# EXCLUDED_RESIDUES HETATM # PDBID_LIST 2xx8 # POINT_FILE 2xx8_1NE.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_2xx8_0 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 2 134 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 2 268 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 0 416 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 3 2 0 0 0 3 2 0 0 2 3 0 1 0 0 0 2 0 0 0 0 0 -0.3669 8 5 1 2 0 0 0 1 0 2 0 6 204.675 0 0 0 0 -1 4 298 0 0 0 0 0 0 0 0 0 1 0 2 0 1 0 2 0 0 2 0 0 0 2 2 4 0 2 4 2 0 0 0 0 0 2 0 0 2 4 0 0 0 4 4 0 0 3 8 0 4 0 0 0 2 0 1 0 0 0 -2.1385 18 11 4 3 0 0 1 4 0 2 0 12 465.303 0 0 0 0 -2 12 450 0 0 0 0 0 0 0 6 0 1 0 2 3 2 0 1 0 0 2 1 0 0 7 2 3 6 7 9 2 0 0 0 1 0 2 0 0 2 13 0 0 1 4 13 0 0 3 12 4 2 0 0 0 3 0 0 0 0 0 -1.5516 24 19 2 3 0 0 0 2 0 3 4 9 665.548 0 0 0 0 6 32 607 0 0 1 0 0 0 0 1 0 3 1 3 2 7 0 3 0 0 1 2 0 0 15 3 5 1 15 6 3 0 0 0 4 0 1 2 0 1 16 0 0 4 4 16 0 0 # 59.757 81.123 57.171 # 2xx8_B_310_1NE_105_P_1_B Env_2xx8_1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 0 0 0 0 -0.4156 1 0 1 0 0 0 0 1 0 0 0 1 14.137 0 0 0 0 -1 0 26 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 3 1 0 0 0 0 0 2 0 1 0 0 0 0.0648 7 4 0 3 0 0 1 0 0 2 0 6 174.185 0 0 0 0 -3 2 335 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 1 0 0 0 0 0 0 4 2 1 0 4 1 2 0 0 0 0 0 0 0 0 0 7 0 0 0 0 7 0 0 1 7 0 3 0 0 0 1 0 0 0 0 0 -1.774 12 8 3 1 0 0 0 3 0 1 0 9 321.985 0 0 0 0 -2 5 592 0 0 0 0 0 0 0 3 0 0 2 2 2 0 0 3 0 0 0 0 0 0 4 2 3 3 4 6 2 0 0 0 0 0 0 0 0 0 12 0 0 0 0 12 0 0 1 7 0 4 0 0 0 2 0 1 0 0 0 -3.4119 15 8 4 3 0 0 1 4 0 2 0 7 375.065 0 0 0 0 -1 16 626 0 0 1 1 0 0 0 2 0 0 2 2 3 0 0 3 0 0 1 0 0 0 5 3 5 2 5 7 2 1 0 0 1 0 1 0 0 0 13 0 0 1 1 13 0 0 # 58.122 79.99 48.865 # 2xx8_B_310_1NE_108_S_1_B Env_2xx8_2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 0 0 0 1 0 0 0 -0.4678 3 2 0 1 0 0 1 0 0 0 0 1 84.177 0 0 0 0 -1 3 342 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 0 0 0 3 0 0 0 0 3 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 0 190 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 0 317 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 0 0 0 4 0 0 0 0 4 0 0 3 4 0 3 0 0 0 2 1 0 0 0 0 -2.2938 13 7 3 3 0 0 0 3 0 2.5 0 8 311.467 0.666 0.666 0 0.666 -4 10 494 0 0 3 4 0 0 0 2 0 0 3 1 0 0 0 0 0 0 0 0 0 0 3 5 3 2 3 5 1 4 0 0 0 0 0 0 0 1 12 0 0 0 1 12 0 0 4 5 0 4 0 0 0 2 1 0 0 0 0 -1.0598 16 9 4 3 0 0 0 4 0 2.5 0 12 382.332 0.333 0.333 0 0.333 -5 8 656 0 0 4 1 0 0 0 1 0 1 5 4 0 0 0 0 0 0 0 0 0 0 6 5 4 1 6 5 4 1 0 0 0 0 0 1 0 3 12 0 0 0 4 12 0 0 # 52.891 76.968 47.286 # 2xx8_B_310_1NE_217_S_1_B Env_2xx8_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 7 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 -0.0679 5 2 2 1 0 0 0 2 0 1 0 5 106.788 0 0 0 0 -3 0 72 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 1 0 0 0 4 0 0 0 1 4 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 3 118 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 0 0 0 3 0 0 0 0 3 0 0 2 8 0 2 0 0 0 1 0 0 0 0 0 -0.4382 13 10 2 1 0 0 0 2 0 1 0 7 374.868 0 0 0 0 3 10 447 0 0 0 0 0 0 0 0 0 1 1 4 1 0 2 0 0 0 4 0 0 0 5 4 4 0 5 4 4 0 0 0 0 0 4 0 0 0 9 0 0 0 4 9 0 0 4 14 4 5 0 0 0 2 0 0 0 0 0 -1.8081 29 22 5 2 0 0 0 5 0 2 4 16 796.995 0 0 0 0 5 28 941 0 0 0 0 0 0 