# EXCLUDED_RESIDUES HETATM # PDBID_LIST 3rn8 # POINT_FILE 3rn8_RN8.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_3rn8_0 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 44 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 -0.8386 4 3 1 0 0 0 0 1 0 0 0 2 114.667 0 0 0 0 1 4 176 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 2 1 0 1 0 0 0 2 0 0 0 0 0 -0.4229 6 3 1 2 0 0 0 1 0 2 0 5 137.655 0 0 0 0 -2 3 176 0 0 0 0 0 0 0 1 0 3 0 0 0 0 0 0 2 0 0 0 0 0 3 0 2 1 3 3 0 0 0 0 0 0 1 1 0 0 4 0 0 0 2 4 0 0 1 3 6 1 0 0 0 1 0 0 0 0 0 -1.185 12 10 1 1 0 0 0 1 0 1 6 5 312.855 0 0 0 0 5 22 208 0 0 0 0 0 0 0 2 0 0 0 0 0 7 0 0 3 0 0 0 0 0 7 0 3 2 7 5 0 0 0 0 0 0 2 8 0 0 2 0 0 0 10 2 0 0 4 10 0 3 0 0 0 4 1 0 0 0 0 -1.5513 22 14 3 5 0 0 0 3 0 4.5 0 13 558.733 0.666 0.666 0 0.666 -3 17 502 0 0 0 0 0 0 3 3 0 0 2 1 0 0 1 1 7 0 4 0 0 0 3 4 12 3 3 15 1 3 0 0 3 0 3 7 0 0 9 0 0 3 10 9 0 0 5 12 1 6 1 0 0 3 1 2 0 0 0 -4.2585 31 18 7 6 0 0 2 6.5 0.5 3.5 1 19 788.375 0.666 0.333 0.333 0.666 -7 28 1151 0 3 0 0 0 0 4 2 0 1 2 5 0 4 4 2 2 0 2 0 0 0 11 12 6 2 11 8 8 4 0 0 8 0 1 10 0 1 11 0 0 8 12 11 0 0 # 58.112 75.021 58.742 # 3rn8_B_281_RN8_92_I_1_B Env_3rn8_1 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.2359 2 1 1 0 0 0 0 1 0 0 0 1 47.647 0 0 0 0 0 2 136 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0.5753 4 4 0 0 0 0 0 0 0 0 0 2 134.04 0 0 0 0 1 2 272 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 1 1 0 1 0 0 0 2 0 0 0 0 0 -1.0856 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 424 0 0 0 0 0 0 0 0 0 0 0 3 0 1 1 0 0 0 0 0 0 0 2 3 0 0 2 0 3 0 0 0 0 0 0 0 0 4 1 0 0 0 4 1 0 0 1 3 0 1 0 0 0 2 0 0 0 0 0 -0.9641 7 4 1 2 0 0 0 1 0 2 0 5 171.165 0 0 0 0 -1 4 293 0 0 0 0 0 0 0 0 0 1 0 2 0 1 0 1 0 0 2 0 0 0 2 2 3 0 2 3 2 0 0 0 0 0 0 2 0 3 2 0 0 0 5 2 0 0 4 9 0 4 0 0 0 2 0 1 0 0 0 -1.565 20 13 4 3 0 0 1 4 0 2 0 14 532.323 0 0 0 0 -2 12 418 0 0 0 0 0 0 0 6 0 1 0 2 4 2 0 2 0 0 2 1 0 0 8 2 4 6 8 10 2 0 0 0 1 0 0 10 0 4 5 0 0 1 14 5 0 0 3 12 4 3 0 0 0 3 0 0 0 0 0 -1.9684 25 19 3 3 0 0 0 3 0 3 4 10 679.685 0 0 0 0 5 32 723 0 0 1 0 0 0 0 1 0 3 1 3 1 7 0 5 0 0 1 2 0 0 14 3 7 1 14 8 3 0 0 0 4 0 0 8 0 6 7 0 0 4 14 7 0 0 # 59.766 80.948 57.203 # 3rn8_B_281_RN8_105_P_1_B Env_3rn8_2 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 96 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 1 192 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 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 0 288 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 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.41 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 58 0 0 0 0 0 0 0 0 0 0 1 0 3 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 1 4 0 1 0 0 0 2 0 0 0 0 0 -1.1017 8 5 1 2 0 0 0 1 0 2 0 5 204.675 0 0 0 0 0 4 119 0 0 0 0 0 0 0 0 0 0 4 1 3 0 