# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1qw6 # POINT_FILE 1qw6_H4B.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_1qw6_0 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 0 1 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 0 2 0 0 0 0 0 2 0 0 0 1 0 0 2 0 0 0 1 0 0 0 0 0 -0.8019 4 1 2 1 0 0 0 2 0 1 0 4 73.278 0 0 0 0 -3 0 364 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 3 0 0 0 0 0 0 1 0 3 0 1 3 0 0 0 0 0 0 0 0 3 0 1 0 0 0 3 1 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0.4286 4 4 0 0 0 0 0 0 0 0 0 2 134.04 0 0 0 0 2 5 258 0 0 0 0 0 0 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 1 3 1 0 0 0 0 0 0 0 0 1 0 3 0 0 0 1 3 0 0 2 5 0 1 0 0 0 3 0 0 0 0 0 -1.4819 11 7 1 3 0 0 0 1 0 3 0 8 283.189 0 0 0 0 -1 5 688 0 0 0 0 1 0 0 3 0 2 0 0 3 0 0 0 0 0 0 2 0 0 7 0 1 3 7 4 0 0 0 0 2 0 0 0 3 0 6 0 0 2 3 6 0 0 1 3 0 2 0 0 0 1 0 0 0 1 0 -1.1013 8 4 2 1 1 0 0.5 2 0 1 0 4 200.329 0 0 0 0 -1 6 671 0 0 0 0 2 0 0 0 0 2 0 0 3 0 0 0 0 0 0 1 0 0 6 0 2 0 6 2 0 0 0 0 1 0 0 0 0 1 6 0 0 1 1 6 0 0 # 6.364 10.261 41.357 # 1qw6_A_901_H4B_334_S_1_A Env_1qw6_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 3 107 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 0 0 1 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 6 214 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 0 0 2 0 0 0 0 2 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 -0.2496 3 3 0 0 0 0 0 0 0 0 1 1 93.541 0 0 0 0 2 6 328 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 1 0 0 0 0 2 0 1 0 3 0 0 0 0 0 1 0 0 0 0 2 0 0 0 1 2 0 0 0 1 0 2 1 0 0 1 1 0 0 0 0 0 -0.7035 6 3 2 1 0 0 0 1 1 1 3 3 126.82 0 0 0 0 -2 14 663 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 0 0 3 0 3 0 6 0 0 0 0 0 3 0 0 0 0 3 0 0 0 3 3 0 0 0 1 2 4 1 2 0 0 1 0 1 0 0 0 -2.1574 12 7 3 2 0 0 1 2 1 1 3 3 286.376 0.999 0 0.999 0.999 -1 39 1000 0 3 0 0 0 0 0 0 0 2 3 0 0 0 0 0 0 3 1 0 0 0 5 3 4 0 8 1 3 0 0 0 3 0 0 0 3 0 6 0 0 3 3 6 0 0 2 4 4 1 2 0 0 1 0 0 0 0 0 -2.4771 14 10 3 1 0 0 0 1.5 1.5 1 5 5 358.91 0.333 0 0.333 0.333 1 33 1197 0 3 0 0 0 0 0 0 0 2 2 0 0 0 0 2 0 2 3 0 0 0 4 3 7 0 6 5 3 0 0 0 3 0 0 0 4 0 7 0 0 3 4 7 0 0 # 7.852 7.334 50.034 # 1qw6_A_901_H4B_336_M_1_A Env_1qw6_2 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 5 115 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 19 460 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 2 0 0 0 0 0 0 1 0 0 0 0 -0.763 3 2 0 1 0 0 0 0 0 0.5 0 0 81.157 0.333 0.333 0 0.333 1 6 272 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 2 1 0 0 2 0 0 0 0 0 1 0 0 2 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 -0.2658 3 2 0 1 0 0 0 0 0 0.5 0 1 68.226 0.666 0.666 0 0.666 -1 5 199 0 1 0 2 0 0 0 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 0 0 0 2 0 0 1 0 2 0 0 1 3 0 1 0 0 0 1 0 0 0 0 0 -0.2217 6 4 1 1 0 0 0 1 0 1 0 3 159.671 0 0 0 0 1 4 515 0 3 0 1 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 2 4 0 0 2 0 3 1 0 0 3 0 0 0 0 2 1 0 0 3 2 1 0 0 1 9 0 3 1 0 0 3 1 0 0 0 0 -3.8964 18 10 4 4 0 0 0 3.5 0.5 3.5 0 11 450.559 0.666 0.333 0.333 0.666 -5 18 620 0 3 0 5 0 0 2 0 0 0 0 0 0 0 3 0 1 0 0 4 0 0 7 10 1 0 7 1 3 7 0 0 