0 1 0 5 6 1 3 1 4 1 3 0 4 0 0 0 19 1 8 1 19 9 1 0 0 0 0 0 7 0 0 0 22 0 0 0 7 22 0 0 5 7 1 2 0 0 0 4 0 2 0 0 0 -1.8462 21 13 2 6 0 0 2 2 0 4 2 13 524.274 0 0 0 0 -6 22 730 0 0 0 0 0 0 0 2 0 2 2 2 1 2 1 3 4 0 2 0 0 0 8 2 9 2 8 11 2 0 0 0 0 0 6 0 0 1 14 0 0 0 7 14 0 0 # 59.239 77.121 53.891 # 2xx8_B_310_1NE_219_G_1_B Env_2xx8_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 66 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 3 0 1 0 0 0 0 0 0 0 0 0 0.0709 5 4 1 0 0 0 0 1 0 0 0 3 148.177 0 0 0 0 1 5 330 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 1 1 0 1 0 0 0 2 0 0 0 0 0 -1.2985 5 2 1 2 0 0 0 1 0 2 0 4 104.145 0 0 0 0 -2 3 334 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 1 0 0 0 0 -1.7364 7 4 0 3 0 0 0 0 0 2.5 0 6 171.165 0.333 0.333 0 0.333 -3 4 502 0 0 1 0 0 0 1 0 0 0 2 1 0 0 0 0 0 0 0 2 0 0 4 2 1 0 4 1 1 1 0 0 7 0 0 0 0 0 0 0 0 7 0 0 0 0 4 11 0 6 0 0 0 2 1 1 0 0 0 -2.7189 25 15 6 4 0 0 1 6 0 2.5 0 12 628.823 0.666 0.666 0 0.666 -1 24 1905 4 0 1 0 0 0 5 0 0 0 4 5 0 0 0 3 0 0 0 3 0 0 11 10 4 0 11 4 5 5 0 0 23 0 0 0 0 2 0 0 0 23 2 0 0 0 3 12 0 1 0 0 0 2 0 0 0 0 0 -0.9274 18 15 1 2 0 0 0 1 0 2 0 8 537.136 0 0 0 0 4 20 891 1 0 5 0 0 0 1 0 0 0 4 3 0 0 0 2 0 0 0 2 0 0 7 4 7 0 7 7 3 1 0 0 16 0 0 0 0 2 0 0 0 16 2 0 0 0 # 62.459 89.315 60.506 # 2xx8_B_310_1NE_239_L_1_B Env_2xx8_5 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 62 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 1 124 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 0 0 0 0 -0.9026 4 1 2 1 0 0 0 2 0 1 0 4 73.278 0 0 0 0 -3 0 352 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 1 3 0 0 3 0 1 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 1 3 0 0 0 0 0 2 0 0 0 0 0 -0.8973 6 4 0 2 0 0 0 0 0 2 0 4 157.028 0 0 0 0 0 5 413 0 0 0 0 0 0 2 0 0 0 3 0 0 0 0 0 0 0 0 1 0 0 4 2 0 0 4 0 0 2 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 4 7 0 3 0 0 0 3 1 0 0 0 0 -1.5881 18 11 3 4 0 0 0 3 0 3.5 0 11 446.709 0.666 0.666 0 0.666 -2 15 1312 0 0 0 0 0 1 4 0 0 0 10 1 0 0 1 0 0 0 0 1 0 0 12 5 1 0 12 1 1 4 0 0 16 0 0 0 1 0 1 0 0 16 1 1 0 0 6 11 0 5 0 0 0 2 3 0 0 0 0 -2.3674 27 17 5 5 0 0 0 5 0 3.5 0 18 692.823 1.332 1.332 0 1.332 -5 21 1632 0 0 0 4 0 2 2 3 0 0 6 3 0 3 1 0 0 0 0 3 0 0 13 9 2 3 13 5 3 6 0 0 18 0 0 0 5 0 4 0 0 18 5 4 0 0 # 62.857 88.698 54.32 # 2xx8_B_310_1NE_242_S_1_B Env_2xx8_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 14 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 42 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 1 0 0 0 0 0 -0.7138 6 4 1 1 0 0 0 1 0 1 0 4 159.671 0 0 0 0 0 6 195 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 6 0 0 0 0 0 0 0 0 6 0 0 0 0 1 3 0 1 0 0 0 3 0 1 0 0 0 -2.1186 9 4 1 4 0 0 1 1 0 3 0 8 199.816 0 0 0 0 -5 6 300 0 0 0 1 0 0 0 0 0 0 4 0 0 1 0 2 0 0 1 0 0 0 5 1 3 0 5 3 0 1 0 0 8 0 0 0 0 0 1 0 0 8 0 1 0 0 6 13 1 4 0 0 0 2 2 1 0 0 0 -2.0848 29 20 4 5 0 0 1 4 0 3 2 13 762.316 0.999 0.999 0 0.999 1 35 1250 0 0 0 5 0 0 0 3 0 0 10 2 0 3 0 4 0 0 2 0 0 0 13 7 6 3 13 9 2 5 0 0 23 0 0 0 3 0 3 0 0 23 3 3 0 0 3 16 4 5 0 0 0 3 0 0 0 0 0 -5.1307 31 23 5 3 0 0 0 5 0 3 4 15 841.999 0 0 0 0 8 40 1162 0 0 0 1 0 0 1 1 0 0 9 5 5 3 1 0 0 0 2 3 0 0 21 7 2 1 21 3 5 2 0 0 21 0 0 0 1 0 9 0 0 21 1 9 0 0 # 67.344 85.713 52.436 # 2xx8_B_310_1NE_247_L_1_B