 1 0 0 1 1.5 0.5 0 2 3 424.992 0.666 0 0.666 0.666 4 39 256 0 4 0 0 0 0 2 0 0 0 5 0 0 0 0 2 0 0 2 0 0 0 5 6 4 0 5 4 4 2 0 0 6 0 0 6 0 3 0 0 0 6 9 0 0 0 5 7 2 5 1 0 0 4 0 1 0 0 0 -4.0584 25 14 6 5 0 0 1 5.5 0.5 4 2 17 613.409 0.333 0 0.333 0.333 -6 21 262 0 3 0 0 0 0 2 0 2 1 10 0 0 0 0 4 0 0 2 1 0 0 12 5 8 0 12 6 5 2 0 0 5 0 0 16 0 2 2 0 0 5 18 2 0 0 9 8 2 3 0 0 0 9 1 0 0 0 0 -2.3358 32 19 3 10 0 0 0 3 0 9.5 2 27 776.764 0.333 0.333 0 0.333 -9 11 356 1 3 0 2 0 0 1 2 2 3 3 1 0 4 0 4 0 0 3 3 0 0 14 7 9 2 14 9 6 3 0 0 10 0 0 16 1 2 3 0 0 10 19 3 0 0 # 23.129 16.4993 98.4487 # GLU 145 Env_3cjo_21 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 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 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 0 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 1 0 0 0 0 0 -0.6738 6 4 1 1 0 0 0 1 0 1 0 4 159.671 0 0 0 0 0 6 5 0 0 0 1 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 1 0 0 5 0 0 1 0 0 0 0 0 1 0 5 0 0 0 0 6 0 0 0 2 10 0 0 0 0 0 3 2 0 0 0 0 -2.165 17 12 0 5 0 0 0 0 0 4 0 7 451.945 0.999 0.999 0 0.999 2 25 142 0 1 0 2 0 0 4 2 0 0 6 2 0 0 0 0 0 0 0 0 0 0 6 9 0 2 6 2 3 6 0 0 5 0 0 11 0 1 0 0 0 5 12 0 0 0 4 16 1 7 1 1 0 2 1 1 0 0 0 -4.6047 34 21 9 4 0 0 1 7 2 2.5 0 17 898.109 1.666 0.333 1.333 1.666 -2 47 550 0 6 1 3 0 0 2 2 0 0 9 6 0 3 0 0 0 0 1 1 0 0 13 17 2 2 13 4 12 5 0 0 15 0 0 13 1 4 1 0 0 15 18 1 0 0 8 7 1 2 2 0 0 3 0 0 0 0 0 0.4569 23 16 4 3 0 0 0 3 1 3 2 14 614.923 0.999 0.333 0.666 0.999 -3 29 549 4 3 0 1 0 0 2 0 0 0 4 3 0 1 0 2 0 0 2 1 0 0 10 9 4 0 10 4 6 3 0 0 12 0 0 8 1 2 0 0 0 12 11 0 0 0 # 24.396 20.135 100.31 # LEU 154 Env_3cjo_22 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1825 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 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 0 0 1 0 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 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 0 0 2 0 0 0 0 0 0 0 2 0 0 0 2 0 0 1 0 0 0 2 0 0 0 0 0 -0.371 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 71 2 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 3 1 0 1 3 1 0 1 0 0 0 0 2 0 1 0 2 0 0 0 3 2 0 0 1 8 1 2 2 0 0 4 0 0 0 0 0 -3.067 18 10 4 4 0 0 0 2.5 1.5 4 0 10 441.427 0.666 0 0.666 0.666 -4 24 510 0 6 0 3 0 0 1 2 0 0 3 0 0 0 2 0 0 1 0 0 0 0 5 10 1 2 6 2 