6 0 0 0 7 3 2 0 0 6 10 2 0 0 # 6.725 -0.584 49.483 # 1qw6_A_901_H4B_596_R_1_A Env_1qw6_3 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 72 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 4 288 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 1 0 0 0 0 -0.5905 5 2 1 2 0 0 0 1 0 1.5 0 4 106.788 0.333 0.333 0 0.333 -3 3 360 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 2 0 0 2 1 2 0 4 0 0 1 0 0 4 0 0 0 0 0 1 0 0 4 0 1 0 0 1 3 1 1 0 0 0 3 1 0 0 0 0 -2.3789 10 5 1 4 0 0 0 1 0 3.5 1 7 210.386 0.666 0.666 0 0.666 -5 8 660 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 1 0 5 0 0 0 0 0 3 6 1 5 2 0 3 0 0 5 0 0 0 2 0 3 0 0 5 2 3 0 0 4 6 5 2 0 0 1 1 0 0 0 0 0 0.1773 19 15 3 1 0 0 0 2 1 1 6 9 510.226 0 0 0 0 4 24 1391 0 0 0 3 0 0 0 2 0 1 0 0 0 0 0 4 0 9 0 0 0 0 1 3 13 2 10 6 0 3 0 0 10 0 0 0 6 0 3 0 0 10 6 3 0 0 0 4 6 4 2 0 0 3 0 1 0 0 0 -4.6243 20 10 6 4 0 0 1 4.5 1.5 3 5 8 422.593 0.666 0 0.666 0.666 -5 42 1207 0 4 0 1 0 0 0 1 0 3 0 0 0 0 0 1 0 6 0 4 0 0 7 5 7 1 13 2 4 1 0 0 7 0 0 0 6 4 3 0 0 7 10 3 0 0 # 0.993 7.551 44.506 # 1qw6_A_901_H4B_677_V_1_A Env_1qw6_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 -0.5471 6 6 0 0 0 0 0 0 0 0 6 0 147.242 0 0 0 0 5 27 684 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 9 342 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 0 5 1 0 2 0 0 0 0 1 0 0 0 -1.0878 9 6 2 1 0 0 1 0.5 1.5 0 0 1 250.294 0.666 0 0.666 0.666 0 28 632 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 0 0 0 0 6 3 0 2 1 6 0 0 0 2 0 0 0 6 0 1 0 0 2 6 1 0 0 2 2 0 1 1 0 0 2 1 0 1 0 0 -2.9078 10 4 2 3 1 0 0 1.5 0.5 2.5 1 5 223.321 0.666 0.333 0.333 0.666 -3 21 805 0 3 0 1 0 0 0 0 0 0 0 0 2 0 0 0 0 3 1 0 0 0 2 4 4 0 5 1 3 1 0 0 3 0 0 0 3 2 2 0 0 3 5 2 0 0 4 6 2 3 1 0 0 2 1 0 0 0 0 -1.758 19 12 4 3 0 0 0 3.5 0.5 2.5 2 9 479.176 0.999 0.666 0.333 0.999 0 26 1267 0 3 0 3 1 0 0 0 0 1 0 0 5 0 0 0 0 0 2 4 0 0 10 6 3 0 10 3 3 3 0 0 6 0 0 0 2 5 6 0 0 6 7 6 0 0 # 3.124 6.058 51.452 # 1qw6_A_901_H4B_678_W_1_A Env_1qw6_5 0 0 0 0 0 0 1 0 0 0 0 0 0 -0.3418 1 0 1 0 0 0 0 0 1 0 1 0 20.579 0 0 0 0 -1 4 114 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 -0.043 4 4 0 0 0 0 0 0 0 0 4 0 88.258 0 0 0 0 2 12 456 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 4 0 0 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 1 4 0 1 0 0 0 0 0 0 0 0 -0.3389 6 5 1 0 0 0 0 0 1 0 3 0 154.231 0.333 0 0.333 0.333 3 25 566 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 2 4 0 4 0 2 0 0 0 4 0 0 0 2 0 0 0 0 4 2 0 0 0 1 4 1 1 2 0 0 0 1 0 1 0 0 -3.0749 11 6 3 1 1 0 0 2 1 0.5 1 3 297.724 0.999 0.333 0.666 0.999 0 30 823 0 4 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 3 0 2 0 0 3 5 3 0 6 0 4 1 0 0 5 0 0 0 4 1 1 0 0 5 5 1 0 0 3 8 0 1 0 0 0 4 1 1 0 0 0 -1.9139 18 11 1 6 0 0 1 1 0 4.5 0 9 447.086 0.666 0.666 0 0.666 -1 21 1344 0 1 0 3 0 0 0 1 0 1 0 0 7 0 0 0 0 1 1 3 0 0 11 4 2 1 12 2 1 3 0 0 4 0 0 0 2 7 5 0 0 4 9 5 0 0 7 5 1 5 0 0 0 4 0 0 0 0 0 -1.1988 22 13 5 4 0 0 0 5 0 4 2 19 532.371 0 0 0 0 -7 11 1384 0 4 0 3 0 0 0 1 0 4 1 0 0 0 0 3 0 2 2 2 0 0 7 7 7 1 9 6 4 3 0 0 5 0 0 0 8 0 9 0 0 5 8 9 0 0 # 3.251 7.329 49.044 # 1qw6_A_901_H4B_678_W_2_A