0 0 0 0 0 0 0 0 7 1 0 0 7 0 1 0 0 0 0 0 0 8 0 0 0 0 0 0 8 0 0 0 2 4 0 3 0 1 0 1 0 1 1 0 0 -2.0571 13 6 4 2 1 0 1 3 1 1 0 7 332.153 1 0 1 1 0 17 219 0 0 0 0 0 0 0 3 0 0 2 3 1 2 0 1 1 0 0 0 0 0 5 3 2 3 5 5 3 0 0 0 3 0 0 7 0 2 1 0 0 3 9 1 0 0 # 59.648 80.948 48.726 # 3rn8_B_281_RN8_108_S_1_B Env_3rn8_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 2 115 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 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 1 230 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 2 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 -0.461 3 1 1 1 0 0 0 1 0 1 0 3 59.141 0 0 0 0 -2 0 179 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 2 1 0 0 1 0 2 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.2805 4 2 1 1 0 0 0 1 0 1 0 4 92.651 0 0 0 0 -2 0 302 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 2 2 0 0 2 1 1 0 0 0 0 0 1 0 0 3 0 0 0 1 3 0 0 2 4 0 2 0 0 0 1 1 0 0 0 0 -1.9075 10 6 2 2 0 0 0 2 0 1.5 0 5 252.326 0.666 0.666 0 0.666 -2 10 324 0 0 2 4 0 0 0 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 2 5 2 1 2 3 1 4 0 0 0 0 0 3 0 0 7 0 0 0 3 7 0 0 5 7 0 4 0 0 0 3 1 0 0 0 0 -0.8666 20 12 4 4 0 0 0 4 0 3.5 0 14 494.356 0.333 0.333 0 0.333 -5 12 734 0 0 4 1 0 0 0 2 0 1 6 5 0 0 0 1 0 0 0 0 0 0 7 6 5 2 7 7 5 1 0 0 0 0 0 9 0 4 7 0 0 0 13 7 0 0 # 52.673 77.016 47.739 # 3rn8_B_281_RN8_217_S_1_B Env_3rn8_4 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.0252 1 1 0 0 0 0 0 0 0 0 0 1 33.51 0 0 0 0 0 0 9 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 0 0 2 0 0 0 1 0 0 0 0 0 -0.0679 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 67 0 0 0 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 1 3 0 4 1 0 0 0 0 0 0 5 0 0 0 0 0 0 5 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 64 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 2 1 0 0 2 0 1 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 3 9 0 3 0 0 0 1 0 0 0 0 0 -0.2815 16 12 3 1 0 0 0 3 0 1 0 10 456.025 0 0 0 0 2 10 652 0 0 0 0 0 0 0 0 0 1 1 4 1 0 2 3 0 0 4 0 0 0 5 4 7 0 5 7 4 0 0 0 0 0 0 13 0 0 3 0 0 0 13 3 0 0 4 15 4 5 0 0 0 3 0 0 0 0 0 -1.8332 31 23 5 3 0 0 0 5 0 3 4 17 841.999 0 0 0 0 3 29 938 0 0 0 0 0 0 0 1 0 5 6 1 2 1 4 3 4 0 4 0 0 0 18 1 11 1 18 12 1 0 0 0 0 0 4 15 0 1 11 0 0 0 20 11 0 0 5 7 1 2 0 0 0 4 0 2 0 0 0 -2.1773 21 13 2 6 0 0 2 2 0 4 2 13 524.274 0 0 0 0 -5 22 702 0 0 0 0 0 0 0 2 0 2 2 2 2 2 1 3 3 0 2 0 0 0 9 2 8 2 9 10 2 0 0 0 0 0 3 6 0 3 9 0 0 0 12 9 0 0 # 59.098 76.966 53.998 # 3rn8_B_281_RN8_219_G_1_B Env_3rn8_5 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 2 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 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 6 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 3 0 0 0 0 0 0 0 0 3 0 0 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 