6 4 0 0 8 0 0 0 5 0 5 0 0 8 5 5 0 0 8 9 1 5 1 0 0 3 1 0 0 0 0 -1.8358 28 18 6 4 0 0 0 5.5 0.5 3.5 1 18 737.285 0.999 0.666 0.333 0.999 -5 25 1120 0 3 0 3 0 3 5 2 0 0 1 0 0 0 9 0 0 2 0 0 0 0 10 11 5 2 12 5 3 8 0 0 11 0 1 0 9 0 7 0 0 11 10 7 0 0 6 12 3 7 1 0 0 6 1 0 0 0 0 -3.1411 36 21 8 7 0 0 0 7 1 6.5 2 24 860.567 0.666 0.333 0.333 0.666 -10 35 1844 0 6 0 1 0 2 9 3 0 6 1 0 0 0 2 0 1 5 0 0 0 0 9 16 8 3 14 6 6 10 0 0 9 0 3 0 16 0 8 0 0 9 19 8 0 0 # 18.542 9.197 114.356 # ALA 116 Env_3cjo_23 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 54 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 3 0 0 0 0 0 0 0 0 -2.2062 4 1 3 0 0 0 0 1 2 0 0 0 102.947 0.666 0 0.666 0.666 -3 19 216 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 1 0 0 0 0 0 0 2 0 0 0 0 -1.5984 3 1 0 2 0 0 0 0 0 1 0 0 61.784 0.666 0.666 0 0.666 -1 10 101 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 1 2 0 0 1 0 0 1 1 0 0 0 0 1 2 0 0 0 2 3 0 0 0 0 0 0 2 1 0 0 0 -0.8821 8 5 0 3 0 0 1 0 0 1 0 0 187.119 1.332 1.332 0 1.332 -1 21 165 0 1 0 0 0 0 4 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 1 5 2 0 1 2 1 4 0 0 1 0 0 5 2 0 0 0 0 1 7 0 0 0 1 10 0 1 0 0 0 1 1 0 0 0 0 -1.4751 14 11 1 2 0 0 0 1 0 1.5 0 6 408.378 0.333 0.333 0 0.333 4 17 298 2 1 0 1 0 0 2 2 0 0 4 0 0 0 0 1 1 0 0 0 0 0 6 4 2 2 6 4 1 3 0 0 6 0 0 5 1 2 0 0 0 6 8 0 0 0 4 11 4 3 0 0 0 3 0 3 0 0 0 -3.559 28 19 3 6 0 0 3 3 0 3 4 10 724.167 0.333 0.333 0 0.333 4 42 581 3 2 0 2 0 0 2 1 0 1 4 0 0 3 0 4 2 0 3 1 0 0 12 6 9 1 12 10 2 4 0 0 13 0 0 11 1 2 1 0 0 13 14 1 0 0 # 20.998 15.086 101.705 # ARG 204 Env_3cjo_24 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6546 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0.1868 2 2 0 0 0 0 0 0 0 0 0 1 67.02 0 0 0 0 0 1 12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 1 1 0 1 1 0 0 1 0 0 0 0 0 -1.2792 5 2 2 1 0 0 0 1.5 0.5 1 0 3 117.08 0.333 0 0.333 0.333 -2 7 84 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 2 3 0 0 3 1 1 0 0 1 0 0 4 0 0 0 0 0 1 4 0 0 0 4 3 1 2 0 0 0 3 3 0 0 0 0 -2.0037 16 8 2 6 0 0 0 2 0 4.5 0 9 334.454 1.998 1.665 0.333 1.998 -7 24 196 0 1 0 6 0 0 3 0 2 0 2 0 0 0 0 0 0 0 0 2 0 0 4 10 2 0 4 0 3 9 0 0 1 0 0 14 1 0 0 0 0 1 15 0 0 0 4 11 0 4 2 0 0 4 2 0 0 0 0 -4.6072 27 15 6 6 0 0 0 4.5 1.5 5 0 14 665.525 1.332 0.999 0.333 1.332 -4 35 245 