0 107 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 3 0 0 4 0 1 0 4 1 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 3 5 0 0 0 0 0 3 0 1 0 0 0 -0.4462 12 8 0 4 0 0 1 0 0 3 0 9 319.719 0 0 0 0 -3 6 289 3 0 2 0 0 0 0 0 0 1 1 1 0 0 0 2 0 0 0 2 0 0 7 1 4 0 7 4 1 0 0 0 9 0 0 0 0 1 2 0 0 9 1 2 0 0 6 20 2 9 0 0 0 3 0 0 0 0 0 -3.5232 40 28 9 3 0 0 0 9 0 3 2 21 1067.14 0 0 0 0 5 38 1745 2 0 5 0 0 0 0 0 0 3 13 5 0 5 3 2 0 0 0 2 0 0 28 5 7 0 28 7 5 0 0 0 24 0 0 0 0 9 7 0 0 24 9 7 0 0 3 23 2 4 0 0 0 4 0 0 0 0 0 -4.9147 36 28 4 4 0 0 0 4 0 4 2 16 1037.12 0 0 0 0 10 42 1156 1 0 3 0 0 0 0 1 0 6 11 4 0 4 2 2 0 0 0 2 0 0 26 4 5 1 26 6 4 0 0 0 22 0 0 0 0 5 9 0 0 22 5 9 0 0 # 65.157 84.334 60.297 # 3rn8_B_281_RN8_238_V_1_B Env_3rn8_6 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 69 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 4 0 1 0 0 0 0 0 0 0 0 0 -0.9383 5 4 1 0 0 0 0 1 0 0 0 2 148.177 0 0 0 0 2 8 345 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 5 0 0 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 2 0 0 1 0 0 0 2 0 0 0 0 0 -0.2893 5 2 1 2 0 0 0 1 0 2 0 5 104.145 0 0 0 0 -3 0 353 0 0 0 0 0 0 0 0 0 0 3 1 0 0 0 0 0 0 0 1 0 0 4 1 0 0 4 0 1 0 0 0 5 0 0 0 0 0 0 0 0 5 0 0 0 0 1 3 0 0 0 0 0 2 0 0 0 0 0 -0.9177 6 4 0 2 0 0 0 0 0 2 0 6 157.028 0 0 0 0 -2 0 344 0 0 1 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 0 2 0 0 4 1 1 0 4 1 1 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 4 10 0 6 0 0 0 2 2 0 0 0 0 -3.7574 24 14 6 4 0 0 0 6 0 3 0 11 602.585 0.999 0.999 0 0.999 -1 28 1787 4 0 4 0 0 0 4 0 0 0 4 5 0 0 0 0 0 0 0 3 0 0 11 9 4 0 11 4 5 4 0 0 22 0 0 0 0 2 0 0 0 22 2 0 0 0 4 14 0 4 0 0 0 2 0 0 0 0 0 -1.447 24 18 4 2 0 0 0 4 0 2 0 11 667.146 0 0 0 0 3 26 1667 1 0 9 0 0 0 3 0 0 0 4 5 0 0 0 0 0 0 0 2 0 0 7 8 9 0 7 9 5 3 0 0 21 0 0 0 0 3 0 0 0 21 3 0 0 0 # 62.603 89.024 60.855 # 3rn8_B_281_RN8_239_L_1_B Env_3rn8_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 8 246 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 82 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 0 0 0 0 0.0435 3 2 0 1 0 0 0 0 0 1 0 3 78.514 0 0 0 0 -1 0 246 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 2 0 2 0 0 0 0 0 0 0 0 0 -1.3042 4 2 2 0 0 0 0 2 0 0 0 3 95.294 0 0 0 0 -1 3 416 0 0 1 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 1 0 2 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 3 5 0 2 0 0 0 3 2 0 0 0 0 -1.944 15 8 2 5 0 0 0 2 0 4 0 8 346.179 0.999 0.999 0 0.999 -3 14 947 0 0 0 3 0 0 3 1 0 0 7 0 0 0 0 0 0 0 0 1 0 0 8 6 0 1 8 1 0 6 0 0 14 0 0 0 1 0 0 0 0 14 1 0 0 0 10 11 0 6 0 0 0 4 1 0 0 0 0 -0.8368 32 21 6 5 0 0 0 6 0 4.5 0 24 835.714 0.666 0.666 0 0.666 -5 18 2008 0 0 0 3 0 2 3 2 0 0 12 3 0 3 2 0 0 0 0 2 0 0 19 9 2 2 19 4 3 6 0 0 23 0 0 0 4 3 2 0 0 23 7 2 0 0 # 63.181 88.311 53.558 # 3rn8_B_281_RN8_242_N_1_B