0 2 0 1 0 0 4 0 2 1 5 0 0 3 0 1 0 0 0 8 0 0 17 7 3 0 17 1 4 5 0 0 3 0 0 21 1 0 2 0 0 3 22 2 0 0 6 19 2 3 0 0 0 1 1 2 0 0 0 -1.6874 34 27 3 4 0 0 2 3 0 1.5 2 15 987.206 0.333 0.333 0 0.333 7 36 388 0 1 0 0 0 0 5 0 1 2 11 0 2 3 0 3 2 0 0 4 0 0 22 6 6 0 22 5 2 5 0 0 6 0 0 20 2 0 6 0 0 6 22 6 0 0 # 23.916 11.949 99.843 # SER 220 Env_3cjo_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 11 309 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 2 103 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 -0.178 2 2 0 0 0 0 0 0 0 0 1 0 60.031 0 0 0 0 2 5 187 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 0 0 1 0 1 0 0 2 0 0 0 0 0 0 0 0 2 0 0 0 0 2 2 3 2 0 0 0 1 0 1 0 0 0 -1.5268 11 7 2 2 0 0 1 2 0 1 4 6 251.655 0 0 0 0 -1 20 1000 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 7 0 0 0 0 2 9 0 0 9 0 2 0 0 11 0 0 0 0 0 0 0 0 11 0 0 0 0 3 4 1 1 0 0 0 2 0 0 0 0 0 -0.0417 11 8 1 2 0 0 0 1 0 2 1 7 298.216 0 0 0 0 1 7 989 0 0 0 0 0 4 2 0 0 0 1 1 0 0 0 0 0 0 3 0 0 0 1 3 7 0 1 7 1 2 0 0 11 0 0 0 0 0 0 0 0 11 0 0 0 0 2 3 0 3 1 0 0 2 0 0 0 0 0 -2.3955 11 5 4 2 0 0 0 3.5 0.5 2 0 7 244.447 0.333 0 0.333 0.333 -5 14 650 0 1 0 0 0 2 0 0 0 2 4 1 0 0 0 0 0 0 1 0 0 0 6 2 3 0 6 3 2 0 0 0 10 0 0 0 0 0 1 0 0 10 0 1 0 0 # 17.6573 22.6937 112.935 # GLU 198 Env_3cjo_26 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 1 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 17 1 0 0 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 3 2 3 0 0 0 0 1 0 1 0 0 0 3 0 0 1 1 3 0 0 1 0 0 2 0 0 0 3 0 0 0 0 0 -2.5374 6 1 2 3 0 0 0 2 0 3 0 5 106.558 0 0 0 0 -5 4 121 1 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 2 2 1 1 3 0 2 0 0 2 0 2 0 2 0 0 0 0 2 4 0 0 0 5 12 0 3 1 0 0 4 0 0 0 0 0 -1.1115 25 17 4 4 0 0 0 3 1 4 0 14 665.705 0 0 0 0 -2 24 497 3 3 0 0 0 4 2 1 0 4 2 0 2 1 2 0 1 0 0 0 0 0 14 5 5 1 14 6 3 2 0 0 17 0 4 0 4 0 0 0 0 17 8 0 0 0 3 11 1 5 1 0 0 3 0 0 0 0 0 -2.6476 24 15 6 3 0 0 0 5.5 0.5 3 0 17 619.315 0.666 0 0.666 0.666 -4 18 596 0 5 0 0 0 1 2 2 0 5 0 0 2 1 3 0 3 0 0 0 0 0 11 7 4 2 11 6 5 2 0 0 20 0 2 0 1 0 1 0 0 20 3 1 0 0 5 13 8 5 2 0 0 6 0 1 0 0 0 -5.6826 40 26 7 7 0 0 1 6 1 6 8 19 1009.13 0.666 0 0.666 0.666 3 55 1442 0 3 0 1 0 3 3 0 0 5 3 0 1 9 4 0 5 0 3 0 0 0 22 7 11 0 22 11 3 4 0 0 30 0 0 1 6 0 3 0 0 30 7 3 0 0 # 19.837 6.946 110.496 # GLY 117